USER MOD reduce.3.24.130724 H: found=0, std=0, add=1060, rem=0, adj=49 USER MOD reduce.3.24.130724 removed 890 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 27 LYS NZ :NH3+ -155:sc= 0 (180deg=-0.0543) USER MOD Set 1.2: A 80 TYR OH : rot 52:sc= 1.65 USER MOD Set 1.3: A 126 SER OG : rot 178:sc= 1.52 USER MOD Set 2.1: A 58 ASN : amide:sc= -2.01 K(o=-3.8,f=-8.4!) USER MOD Set 2.2: A 91 GLN : amide:sc= -1.77 K(o=-3.8,f=-5.5!) USER MOD Set 3.1: A 45 TYR OH : rot -1:sc= 0.165 USER MOD Set 3.2: A 61 GLN : amide:sc= 0.155 K(o=0.32,f=-0.97) USER MOD Set 4.1: A 17 GLN : amide:sc= -3.51! C(o=-4.2!,f=-8!) USER MOD Set 4.2: A 21 MET CE :methyl 153:sc= -0.709 (180deg=-2.21!) USER MOD Set 5.1: A 12 SER OG : rot 174:sc= -5.52! USER MOD Set 5.2: A 139 THR OG1 : rot 180:sc= -0.116 USER MOD Single : A 2 THR OG1 : rot -37:sc= 0.138 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 180:sc= -0.0017 USER MOD Single : A 6 THR OG1 : rot -9:sc= -0.724! USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 GLN : amide:sc= -0.983 K(o=-0.98,f=-4.4!) USER MOD Single : A 18 MET CE :methyl 154:sc= -0.759 (180deg=-1.97) USER MOD Single : A 19 ASN : amide:sc= -1.7 K(o=-1.7,f=-5.5!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 ASN : amide:sc= -4.53 K(o=-4.5,f=-15!) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot -137:sc= 1.25 USER MOD Single : A 34 ASN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 35 SER OG : rot -130:sc= 0.0254 USER MOD Single : A 42 SER OG : rot -150:sc= -0.936 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot -95:sc= -0.33 USER MOD Single : A 48 LYS NZ :NH3+ 174:sc= -0.176 (180deg=-0.237) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= -0.0796 USER MOD Single : A 53 SER OG : rot 13:sc= 0.687 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 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 ASN : amide:sc= -5.97! C(o=-6!,f=-6!) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 180:sc= -0.643 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -0.187 K(o=-0.19,f=-2.4!) USER MOD Single : A 78 SER OG : rot 22:sc= 0.0044 USER MOD Single : A 87 TYR OH : rot 0:sc= -0.402 USER MOD Single : A 89 LYS NZ :NH3+ 175:sc= -0.097 (180deg=-0.115) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0.00323 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 ASN :FLIP amide:sc= -0.883 F(o=-2.1,f=-0.88) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 133:sc= 0.657 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 GLN : amide:sc= 0.108 K(o=0.11,f=-3.7!) USER MOD Single : A 116 ASN :FLIP amide:sc= -1.77 F(o=-3.1!,f=-1.8) USER MOD Single : A 118 MET CE :methyl -152:sc= -0.306 (180deg=-1.7!) USER MOD Single : A 120 ASN : amide:sc=-0.00615 K(o=-0.0062,f=-1.4) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 130 SER OG : rot 180:sc= -1.66 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 2 125.429 -17.786 2.874 1.00 0.00 N ATOM 2 CA THR A 2 125.440 -17.357 1.443 1.00 0.00 C ATOM 3 C THR A 2 125.049 -15.880 1.347 1.00 0.00 C ATOM 4 O THR A 2 124.621 -15.283 2.317 1.00 0.00 O ATOM 5 CB THR A 2 124.397 -18.237 0.747 1.00 0.00 C ATOM 6 OG1 THR A 2 123.114 -17.973 1.299 1.00 0.00 O ATOM 7 CG2 THR A 2 124.749 -19.713 0.942 1.00 0.00 C ATOM 0 HA THR A 2 126.423 -17.464 0.984 1.00 0.00 H new ATOM 0 HB THR A 2 124.388 -18.012 -0.320 1.00 0.00 H new ATOM 0 HG1 THR A 2 123.198 -17.817 2.263 1.00 0.00 H new ATOM 0 HG21 THR A 2 124.004 -20.334 0.445 1.00 0.00 H new ATOM 0 HG22 THR A 2 125.731 -19.912 0.514 1.00 0.00 H new ATOM 0 HG23 THR A 2 124.763 -19.946 2.007 1.00 0.00 H new ATOM 15 N SER A 3 125.182 -15.288 0.189 1.00 0.00 N ATOM 16 CA SER A 3 124.806 -13.852 0.039 1.00 0.00 C ATOM 17 C SER A 3 123.702 -13.723 -1.008 1.00 0.00 C ATOM 18 O SER A 3 123.687 -14.442 -1.987 1.00 0.00 O ATOM 19 CB SER A 3 126.080 -13.151 -0.428 1.00 0.00 C ATOM 20 OG SER A 3 127.103 -13.341 0.541 1.00 0.00 O ATOM 0 H SER A 3 125.534 -15.736 -0.657 1.00 0.00 H new ATOM 0 HA SER A 3 124.429 -13.417 0.964 1.00 0.00 H new ATOM 0 HB2 SER A 3 126.397 -13.551 -1.391 1.00 0.00 H new ATOM 0 HB3 SER A 3 125.892 -12.087 -0.571 1.00 0.00 H new ATOM 0 HG SER A 3 127.923 -12.894 0.243 1.00 0.00 H new ATOM 25 N THR A 4 122.782 -12.816 -0.819 1.00 0.00 N ATOM 26 CA THR A 4 121.690 -12.655 -1.821 1.00 0.00 C ATOM 27 C THR A 4 121.425 -11.171 -2.095 1.00 0.00 C ATOM 28 O THR A 4 121.466 -10.345 -1.203 1.00 0.00 O ATOM 29 CB THR A 4 120.471 -13.315 -1.182 1.00 0.00 C ATOM 30 OG1 THR A 4 120.780 -14.665 -0.864 1.00 0.00 O ATOM 31 CG2 THR A 4 119.291 -13.276 -2.155 1.00 0.00 C ATOM 0 H THR A 4 122.739 -12.184 -0.020 1.00 0.00 H new ATOM 0 HA THR A 4 121.942 -13.106 -2.781 1.00 0.00 H new ATOM 0 HB THR A 4 120.203 -12.776 -0.273 1.00 0.00 H new ATOM 0 HG1 THR A 4 119.999 -15.091 -0.452 1.00 0.00 H new ATOM 0 HG21 THR A 4 118.424 -13.748 -1.694 1.00 0.00 H new ATOM 0 HG22 THR A 4 119.054 -12.240 -2.398 1.00 0.00 H new ATOM 0 HG23 THR A 4 119.554 -13.812 -3.067 1.00 0.00 H new ATOM 39 N VAL A 5 121.141 -10.840 -3.325 1.00 0.00 N ATOM 40 CA VAL A 5 120.856 -9.415 -3.672 1.00 0.00 C ATOM 41 C VAL A 5 119.474 -9.305 -4.319 1.00 0.00 C ATOM 42 O VAL A 5 119.073 -10.153 -5.091 1.00 0.00 O ATOM 43 CB VAL A 5 121.958 -9.003 -4.652 1.00 0.00 C ATOM 44 CG1 VAL A 5 123.320 -9.124 -3.967 1.00 0.00 C ATOM 45 CG2 VAL A 5 121.929 -9.917 -5.880 1.00 0.00 C ATOM 0 H VAL A 5 121.094 -11.494 -4.106 1.00 0.00 H new ATOM 0 HA VAL A 5 120.848 -8.768 -2.795 1.00 0.00 H new ATOM 0 HB VAL A 5 121.792 -7.972 -4.964 1.00 0.00 H new ATOM 0 HG11 VAL A 5 124.105 -8.831 -4.664 1.00 0.00 H new ATOM 0 HG12 VAL A 5 123.348 -8.472 -3.094 1.00 0.00 H new ATOM 0 HG13 VAL A 5 123.479 -10.156 -3.654 1.00 0.00 H new ATOM 0 HG21 VAL A 5 122.715 -9.619 -6.574 1.00 0.00 H new ATOM 0 HG22 VAL A 5 122.091 -10.949 -5.569 1.00 0.00 H new ATOM 0 HG23 VAL A 5 120.960 -9.834 -6.372 1.00 0.00 H new ATOM 55 N THR A 6 118.747 -8.266 -4.007 1.00 0.00 N ATOM 56 CA THR A 6 117.388 -8.087 -4.596 1.00 0.00 C ATOM 57 C THR A 6 117.007 -6.606 -4.566 1.00 0.00 C ATOM 58 O THR A 6 117.124 -5.955 -3.545 1.00 0.00 O ATOM 59 CB THR A 6 116.461 -8.902 -3.689 1.00 0.00 C ATOM 60 OG1 THR A 6 116.883 -10.259 -3.681 1.00 0.00 O ATOM 61 CG2 THR A 6 115.022 -8.816 -4.200 1.00 0.00 C ATOM 0 H THR A 6 119.038 -7.529 -3.365 1.00 0.00 H new ATOM 0 HA THR A 6 117.330 -8.413 -5.634 1.00 0.00 H new ATOM 0 HB THR A 6 116.504 -8.499 -2.677 1.00 0.00 H new ATOM 0 HG1 THR A 6 117.574 -10.391 -4.363 1.00 0.00 H new ATOM 0 HG21 THR A 6 114.369 -9.398 -3.549 1.00 0.00 H new ATOM 0 HG22 THR A 6 114.698 -7.775 -4.201 1.00 0.00 H new ATOM 0 HG23 THR A 6 114.972 -9.213 -5.214 1.00 0.00 H new ATOM 69 N GLY A 7 116.555 -6.061 -5.668 1.00 0.00 N ATOM 70 CA GLY A 7 116.179 -4.618 -5.673 1.00 0.00 C ATOM 71 C GLY A 7 115.331 -4.294 -6.905 1.00 0.00 C ATOM 72 O GLY A 7 115.105 -5.132 -7.754 1.00 0.00 O ATOM 0 H GLY A 7 116.432 -6.549 -6.555 1.00 0.00 H new ATOM 0 HA2 GLY A 7 115.623 -4.377 -4.767 1.00 0.00 H new ATOM 0 HA3 GLY A 7 117.078 -4.001 -5.669 1.00 0.00 H new ATOM 75 N GLY A 8 114.863 -3.074 -7.002 1.00 0.00 N ATOM 76 CA GLY A 8 114.026 -2.676 -8.172 1.00 0.00 C ATOM 77 C GLY A 8 113.566 -1.223 -8.010 1.00 0.00 C ATOM 78 O GLY A 8 114.365 -0.328 -7.816 1.00 0.00 O ATOM 0 H GLY A 8 115.026 -2.335 -6.318 1.00 0.00 H new ATOM 0 HA2 GLY A 8 114.597 -2.786 -9.094 1.00 0.00 H new ATOM 0 HA3 GLY A 8 113.161 -3.334 -8.253 1.00 0.00 H new ATOM 81 N TYR A 9 112.282 -0.987 -8.089 1.00 0.00 N ATOM 82 CA TYR A 9 111.753 0.404 -7.942 1.00 0.00 C ATOM 83 C TYR A 9 110.375 0.360 -7.272 1.00 0.00 C ATOM 84 O TYR A 9 109.739 -0.681 -7.234 1.00 0.00 O ATOM 85 CB TYR A 9 111.669 0.954 -9.373 1.00 0.00 C ATOM 86 CG TYR A 9 110.586 0.239 -10.151 1.00 0.00 C ATOM 87 CD1 TYR A 9 110.870 -0.975 -10.789 1.00 0.00 C ATOM 88 CD2 TYR A 9 109.301 0.790 -10.233 1.00 0.00 C ATOM 89 CE1 TYR A 9 109.869 -1.638 -11.509 1.00 0.00 C ATOM 90 CE2 TYR A 9 108.300 0.126 -10.953 1.00 0.00 C ATOM 91 CZ TYR A 9 108.584 -1.087 -11.591 1.00 0.00 C ATOM 92 OH TYR A 9 107.597 -1.740 -12.301 1.00 0.00 O ATOM 0 H TYR A 9 111.572 -1.702 -8.250 1.00 0.00 H new ATOM 0 HA TYR A 9 112.384 1.036 -7.318 1.00 0.00 H new ATOM 0 HB2 TYR A 9 111.461 2.024 -9.346 1.00 0.00 H new ATOM 0 HB3 TYR A 9 112.629 0.829 -9.874 1.00 0.00 H new ATOM 0 HD1 TYR A 9 111.861 -1.400 -10.726 1.00 0.00 H new ATOM 0 HD2 TYR A 9 109.082 1.726 -9.741 1.00 0.00 H new ATOM 0 HE1 TYR A 9 110.088 -2.574 -12.001 1.00 0.00 H new ATOM 0 HE2 TYR A 9 107.309 0.550 -11.016 1.00 0.00 H new ATOM 0 HH TYR A 9 106.766 -1.223 -12.256 1.00 0.00 H new ATOM 101 N ALA A 10 109.903 1.461 -6.733 1.00 0.00 N ATOM 102 CA ALA A 10 108.567 1.420 -6.072 1.00 0.00 C ATOM 103 C ALA A 10 107.795 2.722 -6.283 1.00 0.00 C ATOM 104 O ALA A 10 108.348 3.802 -6.254 1.00 0.00 O ATOM 105 CB ALA A 10 108.871 1.216 -4.588 1.00 0.00 C ATOM 0 H ALA A 10 110.376 2.365 -6.723 1.00 0.00 H new ATOM 0 HA ALA A 10 107.941 0.629 -6.485 1.00 0.00 H new ATOM 0 HB1 ALA A 10 107.937 1.175 -4.028 1.00 0.00 H new ATOM 0 HB2 ALA A 10 109.417 0.282 -4.453 1.00 0.00 H new ATOM 0 HB3 ALA A 10 109.476 2.046 -4.223 1.00 0.00 H new ATOM 111 N GLN A 11 106.507 2.611 -6.459 1.00 0.00 N ATOM 112 CA GLN A 11 105.652 3.819 -6.636 1.00 0.00 C ATOM 113 C GLN A 11 104.542 3.767 -5.586 1.00 0.00 C ATOM 114 O GLN A 11 104.070 2.699 -5.242 1.00 0.00 O ATOM 115 CB GLN A 11 105.086 3.716 -8.058 1.00 0.00 C ATOM 116 CG GLN A 11 104.237 2.448 -8.196 1.00 0.00 C ATOM 117 CD GLN A 11 103.694 2.349 -9.622 1.00 0.00 C ATOM 118 OE1 GLN A 11 104.383 1.901 -10.517 1.00 0.00 O ATOM 119 NE2 GLN A 11 102.479 2.753 -9.875 1.00 0.00 N ATOM 0 H GLN A 11 106.005 1.724 -6.488 1.00 0.00 H new ATOM 0 HA GLN A 11 106.190 4.759 -6.511 1.00 0.00 H new ATOM 0 HB2 GLN A 11 104.481 4.594 -8.281 1.00 0.00 H new ATOM 0 HB3 GLN A 11 105.901 3.698 -8.782 1.00 0.00 H new ATOM 0 HG2 GLN A 11 104.837 1.569 -7.962 1.00 0.00 H new ATOM 0 HG3 GLN A 11 103.413 2.470 -7.483 1.00 0.00 H new ATOM 0 HE21 GLN A 11 101.900 3.129 -9.124 1.00 0.00 H new ATOM 0 HE22 GLN A 11 102.109 2.693 -10.823 1.00 0.00 H new ATOM 126 N SER A 12 104.139 4.886 -5.046 1.00 0.00 N ATOM 127 CA SER A 12 103.084 4.832 -3.989 1.00 0.00 C ATOM 128 C SER A 12 102.178 6.062 -4.012 1.00 0.00 C ATOM 129 O SER A 12 102.603 7.159 -4.321 1.00 0.00 O ATOM 130 CB SER A 12 103.866 4.799 -2.675 1.00 0.00 C ATOM 131 OG SER A 12 105.078 4.077 -2.858 1.00 0.00 O ATOM 0 H SER A 12 104.484 5.816 -5.283 1.00 0.00 H new ATOM 0 HA SER A 12 102.429 3.972 -4.132 1.00 0.00 H new ATOM 0 HB2 SER A 12 104.083 5.815 -2.344 1.00 0.00 H new ATOM 0 HB3 SER A 12 103.266 4.330 -1.895 1.00 0.00 H new ATOM 0 HG SER A 12 105.620 4.135 -2.043 1.00 0.00 H new ATOM 136 N ASP A 13 100.940 5.886 -3.628 1.00 0.00 N ATOM 137 CA ASP A 13 100.004 7.043 -3.559 1.00 0.00 C ATOM 138 C ASP A 13 100.376 7.854 -2.321 1.00 0.00 C ATOM 139 O ASP A 13 100.855 7.301 -1.351 1.00 0.00 O ATOM 140 CB ASP A 13 98.606 6.432 -3.416 1.00 0.00 C ATOM 141 CG ASP A 13 97.540 7.527 -3.523 1.00 0.00 C ATOM 142 OD1 ASP A 13 97.875 8.624 -3.943 1.00 0.00 O ATOM 143 OD2 ASP A 13 96.400 7.249 -3.185 1.00 0.00 O ATOM 0 H ASP A 13 100.538 4.988 -3.359 1.00 0.00 H new ATOM 0 HA ASP A 13 100.045 7.697 -4.430 1.00 0.00 H new ATOM 0 HB2 ASP A 13 98.447 5.682 -4.191 1.00 0.00 H new ATOM 0 HB3 ASP A 13 98.520 5.922 -2.456 1.00 0.00 H new ATOM 147 N ALA A 14 100.188 9.145 -2.329 1.00 0.00 N ATOM 148 CA ALA A 14 100.574 9.941 -1.129 1.00 0.00 C ATOM 149 C ALA A 14 99.404 10.772 -0.606 1.00 0.00 C ATOM 150 O ALA A 14 99.107 11.834 -1.118 1.00 0.00 O ATOM 151 CB ALA A 14 101.701 10.849 -1.612 1.00 0.00 C ATOM 0 H ALA A 14 99.790 9.678 -3.102 1.00 0.00 H new ATOM 0 HA ALA A 14 100.878 9.299 -0.302 1.00 0.00 H new ATOM 0 HB1 ALA A 14 102.045 11.472 -0.787 1.00 0.00 H new ATOM 0 HB2 ALA A 14 102.528 10.240 -1.976 1.00 0.00 H new ATOM 0 HB3 ALA A 14 101.336 11.485 -2.419 1.00 0.00 H new ATOM 157 N GLN A 15 98.758 10.306 0.428 1.00 0.00 N ATOM 158 CA GLN A 15 97.626 11.079 1.010 1.00 0.00 C ATOM 159 C GLN A 15 98.186 12.195 1.892 1.00 0.00 C ATOM 160 O GLN A 15 98.824 11.942 2.898 1.00 0.00 O ATOM 161 CB GLN A 15 96.835 10.070 1.845 1.00 0.00 C ATOM 162 CG GLN A 15 96.201 9.027 0.922 1.00 0.00 C ATOM 163 CD GLN A 15 95.449 7.988 1.758 1.00 0.00 C ATOM 164 OE1 GLN A 15 95.691 7.851 2.942 1.00 0.00 O ATOM 165 NE2 GLN A 15 94.540 7.244 1.188 1.00 0.00 N ATOM 0 H GLN A 15 98.966 9.423 0.894 1.00 0.00 H new ATOM 0 HA GLN A 15 96.995 11.543 0.252 1.00 0.00 H new ATOM 0 HB2 GLN A 15 97.493 9.582 2.564 1.00 0.00 H new ATOM 0 HB3 GLN A 15 96.062 10.583 2.417 1.00 0.00 H new ATOM 0 HG2 GLN A 15 95.517 9.512 0.225 1.00 0.00 H new ATOM 0 HG3 GLN A 15 96.972 8.539 0.325 1.00 0.00 H new ATOM 0 HE21 GLN A 15 94.336 7.358 0.195 1.00 0.00 H new ATOM 0 HE22 GLN A 15 94.033 6.548 1.736 1.00 0.00 H new ATOM 172 N GLY A 16 97.963 13.427 1.513 1.00 0.00 N ATOM 173 CA GLY A 16 98.490 14.571 2.311 1.00 0.00 C ATOM 174 C GLY A 16 99.691 15.202 1.591 1.00 0.00 C ATOM 175 O GLY A 16 100.092 16.308 1.898 1.00 0.00 O ATOM 0 H GLY A 16 97.436 13.690 0.680 1.00 0.00 H new ATOM 0 HA2 GLY A 16 97.708 15.317 2.454 1.00 0.00 H new ATOM 0 HA3 GLY A 16 98.788 14.228 3.302 1.00 0.00 H new ATOM 178 N GLN A 17 100.266 14.514 0.631 1.00 0.00 N ATOM 179 CA GLN A 17 101.434 15.085 -0.109 1.00 0.00 C ATOM 180 C GLN A 17 100.998 15.520 -1.512 1.00 0.00 C ATOM 181 O GLN A 17 99.882 15.271 -1.926 1.00 0.00 O ATOM 182 CB GLN A 17 102.462 13.956 -0.182 1.00 0.00 C ATOM 183 CG GLN A 17 102.928 13.598 1.232 1.00 0.00 C ATOM 184 CD GLN A 17 103.991 12.498 1.166 1.00 0.00 C ATOM 185 OE1 GLN A 17 104.197 11.891 0.132 1.00 0.00 O ATOM 186 NE2 GLN A 17 104.682 12.213 2.236 1.00 0.00 N ATOM 0 H GLN A 17 99.976 13.584 0.330 1.00 0.00 H new ATOM 0 HA GLN A 17 101.847 15.965 0.384 1.00 0.00 H new ATOM 0 HB2 GLN A 17 102.024 13.082 -0.664 1.00 0.00 H new ATOM 0 HB3 GLN A 17 103.313 14.263 -0.790 1.00 0.00 H new ATOM 0 HG2 GLN A 17 103.335 14.481 1.725 1.00 0.00 H new ATOM 0 HG3 GLN A 17 102.081 13.262 1.830 1.00 0.00 H new ATOM 0 HE21 GLN A 17 104.511 12.721 3.104 1.00 0.00 H new ATOM 0 HE22 GLN A 17 105.393 11.483 2.204 1.00 0.00 H new ATOM 193 N MET A 18 101.859 16.190 -2.236 1.00 0.00 N ATOM 194 CA MET A 18 101.478 16.666 -3.602 1.00 0.00 C ATOM 195 C MET A 18 101.021 15.508 -4.498 1.00 0.00 C ATOM 196 O MET A 18 99.980 15.589 -5.123 1.00 0.00 O ATOM 197 CB MET A 18 102.742 17.314 -4.169 1.00 0.00 C ATOM 198 CG MET A 18 103.067 18.578 -3.373 1.00 0.00 C ATOM 199 SD MET A 18 104.435 19.457 -4.167 1.00 0.00 S ATOM 200 CE MET A 18 103.510 20.073 -5.595 1.00 0.00 C ATOM 0 H MET A 18 102.806 16.428 -1.942 1.00 0.00 H new ATOM 0 HA MET A 18 100.640 17.361 -3.557 1.00 0.00 H new ATOM 0 HB2 MET A 18 103.576 16.615 -4.118 1.00 0.00 H new ATOM 0 HB3 MET A 18 102.597 17.561 -5.221 1.00 0.00 H new ATOM 0 HG2 MET A 18 102.189 19.222 -3.319 1.00 0.00 H new ATOM 0 HG3 MET A 18 103.334 18.317 -2.349 1.00 0.00 H new ATOM 0 HE1 MET A 18 103.981 20.982 -5.969 1.00 0.00 H new ATOM 0 HE2 MET A 18 103.506 19.317 -6.380 1.00 0.00 H new ATOM 0 HE3 MET A 18 102.485 20.292 -5.297 1.00 0.00 H new ATOM 208 N ASN A 19 101.773 14.436 -4.585 1.00 0.00 N ATOM 209 CA ASN A 19 101.348 13.300 -5.460 1.00 0.00 C ATOM 210 C ASN A 19 102.111 12.019 -5.085 1.00 0.00 C ATOM 211 O ASN A 19 102.575 11.869 -3.972 1.00 0.00 O ATOM 212 CB ASN A 19 101.685 13.751 -6.888 1.00 0.00 C ATOM 213 CG ASN A 19 103.205 13.843 -7.072 1.00 0.00 C ATOM 214 OD1 ASN A 19 103.947 13.857 -6.110 1.00 0.00 O ATOM 215 ND2 ASN A 19 103.699 13.905 -8.278 1.00 0.00 N ATOM 0 H ASN A 19 102.655 14.300 -4.092 1.00 0.00 H new ATOM 0 HA ASN A 19 100.289 13.067 -5.353 1.00 0.00 H new ATOM 0 HB2 ASN A 19 101.267 13.047 -7.607 1.00 0.00 H new ATOM 0 HB3 ASN A 19 101.228 14.720 -7.088 1.00 0.00 H new ATOM 0 HD21 ASN A 19 104.708 13.965 -8.413 1.00 0.00 H new ATOM 0 HD22 ASN A 19 103.076 13.893 -9.086 1.00 0.00 H new ATOM 221 N LYS A 20 102.239 11.096 -6.007 1.00 0.00 N ATOM 222 CA LYS A 20 102.967 9.822 -5.706 1.00 0.00 C ATOM 223 C LYS A 20 104.483 9.997 -5.890 1.00 0.00 C ATOM 224 O LYS A 20 104.940 10.975 -6.450 1.00 0.00 O ATOM 225 CB LYS A 20 102.404 8.794 -6.699 1.00 0.00 C ATOM 226 CG LYS A 20 102.818 9.151 -8.133 1.00 0.00 C ATOM 227 CD LYS A 20 102.144 8.187 -9.112 1.00 0.00 C ATOM 228 CE LYS A 20 102.778 8.335 -10.496 1.00 0.00 C ATOM 229 NZ LYS A 20 102.168 7.252 -11.316 1.00 0.00 N ATOM 0 H LYS A 20 101.871 11.169 -6.955 1.00 0.00 H new ATOM 0 HA LYS A 20 102.824 9.507 -4.672 1.00 0.00 H new ATOM 0 HB2 LYS A 20 102.768 7.798 -6.446 1.00 0.00 H new ATOM 0 HB3 LYS A 20 101.317 8.765 -6.624 1.00 0.00 H new ATOM 0 HG2 LYS A 20 102.531 10.178 -8.361 1.00 0.00 H new ATOM 0 HG3 LYS A 20 103.902 9.092 -8.236 1.00 0.00 H new ATOM 0 HD2 LYS A 20 102.251 7.161 -8.760 1.00 0.00 H new ATOM 0 HD3 LYS A 20 101.076 8.396 -9.166 1.00 0.00 H new ATOM 0 HE2 LYS A 20 102.571 9.317 -10.922 1.00 0.00 H new ATOM 0 HE3 LYS A 20 103.862 8.230 -10.