USER MOD reduce.3.24.130724 H: found=0, std=0, add=1060, rem=0, adj=45 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 12 SER OG : rot -156:sc= 0.939 USER MOD Set 1.2: A 139 THR OG1 : rot -152:sc= 0.114 USER MOD Set 2.1: A 127 TYR OH : rot 130:sc= 0 USER MOD Set 2.2: A 129 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Set 3.1: A 108 SER OG : rot -85:sc= 0.528 USER MOD Set 3.2: A 130 SER OG : rot 174:sc= 0.492 USER MOD Set 4.1: A 100 ASN : amide:sc= -0.105 X(o=-0.1,f=-0.51) USER MOD Set 4.2: A 102 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 80 TYR OH : rot 180:sc= -0.613 USER MOD Set 5.2: A 126 SER OG : rot 180:sc= -0.211 USER MOD Set 6.1: A 61 GLN : amide:sc= 1.14 K(o=2.4,f=-4.5!) USER MOD Set 6.2: A 63 TYR OH : rot -165:sc= 1.25 USER MOD Set 7.1: A 58 ASN : amide:sc= -0.353 K(o=-2.5,f=-8.1!) USER MOD Set 7.2: A 60 ASN : amide:sc= -2.15 K(o=-2.5,f=-10!) USER MOD Set 8.1: A 21 MET CE :methyl -169:sc= -2.36 (180deg=-2.58) USER MOD Set 8.2: A 46 THR OG1 : rot -109:sc= -1.23! USER MOD Set 9.1: A 25 ASN : amide:sc= -3.13 K(o=-4.6,f=-8.8!) USER MOD Set 9.2: A 27 LYS NZ :NH3+ -165:sc= 0.00266 (180deg=0) USER MOD Set 9.3: A 42 SER OG : rot 6:sc= -1.52 USER MOD Single : A 2 THR OG1 : rot 36:sc= 0.318 USER MOD Single : A 3 SER OG : rot -91:sc= -1.01 USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot -26:sc= -0.451! USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 15 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 17 GLN : amide:sc= -4.53! C(o=-4.5!,f=-5!) USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 ASN : amide:sc= -0.0927 X(o=-0.093,f=-0.0098) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= -3.68 K(o=-3.7,f=-17!) USER MOD Single : A 35 SER OG : rot 180:sc= -0.257 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 158:sc= 0.262 (180deg=0.0693) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 132:sc= -1.11 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -0.0808 K(o=-0.081,f=-1.5) USER MOD Single : A 78 SER OG : rot 20:sc= 1.08 USER MOD Single : A 87 TYR OH : rot 61:sc= 0.139 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot -26:sc= 0.0355 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 15:sc= 0.0767 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 103 SER OG : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot 30:sc= -1.83! USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 GLN : amide:sc= -1.66 K(o=-1.7,f=-4.3!) USER MOD Single : A 116 ASN : amide:sc= -3.63 K(o=-3.6,f=-6.1!) USER MOD Single : A 118 MET CE :methyl 135:sc= -0.123 (180deg=-0.777) USER MOD Single : A 120 ASN : amide:sc= 0 K(o=0,f=-1.1) 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 2 125.224 -18.099 2.723 1.00 0.00 N ATOM 2 CA THR A 2 124.673 -17.886 1.353 1.00 0.00 C ATOM 3 C THR A 2 124.390 -16.397 1.137 1.00 0.00 C ATOM 4 O THR A 2 124.038 -15.689 2.061 1.00 0.00 O ATOM 5 CB THR A 2 123.373 -18.691 1.317 1.00 0.00 C ATOM 6 OG1 THR A 2 123.643 -20.040 1.674 1.00 0.00 O ATOM 7 CG2 THR A 2 122.779 -18.642 -0.092 1.00 0.00 C ATOM 0 HA THR A 2 125.364 -18.201 0.571 1.00 0.00 H new ATOM 0 HB THR A 2 122.661 -18.264 2.023 1.00 0.00 H new ATOM 0 HG1 THR A 2 124.346 -20.063 2.356 1.00 0.00 H new ATOM 0 HG21 THR A 2 121.853 -19.216 -0.117 1.00 0.00 H new ATOM 0 HG22 THR A 2 122.572 -17.607 -0.364 1.00 0.00 H new ATOM 0 HG23 THR A 2 123.489 -19.068 -0.801 1.00 0.00 H new ATOM 15 N SER A 3 124.535 -15.914 -0.070 1.00 0.00 N ATOM 16 CA SER A 3 124.265 -14.471 -0.330 1.00 0.00 C ATOM 17 C SER A 3 123.104 -14.332 -1.313 1.00 0.00 C ATOM 18 O SER A 3 122.954 -15.131 -2.218 1.00 0.00 O ATOM 19 CB SER A 3 125.557 -13.927 -0.938 1.00 0.00 C ATOM 20 OG SER A 3 125.801 -14.574 -2.179 1.00 0.00 O ATOM 0 H SER A 3 124.828 -16.455 -0.883 1.00 0.00 H new ATOM 0 HA SER A 3 123.987 -13.928 0.573 1.00 0.00 H new ATOM 0 HB2 SER A 3 125.478 -12.850 -1.086 1.00 0.00 H new ATOM 0 HB3 SER A 3 126.392 -14.095 -0.257 1.00 0.00 H new ATOM 0 HG SER A 3 126.354 -15.369 -2.030 1.00 0.00 H new ATOM 25 N THR A 4 122.283 -13.331 -1.146 1.00 0.00 N ATOM 26 CA THR A 4 121.132 -13.150 -2.076 1.00 0.00 C ATOM 27 C THR A 4 120.998 -11.680 -2.484 1.00 0.00 C ATOM 28 O THR A 4 121.156 -10.785 -1.678 1.00 0.00 O ATOM 29 CB THR A 4 119.908 -13.600 -1.279 1.00 0.00 C ATOM 30 OG1 THR A 4 120.111 -14.926 -0.811 1.00 0.00 O ATOM 31 CG2 THR A 4 118.668 -13.556 -2.173 1.00 0.00 C ATOM 0 H THR A 4 122.359 -12.632 -0.407 1.00 0.00 H new ATOM 0 HA THR A 4 121.254 -13.720 -2.997 1.00 0.00 H new ATOM 0 HB THR A 4 119.763 -12.933 -0.430 1.00 0.00 H new ATOM 0 HG1 THR A 4 119.328 -15.216 -0.298 1.00 0.00 H new ATOM 0 HG21 THR A 4 117.797 -13.877 -1.603 1.00 0.00 H new ATOM 0 HG22 THR A 4 118.513 -12.538 -2.530 1.00 0.00 H new ATOM 0 HG23 THR A 4 118.810 -14.221 -3.025 1.00 0.00 H new ATOM 39 N VAL A 5 120.689 -11.432 -3.728 1.00 0.00 N ATOM 40 CA VAL A 5 120.519 -10.026 -4.199 1.00 0.00 C ATOM 41 C VAL A 5 119.063 -9.818 -4.615 1.00 0.00 C ATOM 42 O VAL A 5 118.471 -10.671 -5.245 1.00 0.00 O ATOM 43 CB VAL A 5 