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 102.554 7.288 -12.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 102.387 6.329 -10.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 101.137 7.382 -11.350 1.00 0.00 H new ATOM 239 N MET A 21 105.261 9.056 -5.414 1.00 0.00 N ATOM 240 CA MET A 21 106.748 9.162 -5.551 1.00 0.00 C ATOM 241 C MET A 21 107.328 7.906 -6.216 1.00 0.00 C ATOM 242 O MET A 21 106.654 6.904 -6.366 1.00 0.00 O ATOM 243 CB MET A 21 107.265 9.298 -4.119 1.00 0.00 C ATOM 244 CG MET A 21 106.772 10.617 -3.522 1.00 0.00 C ATOM 245 SD MET A 21 107.496 10.845 -1.879 1.00 0.00 S ATOM 246 CE MET A 21 106.631 12.379 -1.463 1.00 0.00 C ATOM 0 H MET A 21 104.930 8.218 -4.936 1.00 0.00 H new ATOM 0 HA MET A 21 107.040 10.005 -6.178 1.00 0.00 H new ATOM 0 HB2 MET A 21 106.917 8.460 -3.514 1.00 0.00 H new ATOM 0 HB3 MET A 21 108.355 9.267 -4.110 1.00 0.00 H new ATOM 0 HG2 MET A 21 107.048 11.448 -4.171 1.00 0.00 H new ATOM 0 HG3 MET A 21 105.684 10.614 -3.454 1.00 0.00 H new ATOM 0 HE1 MET A 21 106.533 12.459 -0.380 1.00 0.00 H new ATOM 0 HE2 MET A 21 107.198 13.230 -1.840 1.00 0.00 H new ATOM 0 HE3 MET A 21 105.640 12.373 -1.918 1.00 0.00 H new ATOM 254 N GLY A 22 108.575 7.963 -6.618 1.00 0.00 N ATOM 255 CA GLY A 22 109.205 6.773 -7.283 1.00 0.00 C ATOM 256 C GLY A 22 110.698 6.704 -6.950 1.00 0.00 C ATOM 257 O GLY A 22 111.414 7.676 -7.096 1.00 0.00 O ATOM 0 H GLY A 22 109.183 8.776 -6.516 1.00 0.00 H new ATOM 0 HA2 GLY A 22 108.710 5.860 -6.953 1.00 0.00 H new ATOM 0 HA3 GLY A 22 109.069 6.837 -8.363 1.00 0.00 H new ATOM 260 N GLY A 23 111.176 5.569 -6.483 1.00 0.00 N ATOM 261 CA GLY A 23 112.624 5.477 -6.127 1.00 0.00 C ATOM 262 C GLY A 23 113.173 4.081 -6.419 1.00 0.00 C ATOM 263 O GLY A 23 112.550 3.277 -7.085 1.00 0.00 O ATOM 0 H GLY A 23 110.632 4.718 -6.337 1.00 0.00 H new ATOM 0 HA2 GLY A 23 113.189 6.219 -6.692 1.00 0.00 H new ATOM 0 HA3 GLY A 23 112.758 5.711 -5.071 1.00 0.00 H new ATOM 266 N PHE A 24 114.347 3.799 -5.917 1.00 0.00 N ATOM 267 CA PHE A 24 114.973 2.465 -6.144 1.00 0.00 C ATOM 268 C PHE A 24 115.262 1.801 -4.797 1.00 0.00 C ATOM 269 O PHE A 24 115.296 2.456 -3.772 1.00 0.00 O ATOM 270 CB PHE A 24 116.274 2.755 -6.894 1.00 0.00 C ATOM 271 CG PHE A 24 115.958 3.386 -8.228 1.00 0.00 C ATOM 272 CD1 PHE A 24 115.658 2.577 -9.331 1.00 0.00 C ATOM 273 CD2 PHE A 24 115.964 4.779 -8.364 1.00 0.00 C ATOM 274 CE1 PHE A 24 115.364 3.161 -10.569 1.00 0.00 C ATOM 275 CE2 PHE A 24 115.670 5.364 -9.601 1.00 0.00 C ATOM 276 CZ PHE A 24 115.370 4.555 -10.704 1.00 0.00 C ATOM 0 H PHE A 24 114.903 4.443 -5.354 1.00 0.00 H new ATOM 0 HA PHE A 24 114.329 1.790 -6.708 1.00 0.00 H new ATOM 0 HB2 PHE A 24 116.905 3.421 -6.305 1.00 0.00 H new ATOM 0 HB3 PHE A 24 116.835 1.832 -7.040 1.00 0.00 H new ATOM 0 HD1 PHE A 24 115.653 1.502 -9.227 1.00 0.00 H new ATOM 0 HD2 PHE A 24 116.196 5.403 -7.514 1.00 0.00 H new ATOM 0 HE1 PHE A 24 115.133 2.537 -11.419 1.00 0.00 H new ATOM 0 HE2 PHE A 24 115.674 6.439 -9.705 1.00 0.00 H new ATOM 0 HZ PHE A 24 115.143 5.006 -11.659 1.00 0.00 H new ATOM 285 N ASN A 25 115.464 0.511 -4.786 1.00 0.00 N ATOM 286 CA ASN A 25 115.741 -0.173 -3.490 1.00 0.00 C ATOM 287 C ASN A 25 116.661 -1.386 -3.660 1.00 0.00 C ATOM 288 O ASN A 25 116.482 -2.200 -4.541 1.00 0.00 O ATOM 289 CB ASN A 25 114.363 -0.609 -2.978 1.00 0.00 C ATOM 290 CG ASN A 25 113.762 -1.649 -3.927 1.00 0.00 C ATOM 291 OD1 ASN A 25 113.923 -1.558 -5.128 1.00 0.00 O ATOM 292 ND2 ASN A 25 113.079 -2.646 -3.436 1.00 0.00 N ATOM 0 H ASN A 25 115.450 -0.093 -5.608 1.00 0.00 H new ATOM 0 HA ASN A 25 116.260 0.489 -2.797 1.00 0.00 H new ATOM 0 HB2 ASN A 25 114.453 -1.027 -1.975 1.00 0.00 H new ATOM 0 HB3 ASN A 25 113.702 0.255 -2.905 1.00 0.00 H new ATOM 0 HD21 ASN A 25 112.681 -3.348 -4.060 1.00 0.00 H new ATOM 0 HD22 ASN A 25 112.943 -2.724 -2.428 1.00 0.00 H new ATOM 298 N LEU A 26 117.625 -1.514 -2.791 1.00 0.00 N ATOM 299 CA LEU A 26 118.556 -2.680 -2.844 1.00 0.00 C ATOM 300 C LEU A 26 118.312 -3.514 -1.590 1.00 0.00 C ATOM 301 O LEU A 26 117.920 -2.975 -0.572 1.00 0.00 O ATOM 302 CB LEU A 26 119.969 -2.085 -2.843 1.00 0.00 C ATOM 303 CG LEU A 26 120.133 -1.120 -4.022 1.00 0.00 C ATOM 304 CD1 LEU A 26 121.546 -0.535 -4.008 1.00 0.00 C ATOM 305 CD2 LEU A 26 119.913 -1.871 -5.339 1.00 0.00 C ATOM 0 H LEU A 26 117.811 -0.853 -2.037 1.00 0.00 H new ATOM 0 HA LEU A 26 118.415 -3.315 -3.719 1.00 0.00 H new ATOM 0 HB2 LEU A 26 120.151 -1.560 -1.905 1.00 0.00 H new ATOM 0 HB3 LEU A 26 120.708 -2.883 -2.910 1.00 0.00 H new ATOM 0 HG LEU A 26 119.400 -0.318 -3.934 1.00 0.00 H new ATOM 0 HD11 LEU A 26 121.664 0.152 -4.846 1.00 0.00 H new ATOM 0 HD12 LEU A 26 121.708 0.002 -3.073 1.00 0.00 H new ATOM 0 HD13 LEU A 26 122.274 -1.341 -4.094 1.00 0.00 H new ATOM 0 HD21 LEU A 26 120.030 -1.182 -6.175 1.00 0.00 H new ATOM 0 HD22 LEU A 26 120.644 -2.675 -5.426 1.00 0.00 H new ATOM 0 HD23 LEU A 26 118.908 -2.292 -5.354 1.00 0.00 H new ATOM 316 N LYS A 27 118.514 -4.808 -1.622 1.00 0.00 N ATOM 317 CA LYS A 27 118.258 -5.610 -0.394 1.00 0.00 C ATOM 318 C LYS A 27 119.383 -6.623 -0.171 1.00 0.00 C ATOM 319 O LYS A 27 119.883 -7.223 -1.103 1.00 0.00 O ATOM 320 CB LYS A 27 116.944 -6.347 -0.673 1.00 0.00 C ATOM 321 CG LYS A 27 115.830 -5.336 -0.953 1.00 0.00 C ATOM 322 CD LYS A 27 114.497 -6.073 -1.094 1.00 0.00 C ATOM 323 CE LYS A 27 113.405 -5.082 -1.502 1.00 0.00 C ATOM 324 NZ LYS A 27 112.123 -5.757 -1.154 1.00 0.00 N ATOM 0 H LYS A 27 118.840 -5.334 -2.433 1.00 0.00 H new ATOM 0 HA LYS A 27 118.207 -4.985 0.497 1.00 0.00 H new ATOM 0 HB2 LYS A 27 117.065 -7.014 -1.527 1.00 0.00 H new ATOM 0 HB3 LYS A 27 116.677 -6.969 0.182 1.00 0.00 H new ATOM 0 HG2 LYS A 27 115.772 -4.609 -0.143 1.00 0.00 H new ATOM 0 HG3 LYS A 27 116.049 -4.781 -1.865 1.00 0.00 H new ATOM 0 HD2 LYS A 27 114.583 -6.863 -1.840 1.00 0.00 H new ATOM 0 HD3 LYS A 27 114.233 -6.553 -0.151 1.00 0.00 H new ATOM 0 HE2 LYS A 27 113.511 -4.137 -0.970 1.00 0.00 H new ATOM 0 HE3 LYS A 27 113.455 -4.855 -2.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 111.359 -5.381 -1.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 112.215 -6.781 -1.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 111.899 -5.581 -0.154 1.00 0.00 H new ATOM 334 N TYR A 28 119.761 -6.840 1.060 1.00 0.00 N ATOM 335 CA TYR A 28 120.827 -7.842 1.355 1.00 0.00 C ATOM 336 C TYR A 28 120.234 -8.923 2.257 1.00 0.00 C ATOM 337 O TYR A 28 119.696 -8.625 3.305 1.00 0.00 O ATOM 338 CB TYR A 28 121.925 -7.063 2.083 1.00 0.00 C ATOM 339 CG TYR A 28 122.443 -5.961 1.189 1.00 0.00 C ATOM 340 CD1 TYR A 28 123.383 -6.251 0.193 1.00 0.00 C ATOM 341 CD2 TYR A 28 121.983 -4.649 1.357 1.00 0.00 C ATOM 342 CE1 TYR A 28 123.862 -5.230 -0.636 1.00 0.00 C ATOM 343 CE2 TYR A 28 122.463 -3.628 0.529 1.00 0.00 C ATOM 344 CZ TYR A 28 123.402 -3.918 -0.468 1.00 0.00 C ATOM 345 OH TYR A 28 123.874 -2.911 -1.284 1.00 0.00 O ATOM 0 H TYR A 28 119.377 -6.365 1.877 1.00 0.00 H new ATOM 0 HA TYR A 28 121.223 -8.328 0.463 1.00 0.00 H new ATOM 0 HB2 TYR A 28 121.533 -6.640 3.008 1.00 0.00 H new ATOM 0 HB3 TYR A 28 122.739 -7.734 2.359 1.00 0.00 H new ATOM 0 HD1 TYR A 28 123.739 -7.263 0.064 1.00 0.00 H new ATOM 0 HD2 TYR A 28 121.258 -4.425 2.125 1.00 0.00 H new ATOM 0 HE1 TYR A 28 124.586 -5.454 -1.405 1.00 0.00 H new ATOM 0 HE2 TYR A 28 122.109 -2.616 0.659 1.00 0.00 H new ATOM 0 HH TYR A 28 123.452 -2.063 -1.034 1.00 0.00 H new ATOM 354 N ARG A 29 120.299 -10.167 1.860 1.00 0.00 N ATOM 355 CA ARG A 29 119.699 -11.237 2.710 1.00 0.00 C ATOM 356 C ARG A 29 120.719 -12.311 3.089 1.00 0.00 C ATOM 357 O ARG A 29 121.576 -12.689 2.311 1.00 0.00 O ATOM 358 CB ARG A 29 118.577 -11.841 1.859 1.00 0.00 C ATOM 359 CG ARG A 29 117.856 -12.932 2.657 1.00 0.00 C ATOM 360 CD ARG A 29 116.679 -13.469 1.838 1.00 0.00 C ATOM 361 NE ARG A 29 117.298 -14.214 0.706 1.00 0.00 N ATOM 362 CZ ARG A 29 116.568 -15.008 -0.029 1.00 0.00 C ATOM 363 NH1 ARG A 29 115.409 -14.605 -0.470 1.00 0.00 N ATOM 364 NH2 ARG A 29 116.998 -16.205 -0.320 1.00 0.00 N ATOM 0 H ARG A 29 120.736 -10.486 0.995 1.00 0.00 H new ATOM 0 HA ARG A 29 119.337 -10.829 3.653 1.00 0.00 H new ATOM 0 HB2 ARG A 29 117.871 -11.064 1.566 1.00 0.00 H new ATOM 0 HB3 ARG A 29 118.989 -12.260 0.941 1.00 0.00 H new ATOM 0 HG2 ARG A 29 118.547 -13.741 2.894 1.00 0.00 H new ATOM 0 HG3 ARG A 29 117.500 -12.529 3.605 1.00 0.00 H new ATOM 0 HD2 ARG A 29 116.046 -14.121 2.439 1.00 0.00 H new ATOM 0 HD3 ARG A 29 116.048 -12.657 1.477 1.00 0.00 H new ATOM 0 HE ARG A 29 118.292 -14.104 0.505 1.00 0.00 H new ATOM 0 HH11 ARG A 29 115.073 -13.670 -0.241 1.00 0.00 H new ATOM 0 HH12 ARG A 29 114.838 -15.225 -1.044 1.00 0.00 H new ATOM 0 HH21 ARG A 29 117.904 -16.520 0.027 1.00 0.00 H new ATOM 0 HH22 ARG A 29 116.428 -16.826 -0.894 1.00 0.00 H new ATOM 375 N TYR A 30 120.596 -12.808 4.289 1.00 0.00 N ATOM 376 CA TYR A 30 121.506 -13.877 4.779 1.00 0.00 C ATOM 377 C TYR A 30 120.701 -15.166 4.964 1.00 0.00 C ATOM 378 O TYR A 30 119.621 -15.153 5.531 1.00 0.00 O ATOM 379 CB TYR A 30 122.032 -13.364 6.121 1.00 0.00 C ATOM 380 CG TYR A 30 122.983 -14.372 6.717 1.00 0.00 C ATOM 381 CD1 TYR A 30 124.320 -14.408 6.303 1.00 0.00 C ATOM 382 CD2 TYR A 30 122.528 -15.271 7.689 1.00 0.00 C ATOM 383 CE1 TYR A 30 125.201 -15.344 6.860 1.00 0.00 C ATOM 384 CE2 TYR A 30 123.408 -16.206 8.246 1.00 0.00 C ATOM 385 CZ TYR A 30 124.745 -16.242 7.832 1.00 0.00 C ATOM 386 OH TYR A 30 125.612 -17.164 8.381 1.00 0.00 O ATOM 0 H TYR A 30 119.889 -12.511 4.962 1.00 0.00 H new ATOM 0 HA TYR A 30 122.323 -14.095 4.091 1.00 0.00 H new ATOM 0 HB2 TYR A 30 122.540 -12.410 5.982 1.00 0.00 H new ATOM 0 HB3 TYR A 30 121.201 -13.187 6.804 1.00 0.00 H new ATOM 0 HD1 TYR A 30 124.672 -13.714 5.554 1.00 0.00 H new ATOM 0 HD2 TYR A 30 121.497 -15.243 8.009 1.00 0.00 H new ATOM 0 HE1 TYR A 30 126.232 -15.373 6.539 1.00 0.00 H new ATOM 0 HE2 TYR A 30 123.056 -16.900 8.995 1.00 0.00 H new ATOM 0 HH TYR A 30 125.167 -18.035 8.442 1.00 0.00 H new ATOM 395 N GLU A 31 121.210 -16.275 4.493 1.00 0.00 N ATOM 396 CA GLU A 31 120.472 -17.565 4.641 1.00 0.00 C ATOM 397 C GLU A 31 121.460 -18.703 4.910 1.00 0.00 C ATOM 398 O GLU A 31 122.612 -18.635 4.526 1.00 0.00 O ATOM 399 CB GLU A 31 119.769 -17.786 3.299 1.00 0.00 C ATOM 400 CG GLU A 31 118.807 -16.626 3.007 1.00 0.00 C ATOM 401 CD GLU A 31 117.736 -16.540 4.100 1.00 0.00 C ATOM 402 OE1 GLU A 31 117.552 -17.517 4.810 1.00 0.00 O ATOM 403 OE2 GLU A 31 117.114 -15.496 4.207 1.00 0.00 O ATOM 0 H GLU A 31 122.107 -16.343 4.011 1.00 0.00 H new ATOM 0 HA GLU A 31 119.766 -17.540 5.471 1.00 0.00 H new ATOM 0 HB2 GLU A 31 120.508 -17.865 2.502 1.00 0.00 H new ATOM 0 HB3 GLU A 31 119.220 -18.727 3.319 1.00 0.00 H new ATOM 0 HG2 GLU A 31 119.361 -15.689 2.956 1.00 0.00 H new ATOM 0 HG3 GLU A 31 118.335 -16.771 2.035 1.00 0.00 H new ATOM 408 N GLU A 32 121.022 -19.749 5.562 1.00 0.00 N ATOM 409 CA GLU A 32 121.939 -20.891 5.847 1.00 0.00 C ATOM 410 C GLU A 32 121.735 -22.003 4.814 1.00 0.00 C ATOM 411 O GLU A 32 121.002 -21.848 3.857 1.00 0.00 O ATOM 412 CB GLU A 32 121.553 -21.378 7.245 1.00 0.00 C ATOM 413 CG GLU A 32 121.872 -20.291 8.276 1.00 0.00 C ATOM 414 CD GLU A 32 123.384 -20.035 8.314 1.00 0.00 C ATOM 415 OE1 GLU A 32 124.127 -20.877 7.831 1.00 0.00 O ATOM 416 OE2 GLU A 32 123.775 -19.001 8.828 1.00 0.00 O ATOM 0 H GLU A 32 120.069 -19.861 5.909 1.00 0.00 H new ATOM 0 HA GLU A 32 122.988 -20.598 5.796 1.00 0.00 H new ATOM 0 HB2 GLU A 32 120.491 -21.621 7.276 1.00 0.00 H new ATOM 0 HB3 GLU A 32 122.097 -22.292 7.485 1.00 0.00 H new ATOM 0 HG2 GLU A 32 121.345 -19.371 8.022 1.00 0.00 H new ATOM 0 HG3 GLU A 32 121.521 -20.598 9.261 1.00 0.00 H new ATOM 421 N ASP A 33 122.380 -23.122 5.008 1.00 0.00 N ATOM 422 CA ASP A 33 122.228 -24.254 4.044 1.00 0.00 C ATOM 423 C ASP A 33 120.777 -24.747 4.023 1.00 0.00 C ATOM 424 O ASP A 33 120.249 -25.106 2.987 1.00 0.00 O ATOM 425 CB ASP A 33 123.159 -25.352 4.566 1.00 0.00 C ATOM 426 CG ASP A 33 124.619 -24.890 4.470 1.00 0.00 C ATOM 427 OD1 ASP A 33 124.880 -23.949 3.737 1.00 0.00 O ATOM 428 OD2 ASP A 33 125.450 -25.488 5.132 1.00 0.00 O ATOM 0 H ASP A 33 123.006 -23.303 5.792 1.00 0.00 H new ATOM 0 HA ASP A 33 122.477 -23.959 3.025 1.00 0.00 H new ATOM 0 HB2 ASP A 33 122.911 -25.589 5.601 1.00 0.00 H new ATOM 0 HB3 ASP A 33 123.019 -26.265 3.987 1.00 0.00 H new ATOM 432 N ASN A 34 120.136 -24.780 5.162 1.00 0.00 N ATOM 433 CA ASN A 34 118.723 -25.261 5.220 1.00 0.00 C ATOM 434 C ASN A 34 117.737 -24.087 5.225 1.00 0.00 C ATOM 435 O ASN A 34 116.586 -24.248 5.578 1.00 0.00 O ATOM 436 CB ASN A 34 118.629 -26.043 6.531 1.00 0.00 C ATOM 437 CG ASN A 34 119.539 -27.272 6.463 1.00 0.00 C ATOM 438 OD1 ASN A 34 119.931 -27.695 5.393 1.00 0.00 O ATOM 439 ND2 ASN A 34 119.894 -27.869 7.568 1.00 0.00 N ATOM 0 H ASN A 34 120.531 -24.494 6.058 1.00 0.00 H new ATOM 0 HA ASN A 34 118.468 -25.870 4.352 1.00 0.00 H new ATOM 0 HB2 ASN A 34 118.921 -25.407 7.367 1.00 0.00 H new ATOM 0 HB3 ASN A 34 117.599 -26.350 6.710 1.00 0.00 H new ATOM 0 HD21 ASN A 34 120.499 -28.689 7.533 1.00 0.00 H new ATOM 0 HD22 ASN A 34 119.566 -27.515 8.467 1.00 0.00 H new ATOM 445 N SER A 35 118.172 -22.917 4.816 1.00 0.00 N ATOM 446 CA SER A 35 117.274 -21.710 4.764 1.00 0.00 C ATOM 447 C SER A 35 116.225 -21.671 5.896 1.00 0.00 C ATOM 448 O SER A 35 115.045 -21.563 5.627 1.00 0.00 O ATOM 449 CB SER A 35 116.583 -21.812 3.405 1.00 0.00 C ATOM 450 OG SER A 35 117.366 -21.136 2.430 1.00 0.00 O ATOM 0 H SER A 35 119.129 -22.742 4.510 1.00 0.00 H new ATOM 0 HA SER A 35 117.854 -20.796 4.896 1.00 0.00 H new ATOM 0 HB2 SER A 35 116.457 -22.858 3.126 1.00 0.00 H new ATOM 0 HB3 SER A 35 115.587 -21.373 3.457 1.00 0.00 H new ATOM 0 HG SER A 35 116.796 -20.523 1.921 1.00 0.00 H new ATOM 455 N PRO A 36 116.675 -21.733 7.129 1.00 0.00 N ATOM 456 CA PRO A 36 115.738 -21.671 8.267 1.00 0.00 C ATOM 457 C PRO A 36 115.493 -20.207 8.664 1.00 0.00 C ATOM 458 O PRO A 36 114.429 -19.661 8.443 1.00 0.00 O ATOM 459 CB PRO A 36 116.476 -22.433 9.365 1.00 0.00 C ATOM 460 CG PRO A 36 117.938 -22.343 9.021 1.00 0.00 C ATOM 461 CD PRO A 36 118.062 -21.866 7.589 1.00 0.00 C ATOM 0 HA PRO A 36 114.755 -22.093 8.056 1.00 0.00 H new ATOM 0 HB2 PRO A 36 116.278 -21.996 10.344 1.00 0.00 H new ATOM 0 HB3 PRO A 36 116.148 -23.472 9.407 1.00 0.00 H new ATOM 0 HG2 PRO A 36 118.445 -21.653 9.696 1.00 0.00 H new ATOM 0 HG3 PRO A 36 118.416 -23.315 9.140 1.00 0.00 H new ATOM 0 HD2 PRO A 36 118.593 -20.916 7.531 1.00 0.00 H new ATOM 0 HD3 PRO A 36 118.617 -22.579 6.979 1.00 0.00 H new ATOM 466 N LEU A 37 116.480 -19.573 9.241 1.00 0.00 N ATOM 467 CA LEU A 37 116.322 -18.145 9.649 1.00 0.00 C ATOM 468 C LEU A 37 116.830 -17.224 8.538 1.00 0.00 C ATOM 469 O LEU A 37 117.984 -17.276 8.158 1.00 0.00 O ATOM 470 CB LEU A 37 117.179 -17.991 10.910 1.00 0.00 C ATOM 471 CG LEU A 37 116.714 -18.980 11.986 1.00 0.00 C ATOM 472 CD1 LEU A 37 117.588 -18.824 13.231 1.00 0.00 C ATOM 473 CD2 LEU A 37 115.255 -18.695 12.354 1.00 0.00 C ATOM 0 H LEU A 37 117.391 -19.983 9.448 1.00 0.00 H new ATOM 0 HA LEU A 37 115.281 -17.880 9.833 1.00 0.00 H new ATOM 0 HB2 LEU A 37 118.228 -18.168 10.671 1.00 0.00 H new ATOM 0 HB3 LEU A 37 117.106 -16.971 11.287 1.00 0.00 H new ATOM 0 HG LEU A 37 116.799 -19.996 11.602 1.00 0.00 H new ATOM 0 HD11 LEU A 37 117.259 -19.526 13.997 1.00 0.00 H new ATOM 0 HD12 LEU A 37 118.627 -19.028 12.974 1.00 0.00 H new ATOM 0 HD13 LEU A 37 117.502 -17.806 13.611 1.00 0.00 H new ATOM 0 HD21 LEU A 37 114.928 -19.400 13.119 1.00 0.00 H new ATOM 0 HD22 LEU A 37 115.168 -17.678 12.737 1.00 0.00 H new ATOM 0 HD23 LEU A 37 114.628 -18.804 11.469 1.00 0.00 H new ATOM 484 N GLY A 38 115.976 -16.384 8.010 1.00 0.00 N ATOM 485 CA GLY A 38 116.413 -15.464 6.920 1.00 0.00 C ATOM 486 C GLY A 38 116.179 -14.009 7.329 1.00 0.00 C ATOM 487 O GLY A 38 115.136 -13.657 7.835 1.00 0.00 O ATOM 0 H GLY A 38 114.998 -16.297 8.287 1.00 0.00 H new ATOM 0 HA2 GLY A 38 117.469 -15.623 6.702 1.00 0.00 H new ATOM 0 HA3 GLY A 38 115.863 -15.685 6.006 1.00 0.00 H new ATOM 490 N VAL A 39 117.145 -13.158 7.100 1.00 0.00 N ATOM 491 CA VAL A 39 116.979 -11.712 7.456 1.00 0.00 C ATOM 492 C VAL A 39 117.376 -10.856 6.252 1.00 0.00 C ATOM 493 O VAL A 39 118.402 -11.090 5.641 1.00 0.00 O ATOM 494 CB VAL A 39 117.932 -11.471 8.629 1.00 0.00 C ATOM 495 CG1 VAL A 39 117.809 -10.020 9.096 1.00 0.00 C ATOM 496 CG2 VAL A 39 117.570 -12.406 9.786 1.00 0.00 C ATOM 0 H VAL A 39 118.043 -13.399 6.682 1.00 0.00 H new ATOM 0 HA VAL A 39 115.954 -11.456 7.723 1.00 0.00 H new ATOM 0 HB VAL A 39 118.955 -11.668 8.308 1.00 0.00 H new ATOM 0 HG11 VAL A 39 118.488 -9.848 9.931 1.00 0.00 H new ATOM 0 HG12 VAL A 39 118.067 -9.351 8.275 1.00 0.00 H new ATOM 0 HG13 VAL A 39 116.785 -9.826 9.415 1.00 0.00 H new ATOM 0 HG21 VAL A 39 118.250 -12.233 10.620 1.00 0.00 H new ATOM 0 HG22 VAL A 39 116.546 -12.210 10.105 1.00 0.00 H new ATOM 0 HG23 VAL A 39 117.656 -13.442 9.457 1.00 0.00 H new ATOM 506 N ILE A 40 116.584 -9.877 5.883 1.00 0.00 N ATOM 507 CA ILE A 40 116.941 -9.038 4.699 1.00 0.00 C ATOM 508 C ILE A 40 117.087 -7.565 5.099 1.00 0.00 C ATOM 509 O ILE A 40 116.299 -7.043 5.858 1.00 0.00 O ATOM 510 CB ILE A 40 115.758 -9.192 3.736 1.00 0.00 C ATOM 511 CG1 ILE A 40 115.533 -10.670 3.411 1.00 0.00 C ATOM 512 CG2 ILE A 40 116.052 -8.432 2.441 1.00 0.00 C ATOM 513 CD1 ILE A 40 114.227 -10.829 2.631 1.00 0.00 C ATOM 0 H ILE A 40 115.712 -9.625 6.348 1.00 0.00 H new ATOM 0 HA ILE A 40 117.889 -9.347 4.259 1.00 0.00 H new ATOM 0 HB ILE A 40 114.863 -8.788 4.208 1.00 0.00 H new ATOM 0 HG12 ILE A 40 116.368 -11.055 2.825 1.00 0.00 H new ATOM 0 HG13 ILE A 40 115.493 -11.253 4.331 1.00 0.00 H new ATOM 0 HG21 ILE A 40 115.211 -8.541 1.756 1.00 0.00 H new ATOM 0 HG22 ILE A 40 116.203 -7.376 2.665 1.00 0.00 H new ATOM 0 HG23 ILE A 40 116.952 -8.837 1.978 1.00 0.00 H new ATOM 0 HD11 ILE A 40 114.067 -11.882 2.400 1.00 0.00 H new ATOM 0 HD12 ILE A 40 113.397 -10.460 3.233 1.00 0.00 H new ATOM 0 HD13 ILE A 40 114.285 -10.259 1.704 1.00 0.00 H new ATOM 524 N GLY A 41 118.070 -6.889 4.564 1.00 0.00 N ATOM 525 CA GLY A 41 118.253 -5.439 4.875 1.00 0.00 C ATOM 526 C GLY A 41 117.979 -4.650 3.593 1.00 0.00 C ATOM 527 O GLY A 41 118.651 -4.833 2.598 1.00 0.00 O ATOM 0 H GLY A 41 118.758 -7.281 3.921 1.00 0.00 H new ATOM 0 HA2 GLY A 41 117.572 -5.129 5.668 1.00 0.00 H new ATOM 0 HA3 GLY A 41 119.265 -5.249 5.232 1.00 0.00 H new ATOM 530 N SER A 42 116.981 -3.801 3.590 1.00 0.00 N ATOM 531 CA SER A 42 116.656 -3.046 2.340 1.00 0.00 C ATOM 532 C SER A 42 116.666 -1.529 2.552 1.00 0.00 C ATOM 533 O SER A 42 116.212 -1.023 3.560 1.00 0.00 O ATOM 534 CB SER A 42 115.248 -3.507 1.972 1.00 0.00 C ATOM 535 OG SER A 42 114.830 -2.838 0.789 1.00 0.00 O ATOM 0 H SER A 42 116.382 -3.599 4.391 1.00 0.00 H new ATOM 0 HA SER A 42 117.396 -3.241 1.564 1.00 0.00 H new ATOM 0 HB2 SER A 42 115.235 -4.586 1.818 1.00 0.00 H new ATOM 0 HB3 SER A 42 114.558 -3.293 2.788 1.00 0.00 H new ATOM 0 HG SER A 42 113.856 -2.732 0.800 1.00 0.00 H new ATOM 540 N PHE A 43 117.157 -0.803 1.577 1.00 0.00 N ATOM 541 CA PHE A 43 117.175 0.686 1.670 1.00 0.00 C ATOM 542 C PHE A 43 116.357 1.256 0.508 1.00 0.00 C ATOM 543 O PHE A 43 116.388 0.726 -0.586 1.00 0.00 O ATOM 544 CB PHE A 43 118.647 1.081 1.542 1.00 0.00 C ATOM 545 CG PHE A 43 119.430 0.487 2.688 1.00 0.00 C ATOM 546 CD1 PHE A 43 119.480 1.153 3.919 1.00 0.00 C ATOM 547 CD2 PHE A 43 120.105 -0.727 2.520 1.00 0.00 C ATOM 548 CE1 PHE A 43 120.206 0.602 4.983 1.00 0.00 C ATOM 549 CE2 PHE A 43 120.830 -1.278 3.585 1.00 0.00 C ATOM 550 CZ PHE A 43 120.880 -0.612 4.816 1.00 0.00 C ATOM 0 H PHE A 43 117.548 -1.183 0.715 1.00 0.00 H new ATOM 0 HA PHE A 43 116.748 1.063 2.599 1.00 0.00 H new ATOM 0 HB2 PHE A 43 119.048 0.728 0.592 1.00 0.00 H new ATOM 0 HB3 PHE A 43 118.745 2.167 1.545 1.00 0.00 H new ATOM 0 HD1 PHE A 43 118.959 2.090 4.048 1.00 0.00 H new ATOM 0 HD2 PHE A 43 120.067 -1.239 1.570 1.00 0.00 H new ATOM 0 HE1 PHE A 43 120.245 1.115 5.933 1.00 0.00 H new ATOM 0 HE2 PHE A 43 121.350 -2.216 3.457 1.00 0.00 H new ATOM 0 HZ PHE A 43 121.439 -1.036 5.637 1.00 0.00 H new ATOM 559 N THR A 44 115.617 2.313 0.724 1.00 0.00 N ATOM 560 CA THR A 44 114.801 2.875 -0.394 1.00 0.00 C ATOM 561 C THR A 44 115.008 4.382 -0.515 1.00 0.00 C ATOM 562 O THR A 44 115.053 5.090 0.474 1.00 0.00 O ATOM 563 CB THR A 44 113.352 2.563 -0.017 1.00 0.00 C ATOM 564 OG1 THR A 44 113.214 1.168 0.216 1.00 0.00 O ATOM 565 CG2 THR A 44 112.423 2.986 -1.157 1.00 0.00 C ATOM 0 H THR A 44 115.542 2.806 1.614 1.00 0.00 H new ATOM 0 HA THR A 44 115.080 2.447 -1.357 1.00 0.00 H new ATOM 0 HB THR A 44 113.086 3.111 0.887 1.00 0.00 H new ATOM 0 HG1 THR A 44 112.286 0.967 0.459 1.00 0.00 H new ATOM 0 HG21 THR A 44 111.391 2.763 -0.887 1.00 0.00 H new ATOM 0 HG22 THR A 44 112.529 4.056 -1.334 1.00 0.00 H new ATOM 0 HG23 THR A 44 112.687 2.440 -2.063 1.00 0.00 H new ATOM 573 N TYR A 45 115.108 4.886 -1.718 1.00 0.00 N ATOM 574 CA TYR A 45 115.281 6.351 -1.905 1.00 0.00 C ATOM 575 C TYR A 45 114.371 6.802 -3.047 1.00 0.00 C ATOM 576 O TYR A 45 114.596 6.468 -4.194 1.00 0.00 O ATOM 577 CB TYR A 45 116.753 6.536 -2.274 1.00 0.00 C ATOM 578 CG TYR A 45 117.070 8.009 -2.369 1.00 0.00 C ATOM 579 CD1 TYR A 45 117.408 8.727 -1.216 1.00 0.00 C ATOM 580 CD2 TYR A 45 117.027 8.656 -3.609 1.00 0.00 C ATOM 581 CE1 TYR A 45 117.702 10.093 -1.303 1.00 0.00 C ATOM 582 CE2 TYR A 45 117.322 10.022 -3.697 1.00 0.00 C ATOM 583 CZ TYR A 45 117.660 10.740 -2.544 1.00 0.00 C ATOM 584 OH TYR A 45 117.951 12.086 -2.631 1.00 0.00 O ATOM 0 H TYR A 45 115.077 4.341 -2.580 1.00 0.00 H new ATOM 0 HA TYR A 45 115.024 6.934 -1.021 1.00 0.00 H new ATOM 0 HB2 TYR A 45 117.388 6.065 -1.524 1.00 0.00 H new ATOM 0 HB3 TYR A 45 116.964 6.046 -3.224 1.00 0.00 H new ATOM 0 HD1 TYR A 45 117.442 8.227 -0.259 1.00 0.00 H new ATOM 0 HD2 TYR A 45 116.766 8.102 -4.498 1.00 0.00 H new ATOM 0 HE1 TYR A 45 117.961 10.648 -0.413 1.00 0.00 H new ATOM 0 HE2 TYR A 45 117.289 10.521 -4.654 1.00 0.00 H new ATOM 0 HH TYR A 45 118.149 12.436 -1.737 1.00 0.00 H new ATOM 593 N THR A 46 113.345 7.548 -2.744 1.00 0.00 N ATOM 594 CA THR A 46 112.411 8.007 -3.817 1.00 0.00 C ATOM 595 C THR A 46 112.352 9.529 -3.840 1.00 0.00 C ATOM 596 O THR A 46 112.657 10.183 -2.861 1.00 0.00 O ATOM 597 CB THR A 46 111.037 7.431 -3.442 1.00 0.00 C ATOM 598 OG1 THR A 46 110.581 8.045 -2.245 1.00 0.00 O ATOM 599 CG2 THR A 46 111.126 5.915 -3.237 1.00 0.00 C ATOM 0 H THR A 46 113.111 7.861 -1.802 1.00 0.00 H new ATOM 0 HA THR A 46 112.733 7.676 -4.805 1.00 0.00 H new ATOM 0 HB THR A 46 110.338 7.633 -4.253 1.00 0.00 H new ATOM 0 HG1 THR A 46 110.814 7.481 -1.478 1.00 0.00 H new ATOM 0 HG21 THR A 46 110.143 5.525 -2.972 1.00 0.00 H new ATOM 0 HG22 THR A 46 111.467 5.443 -4.158 1.00 0.00 H new ATOM 0 HG23 THR A 46 111.831 5.697 -2.435 1.00 0.00 H new ATOM 607 N GLU A 47 111.962 10.104 -4.947 1.00 0.00 N ATOM 608 CA GLU A 47 111.886 11.588 -5.023 1.00 0.00 C ATOM 609 C GLU A 47 110.447 12.031 -5.294 1.00 0.00 C ATOM 610 O GLU A 47 109.647 11.291 -5.843 1.00 0.00 O ATOM 611 CB GLU A 47 112.817 11.980 -6.180 1.00 0.00 C ATOM 612 CG GLU A 47 112.257 11.468 -7.515 1.00 0.00 C ATOM 613 CD GLU A 47 113.239 11.780 -8.651 1.00 0.00 C ATOM 614 OE1 GLU A 47 114.205 12.485 -8.406 1.00 0.00 O ATOM 615 OE2 GLU A 47 113.005 11.307 -9.751 1.00 0.00 O ATOM 0 H GLU A 47 111.694 9.610 -5.798 1.00 0.00 H new ATOM 0 HA GLU A 47 112.186 12.068 -4.091 1.00 0.00 H new ATOM 0 HB2 GLU A 47 112.926 13.064 -6.216 1.00 0.00 H new ATOM 0 HB3 GLU A 47 113.811 11.565 -6.012 1.00 0.00 H new ATOM 0 HG2 GLU A 47 112.084 10.393 -7.458 1.00 0.00 H new ATOM 0 HG3 GLU A 47 111.293 11.936 -7.718 1.00 0.00 H new ATOM 620 N LYS A 48 110.121 13.236 -4.908 1.00 0.00 N ATOM 621 CA LYS A 48 108.744 13.760 -5.130 1.00 0.00 C ATOM 622 C LYS A 48 108.696 14.526 -6.456 1.00 0.00 C ATOM 623 O LYS A 48 109.582 15.302 -6.759 1.00 0.00 O ATOM 624 CB LYS A 48 108.501 14.699 -3.949 1.00 0.00 C ATOM 625 CG LYS A 48 107.017 15.051 -3.856 1.00 0.00 C ATOM 626 CD LYS A 48 106.805 16.026 -2.696 1.00 0.00 C ATOM 627 CE LYS A 48 105.311 16.133 -2.378 1.00 0.00 C ATOM 628 NZ LYS A 48 105.226 16.011 -0.895 1.00 0.00 N ATOM 0 H LYS A 48 110.757 13.885 -4.444 1.00 0.00 H new ATOM 0 HA LYS A 48 107.989 12.976 -5.188 1.00 0.00 H new ATOM 0 HB2 LYS A 48 108.829 14.225 -3.024 1.00 0.00 H new ATOM 0 HB3 LYS A 48 109.092 15.607 -4.069 1.00 0.00 H new ATOM 0 HG2 LYS A 48 106.678 15.499 -4.790 1.00 0.00 H new ATOM 0 HG3 LYS A 48 106.426 14.149 -3.701 1.00 0.00 H new ATOM 0 HD2 LYS A 48 107.350 15.684 -1.816 1.00 0.00 H new ATOM 0 HD3 LYS A 48 107.203 17.007 -2.956 1.00 0.00 H new ATOM 0 HE2 LYS A 48 104.901 17.083 -2.721 1.00 0.00 H new ATOM 0 HE3 LYS A 48 104.744 15.344 -2.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 104.246 16.176 -0.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 105.523 15.057 -0.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 105.850 16.715 -0.452 1.00 0.00 H new ATOM 638 N SER A 49 107.681 14.309 -7.251 1.00 0.00 N ATOM 639 CA SER A 49 107.596 15.023 -8.559 1.00 0.00 C ATOM 640 C SER A 49 106.470 16.060 -8.536 1.00 0.00 C ATOM 641 O SER A 49 105.408 15.826 -7.993 1.00 0.00 O ATOM 642 CB SER A 49 107.298 13.931 -9.586 1.00 0.00 C ATOM 643 OG SER A 49 107.283 14.504 -10.887 1.00 0.00 O ATOM 0 H SER A 49 106.910 13.671 -7.052 1.00 0.00 H new ATOM 0 HA SER A 49 108.514 15.564 -8.789 1.00 0.00 H new ATOM 0 HB2 SER A 49 108.053 13.147 -9.530 1.00 0.00 H new ATOM 0 HB3 SER A 49 106.337 13.465 -9.370 1.00 0.00 H new ATOM 0 HG SER A 49 107.094 13.807 -11.549 1.00 0.00 H new ATOM 648 N ARG A 50 106.700 17.202 -9.128 1.00 0.00 N ATOM 649 CA ARG A 50 105.650 18.263 -9.155 1.00 0.00 C ATOM 650 C ARG A 50 105.379 18.690 -10.599 1.00 0.00 C ATOM 651 O ARG A 50 106.288 18.807 -11.397 1.00 0.00 O ATOM 652 CB ARG A 50 106.245 19.425 -8.358 1.00 0.00 C ATOM 653 CG ARG A 50 106.479 18.988 -6.911 1.00 0.00 C ATOM 654 CD ARG A 50 106.987 20.179 -6.095 1.00 0.00 C ATOM 655 NE ARG A 50 107.419 19.597 -4.794 1.00 0.00 N ATOM 656 CZ ARG A 50 108.331 20.199 -4.081 1.00 0.00 C ATOM 657 NH1 ARG A 50 108.195 21.461 -3.780 1.00 0.00 N ATOM 658 NH2 ARG A 50 109.379 19.538 -3.670 1.00 0.00 N ATOM 0 H ARG A 50 107.573 17.447 -9.596 1.00 0.00 H new ATOM 0 HA ARG A 50 104.703 17.923 -8.736 1.00 0.00 H new ATOM 0 HB2 ARG A 50 107.185 19.745 -8.808 1.00 0.00 H new ATOM 0 HB3 ARG A 50 105.571 20.281 -8.386 1.00 0.00 H new ATOM 0 HG2 ARG A 50 105.553 18.607 -6.481 1.00 0.00 H new ATOM 0 HG3 ARG A 50 107.204 18.175 -6.878 1.00 0.00 H new ATOM 0 HD2 ARG A 50 107.815 20.678 -6.599 1.00 0.00 H new ATOM 0 HD3 ARG A 50 106.204 20.924 -5.954 1.00 0.00 H new ATOM 0 HE ARG A 50 107.002 18.728 -4.460 1.00 0.00 H new ATOM 0 HH11 ARG A 50 107.376 21.977 -4.102 1.00 0.00 H new ATOM 0 HH12 ARG A 50 108.908 21.932 -3.223 1.00 0.00 H new ATOM 0 HH21 ARG A 50 109.485 18.551 -3.906 1.00 0.00 H new ATOM 0 HH22 ARG A 50 110.092 20.008 -3.113 1.00 0.00 H new ATOM 669 N THR A 51 104.139 18.925 -10.940 1.00 0.00 N ATOM 670 CA THR A 51 103.820 19.346 -12.338 1.00 0.00 C ATOM 671 C THR A 51 104.405 20.734 -12.615 1.00 0.00 C ATOM 672 O THR A 51 104.937 20.993 -13.678 1.00 0.00 O ATOM 673 CB THR A 51 102.291 19.383 -12.411 1.00 0.00 C ATOM 674 OG1 THR A 51 101.795 20.322 -11.466 1.00 0.00 O ATOM 675 CG2 THR A 51 101.724 17.996 -12.103 1.00 0.00 C ATOM 0 H THR A 51 103.337 18.844 -10.315 1.00 0.00 H new ATOM 0 HA THR A 51 104.242 18.667 -13.078 1.00 0.00 H new ATOM 0 HB THR A 51 101.985 19.680 -13.414 1.00 0.00 H new ATOM 0 HG1 THR A 51 100.816 20.348 -11.513 1.00 0.00 H new ATOM 0 HG21 THR A 51 100.636 18.028 -12.156 1.00 0.00 H new ATOM 0 HG22 THR A 51 102.102 17.278 -12.831 1.00 0.00 H new ATOM 0 HG23 THR A 51 102.030 17.692 -11.102 1.00 0.00 H new ATOM 683 N ALA A 52 104.316 21.624 -11.661 1.00 0.00 N ATOM 684 CA ALA A 52 104.872 22.996 -11.858 1.00 0.00 C ATOM 685 C ALA A 52 106.402 22.951 -11.863 1.00 0.00 C ATOM 686 O ALA A 52 107.054 23.720 -12.541 1.00 0.00 O ATOM 687 CB ALA A 52 104.364 23.810 -10.667 1.00 0.00 C ATOM 0 H ALA A 52 103.882 21.460 -10.753 1.00 0.00 H new ATOM 0 HA ALA A 52 104.563 23.432 -12.808 1.00 0.00 H new ATOM 0 HB1 ALA A 52 104.732 24.833 -10.742 1.00 0.00 H new ATOM 0 HB2 ALA A 52 103.274 23.816 -10.669 1.00 0.00 H new ATOM 0 HB3 ALA A 52 104.723 23.362 -9.740 1.00 0.00 H new ATOM 693 N SER A 53 106.978 22.052 -11.102 1.00 0.00 N ATOM 694 CA SER A 53 108.471 21.942 -11.039 1.00 0.00 C ATOM 695 C SER A 53 109.112 23.299 -10.715 1.00 0.00 C ATOM 696 O SER A 53 110.277 23.521 -10.984 1.00 0.00 O ATOM 697 CB SER A 53 108.897 21.468 -12.431 1.00 0.00 C ATOM 698 OG SER A 53 108.358 20.175 -12.673 1.00 0.00 O ATOM 0 H SER A 53 106.475 21.385 -10.517 1.00 0.00 H new ATOM 0 HA SER A 53 108.790 21.256 -10.254 1.00 0.00 H new ATOM 0 HB2 SER A 53 108.546 22.168 -13.189 1.00 0.00 H new ATOM 0 HB3 SER A 53 109.984 21.440 -12.501 1.00 0.00 H new ATOM 0 HG SER A 53 107.677 19.973 -11.998 1.00 0.00 H new ATOM 703 N SER A 54 108.364 24.205 -10.136 1.00 0.00 N ATOM 704 CA SER A 54 108.935 25.541 -9.791 1.00 0.00 C ATOM 705 C SER A 54 109.720 25.468 -8.476 1.00 0.00 C ATOM 706 O SER A 54 110.519 26.335 -8.174 1.00 0.00 O ATOM 707 CB SER A 54 107.725 26.462 -9.643 1.00 0.00 C ATOM 708 OG SER A 54 106.998 26.098 -8.476 1.00 0.00 O ATOM 0 H SER A 54 107.383 24.076 -9.888 1.00 0.00 H new ATOM 0 HA SER A 54 109.631 25.897 -10.551 1.00 0.00 H new ATOM 0 HB2 SER A 54 108.050 27.500 -9.574 1.00 0.00 H new ATOM 0 HB3 SER A 54 107.086 26.386 -10.522 1.00 0.00 H new ATOM 0 HG SER A 54 106.222 26.688 -8.377 1.00 0.00 H new ATOM 713 N GLY A 55 109.494 24.448 -7.686 1.00 0.00 N ATOM 714 CA GLY A 55 110.218 24.326 -6.388 1.00 0.00 C ATOM 715 C GLY A 55 111.483 23.486 -6.574 1.00 0.00 C ATOM 716 O GLY A 55 111.768 22.601 -5.790 1.00 0.00 O ATOM 0 H GLY A 55 108.837 23.694 -7.887 1.00 0.00 H new ATOM 0 HA2 GLY A 55 110.480 25.316 -6.013 1.00 0.00 H new ATOM 0 HA3 GLY A 55 109.571 23.864 -5.643 1.00 0.00 H new ATOM 719 N ASP A 56 112.249 23.758 -7.601 1.00 0.00 N ATOM 720 CA ASP A 56 113.502 22.972 -7.829 1.00 0.00 C ATOM 721 C ASP A 56 114.417 23.079 -6.603 1.00 0.00 C ATOM 722 O ASP A 56 115.024 22.114 -6.184 1.00 0.00 O ATOM 723 CB ASP A 56 114.164 23.617 -9.050 1.00 0.00 C ATOM 724 CG ASP A 56 113.299 23.392 -10.294 1.00 0.00 C ATOM 725 OD1 ASP A 56 112.445 22.519 -10.256 1.00 0.00 O ATOM 726 OD2 ASP A 56 113.505 24.099 -11.268 1.00 0.00 O ATOM 0 H ASP A 56 112.063 24.487 -8.289 1.00 0.00 H new ATOM 0 HA ASP A 56 113.302 21.913 -7.990 1.00 0.00 H new ATOM 0 HB2 ASP A 56 114.299 24.685 -8.879 1.00 0.00 H new ATOM 0 HB3 ASP A 56 115.155 23.191 -9.204 1.00 0.00 H new ATOM 730 N TYR A 57 114.504 24.248 -6.025 1.00 0.00 N ATOM 731 CA TYR A 57 115.365 24.429 -4.816 1.00 0.00 C ATOM 732 C TYR A 57 114.746 23.710 -3.612 1.00 0.00 C ATOM 733 O TYR A 57 115.421 23.395 -2.651 1.00 0.00 O ATOM 734 CB TYR A 57 115.404 25.940 -4.575 1.00 0.00 C ATOM 735 CG TYR A 57 116.036 26.626 -5.763 1.00 0.00 C ATOM 736 CD1 TYR A 57 117.430 26.677 -5.883 1.00 0.00 C ATOM 737 CD2 TYR A 57 115.227 27.212 -6.745 1.00 0.00 C ATOM 738 CE1 TYR A 57 118.016 27.313 -6.984 1.00 0.00 C ATOM 739 CE2 TYR A 57 115.813 27.848 -7.846 1.00 0.00 C ATOM 740 CZ TYR A 57 117.206 27.899 -7.965 1.00 0.00 C ATOM 741 OH TYR A 57 117.782 28.527 -9.050 1.00 0.00 O ATOM 0 H TYR A 57 114.016 25.087 -6.337 1.00 0.00 H new ATOM 0 HA TYR A 57 116.363 24.014 -4.957 1.00 0.00 H new ATOM 0 HB2 TYR A 57 114.394 26.320 -4.418 1.00 0.00 H new ATOM 0 HB3 TYR A 57 115.972 26.160 -3.671 1.00 0.00 H new ATOM 0 HD1 TYR A 57 118.054 26.225 -5.126 1.00 0.00 H new ATOM 0 HD2 TYR A 57 114.152 27.173 -6.653 1.00 0.00 H new ATOM 0 HE1 TYR A 57 119.091 27.352 -7.077 1.00 0.00 H new ATOM 0 HE2 TYR A 57 115.190 28.299 -8.604 1.00 0.00 H new ATOM 0 HH TYR A 57 117.079 28.878 -9.636 1.00 0.00 H new ATOM 750 N ASN A 58 113.463 23.453 -3.658 1.00 0.00 N ATOM 751 CA ASN A 58 112.789 22.758 -2.520 1.00 0.00 C ATOM 752 C ASN A 58 112.715 21.251 -2.782 1.00 0.00 C ATOM 753 O ASN A 58 111.771 20.593 -2.390 1.00 0.00 O ATOM 754 CB ASN A 58 111.384 23.362 -2.467 1.00 0.00 C ATOM 755 CG ASN A 58 111.476 24.853 -2.132 1.00 0.00 C ATOM 756 OD1 ASN A 58 112.491 25.322 -1.656 1.00 0.00 O ATOM 757 ND2 ASN A 58 110.448 25.624 -2.363 1.00 0.00 N ATOM 0 H ASN A 58 112.852 23.696 -4.438 1.00 0.00 H new ATOM 0 HA ASN A 58 113.328 22.888 -1.581 1.00 0.00 H new ATOM 0 HB2 ASN A 58 110.882 23.225 -3.425 1.00 0.00 H new ATOM 0 HB3 ASN A 58 110.784 22.847 -1.716 1.00 0.00 H new ATOM 0 HD21 ASN A 58 110.497 26.619 -2.144 1.00 0.00 H new ATOM 0 HD22 ASN A 58 109.596 25.231 -2.763 1.00 0.00 H new ATOM 763 N LYS A 59 113.700 20.701 -3.445 1.00 0.00 N ATOM 764 CA LYS A 59 113.683 19.235 -3.735 1.00 0.00 C ATOM 765 C LYS A 59 113.634 18.431 -2.429 1.00 0.00 C ATOM 766 O LYS A 59 114.453 18.608 -1.547 1.00 0.00 O ATOM 767 CB LYS A 59 114.981 18.967 -4.510 1.00 0.00 C ATOM 768 CG LYS A 59 116.198 19.246 -3.621 1.00 0.00 C ATOM 769 CD LYS A 59 117.476 19.144 -4.457 1.00 0.00 C ATOM 770 CE LYS A 59 118.696 19.117 -3.530 1.00 0.00 C ATOM 771 NZ LYS A 59 119.637 20.124 -4.098 1.00 0.00 N ATOM 0 H LYS A 59 114.515 21.203 -3.798 1.00 0.00 H new ATOM 0 HA LYS A 59 112.806 18.935 -4.309 1.00 0.00 H new ATOM 0 HB2 LYS A 59 115.001 17.932 -4.852 1.00 0.00 H new ATOM 0 HB3 LYS A 59 115.019 19.597 -5.399 1.00 0.00 H new ATOM 0 HG2 LYS A 59 116.118 20.239 -3.179 1.00 0.00 H new ATOM 0 HG3 LYS A 59 116.231 18.532 -2.798 1.00 0.00 H new ATOM 0 HD2 LYS A 59 117.451 18.242 -5.069 1.00 0.00 H new ATOM 0 HD3 LYS A 59 117.544 19.991 -5.140 1.00 0.00 H new ATOM 0 HE2 LYS A 59 118.419 19.369 -2.506 1.00 0.00 H new ATOM 0 HE3 LYS A 59 119.149 18.126 -3.