121.455 -9.886 -5.402 1.00 0.00 C ATOM 44 CG1 VAL A 5 121.383 -8.457 -5.942 1.00 0.00 C ATOM 45 CG2 VAL A 5 122.893 -10.191 -4.971 1.00 0.00 C ATOM 0 H VAL A 5 120.546 -12.146 -4.442 1.00 0.00 H new ATOM 0 HA VAL A 5 120.754 -9.288 -3.432 1.00 0.00 H new ATOM 0 HB VAL A 5 121.150 -10.587 -6.179 1.00 0.00 H new ATOM 0 HG11 VAL A 5 122.050 -8.358 -6.799 1.00 0.00 H new ATOM 0 HG12 VAL A 5 120.361 -8.235 -6.250 1.00 0.00 H new ATOM 0 HG13 VAL A 5 121.687 -7.758 -5.163 1.00 0.00 H new ATOM 0 HG21 VAL A 5 123.559 -10.091 -5.828 1.00 0.00 H new ATOM 0 HG22 VAL A 5 123.196 -9.491 -4.193 1.00 0.00 H new ATOM 0 HG23 VAL A 5 122.949 -11.209 -4.585 1.00 0.00 H new ATOM 55 N THR A 6 118.479 -8.698 -4.275 1.00 0.00 N ATOM 56 CA THR A 6 117.058 -8.450 -4.662 1.00 0.00 C ATOM 57 C THR A 6 116.780 -6.946 -4.699 1.00 0.00 C ATOM 58 O THR A 6 117.125 -6.227 -3.780 1.00 0.00 O ATOM 59 CB THR A 6 116.229 -9.117 -3.561 1.00 0.00 C ATOM 60 OG1 THR A 6 116.658 -10.463 -3.394 1.00 0.00 O ATOM 61 CG2 THR A 6 114.748 -9.090 -3.947 1.00 0.00 C ATOM 0 H THR A 6 118.923 -7.946 -3.748 1.00 0.00 H new ATOM 0 HA THR A 6 116.822 -8.845 -5.650 1.00 0.00 H new ATOM 0 HB THR A 6 116.366 -8.576 -2.624 1.00 0.00 H new ATOM 0 HG1 THR A 6 117.056 -10.785 -4.229 1.00 0.00 H new ATOM 0 HG21 THR A 6 114.159 -9.565 -3.163 1.00 0.00 H new ATOM 0 HG22 THR A 6 114.423 -8.057 -4.070 1.00 0.00 H new ATOM 0 HG23 THR A 6 114.606 -9.629 -4.884 1.00 0.00 H new ATOM 69 N GLY A 7 116.156 -6.459 -5.742 1.00 0.00 N ATOM 70 CA GLY A 7 115.859 -4.999 -5.812 1.00 0.00 C ATOM 71 C GLY A 7 114.788 -4.732 -6.870 1.00 0.00 C ATOM 72 O GLY A 7 114.409 -5.613 -7.617 1.00 0.00 O ATOM 0 H GLY A 7 115.842 -7.007 -6.543 1.00 0.00 H new ATOM 0 HA2 GLY A 7 115.518 -4.642 -4.840 1.00 0.00 H new ATOM 0 HA3 GLY A 7 116.767 -4.446 -6.054 1.00 0.00 H new ATOM 75 N GLY A 8 114.300 -3.518 -6.941 1.00 0.00 N ATOM 76 CA GLY A 8 113.250 -3.183 -7.947 1.00 0.00 C ATOM 77 C GLY A 8 112.865 -1.705 -7.815 1.00 0.00 C ATOM 78 O GLY A 8 113.676 -0.875 -7.455 1.00 0.00 O ATOM 0 H GLY A 8 114.586 -2.743 -6.342 1.00 0.00 H new ATOM 0 HA2 GLY A 8 113.618 -3.385 -8.953 1.00 0.00 H new ATOM 0 HA3 GLY A 8 112.373 -3.813 -7.796 1.00 0.00 H new ATOM 81 N TYR A 9 111.631 -1.375 -8.100 1.00 0.00 N ATOM 82 CA TYR A 9 111.182 0.047 -7.989 1.00 0.00 C ATOM 83 C TYR A 9 109.776 0.103 -7.380 1.00 0.00 C ATOM 84 O TYR A 9 109.060 -0.883 -7.391 1.00 0.00 O ATOM 85 CB TYR A 9 111.197 0.582 -9.428 1.00 0.00 C ATOM 86 CG TYR A 9 110.133 -0.107 -10.255 1.00 0.00 C ATOM 87 CD1 TYR A 9 110.406 -1.341 -10.859 1.00 0.00 C ATOM 88 CD2 TYR A 9 108.875 0.487 -10.416 1.00 0.00 C ATOM 89 CE1 TYR A 9 109.423 -1.979 -11.623 1.00 0.00 C ATOM 90 CE2 TYR A 9 107.892 -0.152 -11.180 1.00 0.00 C ATOM 91 CZ TYR A 9 108.166 -1.385 -11.784 1.00 0.00 C ATOM 92 OH TYR A 9 107.195 -2.015 -12.537 1.00 0.00 O ATOM 0 H TYR A 9 110.912 -2.031 -8.406 1.00 0.00 H new ATOM 0 HA TYR A 9 111.823 0.644 -7.340 1.00 0.00 H new ATOM 0 HB2 TYR A 9 111.025 1.658 -9.425 1.00 0.00 H new ATOM 0 HB3 TYR A 9 112.178 0.417 -9.874 1.00 0.00 H new ATOM 0 HD1 TYR A 9 111.376 -1.800 -10.735 1.00 0.00 H new ATOM 0 HD2 TYR A 9 108.663 1.438 -9.950 1.00 0.00 H new ATOM 0 HE1 TYR A 9 109.634 -2.930 -12.089 1.00 0.00 H new ATOM 0 HE2 TYR A 9 106.922 0.306 -11.304 1.00 0.00 H new ATOM 0 HH TYR A 9 106.382 -1.468 -12.546 1.00 0.00 H new ATOM 101 N ALA A 10 109.373 1.230 -6.837 1.00 0.00 N ATOM 102 CA ALA A 10 108.009 1.290 -6.229 1.00 0.00 C ATOM 103 C ALA A 10 107.369 2.668 -6.414 1.00 0.00 C ATOM 104 O ALA A 10 108.036 3.683 -6.391 1.00 0.00 O ATOM 105 CB ALA A 10 108.233 1.003 -4.743 1.00 0.00 C ATOM 0 H ALA A 10 109.918 2.091 -6.790 1.00 0.00 H new ATOM 0 HA ALA A 10 107.330 0.578 -6.699 1.00 0.00 H new ATOM 0 HB1 ALA A 10 107.277 1.028 -4.219 1.00 0.00 H new ATOM 0 HB2 ALA A 10 108.685 0.018 -4.627 1.00 0.00 H new ATOM 0 HB3 ALA A 10 108.897 1.758 -4.323 1.00 0.00 H new ATOM 111 N GLN A 11 106.069 2.699 -6.559 1.00 0.00 N ATOM 112 CA GLN A 11 105.350 3.999 -6.703 1.00 0.00 C ATOM 113 C GLN A 11 104.765 4.365 -5.340 1.00 0.00 C ATOM 114 O GLN A 11 104.272 3.506 -4.633 1.00 0.00 O ATOM 115 CB GLN A 11 104.244 3.740 -7.726 1.00 0.00 C ATOM 116 CG GLN A 11 104.871 3.388 -9.076 1.00 0.00 C ATOM 117 CD GLN A 11 103.770 3.096 -10.099 1.00 0.00 C ATOM 118 OE1 GLN A 11 102.636 2.849 -9.737 1.00 0.00 O ATOM 119 NE2 GLN A 11 104.058 3.115 -11.370 1.00 0.00 N ATOM 0 H GLN A 11 105.471 1.873 -6.584 1.00 0.00 H new ATOM 0 HA GLN A 11 105.990 4.819 -7.030 1.00 0.00 H new ATOM 0 HB2 GLN A 11 103.604 2.926 -7.387 1.00 0.00 H new ATOM 0 HB3 GLN A 11 103.612 4.622 -7.825 1.00 0.00 H new ATOM 0 HG2 GLN A 11 105.494 4.212 -9.424 1.00 0.00 H new ATOM 0 HG3 GLN A 11 105.521 2.520 -8.970 1.00 0.00 H new ATOM 0 HE21 GLN A 11 105.009 3.322 -11.674 1.00 0.00 H new ATOM 0 HE22 GLN A 11 103.332 2.923 -12.060 1.00 0.00 H new ATOM 126 N SER A 12 104.842 5.607 -4.939 1.00 0.00 N ATOM 127 CA SER A 12 104.321 5.965 -3.587 1.00 0.00 C ATOM 128 C SER A 12 103.192 7.000 -3.630 1.00 0.00 C ATOM 129 O SER A 12 103.187 7.922 -4.422 1.00 0.00 O ATOM 130 CB SER A 12 105.528 6.544 -2.854 1.00 0.00 C ATOM 131 OG SER A 12 106.576 5.583 -2.839 1.00 0.00 O ATOM 0 H SER A 12 105.236 6.377 -5.479 1.00 0.00 H new ATOM 0 HA SER A 12 103.889 5.091 -3.100 1.00 0.00 H new ATOM 0 HB2 SER A 12 105.863 7.457 -3.347 1.00 0.00 H new ATOM 0 HB3 SER A 12 105.253 6.815 -1.835 1.00 0.00 H new ATOM 0 HG SER A 12 107.176 5.765 -2.086 1.00 0.00 H new ATOM 136 N ASP A 13 102.265 6.854 -2.725 1.00 0.00 N ATOM 137 CA ASP A 13 101.129 7.808 -2.597 1.00 0.00 C ATOM 138 C ASP A 13 100.960 8.066 -1.101 1.00 0.00 C ATOM 139 O ASP A 13 101.135 7.162 -0.313 1.00 0.00 O ATOM 140 CB ASP A 13 99.912 7.080 -3.173 1.00 0.00 C ATOM 141 CG ASP A 13 98.719 8.036 -3.220 1.00 0.00 C ATOM 142 OD1 ASP A 13 98.615 8.775 -4.185 1.00 0.00 O ATOM 143 OD2 ASP A 13 97.930 8.014 -2.289 1.00 0.00 O ATOM 0 H ASP A 13 102.248 6.090 -2.049 1.00 0.00 H new ATOM 0 HA ASP A 13 101.272 8.756 -3.115 1.00 0.00 H new ATOM 0 HB2 ASP A 13 100.136 6.712 -4.174 1.00 0.00 H new ATOM 0 HB3 ASP A 13 99.671 6.211 -2.560 1.00 0.00 H new ATOM 147 N ALA A 14 100.670 9.267 -0.676 1.00 0.00 N ATOM 148 CA ALA A 14 100.564 9.490 0.781 1.00 0.00 C ATOM 149 C ALA A 14 99.654 10.654 1.125 1.00 0.00 C ATOM 150 O ALA A 14 99.556 11.633 0.411 1.00 0.00 O ATOM 151 CB ALA A 14 101.989 9.810 1.212 1.00 0.00 C ATOM 0 H ALA A 14 100.506 10.083 -1.266 1.00 0.00 H new ATOM 0 HA ALA A 14 100.136 8.622 1.281 1.00 0.00 H new ATOM 0 HB1 ALA A 14 102.012 9.992 2.286 1.00 0.00 H new ATOM 0 HB2 ALA A 14 102.639 8.969 0.973 1.00 0.00 H new ATOM 0 HB3 ALA A 14 102.337 10.699 0.686 1.00 0.00 H new ATOM 157 N GLN A 15 99.032 10.552 2.253 1.00 0.00 N ATOM 158 CA GLN A 15 98.152 11.642 2.737 1.00 0.00 C ATOM 159 C GLN A 15 99.036 12.736 3.338 1.00 0.00 C ATOM 160 O GLN A 15 99.900 12.466 4.164 1.00 0.00 O ATOM 161 CB GLN A 15 97.266 11.004 3.810 1.00 0.00 C ATOM 162 CG GLN A 15 96.215 12.016 4.275 1.00 0.00 C ATOM 163 CD GLN A 15 95.305 11.372 5.325 1.00 0.00 C ATOM 164 OE1 GLN A 15 95.376 10.183 5.567 1.00 0.00 O ATOM 165 NE2 GLN A 15 94.442 12.115 5.965 1.00 0.00 N ATOM 0 H GLN A 15 99.095 9.746 2.874 1.00 0.00 H new ATOM 0 HA GLN A 15 97.544 12.090 1.951 1.00 0.00 H new ATOM 0 HB2 GLN A 15 96.778 10.114 3.412 1.00 0.00 H new ATOM 0 HB3 GLN A 15 97.875 10.682 4.655 1.00 0.00 H new ATOM 0 HG2 GLN A 15 96.704 12.895 4.694 1.00 0.00 H new ATOM 0 HG3 GLN A 15 95.622 12.355 3.425 1.00 0.00 H new ATOM 0 HE21 GLN A 15 94.380 13.113 5.764 1.00 0.00 H new ATOM 0 HE22 GLN A 15 93.830 11.697 6.666 1.00 0.00 H new ATOM 172 N GLY A 16 98.848 13.954 2.905 1.00 0.00 N ATOM 173 CA GLY A 16 99.685 15.079 3.409 1.00 0.00 C ATOM 174 C GLY A 16 100.686 15.476 2.319 1.00 0.00 C ATOM 175 O GLY A 16 101.100 16.616 2.229 1.00 0.00 O ATOM 0 H GLY A 16 98.143 14.219 2.217 1.00 0.00 H new ATOM 0 HA2 GLY A 16 99.056 15.929 3.672 1.00 0.00 H new ATOM 0 HA3 GLY A 16 100.212 14.781 4.315 1.00 0.00 H new ATOM 178 N GLN A 17 101.063 14.543 1.479 1.00 0.00 N ATOM 179 CA GLN A 17 102.021 14.860 0.377 1.00 0.00 C ATOM 180 C GLN A 17 101.329 14.719 -0.983 1.00 0.00 C ATOM 181 O GLN A 17 100.340 14.026 -1.116 1.00 0.00 O ATOM 182 CB GLN A 17 103.153 13.841 0.511 1.00 0.00 C ATOM 183 CG GLN A 17 103.924 14.101 1.807 1.00 0.00 C ATOM 184 CD GLN A 17 105.080 13.105 1.922 1.00 0.00 C ATOM 185 OE1 GLN A 17 105.045 12.043 1.334 1.00 0.00 O ATOM 186 NE2 GLN A 17 106.115 13.410 2.658 1.00 0.00 N ATOM 0 H GLN A 17 100.747 13.574 1.510 1.00 0.00 H new ATOM 0 HA GLN A 17 102.392 15.883 0.443 1.00 0.00 H new ATOM 0 HB2 GLN A 17 102.747 12.829 0.514 1.00 0.00 H new ATOM 0 HB3 GLN A 17 103.824 13.913 -0.345 1.00 0.00 H new ATOM 0 HG2 GLN A 17 104.307 15.121 1.816 1.00 0.00 H new ATOM 0 HG3 GLN A 17 103.258 14.002 2.665 1.00 0.00 H new ATOM 0 HE21 GLN A 17 106.145 14.302 3.152 1.00 0.00 H new ATOM 0 HE22 GLN A 17 106.894 12.756 2.739 1.00 0.00 H new ATOM 193 N MET A 18 101.844 15.373 -1.991 1.00 0.00 N ATOM 194 CA MET A 18 101.223 15.282 -3.345 1.00 0.00 C ATOM 195 C MET A 18 102.238 14.748 -4.360 1.00 0.00 C ATOM 196 O MET A 18 103.407 14.605 -4.060 1.00 0.00 O ATOM 197 CB MET A 18 100.821 16.716 -3.694 1.00 0.00 C ATOM 198 CG MET A 18 99.724 17.188 -2.738 1.00 0.00 C ATOM 199 SD MET A 18 99.153 18.831 -3.240 1.00 0.00 S ATOM 200 CE MET A 18 97.953 19.071 -1.906 1.00 0.00 C ATOM 0 H MET A 18 102.671 15.968 -1.934 1.00 0.00 H new ATOM 0 HA MET A 18 100.370 14.603 -3.362 1.00 0.00 H new ATOM 0 HB2 MET A 18 101.687 17.375 -3.624 1.00 0.00 H new ATOM 0 HB3 MET A 18 100.466 16.765 -4.723 1.00 0.00 H new ATOM 0 HG2 MET A 18 98.892 16.484 -2.746 1.00 0.00 H new ATOM 0 HG3 MET A 18 100.105 17.220 -1.717 1.00 0.00 H new ATOM 0 HE1 MET A 18 97.471 20.042 -2.020 1.00 0.00 H new ATOM 0 HE2 MET A 18 97.199 18.285 -1.949 1.00 0.00 H new ATOM 0 HE3 MET A 18 98.465 19.031 -0.945 1.00 0.00 H new ATOM 208 N ASN A 19 101.793 14.447 -5.557 1.00 0.00 N ATOM 209 CA ASN A 19 102.714 13.912 -6.615 1.00 0.00 C ATOM 210 C ASN A 19 103.323 12.579 -6.172 1.00 0.00 C ATOM 211 O ASN A 19 104.058 