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 120.498 20.162 -3.515 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 119.889 19.854 -5.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 119.182 21.059 -4.105 1.00 0.00 H new ATOM 781 N ASN A 60 112.670 17.558 -2.299 1.00 0.00 N ATOM 782 CA ASN A 60 112.549 16.744 -1.053 1.00 0.00 C ATOM 783 C ASN A 60 113.178 15.365 -1.264 1.00 0.00 C ATOM 784 O ASN A 60 113.351 14.924 -2.383 1.00 0.00 O ATOM 785 CB ASN A 60 111.044 16.614 -0.810 1.00 0.00 C ATOM 786 CG ASN A 60 110.424 18.005 -0.668 1.00 0.00 C ATOM 787 OD1 ASN A 60 111.021 18.894 -0.092 1.00 0.00 O ATOM 788 ND2 ASN A 60 109.242 18.235 -1.172 1.00 0.00 N ATOM 0 H ASN A 60 111.958 17.373 -3.005 1.00 0.00 H new ATOM 0 HA ASN A 60 113.060 17.203 -0.207 1.00 0.00 H new ATOM 0 HB2 ASN A 60 110.577 16.080 -1.637 1.00 0.00 H new ATOM 0 HB3 ASN A 60 110.860 16.029 0.091 1.00 0.00 H new ATOM 0 HD21 ASN A 60 108.820 19.159 -1.082 1.00 0.00 H new ATOM 0 HD22 ASN A 60 108.740 17.490 -1.655 1.00 0.00 H new ATOM 794 N GLN A 61 113.516 14.678 -0.202 1.00 0.00 N ATOM 795 CA GLN A 61 114.131 13.322 -0.355 1.00 0.00 C ATOM 796 C GLN A 61 113.377 12.305 0.507 1.00 0.00 C ATOM 797 O GLN A 61 112.801 12.652 1.520 1.00 0.00 O ATOM 798 CB GLN A 61 115.570 13.481 0.139 1.00 0.00 C ATOM 799 CG GLN A 61 116.300 14.513 -0.723 1.00 0.00 C ATOM 800 CD GLN A 61 117.764 14.599 -0.287 1.00 0.00 C ATOM 801 OE1 GLN A 61 118.362 13.604 0.071 1.00 0.00 O ATOM 802 NE2 GLN A 61 118.370 15.754 -0.300 1.00 0.00 N ATOM 0 H GLN A 61 113.394 14.994 0.760 1.00 0.00 H new ATOM 0 HA GLN A 61 114.092 12.962 -1.383 1.00 0.00 H new ATOM 0 HB2 GLN A 61 115.574 13.796 1.182 1.00 0.00 H new ATOM 0 HB3 GLN A 61 116.088 12.523 0.094 1.00 0.00 H new ATOM 0 HG2 GLN A 61 116.239 14.233 -1.775 1.00 0.00 H new ATOM 0 HG3 GLN A 61 115.822 15.488 -0.625 1.00 0.00 H new ATOM 0 HE21 GLN A 61 117.868 16.590 -0.601 1.00 0.00 H new ATOM 0 HE22 GLN A 61 119.345 15.821 -0.010 1.00 0.00 H new ATOM 809 N TYR A 62 113.373 11.051 0.118 1.00 0.00 N ATOM 810 CA TYR A 62 112.649 10.029 0.932 1.00 0.00 C ATOM 811 C TYR A 62 113.604 8.918 1.390 1.00 0.00 C ATOM 812 O TYR A 62 114.107 8.144 0.599 1.00 0.00 O ATOM 813 CB TYR A 62 111.572 9.473 0.000 1.00 0.00 C ATOM 814 CG TYR A 62 110.722 8.472 0.747 1.00 0.00 C ATOM 815 CD1 TYR A 62 109.637 8.912 1.517 1.00 0.00 C ATOM 816 CD2 TYR A 62 111.018 7.107 0.672 1.00 0.00 C ATOM 817 CE1 TYR A 62 108.850 7.985 2.210 1.00 0.00 C ATOM 818 CE2 TYR A 62 110.231 6.180 1.364 1.00 0.00 C ATOM 819 CZ TYR A 62 109.146 6.619 2.134 1.00 0.00 C ATOM 820 OH TYR A 62 108.369 5.705 2.817 1.00 0.00 O ATOM 0 H TYR A 62 113.835 10.696 -0.719 1.00 0.00 H new ATOM 0 HA TYR A 62 112.222 10.456 1.839 1.00 0.00 H new ATOM 0 HB2 TYR A 62 110.949 10.284 -0.377 1.00 0.00 H new ATOM 0 HB3 TYR A 62 112.035 8.998 -0.865 1.00 0.00 H new ATOM 0 HD1 TYR A 62 109.408 9.966 1.576 1.00 0.00 H new ATOM 0 HD2 TYR A 62 111.855 6.768 0.079 1.00 0.00 H new ATOM 0 HE1 TYR A 62 108.014 8.324 2.804 1.00 0.00 H new ATOM 0 HE2 TYR A 62 110.460 5.126 1.305 1.00 0.00 H new ATOM 0 HH TYR A 62 108.710 4.801 2.656 1.00 0.00 H new ATOM 829 N TYR A 63 113.844 8.847 2.672 1.00 0.00 N ATOM 830 CA TYR A 63 114.759 7.794 3.211 1.00 0.00 C ATOM 831 C TYR A 63 113.925 6.634 3.745 1.00 0.00 C ATOM 832 O TYR A 63 112.890 6.841 4.350 1.00 0.00 O ATOM 833 CB TYR A 63 115.542 8.466 4.341 1.00 0.00 C ATOM 834 CG TYR A 63 116.672 7.561 4.774 1.00 0.00 C ATOM 835 CD1 TYR A 63 117.904 7.613 4.111 1.00 0.00 C ATOM 836 CD2 TYR A 63 116.487 6.668 5.837 1.00 0.00 C ATOM 837 CE1 TYR A 63 118.951 6.775 4.511 1.00 0.00 C ATOM 838 CE2 TYR A 63 117.535 5.830 6.237 1.00 0.00 C ATOM 839 CZ TYR A 63 118.767 5.883 5.574 1.00 0.00 C ATOM 840 OH TYR A 63 119.799 5.056 5.968 1.00 0.00 O ATOM 0 H TYR A 63 113.446 9.473 3.372 1.00 0.00 H new ATOM 0 HA TYR A 63 115.433 7.395 2.453 1.00 0.00 H new ATOM 0 HB2 TYR A 63 115.937 9.425 4.005 1.00 0.00 H new ATOM 0 HB3 TYR A 63 114.882 8.671 5.184 1.00 0.00 H new ATOM 0 HD1 TYR A 63 118.046 8.300 3.290 1.00 0.00 H new ATOM 0 HD2 TYR A 63 115.536 6.626 6.348 1.00 0.00 H new ATOM 0 HE1 TYR A 63 119.901 6.817 3.999 1.00 0.00 H new ATOM 0 HE2 TYR A 63 117.393 5.142 7.058 1.00 0.00 H new ATOM 0 HH TYR A 63 119.504 4.501 6.720 1.00 0.00 H new ATOM 849 N GLY A 64 114.350 5.412 3.530 1.00 0.00 N ATOM 850 CA GLY A 64 113.549 4.267 4.036 1.00 0.00 C ATOM 851 C GLY A 64 114.466 3.112 4.433 1.00 0.00 C ATOM 852 O GLY A 64 115.152 2.534 3.613 1.00 0.00 O ATOM 0 H GLY A 64 115.206 5.166 3.032 1.00 0.00 H new ATOM 0 HA2 GLY A 64 112.956 4.581 4.895 1.00 0.00 H new ATOM 0 HA3 GLY A 64 112.849 3.937 3.269 1.00 0.00 H new ATOM 855 N ILE A 65 114.449 2.755 5.686 1.00 0.00 N ATOM 856 CA ILE A 65 115.281 1.611 6.158 1.00 0.00 C ATOM 857 C ILE A 65 114.329 0.490 6.554 1.00 0.00 C ATOM 858 O ILE A 65 113.332 0.734 7.205 1.00 0.00 O ATOM 859 CB ILE A 65 116.071 2.137 7.365 1.00 0.00 C ATOM 860 CG1 ILE A 65 116.940 1.009 7.929 1.00 0.00 C ATOM 861 CG2 ILE A 65 115.113 2.642 8.455 1.00 0.00 C ATOM 862 CD1 ILE A 65 118.003 1.600 8.858 1.00 0.00 C ATOM 0 H ILE A 65 113.891 3.209 6.409 1.00 0.00 H new ATOM 0 HA ILE A 65 115.970 1.226 5.406 1.00 0.00 H new ATOM 0 HB ILE A 65 116.701 2.966 7.043 1.00 0.00 H new ATOM 0 HG12 ILE A 65 116.321 0.296 8.474 1.00 0.00 H new ATOM 0 HG13 ILE A 65 117.416 0.461 7.116 1.00 0.00 H new ATOM 0 HG21 ILE A 65 115.689 3.011 9.303 1.00 0.00 H new ATOM 0 HG22 ILE A 65 114.499 3.449 8.055 1.00 0.00 H new ATOM 0 HG23 ILE A 65 114.470 1.825 8.781 1.00 0.00 H new ATOM 0 HD11 ILE A 65 118.622 0.798 9.260 1.00 0.00 H new ATOM 0 HD12 ILE A 65 118.629 2.296 8.299 1.00 0.00 H new ATOM 0 HD13 ILE A 65 117.517 2.128 9.678 1.00 0.00 H new ATOM 873 N THR A 66 114.593 -0.729 6.166 1.00 0.00 N ATOM 874 CA THR A 66 113.649 -1.821 6.533 1.00 0.00 C ATOM 875 C THR A 66 114.361 -3.170 6.647 1.00 0.00 C ATOM 876 O THR A 66 115.231 -3.492 5.862 1.00 0.00 O ATOM 877 CB THR A 66 112.635 -1.842 5.386 1.00 0.00 C ATOM 878 OG1 THR A 66 112.042 -0.558 5.259 1.00 0.00 O ATOM 879 CG2 THR A 66 111.550 -2.882 5.665 1.00 0.00 C ATOM 0 H THR A 66 115.407 -1.012 5.620 1.00 0.00 H new ATOM 0 HA THR A 66 113.188 -1.649 7.505 1.00 0.00 H new ATOM 0 HB THR A 66 113.147 -2.103 4.460 1.00 0.00 H new ATOM 0 HG1 THR A 66 111.393 -0.568 4.524 1.00 0.00 H new ATOM 0 HG21 THR A 66 110.833 -2.890 4.844 1.00 0.00 H new ATOM 0 HG22 THR A 66 112.006 -3.868 5.758 1.00 0.00 H new ATOM 0 HG23 THR A 66 111.036 -2.631 6.593 1.00 0.00 H new ATOM 887 N ALA A 67 113.974 -3.971 7.605 1.00 0.00 N ATOM 888 CA ALA A 67 114.594 -5.314 7.767 1.00 0.00 C ATOM 889 C ALA A 67 113.539 -6.281 8.312 1.00 0.00 C ATOM 890 O ALA A 67 112.636 -5.876 9.020 1.00 0.00 O ATOM 891 CB ALA A 67 115.727 -5.119 8.776 1.00 0.00 C ATOM 0 H ALA A 67 113.249 -3.748 8.286 1.00 0.00 H new ATOM 0 HA ALA A 67 114.971 -5.726 6.831 1.00 0.00 H new ATOM 0 HB1 ALA A 67 116.231 -6.070 8.945 1.00 0.00 H new ATOM 0 HB2 ALA A 67 116.441 -4.394 8.385 1.00 0.00 H new ATOM 0 HB3 ALA A 67 115.317 -4.753 9.717 1.00 0.00 H new ATOM 897 N GLY A 68 113.628 -7.548 7.991 1.00 0.00 N ATOM 898 CA GLY A 68 112.603 -8.508 8.505 1.00 0.00 C ATOM 899 C GLY A 68 113.072 -9.957 8.316 1.00 0.00 C ATOM 900 O GLY A 68 114.062 -10.208 7.658 1.00 0.00 O ATOM 0 H GLY A 68 114.356 -7.955 7.403 1.00 0.00 H new ATOM 0 HA2 GLY A 68 112.416 -8.316 9.562 1.00 0.00 H new ATOM 0 HA3 GLY A 68 111.659 -8.355 7.981 1.00 0.00 H new ATOM 903 N PRO A 69 112.332 -10.870 8.908 1.00 0.00 N ATOM 904 CA PRO A 69 112.670 -12.313 8.808 1.00 0.00 C ATOM 905 C PRO A 69 112.327 -12.856 7.415 1.00 0.00 C ATOM 906 O PRO A 69 111.718 -12.183 6.610 1.00 0.00 O ATOM 907 CB PRO A 69 111.788 -12.965 9.870 1.00 0.00 C ATOM 908 CG PRO A 69 110.632 -12.033 10.043 1.00 0.00 C ATOM 909 CD PRO A 69 111.124 -10.647 9.720 1.00 0.00 C ATOM 0 HA PRO A 69 113.732 -12.509 8.958 1.00 0.00 H new ATOM 0 HB2 PRO A 69 111.454 -13.953 9.553 1.00 0.00 H new ATOM 0 HB3 PRO A 69 112.331 -13.098 10.806 1.00 0.00 H new ATOM 0 HG2 PRO A 69 109.810 -12.313 9.384 1.00 0.00 H new ATOM 0 HG3 PRO A 69 110.251 -12.078 11.063 1.00 0.00 H new ATOM 0 HD2 PRO A 69 110.375 -10.077 9.170 1.00 0.00 H new ATOM 0 HD3 PRO A 69 111.352 -10.085 10.626 1.00 0.00 H new ATOM 914 N ALA A 70 112.711 -14.076 7.135 1.00 0.00 N ATOM 915 CA ALA A 70 112.408 -14.682 5.802 1.00 0.00 C ATOM 916 C ALA A 70 112.221 -16.196 5.952 1.00 0.00 C ATOM 917 O ALA A 70 112.912 -16.837 6.726 1.00 0.00 O ATOM 918 CB ALA A 70 113.631 -14.372 4.937 1.00 0.00 C ATOM 0 H ALA A 70 113.224 -14.682 7.776 1.00 0.00 H new ATOM 0 HA ALA A 70 111.493 -14.287 5.361 1.00 0.00 H new ATOM 0 HB1 ALA A 70 113.485 -14.786 3.939 1.00 0.00 H new ATOM 0 HB2 ALA A 70 113.763 -13.292 4.867 1.00 0.00 H new ATOM 0 HB3 ALA A 70 114.518 -14.817 5.388 1.00 0.00 H new ATOM 924 N TYR A 71 111.283 -16.767 5.232 1.00 0.00 N ATOM 925 CA TYR A 71 111.038 -18.236 5.347 1.00 0.00 C ATOM 926 C TYR A 71 111.072 -18.901 3.970 1.00 0.00 C ATOM 927 O TYR A 71 110.662 -18.325 2.980 1.00 0.00 O ATOM 928 CB TYR A 71 109.646 -18.359 5.968 1.00 0.00 C ATOM 929 CG TYR A 71 109.630 -17.690 7.323 1.00 0.00 C ATOM 930 CD1 TYR A 71 110.185 -18.342 8.431 1.00 0.00 C ATOM 931 CD2 TYR A 71 109.064 -16.419 7.470 1.00 0.00 C ATOM 932 CE1 TYR A 71 110.172 -17.722 9.686 1.00 0.00 C ATOM 933 CE2 TYR A 71 109.050 -15.800 8.725 1.00 0.00 C ATOM 934 CZ TYR A 71 109.605 -16.451 9.833 1.00 0.00 C ATOM 935 OH TYR A 71 109.592 -15.840 11.071 1.00 0.00 O ATOM 0 H TYR A 71 110.679 -16.278 4.572 1.00 0.00 H new ATOM 0 HA TYR A 71 111.801 -18.729 5.949 1.00 0.00 H new ATOM 0 HB2 TYR A 71 108.905 -17.898 5.316 1.00 0.00 H new ATOM 0 HB3 TYR A 71 109.374 -19.410 6.068 1.00 0.00 H new ATOM 0 HD1 TYR A 71 110.623 -19.323 8.317 1.00 0.00 H new ATOM 0 HD2 TYR A 71 108.638 -15.916 6.615 1.00 0.00 H new ATOM 0 HE1 TYR A 71 110.600 -18.225 10.541 1.00 0.00 H new ATOM 0 HE2 TYR A 71 108.611 -14.820 8.839 1.00 0.00 H new ATOM 0 HH TYR A 71 109.163 -14.962 10.998 1.00 0.00 H new ATOM 944 N ARG A 72 111.544 -20.119 3.906 1.00 0.00 N ATOM 945 CA ARG A 72 111.593 -20.837 2.600 1.00 0.00 C ATOM 946 C ARG A 72 110.500 -21.908 2.552 1.00 0.00 C ATOM 947 O ARG A 72 110.347 -22.693 3.469 1.00 0.00 O ATOM 948 CB ARG A 72 112.979 -21.484 2.547 1.00 0.00 C ATOM 949 CG ARG A 72 113.146 -22.225 1.217 1.00 0.00 C ATOM 950 CD ARG A 72 114.538 -22.855 1.152 1.00 0.00 C ATOM 951 NE ARG A 72 114.558 -23.856 2.256 1.00 0.00 N ATOM 952 CZ ARG A 72 114.599 -25.131 1.980 1.00 0.00 C ATOM 953 NH1 ARG A 72 113.505 -25.766 1.659 1.00 0.00 N ATOM 954 NH2 ARG A 72 115.734 -25.773 2.028 1.00 0.00 N ATOM 0 H ARG A 72 111.898 -20.647 4.704 1.00 0.00 H new ATOM 0 HA ARG A 72 111.427 -20.169 1.755 1.00 0.00 H new ATOM 0 HB2 ARG A 72 113.752 -20.722 2.651 1.00 0.00 H new ATOM 0 HB3 ARG A 72 113.101 -22.177 3.379 1.00 0.00 H new ATOM 0 HG2 ARG A 72 112.382 -22.996 1.120 1.00 0.00 H new ATOM 0 HG3 ARG A 72 113.009 -21.535 0.385 1.00 0.00 H new ATOM 0 HD2 ARG A 72 114.712 -23.329 0.186 1.00 0.00 H new ATOM 0 HD3 ARG A 72 115.318 -22.105 1.285 1.00 0.00 H new ATOM 0 HE ARG A 72 114.540 -23.545 3.227 1.00 0.00 H new ATOM 0 HH11 ARG A 72 112.617 -25.266 1.624 1.00 0.00 H new ATOM 0 HH12 ARG A 72 113.538 -26.762 1.443 1.00 0.00 H new ATOM 0 HH21 ARG A 72 116.589 -25.278 2.281 1.00 0.00 H new ATOM 0 HH22 ARG A 72 115.766 -26.769 1.812 1.00 0.00 H new ATOM 965 N ILE A 73 109.747 -21.950 1.486 1.00 0.00 N ATOM 966 CA ILE A 73 108.671 -22.972 1.366 1.00 0.00 C ATOM 967 C ILE A 73 108.920 -23.822 0.121 1.00 0.00 C ATOM 968 O ILE A 73 108.758 -23.370 -0.995 1.00 0.00 O ATOM 969 CB ILE A 73 107.371 -22.176 1.226 1.00 0.00 C ATOM 970 CG1 ILE A 73 107.187 -21.275 2.450 1.00 0.00 C ATOM 971 CG2 ILE A 73 106.188 -23.142 1.124 1.00 0.00 C ATOM 972 CD1 ILE A 73 105.970 -20.371 2.242 1.00 0.00 C ATOM 0 H ILE A 73 109.832 -21.317 0.691 1.00 0.00 H new ATOM 0 HA ILE A 73 108.633 -23.646 2.222 1.00 0.00 H new ATOM 0 HB ILE A 73 107.419 -21.562 0.327 1.00 0.00 H new ATOM 0 HG12 ILE A 73 107.053 -21.883 3.345 1.00 0.00 H new ATOM 0 HG13 ILE A 73 108.080 -20.670 2.607 1.00 0.00 H new ATOM 0 HG21 ILE A 73 105.263 -22.575 1.024 1.00 0.00 H new ATOM 0 HG22 ILE A 73 106.316 -23.783 0.252 1.00 0.00 H new ATOM 0 HG23 ILE A 73 106.142 -23.757 2.023 1.00 0.00 H new ATOM 0 HD11 ILE A 73 105.840 -19.730 3.114 1.00 0.00 H new ATOM 0 HD12 ILE A 73 106.123 -19.753 1.357 1.00 0.00 H new ATOM 0 HD13 ILE A 73 105.080 -20.985 2.107 1.00 0.00 H new ATOM 983 N ASN A 74 109.321 -25.049 0.310 1.00 0.00 N ATOM 984 CA ASN A 74 109.596 -25.950 -0.853 1.00 0.00 C ATOM 985 C ASN A 74 110.587 -25.283 -1.812 1.00 0.00 C ATOM 986 O ASN A 74 110.430 -25.333 -3.017 1.00 0.00 O ATOM 987 CB ASN A 74 108.240 -26.163 -1.535 1.00 0.00 C ATOM 988 CG ASN A 74 108.292 -27.426 -2.399 1.00 0.00 C ATOM 989 OD1 ASN A 74 109.139 -28.276 -2.205 1.00 0.00 O ATOM 990 ND2 ASN A 74 107.413 -27.588 -3.349 1.00 0.00 N ATOM 0 H ASN A 74 109.472 -25.472 1.226 1.00 0.00 H new ATOM 0 HA ASN A 74 110.040 -26.896 -0.543 1.00 0.00 H new ATOM 0 HB2 ASN A 74 107.455 -26.256 -0.785 1.00 0.00 H new ATOM 0 HB3 ASN A 74 107.992 -25.299 -2.151 1.00 0.00 H new ATOM 0 HD21 ASN A 74 107.437 -28.427 -3.928 1.00 0.00 H new ATOM 0 HD22 ASN A 74 106.702 -26.875 -3.513 1.00 0.00 H new ATOM 996 N ASP A 75 111.606 -24.655 -1.280 1.00 0.00 N ATOM 997 CA ASP A 75 112.621 -23.971 -2.144 1.00 0.00 C ATOM 998 C ASP A 75 111.937 -23.045 -3.159 1.00 0.00 C ATOM 999 O ASP A 75 110.736 -22.873 -3.140 1.00 0.00 O ATOM 1000 CB ASP A 75 113.360 -25.101 -2.865 1.00 0.00 C ATOM 1001 CG ASP A 75 114.152 -25.937 -1.853 1.00 0.00 C ATOM 1002 OD1 ASP A 75 114.389 -25.449 -0.759 1.00 0.00 O ATOM 1003 OD2 ASP A 75 114.509 -27.053 -2.191 1.00 0.00 O ATOM 0 H ASP A 75 111.781 -24.586 -0.277 1.00 0.00 H new ATOM 0 HA ASP A 75 113.296 -23.347 -1.558 1.00 0.00 H new ATOM 0 HB2 ASP A 75 112.647 -25.734 -3.394 1.00 0.00 H new ATOM 0 