12.508 -5.206 1.00 0.00 O ATOM 212 CB ASN A 19 103.809 14.973 -6.813 1.00 0.00 C ATOM 213 CG ASN A 19 103.167 16.329 -7.122 1.00 0.00 C ATOM 214 OD1 ASN A 19 103.551 17.337 -6.562 1.00 0.00 O ATOM 215 ND2 ASN A 19 102.198 16.396 -7.994 1.00 0.00 N ATOM 0 H ASN A 19 100.822 14.550 -5.851 1.00 0.00 H new ATOM 0 HA ASN A 19 102.180 13.723 -7.546 1.00 0.00 H new ATOM 0 HB2 ASN A 19 104.423 15.047 -5.916 1.00 0.00 H new ATOM 0 HB3 ASN A 19 104.470 14.679 -7.628 1.00 0.00 H new ATOM 0 HD21 ASN A 19 101.763 17.294 -8.205 1.00 0.00 H new ATOM 0 HD22 ASN A 19 101.876 15.550 -8.464 1.00 0.00 H new ATOM 221 N LYS A 20 103.016 11.522 -6.878 1.00 0.00 N ATOM 222 CA LYS A 20 103.566 10.180 -6.511 1.00 0.00 C ATOM 223 C LYS A 20 105.085 10.158 -6.702 1.00 0.00 C ATOM 224 O LYS A 20 105.650 11.017 -7.352 1.00 0.00 O ATOM 225 CB LYS A 20 102.892 9.197 -7.469 1.00 0.00 C ATOM 226 CG LYS A 20 101.382 9.196 -7.220 1.00 0.00 C ATOM 227 CD LYS A 20 100.721 8.131 -8.096 1.00 0.00 C ATOM 228 CE LYS A 20 99.200 8.198 -7.926 1.00 0.00 C ATOM 229 NZ LYS A 20 98.718 8.991 -9.089 1.00 0.00 N ATOM 0 H LYS A 20 102.406 11.529 -7.696 1.00 0.00 H new ATOM 0 HA LYS A 20 103.374 9.929 -5.468 1.00 0.00 H new ATOM 0 HB2 LYS A 20 103.101 9.478 -8.501 1.00 0.00 H new ATOM 0 HB3 LYS A 20 103.296 8.195 -7.323 1.00 0.00 H new ATOM 0 HG2 LYS A 20 101.176 8.996 -6.168 1.00 0.00 H new ATOM 0 HG3 LYS A 20 100.965 10.178 -7.445 1.00 0.00 H new ATOM 0 HD2 LYS A 20 100.988 8.288 -9.141 1.00 0.00 H new ATOM 0 HD3 LYS A 20 101.085 7.141 -7.820 1.00 0.00 H new ATOM 0 HE2 LYS A 20 98.759 7.201 -7.918 1.00 0.00 H new ATOM 0 HE3 LYS A 20 98.929 8.674 -6.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 97.683 9.081 -9.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 99.149 9.937 -9.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 98.985 8.510 -9.972 1.00 0.00 H new ATOM 239 N MET A 21 105.749 9.185 -6.133 1.00 0.00 N ATOM 240 CA MET A 21 107.233 9.107 -6.272 1.00 0.00 C ATOM 241 C MET A 21 107.656 7.734 -6.805 1.00 0.00 C ATOM 242 O MET A 21 106.886 6.794 -6.815 1.00 0.00 O ATOM 243 CB MET A 21 107.773 9.322 -4.859 1.00 0.00 C ATOM 244 CG MET A 21 107.418 10.734 -4.387 1.00 0.00 C ATOM 245 SD MET A 21 108.236 11.069 -2.807 1.00 0.00 S ATOM 246 CE MET A 21 109.905 11.325 -3.462 1.00 0.00 C ATOM 0 H MET A 21 105.327 8.441 -5.578 1.00 0.00 H new ATOM 0 HA MET A 21 107.616 9.846 -6.976 1.00 0.00 H new ATOM 0 HB2 MET A 21 107.349 8.583 -4.180 1.00 0.00 H new ATOM 0 HB3 MET A 21 108.854 9.184 -4.846 1.00 0.00 H new ATOM 0 HG2 MET A 21 107.729 11.466 -5.132 1.00 0.00 H new ATOM 0 HG3 MET A 21 106.338 10.831 -4.277 1.00 0.00 H new ATOM 0 HE1 MET A 21 110.618 11.355 -2.638 1.00 0.00 H new ATOM 0 HE2 MET A 21 110.161 10.506 -4.135 1.00 0.00 H new ATOM 0 HE3 MET A 21 109.941 12.268 -4.008 1.00 0.00 H new ATOM 254 N GLY A 22 108.882 7.620 -7.244 1.00 0.00 N ATOM 255 CA GLY A 22 109.378 6.316 -7.776 1.00 0.00 C ATOM 256 C GLY A 22 110.858 6.164 -7.433 1.00 0.00 C ATOM 257 O GLY A 22 111.663 7.021 -7.753 1.00 0.00 O ATOM 0 H GLY A 22 109.565 8.378 -7.257 1.00 0.00 H new ATOM 0 HA2 GLY A 22 108.807 5.493 -7.346 1.00 0.00 H new ATOM 0 HA3 GLY A 22 109.236 6.273 -8.856 1.00 0.00 H new ATOM 260 N GLY A 23 111.229 5.105 -6.751 1.00 0.00 N ATOM 261 CA GLY A 23 112.664 4.952 -6.369 1.00 0.00 C ATOM 262 C GLY A 23 113.141 3.525 -6.620 1.00 0.00 C ATOM 263 O GLY A 23 112.439 2.712 -7.185 1.00 0.00 O ATOM 0 H GLY A 23 110.610 4.353 -6.448 1.00 0.00 H new ATOM 0 HA2 GLY A 23 113.274 5.650 -6.942 1.00 0.00 H new ATOM 0 HA3 GLY A 23 112.794 5.204 -5.317 1.00 0.00 H new ATOM 266 N PHE A 24 114.338 3.221 -6.189 1.00 0.00 N ATOM 267 CA PHE A 24 114.886 1.850 -6.379 1.00 0.00 C ATOM 268 C PHE A 24 115.172 1.235 -5.011 1.00 0.00 C ATOM 269 O PHE A 24 115.489 1.936 -4.068 1.00 0.00 O ATOM 270 CB PHE A 24 116.183 2.040 -7.169 1.00 0.00 C ATOM 271 CG PHE A 24 115.870 2.646 -8.517 1.00 0.00 C ATOM 272 CD1 PHE A 24 115.488 1.822 -9.582 1.00 0.00 C ATOM 273 CD2 PHE A 24 115.960 4.031 -8.700 1.00 0.00 C ATOM 274 CE1 PHE A 24 115.198 2.383 -10.832 1.00 0.00 C ATOM 275 CE2 PHE A 24 115.670 4.591 -9.950 1.00 0.00 C ATOM 276 CZ PHE A 24 115.289 3.768 -11.016 1.00 0.00 C ATOM 0 H PHE A 24 114.962 3.871 -5.710 1.00 0.00 H new ATOM 0 HA PHE A 24 114.198 1.187 -6.903 1.00 0.00 H new ATOM 0 HB2 PHE A 24 116.865 2.687 -6.618 1.00 0.00 H new ATOM 0 HB3 PHE A 24 116.686 1.082 -7.298 1.00 0.00 H new ATOM 0 HD1 PHE A 24 115.417 0.754 -9.440 1.00 0.00 H new ATOM 0 HD2 PHE A 24 116.253 4.667 -7.878 1.00 0.00 H new ATOM 0 HE1 PHE A 24 114.904 1.747 -11.654 1.00 0.00 H new ATOM 0 HE2 PHE A 24 115.740 5.659 -10.092 1.00 0.00 H new ATOM 0 HZ PHE A 24 115.065 4.201 -11.980 1.00 0.00 H new ATOM 285 N ASN A 25 115.050 -0.057 -4.882 1.00 0.00 N ATOM 286 CA ASN A 25 115.304 -0.692 -3.558 1.00 0.00 C ATOM 287 C ASN A 25 116.347 -1.807 -3.668 1.00 0.00 C ATOM 288 O ASN A 25 116.291 -2.638 -4.549 1.00 0.00 O ATOM 289 CB ASN A 25 113.949 -1.265 -3.134 1.00 0.00 C ATOM 290 CG ASN A 25 113.980 -1.618 -1.645 1.00 0.00 C