HB3 ASP A 75 114.035 -24.686 -3.614 1.00 0.00 H new ATOM 1007 N TRP A 76 112.703 -22.457 -4.042 1.00 0.00 N ATOM 1008 CA TRP A 76 112.129 -21.539 -5.078 1.00 0.00 C ATOM 1009 C TRP A 76 111.312 -20.406 -4.433 1.00 0.00 C ATOM 1010 O TRP A 76 111.815 -19.318 -4.226 1.00 0.00 O ATOM 1011 CB TRP A 76 111.243 -22.426 -5.962 1.00 0.00 C ATOM 1012 CG TRP A 76 112.100 -23.368 -6.744 1.00 0.00 C ATOM 1013 CD1 TRP A 76 112.319 -24.665 -6.429 1.00 0.00 C ATOM 1014 CD2 TRP A 76 112.853 -23.111 -7.966 1.00 0.00 C ATOM 1015 NE1 TRP A 76 113.159 -25.220 -7.378 1.00 0.00 N ATOM 1016 CE2 TRP A 76 113.515 -24.303 -8.346 1.00 0.00 C ATOM 1017 CE3 TRP A 76 113.024 -21.972 -8.773 1.00 0.00 C ATOM 1018 CZ2 TRP A 76 114.319 -24.361 -9.484 1.00 0.00 C ATOM 1019 CZ3 TRP A 76 113.832 -22.027 -9.921 1.00 0.00 C ATOM 1020 CH2 TRP A 76 114.478 -23.220 -10.275 1.00 0.00 C ATOM 0 H TRP A 76 113.715 -22.574 -4.092 1.00 0.00 H new ATOM 0 HA TRP A 76 112.913 -21.048 -5.655 1.00 0.00 H new ATOM 0 HB2 TRP A 76 110.540 -22.985 -5.345 1.00 0.00 H new ATOM 0 HB3 TRP A 76 110.652 -21.808 -6.639 1.00 0.00 H new ATOM 0 HD1 TRP A 76 111.906 -25.183 -5.576 1.00 0.00 H new ATOM 0 HE1 TRP A 76 113.477 -26.189 -7.364 1.00 0.00 H new ATOM 0 HE3 TRP A 76 112.531 -21.048 -8.508 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 114.816 -25.282 -9.752 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 113.956 -21.146 -10.534 1.00 0.00 H new ATOM 0 HH2 TRP A 76 115.098 -23.257 -11.158 1.00 0.00 H new ATOM 1030 N ALA A 77 110.059 -20.641 -4.132 1.00 0.00 N ATOM 1031 CA ALA A 77 109.216 -19.566 -3.520 1.00 0.00 C ATOM 1032 C ALA A 77 109.724 -19.194 -2.123 1.00 0.00 C ATOM 1033 O ALA A 77 110.133 -20.041 -1.352 1.00 0.00 O ATOM 1034 CB ALA A 77 107.810 -20.163 -3.433 1.00 0.00 C ATOM 0 H ALA A 77 109.583 -21.530 -4.283 1.00 0.00 H new ATOM 0 HA ALA A 77 109.242 -18.651 -4.112 1.00 0.00 H new ATOM 0 HB1 ALA A 77 107.131 -19.433 -2.993 1.00 0.00 H new ATOM 0 HB2 ALA A 77 107.463 -20.424 -4.433 1.00 0.00 H new ATOM 0 HB3 ALA A 77 107.833 -21.058 -2.811 1.00 0.00 H new ATOM 1040 N SER A 78 109.686 -17.929 -1.792 1.00 0.00 N ATOM 1041 CA SER A 78 110.150 -17.479 -0.442 1.00 0.00 C ATOM 1042 C SER A 78 109.186 -16.425 0.111 1.00 0.00 C ATOM 1043 O SER A 78 108.577 -15.688 -0.640 1.00 0.00 O ATOM 1044 CB SER A 78 111.533 -16.873 -0.679 1.00 0.00 C ATOM 1045 OG SER A 78 112.109 -16.517 0.571 1.00 0.00 O ATOM 0 H SER A 78 109.352 -17.183 -2.402 1.00 0.00 H new ATOM 0 HA SER A 78 110.186 -18.294 0.281 1.00 0.00 H new ATOM 0 HB2 SER A 78 112.172 -17.588 -1.197 1.00 0.00 H new ATOM 0 HB3 SER A 78 111.453 -15.995 -1.319 1.00 0.00 H new ATOM 0 HG SER A 78 111.679 -17.029 1.287 1.00 0.00 H new ATOM 1050 N ILE A 79 109.035 -16.339 1.413 1.00 0.00 N ATOM 1051 CA ILE A 79 108.103 -15.320 1.987 1.00 0.00 C ATOM 1052 C ILE A 79 108.780 -14.587 3.146 1.00 0.00 C ATOM 1053 O ILE A 79 109.450 -15.192 3.960 1.00 0.00 O ATOM 1054 CB ILE A 79 106.891 -16.120 2.475 1.00 0.00 C ATOM 1055 CG1 ILE A 79 105.857 -15.167 3.077 1.00 0.00 C ATOM 1056 CG2 ILE A 79 107.328 -17.133 3.538 1.00 0.00 C ATOM 1057 CD1 ILE A 79 104.513 -15.885 3.205 1.00 0.00 C ATOM 0 H ILE A 79 109.513 -16.926 2.096 1.00 0.00 H new ATOM 0 HA ILE A 79 107.815 -14.560 1.261 1.00 0.00 H new ATOM 0 HB ILE A 79 106.451 -16.651 1.631 1.00 0.00 H new ATOM 0 HG12 ILE A 79 106.191 -14.822 4.055 1.00 0.00 H new ATOM 0 HG13 ILE A 79 105.751 -14.284 2.447 1.00 0.00 H new ATOM 0 HG21 ILE A 79 106.461 -17.698 3.880 1.00 0.00 H new ATOM 0 HG22 ILE A 79 108.061 -17.817 3.110 1.00 0.00 H new ATOM 0 HG23 ILE A 79 107.774 -16.606 4.382 1.00 0.00 H new ATOM 0 HD11 ILE A 79 103.777 -15.205 3.634 1.00 0.00 H new ATOM 0 HD12 ILE A 79 104.178 -16.208 2.219 1.00 0.00 H new ATOM 0 HD13 ILE A 79 104.625 -16.754 3.853 1.00 0.00 H new ATOM 1068 N TYR A 80 108.617 -13.291 3.232 1.00 0.00 N ATOM 1069 CA TYR A 80 109.265 -12.544 4.348 1.00 0.00 C ATOM 1070 C TYR A 80 108.427 -11.336 4.781 1.00 0.00 C ATOM 1071 O TYR A 80 107.622 -10.818 4.031 1.00 0.00 O ATOM 1072 CB TYR A 80 110.624 -12.107 3.785 1.00 0.00 C ATOM 1073 CG TYR A 80 110.434 -11.129 2.649 1.00 0.00 C ATOM 1074 CD1 TYR A 80 110.208 -11.601 1.351 1.00 0.00 C ATOM 1075 CD2 TYR A 80 110.493 -9.751 2.893 1.00 0.00 C ATOM 1076 CE1 TYR A 80 110.041 -10.696 0.296 1.00 0.00 C ATOM 1077 CE2 TYR A 80 110.325 -8.847 1.839 1.00 0.00 C ATOM 1078 CZ TYR A 80 110.100 -9.319 0.540 1.00 0.00 C ATOM 1079 OH TYR A 80 109.939 -8.427 -0.500 1.00 0.00 O ATOM 0 H TYR A 80 108.069 -12.724 2.585 1.00 0.00 H new ATOM 0 HA TYR A 80 109.368 -13.158 5.242 1.00 0.00 H new ATOM 0 HB2 TYR A 80 111.220 -11.647 4.573 1.00 0.00 H new ATOM 0 HB3 TYR A 80 111.177 -12.979 3.434 1.00 0.00 H new ATOM 0 HD1 TYR A 80 110.162 -12.664 1.163 1.00 0.00 H new ATOM 0 HD2 TYR A 80 110.668 -9.387 3.894 1.00 0.00 H new ATOM 0 HE1 TYR A 80 109.867 -11.060 -0.706 1.00 0.00 H new ATOM 0 HE2 TYR A 80 110.369 -7.784 2.027 1.00 0.00 H new ATOM 0 HH TYR A 80 109.119 -8.643 -0.992 1.00 0.00 H new ATOM 1088 N GLY A 81 108.640 -10.879 5.986 1.00 0.00 N ATOM 1089 CA GLY A 81 107.894 -9.693 6.494 1.00 0.00 C ATOM 1090 C GLY A 81 108.860 -8.512 6.533 1.00 0.00 C ATOM 1091 O GLY A 81 110.061 -8.699 6.509 1.00 0.00 O ATOM 0 H GLY A 81 109.306 -11.281 6.646 1.00 0.00 H new ATOM 0 HA2 GLY A 81 107.045 -9.470 5.847 1.00 0.00 H new ATOM 0 HA3 GLY A 81 107.494 -9.891 7.488 1.00 0.00 H new ATOM 1094 N VAL A 82 108.366 -7.303 6.579 1.00 0.00 N ATOM 1095 CA VAL A 82 109.297 -6.141 6.605 1.00 0.00 C ATOM 1096 C VAL A 82 108.786 -5.018 7.512 1.00 0.00 C ATOM 1097 O VAL A 82 107.604 -4.762 7.617 1.00 0.00 O ATOM 1098 CB VAL A 82 109.384 -5.663 5.152 1.00 0.00 C ATOM 1099 CG1 VAL A 82 109.963 -6.782 4.281 1.00 0.00 C ATOM 1100 CG2 VAL A 82 107.990 -5.285 4.637 1.00 0.00 C ATOM 0 H VAL A 82 107.372 -7.073 6.599 1.00 0.00 H new ATOM 0 HA VAL A 82 110.269 -6.427 7.007 1.00 0.00 H new ATOM 0 HB VAL A 82 110.031 -4.787 5.104 1.00 0.00 H new ATOM 0 HG11 VAL A 82 110.025 -6.443 3.247 1.00 0.00 H new ATOM 0 HG12 VAL A 82 110.959 -7.042 4.638 1.00 0.00 H new ATOM 0 HG13 VAL A 82 109.317 -7.658 4.337 1.00 0.00 H new ATOM 0 HG21 VAL A 82 108.063 -4.947 3.603 1.00 0.00 H new ATOM 0 HG22 VAL A 82 107.335 -6.155 4.688 1.00 0.00 H new ATOM 0 HG23 VAL A 82 107.579 -4.485 5.253 1.00 0.00 H new ATOM 1110 N VAL A 83 109.699 -4.324 8.132 1.00 0.00 N ATOM 1111 CA VAL A 83 109.340 -3.172 9.006 1.00 0.00 C ATOM 1112 C VAL A 83 110.349 -2.063 8.719 1.00 0.00 C ATOM 1113 O VAL A 83 111.462 -2.350 8.334 1.00 0.00 O ATOM 1114 CB VAL A 83 109.462 -3.684 10.446 1.00 0.00 C ATOM 1115 CG1 VAL A 83 108.440 -4.797 10.677 1.00 0.00 C ATOM 1116 CG2 VAL A 83 110.871 -4.236 10.692 1.00 0.00 C ATOM 0 H VAL A 83 110.700 -4.511 8.068 1.00 0.00 H new ATOM 0 HA VAL A 83 108.336 -2.783 8.838 1.00 0.00 H new ATOM 0 HB VAL A 83 109.275 -2.859 11.133 1.00 0.00 H new ATOM 0 HG11 VAL A 83 108.525 -5.162 11.700 1.00 0.00 H new ATOM 0 HG12 VAL A 83 107.435 -4.408 10.513 1.00 0.00 H new ATOM 0 HG13 VAL A 83 108.630 -5.615 9.983 1.00 0.00 H new ATOM 0 HG21 VAL A 83 110.946 -4.597 11.718 1.00 0.00 H new ATOM 0 HG22 VAL A 83 111.065 -5.058 10.003 1.00 0.00 H new ATOM 0 HG23 VAL A 83 111.605 -3.446 10.530 1.00 0.00 H new ATOM 1126 N GLY A 84 110.003 -0.814 8.893 1.00 0.00 N ATOM 1127 CA GLY A 84 110.991 0.248 8.603 1.00 0.00 C ATOM 1128 C GLY A 84 110.398 1.623 8.871 1.00 0.00 C ATOM 1129 O GLY A 84 109.248 1.772 9.237 1.00 0.00 O ATOM 0 H GLY A 84 109.091 -0.494 9.219 1.00 0.00 H new ATOM 0 HA2 GLY A 84 111.879 0.103 9.219 1.00 0.00 H new ATOM 0 HA3 GLY A 84 111.310 0.181 7.563 1.00 0.00 H new ATOM 1132 N VAL A 85 111.203 2.622 8.695 1.00 0.00 N ATOM 1133 CA VAL A 85 110.751 4.022 8.936 1.00 0.00 C ATOM 1134 C VAL A 85 110.922 4.880 7.675 1.00 0.00 C ATOM 1135 O VAL A 85 111.937 4.839 7.006 1.00 0.00 O ATOM 1136 CB VAL A 85 111.648 4.543 10.063 1.00 0.00 C ATOM 1137 CG1 VAL A 85 111.224 5.964 10.440 1.00 0.00 C ATOM 1138 CG2 VAL A 85 111.512 3.636 11.290 1.00 0.00 C ATOM 0 H VAL A 85 112.172 2.533 8.389 1.00 0.00 H new ATOM 0 HA VAL A 85 109.694 4.064 9.198 1.00 0.00 H new ATOM 0 HB VAL A 85 112.684 4.547 9.724 1.00 0.00 H new ATOM 0 HG11 VAL A 85 111.863 6.334 11.242 1.00 0.00 H new ATOM 0 HG12 VAL A 85 111.319 6.615 9.571 1.00 0.00 H new ATOM 0 HG13 VAL A 85 110.187 5.957 10.776 1.00 0.00 H new ATOM 0 HG21 VAL A 85 112.151 4.009 12.091 1.00 0.00 H new ATOM 0 HG22 VAL A 85 110.475 3.631 11.626 1.00 0.00 H new ATOM 0 HG23 VAL A 85 111.813 2.622 11.028 1.00 0.00 H new ATOM 1148 N GLY A 86 109.926 5.665 7.369 1.00 0.00 N ATOM 1149 CA GLY A 86 109.996 6.557 6.172 1.00 0.00 C ATOM 1150 C GLY A 86 110.272 7.986 6.642 1.00 0.00 C ATOM 1151 O GLY A 86 109.656 8.457 7.573 1.00 0.00 O ATOM 0 H GLY A 86 109.058 5.729 7.901 1.00 0.00 H new ATOM 0 HA2 GLY A 86 110.784 6.222 5.497 1.00 0.00 H new ATOM 0 HA3 GLY A 86 109.060 6.516 5.615 1.00 0.00 H new ATOM 1154 N TYR A 87 111.193 8.681 6.016 1.00 0.00 N ATOM 1155 CA TYR A 87 111.492 10.078 6.455 1.00 0.00 C ATOM 1156 C TYR A 87 111.169 11.070 5.338 1.00 0.00 C ATOM 1157 O TYR A 87 111.329 10.775 4.169 1.00 0.00 O ATOM 1158 CB TYR A 87 112.990 10.095 6.760 1.00 0.00 C ATOM 1159 CG TYR A 87 113.301 9.100 7.852 1.00 0.00 C ATOM 1160 CD1 TYR A 87 113.211 9.484 9.195 1.00 0.00 C ATOM 1161 CD2 TYR A 87 113.679 7.794 7.521 1.00 0.00 C ATOM 1162 CE1 TYR A 87 113.501 8.561 10.208 1.00 0.00 C ATOM 1163 CE2 TYR A 87 113.968 6.871 8.532 1.00 0.00 C ATOM 1164 CZ TYR A 87 113.879 7.254 9.876 1.00 0.00 C ATOM 1165 OH TYR A 87 114.164 6.344 10.873 1.00 0.00 O ATOM 0 H TYR A 87 111.745 8.343 5.227 1.00 0.00 H new ATOM 0 HA TYR A 87 110.896 10.366 7.321 1.00 0.00 H new ATOM 0 HB2 TYR A 87 113.556 9.851 5.861 1.00 0.00 H new ATOM 0 HB3 TYR A 87 113.296 11.095 7.068 1.00 0.00 H new ATOM 0 HD1 TYR A 87 112.918 10.492 9.450 1.00 0.00 H new ATOM 0 HD2 TYR A 87 113.748 7.498 6.485 1.00 0.00 H new ATOM 0 HE1 TYR A 87 113.433 8.857 11.244 1.00 0.00 H new ATOM 0 HE2 TYR A 87 114.260 5.863 8.276 1.00 0.00 H new ATOM 0 HH TYR A 87 114.054 6.772 11.748 1.00 0.00 H new ATOM 1174 N GLY A 88 110.720 12.246 5.690 1.00 0.00 N ATOM 1175 CA GLY A 88 110.392 13.261 4.651 1.00 0.00 C ATOM 1176 C GLY A 88 111.233 14.516 4.884 1.00 0.00 C ATOM 1177 O GLY A 88 111.110 15.175 5.900 1.00 0.00 O ATOM 0 H GLY A 88 110.567 12.546 6.653 1.00 0.00 H new ATOM 0 HA2 GLY A 88 110.589 12.857 3.658 1.00 0.00 H new ATOM 0 HA3 GLY A 88 109.331 13.508 4.690 1.00 0.00 H new ATOM 1180 N LYS A 89 112.084 14.853 3.949 1.00 0.00 N ATOM 1181 CA LYS A 89 112.931 16.069 4.112 1.00 0.00 C ATOM 1182 C LYS A 89 112.378 17.209 3.256 1.00 0.00 C ATOM 1183 O LYS A 89 112.399 17.150 2.039 1.00 0.00 O ATOM 1184 CB LYS A 89 114.321 15.658 3.626 1.00 0.00 C ATOM 1185 CG LYS A 89 114.890 14.582 4.553 1.00 0.00 C ATOM 1186 CD LYS A 89 116.331 14.265 4.146 1.00 0.00 C ATOM 1187 CE LYS A 89 116.861 13.107 4.995 1.00 0.00 C ATOM 1188 NZ LYS A 89 116.760 11.909 4.116 1.00 0.00 N ATOM 0 H LYS A 89 112.228 14.338 3.081 1.00 0.00 H new ATOM 0 HA LYS A 89 112.952 16.423 5.143 1.00 0.00 H new ATOM 0 HB2 LYS A 89 114.264 15.280 2.605 1.00 0.00 H new ATOM 0 HB3 LYS A 89 114.982 16.524 3.608 1.00 0.00 H new ATOM 0 HG2 LYS A 89 114.860 14.926 5.587 1.00 0.00 H new ATOM 0 HG3 LYS A 89 114.279 13.681 4.499 1.00 0.00 H new ATOM 0 HD2 LYS A 89 116.372 14.003 3.089 1.00 0.00 H new ATOM 0 HD3 LYS A 89 116.960 15.145 4.280 1.00 0.00 H new ATOM 0 HE2 LYS A 89 117.891 13.284 5.305 1.00 0.00 H new ATOM 0 HE3 LYS A 89 116.272 12.981 5.903 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 117.183 11.089 4.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 115.760 11.712 3.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 117.267 12.088 3.226 1.00 0.00 H new ATOM 1198 N PHE A 90 111.884 18.242 3.888 1.00 0.00 N ATOM 1199 CA PHE A 90 111.325 19.401 3.131 1.00 0.00 C ATOM 1200 C PHE A 90 112.010 20.698 3.574 1.00 0.00 C ATOM 1201 O PHE A 90 112.537 20.787 4.666 1.00 0.00 O ATOM 1202 CB PHE A 90 109.840 19.440 3.501 1.00 0.00 C ATOM 1203 CG PHE A 90 109.163 18.169 3.044 1.00 0.00 C ATOM 1204 CD1 PHE A 90 108.671 18.071 1.738 1.00 0.00 C ATOM 1205 CD2 PHE A 90 109.022 17.095 3.930 1.00 0.00 C ATOM 1206 CE1 PHE A 90 108.040 16.895 1.315 1.00 0.00 C ATOM 1207 CE2 PHE A 90 108.389 15.920 3.506 1.00 0.00 C ATOM 1208 CZ PHE A 90 107.898 15.819 2.199 1.00 0.00 C ATOM 0 H PHE A 90 111.844 18.333 4.903 1.00 0.00 H new ATOM 0 HA PHE A 90 111.479 19.302 2.056 1.00 0.00 H new ATOM 0 HB2 PHE A 90 109.728 19.555 4.579 1.00 0.00 H new ATOM 0 HB3 PHE A 90 109.363 20.303 3.037 1.00 0.00 H new ATOM 0 HD1 PHE A 90 108.778 18.902 1.057 1.00 0.00 H new ATOM 0 HD2 PHE A 90 109.401 17.172 4.939 1.00 0.00 H new ATOM 0 HE1 PHE A 90 107.663 16.818 0.306 1.00 0.00 H new ATOM 0 HE2 PHE A 90 108.279 15.090 4.189 1.00 0.00 H new ATOM 0 HZ PHE A 90 107.410 14.912 1.873 1.00 0.00 H new ATOM 1217 N GLN A 91 111.995 21.707 2.741 1.00 0.00 N ATOM 1218 CA GLN A 91 112.635 23.001 3.125 1.00 0.00 C ATOM 1219 C GLN A 91 111.778 23.706 4.179 1.00 0.00 C ATOM 1220 O GLN A 91 110.562 23.653 4.136 1.00 0.00 O ATOM 1221 CB GLN A 91 112.689 23.825 1.838 1.00 0.00 C ATOM 1222 CG GLN A 91 113.463 25.121 2.095 1.00 0.00 C ATOM 1223 CD GLN A 91 113.401 26.010 0.853 1.00 0.00 C ATOM 1224 OE1 GLN A 91 112.356 26.529 0.514 1.00 0.00 O ATOM 1225 NE2 GLN A 91 114.485 26.210 0.153 1.00 0.00 N ATOM 0 H GLN A 91 111.569 21.691 1.814 1.00 0.00 H new ATOM 0 HA GLN A 91 113.628 22.862 3.552 1.00 0.00 H new ATOM 0 HB2 GLN A 91 113.171 23.252 1.046 1.00 0.00 H new ATOM 0 HB3 GLN A 91 111.679 24.053 1.497 1.00 0.00 H new ATOM 0 HG2 GLN A 91 113.040 25.646 2.952 1.00 0.00 H new ATOM 0 HG3 GLN A 91 114.500 24.894 2.341 1.00 0.00 H new ATOM 0 HE21 GLN A 91 115.363 25.775 0.437 1.00 0.00 H new ATOM 0 HE22 GLN A 91 114.454 26.801 -0.677 1.00 0.00 H new ATOM 1232 N THR A 92 112.397 24.355 5.129 1.00 0.00 N ATOM 1233 CA THR A 92 111.615 25.051 6.194 1.00 0.00 C ATOM 1234 C THR A 92 112.130 26.482 6.400 1.00 0.00 C ATOM 1235 O THR A 92 113.209 26.833 5.966 1.00 0.00 O ATOM 1236 CB THR A 92 111.821 24.200 7.455 1.00 0.00 C ATOM 1237 OG1 THR A 92 110.976 24.682 8.490 1.00 0.00 O ATOM 1238 CG2 THR A 92 113.283 24.268 7.907 1.00 0.00 C ATOM 0 H THR A 92 113.410 24.434 5.214 1.00 0.00 H new ATOM 0 HA THR A 92 110.560 25.144 5.936 1.00 0.00 H new ATOM 0 HB THR A 92 111.572 23.163 7.231 1.00 0.00 H new ATOM 0 HG1 THR A 92 111.104 24.140 9.296 1.00 0.00 H new ATOM 0 HG21 THR A 92 113.416 23.660 8.802 1.00 0.00 H new ATOM 0 HG22 THR A 92 113.927 23.890 7.113 1.00 0.00 H new ATOM 0 HG23 THR A 92 113.548 25.302 8.128 1.00 0.00 H new ATOM 1246 N THR A 93 111.358 27.305 7.063 1.00 0.00 N ATOM 1247 CA THR A 93 111.787 28.718 7.307 1.00 0.00 C ATOM 1248 C THR A 93 113.151 28.748 8.004 1.00 0.00 C ATOM 1249 O THR A 93 113.953 29.630 7.773 1.00 0.00 O ATOM 1250 CB THR A 93 110.710 29.314 8.215 1.00 0.00 C ATOM 1251 OG1 THR A 93 109.436 29.144 7.612 1.00 0.00 O ATOM 1252 CG2 THR A 93 110.984 30.804 8.425 1.00 0.00 C ATOM 0 H THR A 93 110.446 27.059 7.448 1.00 0.00 H new ATOM 0 HA THR A 93 111.892 29.279 6.378 1.00 0.00 H new ATOM 0 HB THR A 93 110.725 28.805 9.179 1.00 0.00 H new ATOM 0 HG1 THR A 93 108.745 29.524 8.194 1.00 0.00 H new ATOM 0 HG21 THR A 93 110.216 31.228 9.072 1.00 0.00 H new ATOM 0 HG22 THR A 93 111.961 30.932 8.890 1.00 0.00 H new ATOM 0 HG23 THR A 93 110.970 31.316 7.463 1.00 0.00 H new ATOM 1260 N GLU A 94 113.412 27.786 8.855 1.00 0.00 N ATOM 1261 CA GLU A 94 114.722 27.736 9.582 1.00 0.00 C ATOM 1262 C GLU A 94 114.953 29.024 10.377 1.00 0.00 C ATOM 1263 O GLU A 94 115.240 30.067 9.820 1.00 0.00 O ATOM 1264 CB GLU A 94 115.789 27.577 8.493 1.00 0.00 C ATOM 1265 CG GLU A 94 117.166 27.417 9.141 1.00 0.00 C ATOM 1266 CD GLU A 94 118.252 27.368 8.059 1.00 0.00 C ATOM 1267 OE1 GLU A 94 117.909 27.429 6.888 1.00 0.00 O ATOM 1268 OE2 GLU A 94 119.413 27.272 8.421 1.00 0.00 O ATOM 0 H GLU A 94 112.769 27.027 9.080 1.00 0.00 H new ATOM 0 HA GLU A 94 114.751 26.917 10.301 1.00 0.00 H new ATOM 0 HB2 GLU A 94 115.564 26.708 7.874 1.00 0.00 H new ATOM 0 HB3 GLU A 94 115.784 28.447 7.836 1.00 0.00 H new ATOM 0 HG2 GLU A 94 117.356 28.247 9.821 1.00 0.00 H new ATOM 0 HG3 GLU A 94 117.193 26.505 9.737 1.00 0.00 H new ATOM 1273 N TYR A 95 114.837 28.956 11.679 1.00 0.00 N ATOM 1274 CA TYR A 95 115.053 30.172 12.518 1.00 0.00 C ATOM 1275 C TYR A 95 116.488 30.686 12.337 1.00 0.00 C ATOM 1276 O TYR A 95 117.397 29.908 12.127 1.00 0.00 O ATOM 1277 CB TYR A 95 114.828 29.710 13.959 1.00 0.00 C ATOM 1278 CG TYR A 95 113.402 29.992 14.366 1.00 0.00 C ATOM 1279 CD1 TYR A 95 112.343 29.484 13.604 1.00 0.00 C ATOM 1280 CD2 TYR A 95 113.137 30.761 15.506 1.00 0.00 C ATOM 1281 CE1 TYR A 95 111.020 29.745 13.982 1.00 0.00 C ATOM 1282 CE2 TYR A 95 111.814 31.022 15.884 1.00 0.00 C ATOM 1283 CZ TYR A 95 110.756 30.514 15.121 1.00 0.00 C ATOM 1284 OH TYR A 95 109.453 30.771 15.494 1.00 0.00 O ATOM 0 H TYR A 95 114.602 28.109 12.197 1.00 0.00 H new ATOM 0 HA TYR A 95 114.383 30.987 12.245 1.00 0.00 H new ATOM 0 HB2 TYR A 95 115.037 28.644 14.046 1.00 0.00 H new ATOM 0 HB3 TYR A 95 115.516 30.226 14.628 1.00 0.00 H new ATOM 0 HD1 TYR A 95 112.546 28.891 12.725 1.00 0.00 H new ATOM 0 HD2 TYR A 95 113.954 31.153 16.094 1.00 0.00 H new ATOM 0 HE1 TYR A 95 110.203 29.353 13.394 1.00 0.00 H new ATOM 0 HE2 TYR A 95 111.610 31.615 16.763 1.00 0.00 H new ATOM 0 HH TYR A 95 109.447 31.318 16.307 1.00 0.00 H new ATOM 1293 N PRO A 96 116.651 31.986 12.419 1.00 0.00 N ATOM 1294 CA PRO A 96 117.999 32.591 12.256 1.00 0.00 C ATOM 1295 C PRO A 96 118.905 32.241 13.443 1.00 0.00 C ATOM 1296 O PRO A 96 120.115 32.314 13.348 1.00 0.00 O ATOM 1297 CB PRO A 96 117.716 34.092 12.206 1.00 0.00 C ATOM 1298 CG PRO A 96 116.417 34.260 12.923 1.00 0.00 C ATOM 1299 CD PRO A 96 115.623 33.007 12.674 1.00 0.00 C ATOM 0 HA PRO A 96 118.521 32.230 11.370 1.00 0.00 H new ATOM 0 HB2 PRO A 96 118.511 34.661 12.689 1.00 0.00 H new ATOM 0 HB3 PRO A 96 117.649 34.448 11.178 1.00 0.00 H new ATOM 0 HG2 PRO A 96 116.580 34.409 13.990 1.00 0.00 H new ATOM 0 HG3 PRO A 96 115.883 35.136 12.556 1.00 0.00 H new ATOM 0 HD2 PRO A 96 115.005 32.747 13.534 1.00 0.00 H new ATOM 0 HD3 PRO A 96 114.952 33.121 11.822 1.00 0.00 H new ATOM 1304 N THR A 97 118.332 31.870 14.560 1.00 0.00 N ATOM 1305 CA THR A 97 119.167 31.528 15.750 1.00 0.00 C ATOM 1306 C THR A 97 118.843 30.118 16.257 1.00 0.00 C ATOM 1307 O THR A 97 117.709 29.682 16.234 1.00 0.00 O ATOM 1308 CB THR A 97 118.797 32.572 16.804 1.00 0.00 C ATOM 1309 OG1 THR A 97 118.987 33.873 16.266 1.00 0.00 O ATOM 1310 CG2 THR A 97 119.685 32.391 18.036 1.00 0.00 C ATOM 0 H THR A 97 117.325 31.789 14.699 1.00 0.00 H new ATOM 0 HA THR A 97 120.231 31.536 15.515 1.00 0.00 H new ATOM 0 HB THR A 97 117.753 32.447 17.091 1.00 0.00 H new ATOM 0 HG1 THR A 97 118.749 34.544 16.940 1.00 0.00 H new ATOM 0 HG21 THR A 97 119.421 33.135 18.787 1.00 0.00 H new ATOM 0 HG22 THR A 97 119.538 31.392 18.447 1.00 0.00 H new ATOM 0 HG23 THR A 97 120.730 32.516 17.753 1.00 0.00 H new ATOM 1318 N TYR A 98 119.841 29.407 16.722 1.00 0.00 N ATOM 1319 CA TYR A 98 119.621 28.023 17.250 1.00 0.00 C ATOM 1320 C TYR A 98 118.848 27.163 16.241 1.00 0.00 C ATOM 1321 O TYR A 98 117.735 26.740 16.494 1.00 0.00 O ATOM 1322 CB TYR A 98 118.808 28.212 18.534 1.00 0.00 C ATOM 1323 CG TYR A 98 118.725 26.902 19.281 1.00 0.00 C ATOM 1324 CD1 TYR A 98 119.778 26.505 20.114 1.00 0.00 C ATOM 1325 CD2 TYR A 98 117.596 26.086 19.142 1.00 0.00 C ATOM 1326 CE1 TYR A 98 119.702 25.292 20.809 1.00 0.00 C ATOM 1327 CE2 TYR A 98 117.521 24.872 19.836 1.00 0.00 C ATOM 1328 CZ TYR A 98 118.574 24.476 20.669 1.00 0.00 C ATOM 1329 OH TYR A 98 118.500 23.280 21.355 1.00 0.00 O ATOM 0 H TYR A 98 120.808 29.729 16.759 1.00 0.00 H new ATOM 0 HA TYR A 98 120.563 27.506 17.432 1.00 0.00 H new ATOM 0 HB2 TYR A 98 119.274 28.971 19.162 1.00 0.00 H new ATOM 0 HB3 TYR A 98 117.807 28.568 18.293 1.00 0.00 H new ATOM 0 HD1 TYR A 98 120.649 27.135 20.220 1.00 0.00 H new ATOM 0 HD2 TYR A 98 116.783 26.393 18.500 1.00 0.00 H new ATOM 0 HE1 TYR A 98 120.514 24.986 21.453 1.00 0.00 H new ATOM 0 HE2 TYR A 98 116.651 24.241 19.729 1.00 0.00 H new ATOM 0 HH TYR A 98 117.651 22.836 21.148 1.00 0.00 H new ATOM 1338 N LYS A 99 119.431 26.903 15.100 1.00 0.00 N ATOM 1339 CA LYS A 99 118.735 26.069 14.071 1.00 0.00 C ATOM 1340 C LYS A 99 118.585 24.625 14.561 1.00 0.00 C ATOM 1341 O LYS A 99 119.518 24.034 15.070 1.00 0.00 O ATOM 1342 CB LYS A 99 119.646 26.114 12.843 1.00 0.00 C ATOM 1343 CG LYS A 99 118.982 25.368 11.684 1.00 0.00 C ATOM 1344 CD LYS A 99 119.948 25.304 10.500 1.00 0.00 C ATOM 1345 CE LYS A 99 119.250 24.656 9.301 1.00 0.00 C ATOM 1346 NZ LYS A 99 119.551 23.203 9.419 1.00 0.00 N ATOM 0 H LYS A 99 120.359 27.232 14.835 1.00 0.00 H new ATOM 0 HA LYS A 99 117.732 26.439 13.858 1.00 0.00 H new ATOM 0 HB2 LYS A 99 119.840 27.148 12.559 1.00 0.00 H new ATOM 0 HB3 LYS A 99 120.610 25.661 13.076 1.00 0.00 H new ATOM 0 HG2 LYS A 99 118.705 24.361 11.996 1.00 0.00 H new ATOM 0 HG3 LYS A 99 118.063 25.875 11.390 1.00 0.00 H new ATOM 0 HD2 LYS A 99 120.285 26.307 10.239 1.00 0.00 H new ATOM 0 HD3 LYS A 99 120.834 24.730 10.771 1.00 0.00 H new ATOM 0 HE2 LYS A 99 118.176 24.840 9.323 1.00 0.00 H new ATOM 0 HE3 LYS A 99 119.623 25.061 8.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 119.105 22.691 8.631 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 120.580 23.058 9.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 119.178 22.843 10.321 1.00 0.00 H new ATOM 1356 N ASN A 100 117.420 24.053 14.402 1.00 0.00 N ATOM 1357 CA ASN A 100 117.206 22.644 14.847 1.00 0.00 C ATOM 1358 C ASN A 100 117.015 21.736 13.628 1.00 0.00 C ATOM 1359 O ASN A 100 116.109 21.928 12.840 1.00 0.00 O ATOM 1360 CB ASN A 100 115.932 22.683 15.692 1.00 0.00 C ATOM 1361 CG ASN A 100 116.161 23.554 16.930 1.00 0.00 C ATOM 1362 OD1 ASN A 100 115.131 24.042 17.567 1.00 0.00 O flip ATOM 1363 ND2 ASN A 100 117.286 23.793 17.322 1.00 0.00 N flip ATOM 0 H ASN A 100 116.606 24.502 13.982 1.00 0.00 H new ATOM 0 HA ASN A 100 118.053 22.252 15.410 1.00 0.00 H new ATOM 0 HB2 ASN A 100 115.106 23.081 15.103 1.00 0.00 H new ATOM 0 HB3 ASN A 100 115.652 21.673 15.992 1.00 0.00 H new ATOM 0 HD21 ASN A 100 118.091 23.412 16.825 1.00 0.00 H new ATOM 0 HD22 ASN A 100 117.425 24.375 18.148 1.00 0.00 H new ATOM 1369 N ASP A 101 117.862 20.753 13.466 1.00 0.00 N ATOM 1370 CA ASP A 101 117.729 19.836 12.295 1.00 0.00 C ATOM 1371 C ASP A 101 116.820 18.651 12.638 1.00 0.00 C ATOM 1372 O ASP A 101 117.173 17.797 13.430 1.00 0.00 O ATOM 1373 CB ASP A 101 119.153 19.351 12.012 1.00 0.00 C ATOM 1374 CG ASP A 101 119.175 18.500 10.736 1.00 0.00 C ATOM 1375 OD1 ASP A 101 118.207 18.546 9.993 1.00 0.00 O ATOM 1376 OD2 ASP A 101 120.162 17.815 10.525 1.00 0.00 O ATOM 0 H ASP A 101 118.639 20.546 14.093 1.00 0.00 H new ATOM 0 HA ASP A 101 117.283 20.334 11.434 1.00 0.00 H new ATOM 0 HB2 ASP A 101 119.821 20.205 11.901 1.00 0.00 H new ATOM 0 HB3 ASP A 101 119.521 18.766 12.855 1.00 0.00 H new ATOM 1380 N THR A 102 115.656 18.592 12.046 1.00 0.00 N ATOM 1381 CA THR A 102 114.724 17.460 12.332 1.00 0.00 C ATOM 1382 C THR A 102 114.008 17.015 11.048 1.00 0.00 C ATOM 1383 O THR A 102 113.832 17.790 10.127 1.00 0.00 O ATOM 1384 CB THR A 102 113.730 18.016 13.360 1.00 0.00 C ATOM 1385 OG1 THR A 102 112.921 16.958 13.853 1.00 0.00 O ATOM 1386 CG2 THR A 102 112.844 19.090 12.719 1.00 0.00 C ATOM 0 H THR A 102 115.310 19.279 11.376 1.00 0.00 H new ATOM 0 HA THR A 102 115.244 16.580 12.711 1.00 0.00 H new ATOM 0 HB THR A 102 114.285 18.467 14.183 1.00 0.00 H new ATOM 0 HG1 THR A 102 112.286 17.311 14.511 1.00 0.00 H new ATOM 0 HG21 THR A 102 112.144 19.475 13.461 1.00 0.00 H new ATOM 0 HG22 THR A 102 113.468 19.905 12.352 1.00 0.00 H new ATOM 0 HG23 THR A 102 112.289 18.655 11.888 1.00 0.00 H new ATOM 1394 N SER A 103 113.593 15.777 10.986 1.00 0.00 N ATOM 1395 CA SER A 103 112.884 15.279 9.768 1.00 0.00 C ATOM 1396 C SER A 103 111.585 14.570 10.165 1.00 0.00 C ATOM 1397 O SER A 103 111.499 13.965 11.217 1.00 0.00 O ATOM 1398 CB SER A 103 113.855 14.294 9.120 1.00 0.00 C ATOM 1399 OG SER A 103 115.074 14.963 8.822 1.00 0.00 O ATOM 0 H SER A 103 113.714 15.087 11.727 1.00 0.00 H new ATOM 0 HA SER A 103 112.610 16.087 9.090 1.00 0.00 H new ATOM 0 HB2 SER A 103 114.042 13.455 9.791 1.00 0.00 H new ATOM 0 HB3 SER A 103 113.420 13.883 8.209 1.00 0.00 H new ATOM 0 HG SER A 103 115.700 14.333 8.407 1.00 0.00 H new ATOM 1404 N ASP A 104 110.575 14.639 9.336 1.00 0.00 N ATOM 1405 CA ASP A 104 109.282 13.967 9.672 1.00 0.00 C ATOM 1406 C ASP A 104 109.378 12.474 9.358 1.00 0.00 C ATOM 1407 O ASP A 104 109.716 12.089 8.254 1.00 0.00 O ATOM 1408 CB ASP A 104 108.236 14.639 8.778 1.00 0.00 C ATOM 1409 CG ASP A 104 106.836 14.128 9.134 1.00 0.00 C ATOM 1410 OD1 ASP A 104 106.691 13.511 10.178 1.00 0.00 O ATOM 1411 OD2 ASP A 104 105.928 14.362 8.353 1.00 0.00 O ATOM 0 H ASP A 104 110.589 15.131 8.442 1.00 0.00 H new ATOM 0 HA ASP A 104 109.028 14.059 10.728 1.00 0.00 H new ATOM 0 HB2 ASP A 104 108.280 15.721 8.903 1.00 0.00 H new ATOM 0 HB3 ASP A 104 108.453 14.430 7.730 1.00 0.00 H new ATOM 1415 N TYR A 105 109.102 11.628 10.317 1.00 0.00 N ATOM 1416 CA TYR A 105 109.199 10.163 10.062 1.00 0.00 C ATOM 1417 C TYR A 105 107.950 9.422 10.563 1.00 0.00 C ATOM 1418 O TYR A 105 107.112 9.979 11.245 1.00 0.00 O ATOM 1419 CB TYR A 105 110.458 9.715 10.818 1.00 0.00 C ATOM 1420 CG TYR A 105 110.225 9.775 12.312 1.00 0.00 C ATOM 1421 CD1 TYR A 105 110.394 10.984 12.998 1.00 0.00 C ATOM 1422 CD2 TYR A 105 109.842 8.623 13.008 1.00 0.00 C ATOM 1423 CE1 TYR A 105 110.179 11.040 14.380 1.00 0.00 C ATOM 1424 CE2 TYR A 105 109.627 8.678 14.391 1.00 0.00 C ATOM 1425 CZ TYR A 105 109.796 9.888 15.077 1.00 0.00 C ATOM 1426 OH TYR A 105 109.585 9.942 16.439 1.00 0.00 O ATOM 0 H TYR A 105 108.815 11.888 11.261 1.00 0.00 H new ATOM 0 HA TYR A 105 109.262 9.938 8.997 1.00 0.00 H new ATOM 0 HB2 TYR A 105 110.724 8.699 10.525 1.00 0.00 H new ATOM 0 HB3 TYR A 105 111.299 10.354 10.549 1.00 0.00 H new ATOM 0 HD1 TYR A 105 110.690 11.873 12.461 1.00 0.00 H new ATOM 0 HD2 TYR A 105 109.712 7.691 12.478 1.00 0.00 H new ATOM 0 HE1 TYR A 105 110.309 11.973 14.909 1.00 0.00 H new ATOM 0 HE2 TYR A 105 109.331 7.789 14.928 1.00 0.00 H new ATOM 0 HH TYR A 105 109.324 9.056 16.765 1.00 0.00 H new ATOM 1435 N GLY A 106 107.833 8.165 10.222 1.00 0.00 N ATOM 1436 CA GLY A 106 106.658 7.357 10.662 1.00 0.00 C ATOM 1437 C GLY A 106 107.019 5.875 10.560 1.00 0.00 C ATOM 1438 O GLY A 106 108.142 5.533 10.241 1.00 0.00 O ATOM 0 H GLY A 106 108.510 7.659 9.651 1.00 0.00 H new ATOM 0 HA2 GLY A 106 106.387 7.611 11.687 1.00 0.00 H new ATOM 0 HA3 GLY A 106 105.792 7.579 10.039 1.00 0.00 H new ATOM 1441 N PHE A 107 106.102 4.987 10.854 1.00 0.00 N ATOM 1442 CA PHE A 107 106.440 3.529 10.797 1.00 0.00 C ATOM 1443 C PHE A 107 105.803 2.848 9.579 1.00 0.00 C ATOM 1444 O PHE A 107 104.750 3.238 9.113 1.00 0.00 O ATOM 1445 CB PHE A 107 105.869 2.946 12.090 1.00 0.00 C ATOM 1446 CG PHE A 107 106.284 1.500 12.216 1.00 0.00 C ATOM 1447 CD1 PHE A 107 107.526 1.174 12.775 1.00 0.00 C ATOM 1448 CD2 PHE A 107 105.428 0.484 11.774 1.00 0.00 C ATOM 1449 CE1 PHE A 107 107.911 -0.167 12.892 1.00 0.00 C ATOM 1450 CE2 PHE A 107 105.812 -0.856 11.891 1.00 0.00 C ATOM 1451 CZ PHE A 107 107.054 -1.182 12.450 1.00 0.00 C ATOM 0 H PHE A 107 105.144 5.204 11.128 1.00 0.00 H new ATOM 0 HA PHE A 107 107.514 3.372 10.702 1.00 0.00 H new ATOM 0 HB2 PHE A 107 106.228 3.515 12.948 1.00 0.00 H new ATOM 0 HB3 PHE A 107 104.782 3.025 12.088 1.00 0.00 H new ATOM 0 HD1 PHE A 107 108.187 1.957 13.116 1.00 0.00 H new ATOM 0 HD2 PHE A 107 104.470 0.735 11.342 1.00 0.00 H new ATOM 0 HE1 PHE A 107 108.869 -0.418 13.323 1.00 0.00 H new ATOM 0 HE2 PHE A 107 105.151 -1.639 11.550 1.00 0.00 H new ATOM 0 HZ PHE A 107 107.351 -2.217 12.540 1.00 0.00 H new ATOM 1460 N SER A 108 106.444 1.824 9.071 1.00 0.00 N ATOM 1461 CA SER A 108 105.897 1.094 7.888 1.00 0.00 C ATOM 1462 C SER A 108 105.854 -0.414 8.172 1.00 0.00 C ATOM 1463 O SER A 108 106.521 -0.906 9.062 1.00 0.00 O ATOM 1464 CB SER A 108 106.872 1.398 6.751 1.00 0.00 C ATOM 1465 OG SER A 108 108.130 0.803 7.039 1.00 0.00 O ATOM 0 H SER A 108 107.328 1.461 9.428 1.00 0.00 H new ATOM 0 HA SER A 108 104.880 1.401 7.645 1.00 0.00 H new ATOM 0 HB2 SER A 108 106.482 1.013 5.809 1.00 0.00 H new ATOM 0 HB3 SER A 108 106.985 2.476 6.632 1.00 0.00 H new ATOM 0 HG SER A 108 108.457 0.330 6.246 1.00 0.00 H new ATOM 1470 N TYR A 109 105.079 -1.149 7.415 1.00 0.00 N ATOM 1471 CA TYR A 109 104.991 -2.628 7.625 1.00 0.00 C ATOM 1472 C TYR A 109 104.551 -3.312 6.325 1.00 0.00 C ATOM 1473 O TYR A 109 103.808 -2.742 5.549 1.00 0.00 O ATOM 1474 CB TYR A 109 103.932 -2.808 8.714 1.00 0.00 C ATOM 1475 CG TYR A 109 103.809 -4.270 9.068 1.00 0.00 C ATOM 1476 CD1 TYR A 109 104.684 -4.842 9.999 1.00 0.00 C ATOM 1477 CD2 TYR A 109 102.819 -5.054 8.465 1.00 0.00 C ATOM 1478 CE1 TYR A 109 104.568 -6.198 10.327 1.00 0.00 C ATOM 1479 CE2 TYR A 109 102.703 -6.410 8.794 1.00 0.00 C ATOM 1480 CZ TYR A 109 103.578 -6.981 9.725 1.00 0.00 C ATOM 1481 OH TYR A 109 103.463 -8.319 10.049 1.00 0.00 O ATOM 0 H TYR A 109 104.500 -0.787 6.657 1.00 0.00 H new ATOM 0 HA TYR A 109 105.946 -3.069 7.912 1.00 0.00 H new ATOM 0 HB2 TYR A 109 104.204 -2.232 9.598 1.00 0.00 H new ATOM 0 HB3 TYR A 109 102.972 -2.426 8.368 1.00 0.00 H new ATOM 0 HD1 TYR A 109 105.448 -4.237 10.464 1.00 0.00 H new ATOM 0 HD2 TYR A 109 102.144 -4.613 7.746 1.00 0.00 H new ATOM 0 HE1 TYR A 109 105.243 -6.639 11.045 1.00 0.00 H new ATOM 0 HE2 TYR A 109 101.939 -7.015 8.329 1.00 0.00 H new ATOM 0 HH TYR A 109 102.724 -8.716 9.542 1.00 0.00 H new ATOM 1490 N GLY A 110 104.988 -4.525 6.076 1.00 0.00 N ATOM 1491 CA GLY A 110 104.568 -5.214 4.818 1.00 0.00 C ATOM 1492 C GLY A 110 105.286 -6.560 4.668 1.00 0.00 C ATOM 1493 O GLY A 110 106.016 -6.991 5.535 1.00 0.00 O ATOM 0 H GLY A 110 105.609 -5.060 6.682 1.00 0.00 H new ATOM 0 HA2 GLY A 110 103.489 -5.371 4.827 1.00 0.00 H new ATOM 0 HA3 GLY A 110 104.791 -4.580 3.959 1.00 0.00 H new ATOM 1496 N ALA A 111 105.075 -7.220 3.559 1.00 0.00 N ATOM 1497 CA ALA A 111 105.732 -8.542 3.310 1.00 0.00 C ATOM 1498 C ALA A 111 105.529 -8.932 1.842 1.00 0.00 C ATOM 1499 O ALA A 111 104.632 -8.426 1.193 1.00 0.00 O ATOM 1500 CB ALA A 111 105.015 -9.525 4.236 1.00 0.00 C ATOM 0 H ALA A 111 104.469 -6.897 2.805 1.00 0.00 H new ATOM 0 HA ALA A 111 106.805 -8.527 3.502 1.00 0.00 H new ATOM 0 HB1 ALA A 111 105.442 -10.520 4.111 1.00 0.00 H new ATOM 0 HB2 ALA A 111 105.137 -9.205 5.271 1.00 0.00 H new ATOM 0 HB3 ALA A 111 103.954 -9.551 3.987 1.00 0.00 H new ATOM 1506 N GLY A 112 106.333 -9.816 1.298 1.00 0.00 N ATOM 1507 CA GLY A 112 106.150 -10.208 -0.131 1.00 0.00 C ATOM 1508 C GLY A 112 106.852 -11.549 -0.369 1.00 0.00 C ATOM 1509 O GLY A 112 107.348 -12.163 0.556 1.00 0.00 O ATOM 0 H GLY A 112 107.103 -10.279 1.781 1.00 0.00 H new ATOM 0 HA2 GLY A 112 105.089 -10.290 -0.367 1.00 0.00 H new ATOM 0 HA3 GLY A 112 106.564 -9.443 -0.788 1.00 0.00 H new ATOM 1512 N LEU A 113 106.895 -12.014 -1.594 1.00 0.00 N ATOM 1513 CA LEU A 113 107.565 -13.326 -1.861 1.00 0.00 C ATOM 1514 C LEU A 113 108.306 -13.303 -3.202 1.00 0.00 C ATOM 1515 O LEU A 113 108.051 -12.467 -4.046 1.00 0.00 O ATOM 1516 CB LEU A 113 106.434 -14.358 -1.891 1.00 0.00 C ATOM 1517 CG LEU A 113 105.407 -13.976 -2.966 1.00 0.00 C ATOM 1518 CD1 LEU A 113 104.991 -15.224 -3.747 1.00 0.00 C ATOM 1519 CD2 LEU A 113 104.173 -13.360 -2.299 1.00 0.00 C ATOM 0 H LEU A 113 106.501 -11.549 -2.412 1.00 0.00 H new ATOM 0 HA LEU A 113 108.311 -13.557 -1.100 1.00 0.00 H new ATOM 0 HB2 LEU A 113 106.839 -15.348 -2.098 1.00 0.00 H new ATOM 0 HB3 LEU A 113 105.950 -14.409 -0.915 1.00 0.00 H new ATOM 0 HG LEU A 113 105.853 -13.253 -3.649 1.00 0.00 H new ATOM 0 HD11 LEU A 113 104.262 -14.950 -4.509 1.00 0.00 H new ATOM 0 HD12 LEU A 113 105.867 -15.664 -4.224 1.00 0.00 H new ATOM 0 HD13 LEU A 113 104.547 -15.949 -3.065 1.00 0.00 H new ATOM 0 HD21 LEU A 113 103.444 -13.089 -3.063 1.00 0.00 H new ATOM 0 HD22 LEU A 113 103.730 -14.084 -1.615 1.00 0.00 H new ATOM 0 HD23 LEU A 113 104.466 -12.469 -1.744 1.00 0.00 H new ATOM 1530 N GLN A 114 109.219 -14.223 -3.402 1.00 