ATOM 291 OD1 ASN A 25 115.035 -1.729 -1.053 1.00 0.00 O ATOM 292 ND2 ASN A 25 112.854 -1.796 -1.008 1.00 0.00 N ATOM 0 H ASN A 25 114.787 -0.698 -5.631 1.00 0.00 H new ATOM 0 HA ASN A 25 115.699 0.023 -2.836 1.00 0.00 H new ATOM 0 HB2 ASN A 25 113.160 -0.539 -3.329 1.00 0.00 H new ATOM 0 HB3 ASN A 25 113.718 -2.153 -3.723 1.00 0.00 H new ATOM 0 HD21 ASN A 25 112.861 -2.028 -0.015 1.00 0.00 H new ATOM 0 HD22 ASN A 25 111.967 -1.703 -1.504 1.00 0.00 H new ATOM 298 N LEU A 26 117.284 -1.831 -2.761 1.00 0.00 N ATOM 299 CA LEU A 26 118.329 -2.899 -2.772 1.00 0.00 C ATOM 300 C LEU A 26 118.125 -3.764 -1.532 1.00 0.00 C ATOM 301 O LEU A 26 117.694 -3.271 -0.507 1.00 0.00 O ATOM 302 CB LEU A 26 119.671 -2.160 -2.708 1.00 0.00 C ATOM 303 CG LEU A 26 119.787 -1.177 -3.878 1.00 0.00 C ATOM 304 CD1 LEU A 26 121.124 -0.439 -3.791 1.00 0.00 C ATOM 305 CD2 LEU A 26 119.719 -1.942 -5.203 1.00 0.00 C ATOM 0 H LEU A 26 117.373 -1.152 -2.005 1.00 0.00 H new ATOM 0 HA LEU A 26 118.286 -3.542 -3.651 1.00 0.00 H new ATOM 0 HB2 LEU A 26 119.755 -1.624 -1.763 1.00 0.00 H new ATOM 0 HB3 LEU A 26 120.492 -2.877 -2.742 1.00 0.00 H new ATOM 0 HG LEU A 26 118.967 -0.461 -3.829 1.00 0.00 H new ATOM 0 HD11 LEU A 26 121.208 0.261 -4.623 1.00 0.00 H new ATOM 0 HD12 LEU A 26 121.177 0.108 -2.850 1.00 0.00 H new ATOM 0 HD13 LEU A 26 121.941 -1.159 -3.839 1.00 0.00 H new ATOM 0 HD21 LEU A 26 119.802 -1.240 -6.033 1.00 0.00 H new ATOM 0 HD22 LEU A 26 120.538 -2.659 -5.251 1.00 0.00 H new ATOM 0 HD23 LEU A 26 118.769 -2.472 -5.269 1.00 0.00 H new ATOM 316 N LYS A 27 118.416 -5.041 -1.588 1.00 0.00 N ATOM 317 CA LYS A 27 118.213 -5.887 -0.379 1.00 0.00 C ATOM 318 C LYS A 27 119.248 -7.013 -0.318 1.00 0.00 C ATOM 319 O LYS A 27 119.531 -7.664 -1.306 1.00 0.00 O ATOM 320 CB LYS A 27 116.809 -6.476 -0.529 1.00 0.00 C ATOM 321 CG LYS A 27 115.767 -5.357 -0.523 1.00 0.00 C ATOM 322 CD LYS A 27 114.365 -5.970 -0.485 1.00 0.00 C ATOM 323 CE LYS A 27 113.311 -4.863 -0.596 1.00 0.00 C ATOM 324 NZ LYS A 27 112.419 -5.056 0.581 1.00 0.00 N ATOM 0 H LYS A 27 118.780 -5.526 -2.408 1.00 0.00 H new ATOM 0 HA LYS A 27 118.324 -5.306 0.536 1.00 0.00 H new ATOM 0 HB2 LYS A 27 116.741 -7.042 -1.458 1.00 0.00 H new ATOM 0 HB3 LYS A 27 116.610 -7.173 0.285 1.00 0.00 H new ATOM 0 HG2 LYS A 27 115.917 -4.710 0.341 1.00 0.00 H new ATOM 0 HG3 LYS A 27 115.880 -4.735 -1.411 1.00 0.00 H new ATOM 0 HD2 LYS A 27 114.247 -6.681 -1.303 1.00 0.00 H new ATOM 0 HD3 LYS A 27 114.226 -6.525 0.443 1.00 0.00 H new ATOM 0 HE2 LYS A 27 113.773 -3.876 -0.582 1.00 0.00 H new ATOM 0 HE3 LYS A 27 112.754 -4.941 -1.530 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 111.542 -4.514 0.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 112.190 -6.065 0.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 112.901 -4.724 1.440 1.00 0.00 H new ATOM 334 N TYR A 28 119.791 -7.265 0.843 1.00 0.00 N ATOM 335 CA TYR A 28 120.784 -8.371 0.991 1.00 0.00 C ATOM 336 C TYR A 28 120.249 -9.386 2.002 1.00 0.00 C ATOM 337 O TYR A 28 119.807 -9.021 3.073 1.00 0.00 O ATOM 338 CB TYR A 28 122.057 -7.702 1.513 1.00 0.00 C ATOM 339 CG TYR A 28 122.557 -6.704 0.496 1.00 0.00 C ATOM 340 CD1 TYR A 28 123.314 -7.140 -0.598 1.00 0.00 C ATOM 341 CD2 TYR A 28 122.263 -5.344 0.646 1.00 0.00 C ATOM 342 CE1 TYR A 28 123.777 -6.215 -1.541 1.00 0.00 C ATOM 343 CE2 TYR A 28 122.726 -4.419 -0.297 1.00 0.00 C ATOM 344 CZ TYR A 28 123.483 -4.855 -1.391 1.00 0.00 C ATOM 345 OH TYR A 28 123.940 -3.944 -2.321 1.00 0.00 O ATOM 0 H TYR A 28 119.589 -6.750 1.700 1.00 0.00 H new ATOM 0 HA TYR A 28 120.973 -8.902 0.058 1.00 0.00 H new ATOM 0 HB2 TYR A 28 121.855 -7.202 2.460 1.00 0.00 H new ATOM 0 HB3 TYR A 28 122.822 -8.454 1.707 1.00 0.00 H new ATOM 0 HD1 TYR A 28 123.541 -8.190 -0.714 1.00 0.00 H new ATOM 0 HD2 TYR A 28 121.679 -5.008 1.490 1.00 0.00 H new ATOM 0 HE1 TYR A 28 124.361 -6.551 -2.385 1.00 0.00 H new ATOM 0 HE2 TYR A 28 122.499 -3.369 -0.181 1.00 0.00 H new ATOM 0 HH TYR A 28 123.647 -3.044 -2.068 1.00 0.00 H new ATOM 354 N ARG A 29 120.264 -10.653 1.672 1.00 0.00 N ATOM 355 CA ARG A 29 119.729 -11.666 2.631 1.00 0.00 C ATOM 356 C ARG A 29 120.684 -12.848 2.803 1.00 0.00 C ATOM 357 O ARG A 29 121.277 -13.337 1.859 1.00 0.00 O ATOM 358 CB ARG A 29 118.404 -12.128 2.021 1.00 0.00 C ATOM 359 CG ARG A 29 117.728 -13.133 2.958 1.00 0.00 C ATOM 360 CD ARG A 29 116.348 -13.502 2.407 1.00 0.00 C ATOM 361 NE ARG A 29 116.623 -14.268 1.160 1.00 0.00 N ATOM 362 CZ ARG A 29 116.116 -15.459 1.001 1.00 0.00 C ATOM 363 NH1 ARG A 29 116.741 -16.502 1.475 1.00 0.00 N ATOM 364 NH2 ARG A 29 114.984 -15.610 0.370 1.00 0.00 N ATOM 0 H ARG A 29 120.619 -11.026 0.791 1.00 0.00 H new ATOM 0 HA ARG A 29 119.604 -11.240 3.627 1.00 0.00 H new ATOM 0 HB2 ARG A 29 117.750 -11.272 1.857 1.00 0.00 H new ATOM 0 HB3 ARG A 29 118.580 -12.585 1.047 1.00 0.00 H new ATOM 0 HG2 ARG A 29 118.344 -14.027 3.053 1.00 0.00 H new ATOM 0 HG3 ARG A 29 117.630 -12.706 3.956 1.00 0.00 H new ATOM 0 HD2 ARG A 29 115.785 -14.101 3.122 1.00 0.00 H new ATOM 0 HD3 ARG A 29 115.755 -12.611 2.200 1.00 0.00 H new ATOM 0 HE ARG A 29 117.208 -13.861 0.430 1.00 0.00 H new ATOM 0 HH11 ARG A 29 117.625 -16.385 1.969 1.00 0.00 H new ATOM 0 HH12 ARG A 29 116.345 -17.434 1.351 1.00 0.00 H new ATOM 0 HH21 ARG A 29 114.494 -14.796 -0.000 1.00 0.00 H new ATOM 0 HH22 ARG A 29 114.589 -16.542 0.247 1.00 0.00 H new ATOM 375 N TYR A 30 120.807 -13.314 4.016 1.00 0.00 N ATOM 376 CA TYR A 30 121.689 -14.480 4.302 1.00 0.00 C ATOM 377 C TYR A 30 120.842 -15.619 4.874 1.00 0.00 C ATOM 378 O TYR A 30 120.029 -15.410 5.755 1.00 0.00 O ATOM 379 CB TYR A 30 122.694 -13.980 5.342 1.00 0.00 C ATOM 380 CG TYR A 30 123.486 -12.828 4.772 1.00 0.00 C ATOM 381 CD1 TYR A 30 124.588 -13.077 3.944 1.00 0.00 C ATOM 382 CD2 TYR A 30 123.121 -11.510 5.072 1.00 0.00 C ATOM 383 CE1 TYR A 30 125.323 -12.009 3.417 1.00 0.00 C ATOM 384 CE2 TYR A 30 123.855 -10.442 4.544 1.00 0.00 C ATOM 385 CZ TYR A 30 124.956 -10.691 3.717 1.00 0.00 C ATOM 386 OH TYR A 30 125.681 -9.638 3.197 1.00 0.00 O ATOM 0 H TYR A 30 120.327 -12.931 4.831 1.00 0.00 H new ATOM 0 HA TYR A 30 122.194 -14.857 3.413 1.00 0.00 H new ATOM 0 HB2 TYR A 30 122.171 -13.663 6.244 1.00 0.00 H new ATOM 0 HB3 TYR A 30 123.366 -14.788 5.630 1.00 0.00 H new ATOM 0 HD1 TYR A 30 124.871 -14.093 3.712 1.00 0.00 H new ATOM 0 HD2 TYR A 30 122.272 -11.317 5.711 1.00 0.00 H new ATOM 0 HE1 TYR A 30 126.173 -12.201 2.779 1.00 0.00 H new ATOM 0 HE2 TYR A 30 123.572 -9.426 4.775 1.00 0.00 H new ATOM 0 HH TYR A 30 125.293 -8.791 3.502 1.00 0.00 H new ATOM 395 N GLU A 31 121.017 -16.818 4.385 1.00 0.00 N ATOM 396 CA GLU A 31 120.213 -17.961 4.908 1.00 0.00 C ATOM 397 C GLU A 31 121.070 -19.225 4.988 1.00 0.00 C ATOM 398 O GLU A 31 121.899 -19.477 4.135 1.00 0.00 O ATOM 399 CB GLU A 31 119.080 -18.147 3.898 1.00 0.00 C ATOM 400 CG GLU A 31 118.108 -19.214 4.412 1.00 0.00 C ATOM 401 CD GLU A 31 117.023 -19.489 3.364 1.00 0.00 C ATOM 402 OE1 GLU A 31 117.110 -18.935 2.278 1.00 0.00 O ATOM 403 OE2 GLU A 31 116.122 -20.255 3.664 1.00 0.00 O ATOM 0 H GLU A 31 121.681 -17.055 3.647 1.00 0.00 H new ATOM 0 HA GLU A 31 119.837 -17.770 5.913 1.00 0.00 H new ATOM 0 HB2 GLU A 31 118.555 -17.204 3.747 1.00 0.00 H new ATOM 0 HB3 GLU A 31 119.486 -18.445 2.931 1.00 0.00 H new ATOM 0 HG2 GLU A 31 118.650 -20.133 4.635 1.00 0.00 H new ATOM 0 HG3 GLU A 31 117.649 -18.881 5.343 1.00 0.00 H new ATOM 408 N GLU A 32 120.871 -20.025 6.002 1.00 0.00 N ATOM 409 CA GLU A 32 121.667 -21.278 6.132 1.00 0.00 C ATOM 410 C GLU A 32 120.804 -22.486 5.749 1.00 0.00 C ATOM 411 O GLU A 32 119.689 -22.636 6.210 1.00 0.00 O ATOM 412 CB GLU A 32 122.069 -21.339 7.606 1.00 0.00 C ATOM 413 CG GLU A 32 122.954 -20.135 7.944 1.00 0.00 C ATOM 414 CD GLU A 32 123.421 -20.218 9.403 1.00 0.00 C ATOM 415 OE1 GLU A 32 122.890 -21.038 10.135 1.00 0.00 O ATOM 416 OE2 GLU A 32 124.302 -19.456 9.763 1.00 0.00 O ATOM 0 H GLU A 32 120.191 -19.864 6.745 1.00 0.00 H new ATOM 0 HA GLU A 32 122.538 -21.292 5.477 1.00 0.00 H new ATOM 0 HB2 GLU A 32 121.180 -21.339 8.237 1.00 0.00 H new ATOM 0 HB3 GLU A 32 122.605 -22.266 7.810 1.00 0.00 H new ATOM 0 HG2 GLU A 32 123.817 -20.110 7.279 1.00 0.00 H new ATOM 0 HG3 GLU A 32 122.400 -19.210 7.783 1.00 0.00 H new ATOM 421 N ASP A 33 121.306 -23.328 4.887 1.00 0.00 N ATOM 422 CA ASP A 33 120.520 -24.517 4.432 1.00 0.00 C ATOM 423 C ASP A 33 120.033 -25.363 5.619 1.00 0.00 C ATOM 424 O ASP A 33 119.083 -26.111 5.497 1.00 0.00 O ATOM 425 CB ASP A 33 121.490 -25.323 3.556 1.00 0.00 C ATOM 426 CG ASP A 33 122.660 -25.845 4.399 1.00 0.00 C ATOM 427 OD1 ASP A 33 122.928 -25.263 5.438 1.00 0.00 O ATOM 428 OD2 ASP A 33 123.270 -26.817 3.987 1.00 0.00 O ATOM 0 H ASP A 33 122.235 -23.245 4.473 1.00 0.00 H new ATOM 0 HA ASP A 33 119.622 -24.217 3.891 1.00 0.00 H new ATOM 0 HB2 ASP A 33 120.965 -26.159 3.094 1.00 0.00 H new ATOM 0 HB3 ASP A 33 121.867 -24.697 2.747 1.00 0.00 H new ATOM 432 N ASN A 34 120.676 -25.263 6.753 1.00 0.00 N ATOM 433 CA ASN A 34 120.238 -26.082 7.926 1.00 0.00 C ATOM 434 C ASN A 34 118.793 -25.739 8.318 1.00 0.00 C ATOM 435 O ASN A 34 118.033 -26.600 8.719 1.00 0.00 O ATOM 436 CB ASN A 34 121.216 -25.733 9.056 1.00 0.00 C ATOM 437 CG ASN A 34 121.079 -24.257 9.437 1.00 0.00 C ATOM 438 OD1 ASN A 34 120.684 -23.443 8.629 1.00 0.00 O ATOM 439 ND2 ASN A 34 121.392 -23.876 10.646 1.00 0.00 N ATOM 0 H ASN A 34 121.479 -24.656 6.919 1.00 0.00 H new ATOM 0 HA ASN A 34 120.249 -27.149 7.704 1.00 0.00 H new ATOM 0 HB2 ASN A 34 121.018 -26.360 9.925 1.00 0.00 H new ATOM 0 HB3 ASN A 34 122.238 -25.941 8.739 1.00 0.00 H new ATOM 0 HD21 ASN A 34 121.304 -22.895 10.910 1.00 0.00 H new ATOM 0 HD22 ASN A 34 121.724 -24.560 11.326 1.00 0.00 H new ATOM 445 N SER A 35 118.406 -24.494 8.204 1.00 0.00 N ATOM 446 CA SER A 35 117.011 -24.106 8.571 1.00 0.00 C ATOM 447 C SER A 35 116.503 -22.985 7.650 1.00 0.00 C ATOM 448 O SER A 35 117.288 -22.298 7.027 1.00 0.00 O ATOM 449 CB SER A 35 117.106 -23.611 10.013 1.00 0.00 C ATOM 450 OG SER A 35 117.874 -24.531 10.776 1.00 0.00 O ATOM 0 H SER A 35 118.995 -23.730 7.873 1.00 0.00 H new ATOM 0 HA SER A 35 116.314 -24.937 8.467 1.00 0.00 H new ATOM 0 HB2 SER A 35 117.567 -22.624 10.041 1.00 0.00 H new ATOM 0 HB3 SER A 35 116.109 -23.509 10.441 1.00 0.00 H new ATOM 0 HG SER A 35 117.938 -24.215 11.702 1.00 0.00 H new ATOM 455 N PRO A 36 115.198 -22.833 7.596 1.00 0.00 N ATOM 456 CA PRO A 36 114.582 -21.786 6.749 1.00 0.00 C ATOM 457 C PRO A 36 114.456 -20.457 7.512 1.00 0.00 C ATOM 458 O PRO A 36 113.516 -19.712 7.313 1.00 0.00 O ATOM 459 CB PRO A 36 113.201 -22.356 6.446 1.00 0.00 C ATOM 460 CG PRO A 36 112.889 -23.296 7.578 1.00 0.00 C ATOM 461 CD PRO A 36 114.178 -23.618 8.300 1.00 0.00 C ATOM 0 HA PRO A 36 115.168 -21.564 5.857 1.00 0.00 H new ATOM 0 HB2 PRO A 36 112.456 -21.563 6.380 1.00 0.00 H new ATOM 0 HB3 PRO A 36 113.195 -22.879 5.490 1.00 0.00 H new ATOM 0 HG2 PRO A 36 112.174 -22.840 8.263 1.00 0.00 H new ATOM 0 HG3 PRO A 36 112.429 -24.208 7.198 1.00 0.00 H new ATOM 0 HD2 PRO A 36 114.122 -23.343 9.353 1.00 0.00 H new ATOM 0 HD3 PRO A 36 114.400 -24.684 8.260 1.00 0.00 H new ATOM 466 N LEU A 37 115.388 -20.157 8.379 1.00 0.00 N ATOM 467 CA LEU A 37 115.308 -18.877 9.147 1.00 0.00 C ATOM 468 C LEU A 37 116.492 -17.968 8.804 1.00 0.00 C ATOM 469 O LEU A 37 117.493 -17.953 9.492 1.00 0.00 O ATOM 470 CB LEU A 37 115.363 -19.295 10.616 1.00 0.00 C ATOM 471 CG LEU A 37 115.164 -18.064 11.503 1.00 0.00 C ATOM 472 CD1 LEU A 37 113.707 -17.607 11.421 1.00 0.00 C ATOM 473 CD2 LEU A 37 115.505 -18.421 12.952 1.00 0.00 C ATOM 0 H LEU A 37 116.198 -20.740 8.589 1.00 0.00 H new ATOM 0 HA LEU A 37 114.404 -18.315 8.913 1.00 0.00 H new ATOM 0 HB2 LEU A 37 114.590 -20.035 10.824 1.00 0.00 H new ATOM 0 HB3 LEU A 37 116.322 -19.764 10.836 1.00 0.00 H new ATOM 0 HG LEU A 37 115.817 -17.260 11.162 1.00 0.00 H new ATOM 0 HD11 LEU A 37 113.565 -16.730 12.053 1.00 0.00 H new ATOM 0 HD12 LEU A 37 113.462 -17.355 10.389 1.00 0.00 H new ATOM 0 HD13 LEU A 37 113.054 -18.410 11.763 1.00 0.00 H new ATOM 0 HD21 LEU A 37 115.364 -17.545 13.585 1.00 0.00 H new ATOM 0 HD22 LEU A 37 114.851 -19.224 13.292 1.00 0.00 H new ATOM 0 HD23 LEU A 37 116.543 -18.748 13.011 1.00 0.00 H new ATOM 484 N GLY A 38 116.380 -17.209 7.744 1.00 0.00 N ATOM 485 CA GLY A 38 117.495 -16.297 7.355 1.00 0.00 C ATOM 486 C GLY A 38 117.129 -14.857 7.716 1.00 0.00 C ATOM 487 O GLY A 38 116.089 -14.596 8.291 1.00 0.00 O ATOM 0 H GLY A 38 115.565 -17.182 7.132 1.00 0.00 H new ATOM 0 HA2 GLY A 38 118.412 -16.589 7.866 1.00 0.00 H new ATOM 0 HA3 GLY A 38 117.687 -16.377 6.285 1.00 0.00 H new ATOM 490 N VAL A 39 117.969 -13.918 7.363 1.00 0.00 N ATOM 491 CA VAL A 39 117.672 -12.485 7.662 1.00 0.00 C ATOM 492 C VAL A 39 117.975 -11.635 6.424 1.00 0.00 C ATOM 493 O VAL A 39 118.874 -11.939 5.664 1.00 0.00 O ATOM 494 CB VAL A 39 118.601 -12.112 8.822 1.00 0.00 C ATOM 495 CG1 VAL A 39 118.274 -12.984 10.036 1.00 0.00 C ATOM 496 CG2 VAL A 39 120.060 -12.340 8.412 1.00 0.00 C ATOM 0 H VAL A 39 118.851 -14.083 6.879 1.00 0.00 H new ATOM 0 HA VAL A 39 116.627 -12.317 7.924 1.00 0.00 H new ATOM 0 HB VAL A 39 118.457 -11.061 9.074 1.00 0.00 H new ATOM 0 HG11 VAL A 39 118.934 -12.720 10.862 1.00 0.00 H new ATOM 0 HG12 VAL A 39 117.238 -12.821 10.333 1.00 0.00 H new ATOM 0 HG13 VAL A 39 118.417 -14.034 9.779 1.00 0.00 H new ATOM 0 HG21 VAL A 39 120.717 -12.073 9.240 1.00 0.00 H new ATOM 0 HG22 VAL A 39 120.206 -13.389 8.156 1.00 0.00 H new ATOM 0 HG23 VAL A 39 120.296 -11.720 7.547 1.00 0.00 H new ATOM 506 N ILE A 40 117.234 -10.579 6.210 1.00 0.00 N ATOM 507 CA ILE A 40 117.492 -9.727 5.011 1.00 0.00 C ATOM 508 C ILE A 40 117.458 -8.236 5.365 1.00 0.00 C ATOM 509 O ILE A 40 116.708 -7.803 6.213 1.00 0.00 O ATOM 510 CB ILE A 40 116.374 -10.080 4.020 1.00 0.00 C ATOM 511 CG1 ILE A 40 116.550 -9.257 2.738 1.00 0.00 C ATOM 512 CG2 ILE A 40 115.005 -9.782 4.638 1.00 0.00 C ATOM 513 CD1 ILE A 40 115.613 -9.791 1.652 1.00 0.00 C ATOM 0 H ILE A 40 116.467 -10.271 6.808 1.00 0.00 H new ATOM 0 HA ILE A 40 118.482 -9.912 4.595 1.00 0.00 H new ATOM 0 HB ILE A 40 116.430 -11.143 3.784 1.00 0.00 H new ATOM 0 HG12 ILE A 40 116.333 -8.207 2.935 1.00 0.00 H new ATOM 0 HG13 ILE A 40 117.584 -9.311 2.399 1.00 0.00 H new ATOM 0 HG21 ILE A 40 114.221 -10.037 3.925 1.00 0.00 H new ATOM 0 HG22 ILE A 40 114.878 -10.374 5.544 1.00 0.00 H new ATOM 0 HG23 ILE A 40 114.940 -8.722 4.885 1.00 0.00 H new ATOM 0 HD11 ILE A 40 115.740 -9.205 0.742 1.00 0.00 H new ATOM 0 HD12 ILE A 40 115.851 -10.835 1.447 1.00 0.00 H new ATOM 0 HD13 ILE A 40 114.580 -9.714 1.992 1.00 0.00 H new ATOM 524 N GLY A 41 118.264 -7.453 4.696 1.00 0.00 N ATOM 525 CA GLY A 41 118.285 -5.983 4.949 1.00 0.00 C ATOM 526 C GLY A 41 117.815 -5.283 3.673 1.00 0.00 C ATOM 527 O GLY A 41 117.981 -5.805 2.590 1.00 0.00 O ATOM 0 H GLY A 41 118.914 -7.773 3.979 1.00 0.00 H new ATOM 0 HA2 GLY A 41 117.634 -5.730 5.786 1.00 0.00 H new ATOM 0 HA3 GLY A 41 119.290 -5.656 5.217 1.00 0.00 H new ATOM 530 N SER A 42 117.213 -4.126 3.780 1.00 0.00 N ATOM 531 CA SER A 42 116.722 -3.435 2.549 1.00 0.00 C