0.00 N ATOM 1531 CA GLN A 114 109.978 -14.268 -4.687 1.00 0.00 C ATOM 1532 C GLN A 114 109.506 -15.464 -5.519 1.00 0.00 C ATOM 1533 O GLN A 114 109.191 -16.510 -4.981 1.00 0.00 O ATOM 1534 CB GLN A 114 111.441 -14.465 -4.276 1.00 0.00 C ATOM 1535 CG GLN A 114 111.898 -13.308 -3.383 1.00 0.00 C ATOM 1536 CD GLN A 114 113.318 -13.579 -2.882 1.00 0.00 C ATOM 1537 OE1 GLN A 114 113.776 -14.705 -2.889 1.00 0.00 O ATOM 1538 NE2 GLN A 114 114.042 -12.585 -2.444 1.00 0.00 N ATOM 0 H GLN A 114 109.470 -14.946 -2.727 1.00 0.00 H new ATOM 0 HA GLN A 114 109.837 -13.368 -5.286 1.00 0.00 H new ATOM 0 HB2 GLN A 114 111.553 -15.410 -3.745 1.00 0.00 H new ATOM 0 HB3 GLN A 114 112.072 -14.521 -5.163 1.00 0.00 H new ATOM 0 HG2 GLN A 114 111.870 -12.372 -3.940 1.00 0.00 H new ATOM 0 HG3 GLN A 114 111.218 -13.196 -2.538 1.00 0.00 H new ATOM 0 HE21 GLN A 114 113.659 -11.639 -2.437 1.00 0.00 H new ATOM 0 HE22 GLN A 114 114.990 -12.754 -2.108 1.00 0.00 H new ATOM 1545 N PHE A 115 109.461 -15.324 -6.822 1.00 0.00 N ATOM 1546 CA PHE A 115 109.015 -16.463 -7.678 1.00 0.00 C ATOM 1547 C PHE A 115 109.658 -16.368 -9.068 1.00 0.00 C ATOM 1548 O PHE A 115 109.948 -15.291 -9.549 1.00 0.00 O ATOM 1549 CB PHE A 115 107.490 -16.318 -7.768 1.00 0.00 C ATOM 1550 CG PHE A 115 107.133 -15.072 -8.547 1.00 0.00 C ATOM 1551 CD1 PHE A 115 107.074 -13.830 -7.901 1.00 0.00 C ATOM 1552 CD2 PHE A 115 106.867 -15.161 -9.919 1.00 0.00 C ATOM 1553 CE1 PHE A 115 106.749 -12.679 -8.630 1.00 0.00 C ATOM 1554 CE2 PHE A 115 106.545 -14.011 -10.646 1.00 0.00 C ATOM 1555 CZ PHE A 115 106.485 -12.770 -10.002 1.00 0.00 C ATOM 0 H PHE A 115 109.713 -14.474 -7.326 1.00 0.00 H new ATOM 0 HA PHE A 115 109.305 -17.430 -7.267 1.00 0.00 H new ATOM 0 HB2 PHE A 115 107.061 -17.195 -8.253 1.00 0.00 H new ATOM 0 HB3 PHE A 115 107.062 -16.266 -6.767 1.00 0.00 H new ATOM 0 HD1 PHE A 115 107.279 -13.760 -6.843 1.00 0.00 H new ATOM 0 HD2 PHE A 115 106.911 -16.119 -10.416 1.00 0.00 H new ATOM 0 HE1 PHE A 115 106.702 -11.721 -8.134 1.00 0.00 H new ATOM 0 HE2 PHE A 115 106.343 -14.080 -11.705 1.00 0.00 H new ATOM 0 HZ PHE A 115 106.235 -11.882 -10.564 1.00 0.00 H new ATOM 1564 N ASN A 116 109.850 -17.493 -9.722 1.00 0.00 N ATOM 1565 CA ASN A 116 110.451 -17.498 -11.106 1.00 0.00 C ATOM 1566 C ASN A 116 110.873 -18.916 -11.518 1.00 0.00 C ATOM 1567 O ASN A 116 111.390 -19.661 -10.709 1.00 0.00 O ATOM 1568 CB ASN A 116 111.704 -16.602 -11.054 1.00 0.00 C ATOM 1569 CG ASN A 116 111.514 -15.390 -11.972 1.00 0.00 C ATOM 1570 OD1 ASN A 116 110.343 -14.814 -12.044 1.00 0.00 O flip ATOM 1571 ND2 ASN A 116 112.441 -14.962 -12.631 1.00 0.00 N flip ATOM 0 H ASN A 116 109.616 -18.416 -9.357 1.00 0.00 H new ATOM 0 HA ASN A 116 109.720 -17.139 -11.830 1.00 0.00 H new ATOM 0 HB2 ASN A 116 111.883 -16.270 -10.031 1.00 0.00 H new ATOM 0 HB3 ASN A 116 112.581 -17.170 -11.363 1.00 0.00 H new ATOM 0 HD21 ASN A 116 113.356 -15.410 -12.576 1.00 0.00 H new ATOM 0 HD22 ASN A 116 112.304 -14.154 -13.239 1.00 0.00 H new ATOM 1577 N PRO A 117 110.679 -19.236 -12.779 1.00 0.00 N ATOM 1578 CA PRO A 117 111.091 -20.555 -13.295 1.00 0.00 C ATOM 1579 C PRO A 117 112.547 -20.476 -13.774 1.00 0.00 C ATOM 1580 O PRO A 117 112.881 -20.913 -14.858 1.00 0.00 O ATOM 1581 CB PRO A 117 110.152 -20.781 -14.474 1.00 0.00 C ATOM 1582 CG PRO A 117 109.739 -19.411 -14.934 1.00 0.00 C ATOM 1583 CD PRO A 117 110.056 -18.424 -13.832 1.00 0.00 C ATOM 0 HA PRO A 117 111.038 -21.355 -12.557 1.00 0.00 H new ATOM 0 HB2 PRO A 117 110.652 -21.328 -15.273 1.00 0.00 H new ATOM 0 HB3 PRO A 117 109.286 -21.372 -14.177 1.00 0.00 H new ATOM 0 HG2 PRO A 117 110.268 -19.142 -15.848 1.00 0.00 H new ATOM 0 HG3 PRO A 117 108.674 -19.393 -15.165 1.00 0.00 H new ATOM 0 HD2 PRO A 117 110.730 -17.642 -14.181 1.00 0.00 H new ATOM 0 HD3 PRO A 117 109.154 -17.929 -13.471 1.00 0.00 H new ATOM 1588 N MET A 118 113.414 -19.917 -12.967 1.00 0.00 N ATOM 1589 CA MET A 118 114.842 -19.793 -13.346 1.00 0.00 C ATOM 1590 C MET A 118 115.705 -20.027 -12.109 1.00 0.00 C ATOM 1591 O MET A 118 115.422 -19.535 -11.034 1.00 0.00 O ATOM 1592 CB MET A 118 115.000 -18.357 -13.849 1.00 0.00 C ATOM 1593 CG MET A 118 114.148 -18.136 -15.106 1.00 0.00 C ATOM 1594 SD MET A 118 114.708 -19.234 -16.436 1.00 0.00 S ATOM 1595 CE MET A 118 116.381 -18.562 -16.594 1.00 0.00 C ATOM 0 H MET A 118 113.182 -19.538 -12.049 1.00 0.00 H new ATOM 0 HA MET A 118 115.145 -20.515 -14.104 1.00 0.00 H new ATOM 0 HB2 MET A 118 114.699 -17.656 -13.070 1.00 0.00 H new ATOM 0 HB3 MET A 118 116.048 -18.156 -14.072 1.00 0.00 H new ATOM 0 HG2 MET A 118 113.099 -18.328 -14.882 1.00 0.00 H new ATOM 0 HG3 MET A 118 114.221 -17.097 -15.426 1.00 0.00 H new ATOM 0 HE1 MET A 118 116.736 -18.706 -17.614 1.00 0.00 H new ATOM 0 HE2 MET A 118 116.369 -17.497 -16.361 1.00 0.00 H new ATOM 0 HE3 MET A 118 117.047 -19.077 -15.902 1.00 0.00 H new ATOM 1603 N GLU A 119 116.734 -20.796 -12.257 1.00 0.00 N ATOM 1604 CA GLU A 119 117.624 -21.110 -11.100 1.00 0.00 C ATOM 1605 C GLU A 119 118.321 -19.859 -10.539 1.00 0.00 C ATOM 1606 O GLU A 119 118.447 -19.712 -9.339 1.00 0.00 O ATOM 1607 CB GLU A 119 118.662 -22.087 -11.655 1.00 0.00 C ATOM 1608 CG GLU A 119 119.549 -22.595 -10.514 1.00 0.00 C ATOM 1609 CD GLU A 119 120.658 -23.499 -11.069 1.00 0.00 C ATOM 1610 OE1 GLU A 119 120.724 -23.661 -12.277 1.00 0.00 O ATOM 1611 OE2 GLU A 119 121.425 -24.012 -10.272 1.00 0.00 O ATOM 0 H GLU A 119 117.007 -21.230 -13.138 1.00 0.00 H new ATOM 0 HA GLU A 119 117.049 -21.523 -10.271 1.00 0.00 H new ATOM 0 HB2 GLU A 119 118.164 -22.925 -12.143 1.00 0.00 H new ATOM 0 HB3 GLU A 119 119.272 -21.594 -12.412 1.00 0.00 H new ATOM 0 HG2 GLU A 119 119.989 -21.751 -9.982 1.00 0.00 H new ATOM 0 HG3 GLU A 119 118.946 -23.147 -9.793 1.00 0.00 H new ATOM 1616 N ASN A 120 118.811 -18.976 -11.378 1.00 0.00 N ATOM 1617 CA ASN A 120 119.532 -17.773 -10.849 1.00 0.00 C ATOM 1618 C ASN A 120 118.713 -16.480 -10.978 1.00 0.00 C ATOM 1619 O ASN A 120 119.208 -15.410 -10.684 1.00 0.00 O ATOM 1620 CB ASN A 120 120.798 -17.679 -11.702 1.00 0.00 C ATOM 1621 CG ASN A 120 121.658 -18.927 -11.487 1.00 0.00 C ATOM 1622 OD1 ASN A 120 121.506 -19.623 -10.502 1.00 0.00 O ATOM 1623 ND2 ASN A 120 122.561 -19.241 -12.374 1.00 0.00 N ATOM 0 H ASN A 120 118.744 -19.034 -12.394 1.00 0.00 H new ATOM 0 HA ASN A 120 119.732 -17.881 -9.783 1.00 0.00 H new ATOM 0 HB2 ASN A 120 120.533 -17.585 -12.755 1.00 0.00 H new ATOM 0 HB3 ASN A 120 121.363 -16.786 -11.435 1.00 0.00 H new ATOM 0 HD21 ASN A 120 123.140 -20.070 -12.241 1.00 0.00 H new ATOM 0 HD22 ASN A 120 122.689 -18.657 -13.201 1.00 0.00 H new ATOM 1629 N VAL A 121 117.479 -16.550 -11.408 1.00 0.00 N ATOM 1630 CA VAL A 121 116.672 -15.294 -11.536 1.00 0.00 C ATOM 1631 C VAL A 121 115.426 -15.364 -10.648 1.00 0.00 C ATOM 1632 O VAL A 121 114.751 -16.374 -10.589 1.00 0.00 O ATOM 1633 CB VAL A 121 116.284 -15.202 -13.015 1.00 0.00 C ATOM 1634 CG1 VAL A 121 115.509 -13.905 -13.258 1.00 0.00 C ATOM 1635 CG2 VAL A 121 117.548 -15.203 -13.880 1.00 0.00 C ATOM 0 H VAL A 121 116.998 -17.409 -11.673 1.00 0.00 H new ATOM 0 HA VAL A 121 117.234 -14.417 -11.216 1.00 0.00 H new ATOM 0 HB VAL A 121 115.662 -16.058 -13.278 1.00 0.00 H new ATOM 0 HG11 VAL A 121 115.232 -13.838 -14.310 1.00 0.00 H new ATOM 0 HG12 VAL A 121 114.608 -13.899 -12.645 1.00 0.00 H new ATOM 0 HG13 VAL A 121 116.134 -13.052 -12.992 1.00 0.00 H new ATOM 0 HG21 VAL A 121 117.269 -15.138 -14.932 1.00 0.00 H new ATOM 0 HG22 VAL A 121 118.170 -14.348 -13.616 1.00 0.00 H new ATOM 0 HG23 VAL A 121 118.105 -16.124 -13.709 1.00 0.00 H new ATOM 1645 N ALA A 122 115.122 -14.295 -9.954 1.00 0.00 N ATOM 1646 CA ALA A 122 113.921 -14.304 -9.065 1.00 0.00 C ATOM 1647 C ALA A 122 113.238 -12.930 -9.025 1.00 0.00 C ATOM 1648 O ALA A 122 113.862 -11.920 -8.783 1.00 0.00 O ATOM 1649 CB ALA A 122 114.464 -14.666 -7.683 1.00 0.00 C ATOM 0 H ALA A 122 115.650 -13.422 -9.965 1.00 0.00 H new ATOM 0 HA ALA A 122 113.166 -15.006 -9.419 1.00 0.00 H new ATOM 0 HB1 ALA A 122 113.644 -14.695 -6.966 1.00 0.00 H new ATOM 0 HB2 ALA A 122 114.943 -15.644 -7.725 1.00 0.00 H new ATOM 0 HB3 ALA A 122 115.193 -13.918 -7.371 1.00 0.00 H new ATOM 1655 N LEU A 123 111.947 -12.905 -9.232 1.00 0.00 N ATOM 1656 CA LEU A 123 111.189 -11.618 -9.179 1.00 0.00 C ATOM 1657 C LEU A 123 110.273 -11.651 -7.959 1.00 0.00 C ATOM 1658 O LEU A 123 109.854 -12.715 -7.542 1.00 0.00 O ATOM 1659 CB LEU A 123 110.371 -11.563 -10.475 1.00 0.00 C ATOM 1660 CG LEU A 123 111.302 -11.660 -11.689 1.00 0.00 C ATOM 1661 CD1 LEU A 123 110.473 -11.590 -12.972 1.00 0.00 C ATOM 1662 CD2 LEU A 123 112.297 -10.495 -11.671 1.00 0.00 C ATOM 0 H LEU A 123 111.380 -13.728 -9.437 1.00 0.00 H new ATOM 0 HA LEU A 123 111.835 -10.744 -9.095 1.00 0.00 H new ATOM 0 HB2 LEU A 123 109.649 -12.380 -10.494 1.00 0.00 H new ATOM 0 HB3 LEU A 123 109.802 -10.634 -10.516 1.00 0.00 H new ATOM 0 HG LEU A 123 111.845 -12.604 -11.651 1.00 0.00 H new ATOM 0 HD11 LEU A 123 111.134 -11.659 -13.836 1.00 0.00 H new ATOM 0 HD12 LEU A 123 109.762 -12.416 -12.992 1.00 0.00 H new ATOM 0 HD13 LEU A 123 109.931 -10.645 -13.004 1.00 0.00 H new ATOM 0 HD21 LEU A 123 112.957 -10.567 -12.535 1.00 0.00 H new ATOM 0 HD22 LEU A 123 111.753 -9.551 -11.708 1.00 0.00 H new ATOM 0 HD23 LEU A 123 112.890 -10.537 -10.757 1.00 0.00 H new ATOM 1673 N ASP A 124 109.959 -10.528 -7.360 1.00 0.00 N ATOM 1674 CA ASP A 124 109.076 -10.583 -6.155 1.00 0.00 C ATOM 1675 C ASP A 124 108.198 -9.334 -6.016 1.00 0.00 C ATOM 1676 O ASP A 124 108.514 -8.267 -6.509 1.00 0.00 O ATOM 1677 CB ASP A 124 110.041 -10.693 -4.972 1.00 0.00 C ATOM 1678 CG ASP A 124 110.986 -9.483 -4.927 1.00 0.00 C ATOM 1679 OD1 ASP A 124 110.790 -8.559 -5.699 1.00 0.00 O ATOM 1680 OD2 ASP A 124 111.897 -9.504 -4.115 1.00 0.00 O ATOM 0 H ASP A 124 110.267 -9.598 -7.644 1.00 0.00 H new ATOM 0 HA ASP A 124 108.380 -11.420 -6.217 1.00 0.00 H new ATOM 0 HB2 ASP A 124 109.477 -10.755 -4.041 1.00 0.00 H new ATOM 0 HB3 ASP A 124 110.622 -11.611 -5.055 1.00 0.00 H new ATOM 1684 N PHE A 125 107.094 -9.482 -5.324 1.00 0.00 N ATOM 1685 CA PHE A 125 106.167 -8.331 -5.104 1.00 0.00 C ATOM 1686 C PHE A 125 105.954 -8.125 -3.603 1.00 0.00 C ATOM 1687 O PHE A 125 105.856 -9.076 -2.852 1.00 0.00 O ATOM 1688 CB PHE A 125 104.853 -8.731 -5.776 1.00 0.00 C ATOM 1689 CG PHE A 125 105.070 -8.922 -7.257 1.00 0.00 C ATOM 1690 CD1 PHE A 125 105.662 -7.904 -8.018 1.00 0.00 C ATOM 1691 CD2 PHE A 125 104.675 -10.114 -7.872 1.00 0.00 C ATOM 1692 CE1 PHE A 125 105.859 -8.082 -9.392 1.00 0.00 C ATOM 1693 CE2 PHE A 125 104.870 -10.292 -9.246 1.00 0.00 C ATOM 1694 CZ PHE A 125 105.462 -9.276 -10.006 1.00 0.00 C ATOM 0 H PHE A 125 106.794 -10.360 -4.899 1.00 0.00 H new ATOM 0 HA PHE A 125 106.559 -7.400 -5.513 1.00 0.00 H new ATOM 0 HB2 PHE A 125 104.474 -9.652 -5.334 1.00 0.00 H new ATOM 0 HB3 PHE A 125 104.099 -7.962 -5.606 1.00 0.00 H new ATOM 0 HD1 PHE A 125 105.966 -6.983 -7.544 1.00 0.00 H new ATOM 0 HD2 PHE A 125 104.219 -10.898 -7.286 1.00 0.00 H new ATOM 0 HE1 PHE A 125 106.317 -7.299 -9.978 1.00 0.00 H new ATOM 0 HE2 PHE A 125 104.564 -11.213 -9.720 1.00 0.00 H new ATOM 0 HZ PHE A 125 105.613 -9.413 -11.067 1.00 0.00 H new ATOM 1703 N SER A 126 105.882 -6.898 -3.160 1.00 0.00 N ATOM 1704 CA SER A 126 105.675 -6.650 -1.703 1.00 0.00 C ATOM 1705 C SER A 126 104.687 -5.503 -1.479 1.00 0.00 C ATOM 1706 O SER A 126 104.628 -4.561 -2.245 1.00 0.00 O ATOM 1707 CB SER A 126 107.056 -6.278 -1.170 1.00 0.00 C ATOM 1708 OG SER A 126 107.976 -7.309 -1.494 1.00 0.00 O ATOM 0 H SER A 126 105.957 -6.062 -3.739 1.00 0.00 H new ATOM 0 HA SER A 126 105.256 -7.520 -1.197 1.00 0.00 H new ATOM 0 HB2 SER A 126 107.383 -5.333 -1.603 1.00 0.00 H new ATOM 0 HB3 SER A 126 107.016 -6.137 -0.090 1.00 0.00 H new ATOM 0 HG SER A 126 108.870 -7.060 -1.180 1.00 0.00 H new ATOM 1713 N TYR A 127 103.929 -5.569 -0.416 1.00 0.00 N ATOM 1714 CA TYR A 127 102.957 -4.480 -0.111 1.00 0.00 C ATOM 1715 C TYR A 127 103.334 -3.839 1.227 1.00 0.00 C ATOM 1716 O TYR A 127 103.449 -4.518 2.230 1.00 0.00 O ATOM 1717 CB TYR A 127 101.597 -5.174 -0.010 1.00 0.00 C ATOM 1718 CG TYR A 127 101.263 -5.838 -1.326 1.00 0.00 C ATOM 1719 CD1 TYR A 127 100.632 -5.108 -2.339 1.00 0.00 C ATOM 1720 CD2 TYR A 127 101.586 -7.186 -1.530 1.00 0.00 C ATOM 1721 CE1 TYR A 127 100.323 -5.724 -3.557 1.00 0.00 C ATOM 1722 CE2 TYR A 127 101.277 -7.801 -2.749 1.00 0.00 C ATOM 1723 CZ TYR A 127 100.646 -7.071 -3.762 1.00 0.00 C ATOM 1724 OH TYR A 127 100.343 -7.678 -4.964 1.00 0.00 O ATOM 0 H TYR A 127 103.942 -6.335 0.257 1.00 0.00 H new ATOM 0 HA TYR A 127 102.947 -3.694 -0.866 1.00 0.00 H new ATOM 0 HB2 TYR A 127 101.615 -5.916 0.788 1.00 0.00 H new ATOM 0 HB3 TYR A 127 100.826 -4.448 0.248 1.00 0.00 H new ATOM 0 HD1 TYR A 127 100.383 -4.069 -2.181 1.00 0.00 H new ATOM 0 HD2 TYR A 127 102.073 -7.750 -0.748 1.00 0.00 H new ATOM 0 HE1 TYR A 127 99.835 -5.161 -4.339 1.00 0.00 H new ATOM 0 HE2 TYR A 127 101.526 -8.840 -2.908 1.00 0.00 H new ATOM 0 HH TYR A 127 100.635 -8.613 -4.941 1.00 0.00 H new ATOM 1733 N GLU A 128 103.541 -2.547 1.254 1.00 0.00 N ATOM 1734 CA GLU A 128 103.927 -1.887 2.537 1.00 0.00 C ATOM 1735 C GLU A 128 103.109 -0.616 2.780 1.00 0.00 C ATOM 1736 O GLU A 128 102.886 0.175 1.883 1.00 0.00 O ATOM 1737 CB GLU A 128 105.407 -1.544 2.373 1.00 0.00 C ATOM 1738 CG GLU A 128 105.948 -0.982 3.692 1.00 0.00 C ATOM 1739 CD GLU A 128 107.407 -0.539 3.517 1.00 0.00 C ATOM 1740 OE1 GLU A 128 107.918 -0.644 2.413 1.00 0.00 O ATOM 1741 OE2 GLU A 128 107.988 -0.101 4.496 1.00 0.00 O ATOM 0 H GLU A 128 103.460 -1.925 0.450 1.00 0.00 H new ATOM 0 HA GLU A 128 103.741 -2.536 3.393 1.00 0.00 H new ATOM 0 HB2 GLU A 128 105.968 -2.433 2.086 1.00 0.00 H new ATOM 0 HB3 GLU A 128 105.536 -0.814 1.574 1.00 0.00 H new ATOM 0 HG2 GLU A 128 105.339 -0.137 4.013 1.00 0.00 H new ATOM 0 HG3 GLU A 128 105.881 -1.739 4.474 1.00 0.00 H new ATOM 1746 N GLN A 129 102.680 -0.411 3.997 1.00 0.00 N ATOM 1747 CA GLN A 129 101.893 0.815 4.329 1.00 0.00 C ATOM 1748 C GLN A 129 102.636 1.628 5.395 1.00 0.00 C ATOM 1749 O GLN A 129 103.027 1.103 6.419 1.00 0.00 O ATOM 1750 CB GLN A 129 100.564 0.296 4.879 1.00 0.00 C ATOM 1751 CG GLN A 129 99.626 1.476 5.145 1.00 0.00 C ATOM 1752 CD GLN A 129 98.282 0.962 5.669 1.00 0.00 C ATOM 1753 OE1 GLN A 129 98.024 -0.226 5.664 1.00 0.00 O ATOM 1754 NE2 GLN A 129 97.407 1.816 6.127 1.00 0.00 N ATOM 0 H GLN A 129 102.841 -1.043 4.781 1.00 0.00 H new ATOM 0 HA GLN A 129 101.746 1.466 3.467 1.00 0.00 H new ATOM 0 HB2 GLN A 129 100.108 -0.392 4.167 1.00 0.00 H new ATOM 0 HB3 GLN A 129 100.733 -0.263 5.799 1.00 0.00 H new ATOM 0 HG2 GLN A 129 100.075 2.153 5.872 1.00 0.00 H new ATOM 0 HG3 GLN A 129 99.475 2.047 4.229 1.00 0.00 H new ATOM 0 HE21 GLN A 129 97.622 2.813 6.132 1.00 0.00 H new ATOM 0 HE22 GLN A 129 96.509 1.486 6.480 1.00 0.00 H new ATOM 1761 N SER A 130 102.839 2.899 5.163 1.00 0.00 N ATOM 1762 CA SER A 130 103.563 3.734 6.169 1.00 0.00 C ATOM 1763 C SER A 130 102.696 4.913 6.615 1.00 0.00 C ATOM 1764 O SER A 130 101.931 5.458 5.841 1.00 0.00 O ATOM 1765 CB SER A 130 104.811 4.231 5.443 1.00 0.00 C ATOM 1766 OG SER A 130 105.569 3.117 4.992 1.00 0.00 O ATOM 0 H SER A 130 102.536 3.394 4.324 1.00 0.00 H new ATOM 0 HA SER A 130 103.808 3.170 7.069 1.00 0.00 H new ATOM 0 HB2 SER A 130 104.528 4.859 4.598 1.00 0.00 H new ATOM 0 HB3 SER A 130 105.412 4.848 6.111 1.00 0.00 H new ATOM 0 HG SER A 130 106.370 3.434 4.524 1.00 0.00 H new ATOM 1771 N ARG A 131 102.815 5.316 7.854 1.00 0.00 N ATOM 1772 CA ARG A 131 102.003 6.466 8.348 1.00 0.00 C ATOM 1773 C ARG A 131 102.906 7.489 9.040 1.00 0.00 C ATOM 1774 O ARG A 131 103.647 7.157 9.951 1.00 0.00 O ATOM 1775 CB ARG A 131 101.021 5.854 9.348 1.00 0.00 C ATOM 1776 CG ARG A 131 100.072 4.903 8.616 1.00 0.00 C ATOM 1777 CD ARG A 131 99.021 4.369 9.593 1.00 0.00 C ATOM 1778 NE ARG A 131 99.798 3.676 10.659 1.00 0.00 N ATOM 1779 CZ ARG A 131 99.385 3.710 11.897 1.00 0.00 C ATOM 1780 NH1 ARG A 131 98.195 3.271 12.200 1.00 0.00 N ATOM 1781 NH2 ARG A 131 100.164 4.185 12.831 1.00 0.00 N ATOM 0 H ARG A 131 103.439 4.898 8.544 1.00 0.00 H new ATOM 0 HA ARG A 131 101.490 6.989 7.541 1.00 0.00 H new ATOM 0 HB2 ARG A 131 101.565 5.316 10.124 1.00 0.00 H new ATOM 0 HB3 ARG A 131 100.453 6.641 9.844 1.00 0.00 H new ATOM 0 HG2 ARG A 131 99.585 5.423 7.791 1.00 0.00 H new ATOM 0 HG3 ARG A 131 100.634 4.075 8.183 1.00 0.00 H new ATOM 0 HD2 ARG A 131 98.420 5.179 10.007 1.00 0.00 H new ATOM 0 HD3 ARG A 131 98.334 3.683 9.097 1.00 0.00 H new ATOM 0 HE ARG A 131 100.654 3.174 10.421 1.00 0.00 H new ATOM 0 HH11 ARG A 131 97.587 2.901 11.470 1.00 0.00 H new ATOM 0 HH12 ARG A 131 97.873 3.298 13.167 1.00 0.00 H new ATOM 0 HH21 ARG A 131 101.094 4.529 12.593 1.00 0.00 H new ATOM 0 HH22 ARG A 131 99.842 4.212 13.799 1.00 0.00 H new ATOM 1792 N ILE A 132 102.857 8.727 8.608 1.00 0.00 N ATOM 1793 CA ILE A 132 103.716 9.776 9.232 1.00 0.00 C ATOM 1794 C ILE A 132 102.828 10.795 9.948 1.00 0.00 C ATOM 1795 O ILE A 132 102.789 11.951 9.582 1.00 0.00 O ATOM 1796 CB ILE A 132 104.458 10.461 8.071 1.00 0.00 C ATOM 1797 CG1 ILE A 132 104.978 9.426 7.056 1.00 0.00 C ATOM 1798 CG2 ILE A 132 105.640 11.258 8.627 1.00 0.00 C ATOM 1799 CD1 ILE A 132 105.909 8.427 7.747 1.00 0.00 C ATOM 0 H ILE A 132 102.258 9.054 7.850 1.00 0.00 H new ATOM 0 HA ILE A 132 104.411 9.355 9.958 1.00 0.00 H new ATOM 0 HB ILE A 132 103.760 11.124 7.561 1.00 0.00 H new ATOM 0 HG12 ILE A 132 104.139 8.898 6.602 1.00 0.00 H new ATOM 0 HG13 ILE A 132 105.510 9.932 6.250 1.00 0.00 H new ATOM 0 HG21 ILE A 132 106.168 11.745 7.807 1.00 0.00 H new ATOM 0 HG22 ILE A 132 105.274 12.013 9.323 1.00 0.00 H new ATOM 0 HG23 ILE A 132 106.320 10.584 9.148 1.00 0.00 H new ATOM 0 HD11 ILE A 132 106.269 7.701 7.018 1.00 0.00 H new ATOM 0 HD12 ILE A 132 106.757 8.959 8.179 1.00 0.00 H new ATOM 0 HD13 ILE A 132 105.365 7.909 8.537 1.00 0.00 H new ATOM 1810 N ARG A 133 102.106 10.373 10.961 1.00 0.00 N ATOM 1811 CA ARG A 133 101.198 11.302 11.717 1.00 0.00 C ATOM 1812 C ARG A 133 100.039 11.792 10.835 1.00 0.00 C ATOM 1813 O ARG A 133 98.885 11.572 11.148 1.00 0.00 O ATOM 1814 CB ARG A 133 102.066 12.484 12.172 1.00 0.00 C ATOM 1815 CG ARG A 133 101.268 13.356 13.143 1.00 0.00 C ATOM 1816 CD ARG A 133 102.101 14.578 13.538 1.00 0.00 C ATOM 1817 NE ARG A 133 101.272 15.300 14.542 1.00 0.00 N ATOM 1818 CZ ARG A 133 101.731 15.498 15.747 1.00 0.00 C ATOM 1819 NH1 ARG A 133 102.899 16.051 15.918 1.00 0.00 N ATOM 1820 NH2 ARG A 133 101.020 15.143 16.782 1.00 0.00 N ATOM 0 H ARG A 133 102.106 9.412 11.302 1.00 0.00 H new ATOM 0 HA ARG A 133 100.746 10.790 12.567 1.00 0.00 H new ATOM 0 HB2 ARG A 133 102.973 12.119 12.655 1.00 0.00 H new ATOM 0 HB3 ARG A 133 102.379 13.073 11.310 1.00 0.00 H new ATOM 0 HG2 ARG A 133 100.334 13.674 12.679 1.00 0.00 H new ATOM 0 HG3 ARG A 133 101.003 12.781 14.031 1.00 0.00 H new ATOM 0 HD2 ARG A 133 103.062 14.282 13.959 1.00 0.00 H new ATOM 0 HD3 ARG A 133 102.312 15.208 12.674 1.00 0.00 H new ATOM 0 HE ARG A 133 100.345 15.640 14.288 1.00 0.00 H new ATOM 0 HH11 ARG A 133 103.455 16.329 15.109 1.00 0.00 H new ATOM 0 HH12 ARG A 133 103.257 16.205 16.861 1.00 0.00 H new ATOM 0 HH21 ARG A 133 100.106 14.711 16.649 1.00 0.00 H new ATOM 0 HH22 ARG A 133 101.379 15.298 17.724 1.00 0.00 H new ATOM 1831 N SER A 134 100.328 12.458 9.746 1.00 0.00 N ATOM 1832 CA SER A 134 99.232 12.962 8.862 1.00 0.00 C ATOM 1833 C SER A 134 99.421 12.482 7.417 1.00 0.00 C ATOM 1834 O SER A 134 98.726 12.921 6.520 1.00 0.00 O ATOM 1835 CB SER A 134 99.335 14.486 8.938 1.00 0.00 C ATOM 1836 OG SER A 134 98.266 14.989 9.728 1.00 0.00 O ATOM 0 H SER A 134 101.274 12.675 9.431 1.00 0.00 H new ATOM 0 HA SER A 134 98.256 12.596 9.180 1.00 0.00 H new ATOM 0 HB2 SER A 134 100.292 14.776 9.372 1.00 0.00 H new ATOM 0 HB3 SER A 134 99.296 14.915 7.937 1.00 0.00 H new ATOM 0 HG SER A 134 98.329 15.966 9.781 1.00 0.00 H new ATOM 1841 N VAL A 135 100.347 11.588 7.181 1.00 0.00 N ATOM 1842 CA VAL A 135 100.559 11.097 5.786 1.00 0.00 C ATOM 1843 C VAL A 135 100.452 9.574 5.728 1.00 0.00 C ATOM 1844 O VAL A 135 101.040 8.866 6.522 1.00 0.00 O ATOM 1845 CB VAL A 135 101.969 11.548 5.397 1.00 0.00 C ATOM 1846 CG1 VAL A 135 102.240 11.173 3.939 1.00 0.00 C ATOM 1847 CG2 VAL A 135 102.089 13.067 5.558 1.00 0.00 C ATOM 0 H VAL A 135 100.960 11.180 7.887 1.00 0.00 H new ATOM 0 HA VAL A 135 99.806 11.494 5.105 1.00 0.00 H new ATOM 0 HB VAL A 135 102.695 11.056 6.044 1.00 0.00 H new ATOM 0 HG11 VAL A 135 103.244 11.494 3.661 1.00 0.00 H new ATOM 0 HG12 VAL A 135 102.158 10.093 3.820 1.00 0.00 H new ATOM 0 HG13 VAL A 135 101.511 11.665 3.295 1.00 0.00 H new ATOM 0 HG21 VAL A 135 103.094 13.384 5.280 1.00 0.00 H new ATOM 0 HG22 VAL A 135 101.362 13.560 4.913 1.00 0.00 H new ATOM 0 HG23 VAL A 135 101.897 13.339 6.596 1.00 0.00 H new ATOM 1857 N ASP A 136 99.715 9.070 4.777 1.00 0.00 N ATOM 1858 CA ASP A 136 99.568 7.596 4.630 1.00 0.00 C ATOM 1859 C ASP A 136 99.807 7.229 3.169 1.00 0.00 C ATOM 1860 O ASP A 136 99.034 7.586 2.300 1.00 0.00 O ATOM 1861 CB ASP A 136 98.125 7.292 5.040 1.00 0.00 C ATOM 1862 CG ASP A 136 97.892 5.776 5.055 1.00 0.00 C ATOM 1863 OD1 ASP A 136 98.865 5.040 5.007 1.00 0.00 O ATOM 1864 OD2 ASP A 136 96.740 5.378 5.116 1.00 0.00 O ATOM 0 H ASP A 136 99.204 9.623 4.089 1.00 0.00 H new ATOM 0 HA ASP A 136 100.274 7.030 5.237 1.00 0.00 H new ATOM 0 HB2 ASP A 136 97.923 7.709 6.027 1.00 0.00 H new ATOM 0 HB3 ASP A 136 97.433 7.768 4.345 1.00 0.00 H new ATOM 1868 N VAL A 137 100.880 6.546 2.883 1.00 0.00 N ATOM 1869 CA VAL A 137 101.188 6.183 1.471 1.00 0.00 C ATOM 1870 C VAL A 137 101.144 4.665 1.278 1.00 0.00 C ATOM 1871 O VAL A 137 101.542 3.906 2.141 1.00 0.00 O ATOM 1872 CB VAL A 137 102.614 6.708 1.249 1.00 0.00 C ATOM 1873 CG1 VAL A 137 103.084 6.378 -0.172 1.00 0.00 C ATOM 1874 CG2 VAL A 137 102.639 8.229 1.455 1.00 0.00 C ATOM 0 H VAL A 137 101.561 6.222 3.570 1.00 0.00 H new ATOM 0 HA VAL A 137 100.469 6.604 0.769 1.00 0.00 H new ATOM 0 HB VAL A 137 103.282 6.229 1.965 1.00 0.00 H new ATOM 0 HG11 VAL A 137 104.096 6.755 -0.317 1.00 0.00 H new ATOM 0 HG12 VAL A 137 103.075 5.298 -0.316 1.00 0.00 H new ATOM 0 HG13 VAL A 137 102.415 6.846 -0.894 1.00 0.00 H new ATOM 0 HG21 VAL A 137 103.651 8.601 1.297 1.00 0.00 H new ATOM 0 HG22 VAL A 137 101.963 8.704 0.744 1.00 0.00 H new ATOM 0 HG23 VAL A 137 102.320 8.464 2.471 1.00 0.00 H new ATOM 1884 N GLY A 138 100.702 4.224 0.131 1.00 0.00 N ATOM 1885 CA GLY A 138 100.671 2.762 -0.157 1.00 0.00 C ATOM 1886 C GLY A 138 101.782 2.479 -1.166 1.00 0.00 C ATOM 1887 O GLY A 138 101.665 2.809 -2.331 1.00 0.00 O ATOM 0 H GLY A 138 100.359 4.818 -0.624 1.00 0.00 H new ATOM 0 HA2 GLY A 138 100.824 2.186 0.756 1.00 0.00 H new ATOM 0 HA3 GLY A 138 99.701 2.469 -0.560 1.00 0.00 H new ATOM 1890 N THR A 139 102.875 1.916 -0.725 1.00 0.00 N ATOM 1891 CA THR A 139 104.010 1.669 -1.660 1.00 0.00 C ATOM 1892 C THR A 139 104.126 0.195 -2.047 1.00 0.00 C ATOM 1893 O THR A 139 104.039 -0.692 -1.220 1.00 0.00 O ATOM 1894 CB THR A 139 105.254 2.112 -0.886 1.00 0.00 C ATOM 1895 OG1 THR A 139 105.088 3.455 -0.457 1.00 0.00 O ATOM 1896 CG2 THR A 139 106.486 2.007 -1.786 1.00 0.00 C ATOM 0 H THR A 139 103.031 1.618 0.238 1.00 0.00 H new ATOM 0 HA THR A 139 103.874 2.211 -2.596 1.00 0.00 H new ATOM 0 HB THR A 139 105.390 1.467 -0.018 1.00 0.00 H new ATOM 0 HG1 THR A 139 105.883 3.740 0.040 1.00 0.00 H new ATOM 0 HG21 THR A 139 107.370 2.323 -1.232 1.00 0.00 H new ATOM 0 HG22 THR A 139 106.612 0.974 -2.111 1.00 0.00 H new ATOM 0 HG23 THR A 139 106.356 2.649 -2.657 1.00 0.00 H new ATOM 1904 N TRP A 140 104.359 -0.054 -3.308 1.00 0.00 N ATOM 1905 CA TRP A 140 104.526 -1.453 -3.788 1.00 0.00 C ATOM 1906 C TRP A 140 105.966 -1.628 -4.273 1.00 0.00 C ATOM 1907 O TRP A 140 106.492 -0.788 -4.977 1.00 0.00 O ATOM 1908 CB TRP A 140 103.544 -1.601 -4.950 1.00 0.00 C ATOM 1909 CG TRP A 140 102.148 -1.395 -4.458 1.00 0.00 C ATOM 1910 CD1 TRP A 140 101.485 -2.234 -3.631 1.00 0.00 C ATOM 1911 CD2 TRP A 140 101.234 -0.298 -4.747 1.00 0.00 C ATOM 1912 NE1 TRP A 140 100.222 -1.722 -3.391 1.00 0.00 N ATOM 1913 CE2 TRP A 140 100.021 -0.529 -4.059 1.00 0.00 C ATOM 1914 CE3 TRP A 140 101.340 0.864 -5.533 1.00 0.00 C ATOM 1915 CZ2 TRP A 140 98.948 0.360 -4.146 1.00 0.00 C ATOM 1916 CZ3 TRP A 140 100.263 1.762 -5.623 1.00 0.00 C ATOM 1917 CH2 TRP A 140 99.071 1.510 -4.930 1.00 0.00 C ATOM 0 H TRP A 140 104.441 0.660 -4.031 1.00 0.00 H new ATOM 0 HA TRP A 140 104.335 -2.198 -3.016 1.00 0.00 H new ATOM 0 HB2 TRP A 140 103.776 -0.875 -5.730 1.00 0.00 H new ATOM 0 HB3 TRP A 140 103.640 -2.591 -5.397 1.00 0.00 H new ATOM 0 HD1 TRP A 140 101.877 -3.154 -3.224 1.00 0.00 H new ATOM 0 HE1 TRP A 140 99.526 -2.170 -2.795 1.00 0.00 H new ATOM 0 HE3 TRP A 140 102.255 1.067 -6.070 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 98.031 0.161 -3.612 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 100.354 2.651 -6.229 1.00 0.00 H new ATOM 0 HH2 TRP A 140 98.247 2.205 -5.002 1.00 0.00 H new ATOM 1927 N ILE A 141 106.612 -2.697 -3.899 1.00 0.00 N ATOM 1928 CA ILE A 141 108.024 -2.900 -4.338 1.00 0.00 C ATOM 1929 C ILE A 141 108.135 -4.135 -5.231 1.00 0.00 C ATOM 1930 O ILE A 141 107.627 -5.191 -4.908 1.00 0.00 O ATOM 1931 CB ILE A 141 108.821 -3.096 -3.045 1.00 0.00 C ATOM 1932 CG1 ILE A 141 108.638 -1.876 -2.136 1.00 0.00 C ATOM 1933 CG2 ILE A 141 110.303 -3.260 -3.379 1.00 0.00 C ATOM 1934 CD1 ILE A 141 109.312 -2.135 -0.788 1.00 0.00 C ATOM 0 H ILE A 141 106.227 -3.437 -3.311 1.00 0.00 H new ATOM 0 HA ILE A 141 108.396 -2.058 -4.921 1.00 0.00 H new ATOM 0 HB ILE A 141 108.461 -3.988 -2.532 1.00 0.00 H new ATOM 0 HG12 ILE A 141 109.069 -0.992 -2.606 1.00 0.00 H new ATOM 0 HG13 ILE A 141 107.577 -1.674 -1.991 1.00 0.00 H new ATOM 0 HG21 ILE A 141 110.870 -3.399 -2.459 1.00 0.00 H new ATOM 0 HG22 ILE A 141 110.437 -4.129 -4.023 1.00 0.00 H new ATOM 0 HG23 ILE A 141 110.661 -2.368 -3.894 1.00 0.00 H new ATOM 0 HD11 ILE A 141 109.181 -1.266 -0.143 1.00 0.00 H new ATOM 0 HD12 ILE A 141 108.860 -3.008 -0.317 1.00 0.00 H new ATOM 0 HD13 ILE A 141 110.376 -2.315 -0.942 1.00 0.00 H new ATOM 1945 N ALA A 142 108.806 -4.013 -6.347 1.00 0.00 N ATOM 1946 CA ALA A 142 108.961 -5.185 -7.255 1.00 0.00 C ATOM 1947 C ALA A 142 110.343 -5.149 -7.898 1.00 0.00 C ATOM 1948 O ALA A 142 110.853 -4.090 -8.212 1.00 0.00 O ATOM 1949 CB ALA A 142 107.868 -5.020 -8.311 1.00 0.00 C ATOM 0 H ALA A 142 109.252 -3.153 -6.667 1.00 0.00 H new ATOM 0 HA ALA A 142 108.870 -6.137 -6.733 1.00 0.00 H new ATOM 0 HB1 ALA A 142 107.918 -5.848 -9.018 1.00 0.00 H new ATOM 0 HB2 ALA A 142 106.892 -5.015 -7.826 1.00 0.00 H new ATOM 0 HB3 ALA A 142 108.014 -4.079 -8.842 1.00 0.00 H new ATOM 1955 N GLY A 143 110.968 -6.285 -8.093 1.00 0.00 N ATOM 1956 CA GLY A 143 112.326 -6.259 -8.709 1.00 0.00 C ATOM 1957 C GLY A 143 112.862 -7.667 -8.985 1.00 0.00 C ATOM 1958 O GLY A 143 112.131 -8.583 -9.315 1.00 0.00 O ATOM 0 H GLY A 143 110.605 -7.209 -7.858 1.00 0.00 H new ATOM 0 HA2 GLY A 143 112.289 -5.696 -9.642 1.00 0.00 H new ATOM 0 HA3 GLY A 143 113.014 -5.733 -8.047 1.00 0.00 H new ATOM 1961 N VAL A 144 114.157 -7.814 -8.865 1.00 0.00 N ATOM 1962 CA VAL A 144 114.813 -9.129 -9.135 1.00 0.00 C ATOM 1963 C VAL A 144 115.514 -9.663 -7.881 1.00 0.00 C ATOM 1964 O VAL A 144 115.562 -9.009 -6.858 1.00 0.00 O ATOM 1965 CB VAL A 144 115.836 -8.844 -10.241 1.00 0.00 C ATOM 1966 CG1 VAL A 144 115.112 -8.330 -11.487 1.00 0.00 C ATOM 1967 CG2 VAL A 144 116.834 -7.784 -9.763 1.00 0.00 C ATOM 0 H VAL A 144 114.796 -7.069 -8.588 1.00 0.00 H new ATOM 0 HA VAL A 144 114.088 -9.888 -9.429 1.00 0.00 H new ATOM 0 HB VAL A 144 116.370 -9.764 -10.480 1.00 0.00 H new ATOM 0 HG11 VAL A 144 115.840 -8.127 -12.273 1.00 0.00 H new ATOM 0 HG12 VAL A 144 114.404 -9.083 -11.833 1.00 0.00 H new ATOM 0 HG13 VAL A 144 114.576 -7.413 -11.244 1.00 0.00 H new ATOM 0 HG21 VAL A 144 117.559 -7.585 -10.552 1.00 0.00 H new ATOM 0 HG22 VAL A 144 116.300 -6.865 -9.520 1.00 0.00 H new ATOM 0 HG23 VAL A 144 117.354 -8.147 -8.876 1.00 0.00 H new ATOM 1977 N GLY A 145 116.056 -10.854 -7.961 1.00 0.00 N ATOM 1978 CA GLY A 145 116.752 -11.443 -6.779 1.00 0.00 C ATOM 1979 C GLY A 145 117.751 -12.515 -7.227 1.00 0.00 C ATOM 1980 O GLY A 145 117.480 -13.302 -8.114 1.00 0.00 O ATOM 0 H GLY A 145 116.045 -11.442 -8.794 1.00 0.00 H new ATOM 0 HA2 GLY A 145 117.272 -10.660 -6.228 1.00 0.00 H new ATOM 0 HA3 GLY A 145 116.021 -11.880 -6.099 1.00 0.00 H new ATOM 1983 N TYR A 146 118.904 -12.551 -6.606 1.00 0.00 N ATOM 1984 CA TYR A 146 119.936 -13.572 -6.966 1.00 0.00 C ATOM 1985 C TYR A 146 120.493 -14.221 -5.692 1.00 0.00 C ATOM 1986 O TYR A 146 120.425 -13.650 -4.620 1.00 0.00 O ATOM 1987 CB TYR A 146 121.031 -12.795 -7.700 1.00 0.00 C ATOM 1988 CG TYR A 146 120.462 -12.179 -8.956 1.00 0.00 C ATOM 1989 CD1 TYR A 146 120.424 -12.920 -10.143 1.00 0.00 C ATOM 1990 CD2 TYR A 146 119.973 -10.867 -8.934 1.00 0.00 C ATOM 1991 CE1 TYR A 146 119.897 -12.349 -11.308 1.00 0.00 C ATOM 1992 CE2 TYR A 146 119.447 -10.297 -10.099 1.00 0.00 C ATOM 1993 CZ TYR A 146 119.409 -11.037 -11.286 1.00 0.00 C ATOM 1994 OH TYR A 146 118.889 -10.475 -12.435 1.00 0.00 O ATOM 0 H TYR A 146 119.176 -11.912 -5.859 1.00 0.00 H new ATOM 0 HA TYR A 146 119.530 -14.373 -7.583 1.00 0.00 H new ATOM 0 HB2 TYR A 146 121.435 -12.017 -7.052 1.00 0.00 H new ATOM 0 HB3 TYR A 146 121.857 -13.461 -7.951 1.00 0.00 H new ATOM 0 HD1 TYR A 146 120.801 -13.932 -10.160 1.00 0.00 H new ATOM 0 HD2 TYR A 146 120.002 -10.295 -8.018 1.00 0.00 H new ATOM 0 HE1 TYR A 146 119.867 -12.921 -12.224 1.00 0.00 H new ATOM 0 HE2 TYR A 146 119.070 -9.285 -10.082 1.00 0.00 H new ATOM 0 HH TYR A 146 118.594 -9.560 -12.247 1.00 0.00 H new ATOM 2003 N ARG A 147 121.043 -15.406 -5.798 1.00 0.00 N ATOM 2004 CA ARG A 147 121.602 -16.080 -4.584 1.00 0.00 C ATOM 2005 C ARG A 147 123.010 -16.622 -4.854 1.00 0.00 C ATOM 2006 O ARG A 147 123.215 -17.428 -5.741 1.00 0.00 O ATOM 2007 CB ARG A 147 120.636 -17.230 -4.294 1.00 0.00 C ATOM 2008 CG ARG A 147 121.045 -17.923 -2.993 1.00 0.00 C ATOM 2009 CD ARG A 147 120.117 -19.113 -2.735 1.00 0.00 C ATOM 2010 NE ARG A 147 120.527 -19.640 -1.405 1.00 0.00 N ATOM 2011 CZ ARG A 147 119.623 -20.049 -0.558 1.00 0.00 C ATOM 2012 NH1 ARG A 147 118.934 -21.130 -0.810 1.00 0.00 N ATOM 2013 NH2 ARG A 147 119.406 -19.379 0.540 1.00 0.00 N ATOM 0 H ARG A 147 121.129 -15.933 -6.667 1.00 0.00 H new ATOM 0 HA ARG A 147 121.693 -15.391 -3.745 1.00 0.00 H new ATOM 0 HB2 ARG A 147 119.617 -16.852 -4.212 1.00 0.00 H new ATOM 0 HB3 ARG A 147 120.646 -17.944 -5.118 1.00 0.00 H new ATOM 0 HG2 ARG A 147 122.079 -18.262 -3.058 1.00 0.00 H new ATOM 0 HG3 ARG A 147 120.992 -17.220 -2.162 1.00 0.00 H new ATOM 0 HD2 ARG A 147 119.071 -18.805 -2.732 1.00 0.00 H new ATOM 0 HD3 ARG A 147 120.224 -19.872 -3.510 1.00 0.00 H new ATOM 0 HE ARG A 147 121.515 -19.681 -1.156 1.00 0.00 H new ATOM 0 HH11 ARG A 147 119.103 -21.654 -1.669 1.00 0.00 H new ATOM 0 HH12 ARG A 147 118.227 -21.450 -0.148 1.00 0.00 H new ATOM 0 HH21 ARG A 147 119.943 -18.535 0.737 1.00 0.00 H new ATOM 0 HH22 ARG A 147 118.699 -19.699 1.202 1.00 0.00 H new ATOM 2024 N PHE A 148 123.983 -16.181 -4.093 1.00 0.00 N ATOM 2025 CA PHE A 148 125.378 -16.663 -4.301 1.00 0.00 C ATOM 2026 C PHE A 148 125.851 -17.462 -3.083 1.00 0.00 C ATOM 2027 CB PHE A 148 126.214 -15.394 -4.470 1.00 0.00 C ATOM 2028 CG PHE A 148 125.787 -14.673 -5.727 1.00 0.00 C ATOM 2029 CD1 PHE A 148 126.323 -15.047 -6.965 1.00 0.00 C ATOM 2030 CD2 PHE A 148 124.853 -13.633 -5.653 1.00 0.00 C ATOM 2031 CE1 PHE A 148 125.925 -14.378 -8.130 1.00 0.00 C ATOM 2032 CE2 PHE A 148 124.456 -12.964 -6.819 1.00 0.00 C ATOM 2033 CZ PHE A 148 124.992 -13.338 -8.057 1.00 0.00 C ATOM 0 H PHE A 148 123.867 -15.507 -3.336 1.00 0.00 H new ATOM 0 HA PHE A 148 125.462 -17.324 -5.164 1.00 0.00 H new ATOM 0 HB2 PHE A 148 126.087 -14.744 -3.604 1.00 0.00 H new ATOM 0 HB3 PHE A 148 127.273 -15.648 -4.525 1.00 0.00 H new ATOM 0 HD1 PHE A 148 127.043 -15.850 -7.022 1.00 0.00 H new ATOM 0 HD2 PHE A 148 124.438 -13.346 -4.698 1.00 0.00 H new ATOM 0 HE1 PHE A 148 126.339 -14.665 -9.085 1.00 0.00 H new ATOM 0 HE2 PHE A 148 123.737 -12.160 -6.762 1.00 0.00 H new ATOM 0 HZ PHE A 148 124.685 -12.824 -8.956 1.00 0.00 H new TER 2042 PHE A 148