ATOM 532 C SER A 42 116.959 -1.922 2.613 1.00 0.00 C ATOM 533 O SER A 42 116.799 -1.297 3.643 1.00 0.00 O ATOM 534 CB SER A 42 115.226 -3.732 2.508 1.00 0.00 C ATOM 535 OG SER A 42 114.662 -3.134 1.348 1.00 0.00 O ATOM 0 H SER A 42 117.041 -3.634 4.657 1.00 0.00 H new ATOM 0 HA SER A 42 117.249 -3.785 1.661 1.00 0.00 H new ATOM 0 HB2 SER A 42 115.057 -4.809 2.495 1.00 0.00 H new ATOM 0 HB3 SER A 42 114.741 -3.344 3.404 1.00 0.00 H new ATOM 0 HG SER A 42 115.377 -2.758 0.793 1.00 0.00 H new ATOM 540 N PHE A 43 117.307 -1.333 1.497 1.00 0.00 N ATOM 541 CA PHE A 43 117.525 0.142 1.445 1.00 0.00 C ATOM 542 C PHE A 43 116.729 0.708 0.264 1.00 0.00 C ATOM 543 O PHE A 43 116.688 0.108 -0.794 1.00 0.00 O ATOM 544 CB PHE A 43 119.028 0.316 1.222 1.00 0.00 C ATOM 545 CG PHE A 43 119.381 1.783 1.260 1.00 0.00 C ATOM 546 CD1 PHE A 43 119.619 2.416 2.486 1.00 0.00 C ATOM 547 CD2 PHE A 43 119.472 2.511 0.068 1.00 0.00 C ATOM 548 CE1 PHE A 43 119.947 3.776 2.519 1.00 0.00 C ATOM 549 CE2 PHE A 43 119.801 3.872 0.101 1.00 0.00 C ATOM 550 CZ PHE A 43 120.038 4.504 1.327 1.00 0.00 C ATOM 0 H PHE A 43 117.451 -1.818 0.611 1.00 0.00 H new ATOM 0 HA PHE A 43 117.200 0.660 2.348 1.00 0.00 H new ATOM 0 HB2 PHE A 43 119.584 -0.222 1.990 1.00 0.00 H new ATOM 0 HB3 PHE A 43 119.315 -0.112 0.262 1.00 0.00 H new ATOM 0 HD1 PHE A 43 119.549 1.855 3.406 1.00 0.00 H new ATOM 0 HD2 PHE A 43 119.288 2.023 -0.878 1.00 0.00 H new ATOM 0 HE1 PHE A 43 120.130 4.264 3.465 1.00 0.00 H new ATOM 0 HE2 PHE A 43 119.872 4.433 -0.819 1.00 0.00 H new ATOM 0 HZ PHE A 43 120.291 5.554 1.353 1.00 0.00 H new ATOM 559 N THR A 44 116.086 1.837 0.423 1.00 0.00 N ATOM 560 CA THR A 44 115.292 2.394 -0.716 1.00 0.00 C ATOM 561 C THR A 44 115.553 3.893 -0.909 1.00 0.00 C ATOM 562 O THR A 44 115.805 4.620 0.032 1.00 0.00 O ATOM 563 CB THR A 44 113.827 2.138 -0.333 1.00 0.00 C ATOM 564 OG1 THR A 44 112.989 2.473 -1.429 1.00 0.00 O ATOM 565 CG2 THR A 44 113.442 2.979 0.888 1.00 0.00 C ATOM 0 H THR A 44 116.075 2.391 1.279 1.00 0.00 H new ATOM 0 HA THR A 44 115.563 1.925 -1.662 1.00 0.00 H new ATOM 0 HB THR A 44 113.703 1.084 -0.085 1.00 0.00 H new ATOM 0 HG1 THR A 44 112.053 2.309 -1.188 1.00 0.00 H new ATOM 0 HG21 THR A 44 112.401 2.787 1.148 1.00 0.00 H new ATOM 0 HG22 THR A 44 114.081 2.712 1.730 1.00 0.00 H new ATOM 0 HG23 THR A 44 113.569 4.036 0.656 1.00 0.00 H new ATOM 573 N TYR A 45 115.474 4.352 -2.132 1.00 0.00 N ATOM 574 CA TYR A 45 115.693 5.797 -2.415 1.00 0.00 C ATOM 575 C TYR A 45 114.713 6.251 -3.497 1.00 0.00 C ATOM 576 O TYR A 45 114.784 5.806 -4.626 1.00 0.00 O ATOM 577 CB TYR A 45 117.134 5.891 -2.917 1.00 0.00 C ATOM 578 CG TYR A 45 117.496 7.338 -3.147 1.00 0.00 C ATOM 579 CD1 TYR A 45 117.967 8.118 -2.085 1.00 0.00 C ATOM 580 CD2 TYR A 45 117.360 7.900 -4.422 1.00 0.00 C ATOM 581 CE1 TYR A 45 118.303 9.461 -2.297 1.00 0.00 C ATOM 582 CE2 TYR A 45 117.695 9.242 -4.635 1.00 0.00 C ATOM 583 CZ TYR A 45 118.166 10.023 -3.573 1.00 0.00 C ATOM 584 OH TYR A 45 118.496 11.347 -3.782 1.00 0.00 O ATOM 0 H TYR A 45 115.265 3.781 -2.951 1.00 0.00 H new ATOM 0 HA TYR A 45 115.534 6.429 -1.541 1.00 0.00 H new ATOM 0 HB2 TYR A 45 117.813 5.447 -2.189 1.00 0.00 H new ATOM 0 HB3 TYR A 45 117.245 5.326 -3.843 1.00 0.00 H new ATOM 0 HD1 TYR A 45 118.071 7.684 -1.101 1.00 0.00 H new ATOM 0 HD2 TYR A 45 116.996 7.298 -5.241 1.00 0.00 H new ATOM 0 HE1 TYR A 45 118.667 10.063 -1.478 1.00 0.00 H new ATOM 0 HE2 TYR A 45 117.590 9.675 -5.619 1.00 0.00 H new ATOM 0 HH TYR A 45 118.344 11.578 -4.722 1.00 0.00 H new ATOM 593 N THR A 46 113.801 7.124 -3.165 1.00 0.00 N ATOM 594 CA THR A 46 112.814 7.591 -4.192 1.00 0.00 C ATOM 595 C THR A 46 112.886 9.111 -4.349 1.00 0.00 C ATOM 596 O THR A 46 113.371 9.813 -3.481 1.00 0.00 O ATOM 597 CB THR A 46 111.428 7.174 -3.675 1.00 0.00 C ATOM 598 OG1 THR A 46 111.095 7.946 -2.532 1.00 0.00 O ATOM 599 CG2 THR A 46 111.416 5.684 -3.309 1.00 0.00 C ATOM 0 H THR A 46 113.693 7.533 -2.237 1.00 0.00 H new ATOM 0 HA THR A 46 113.023 7.154 -5.169 1.00 0.00 H new ATOM 0 HB THR A 46 110.694 7.347 -4.462 1.00 0.00 H new ATOM 0 HG1 THR A 46 111.131 7.380 -1.733 1.00 0.00 H new ATOM 0 HG21 THR A 46 110.427 5.407 -2.945 1.00 0.00 H new ATOM 0 HG22 THR A 46 111.658 5.091 -4.191 1.00 0.00 H new ATOM 0 HG23 THR A 46 112.155 5.495 -2.531 1.00 0.00 H new ATOM 607 N GLU A 47 112.407 9.623 -5.455 1.00 0.00 N ATOM 608 CA GLU A 47 112.446 11.097 -5.677 1.00 0.00 C ATOM 609 C GLU A 47 111.173 11.564 -6.392 1.00 0.00 C ATOM 610 O GLU A 47 110.378 10.764 -6.848 1.00 0.00 O ATOM 611 CB GLU A 47 113.683 11.334 -6.551 1.00 0.00 C ATOM 612 CG GLU A 47 113.521 10.605 -7.891 1.00 0.00 C ATOM 613 CD GLU A 47 114.807 10.731 -8.716 1.00 0.00 C ATOM 614 OE1 GLU A 47 115.673 11.501 -8.328 1.00 0.00 O ATOM 615 OE2 GLU A 47 114.905 10.053 -9.725 1.00 0.00 O ATOM 0 H GLU A 47 111.991 9.082 -6.213 1.00 0.00 H new ATOM 0 HA GLU A 47 112.498 11.655 -4.742 1.00 0.00 H new ATOM 0 HB2 GLU A 47 113.819 12.402 -6.722 1.00 0.00 H new ATOM 0 HB3 GLU A 47 114.576 10.977 -6.038 1.00 0.00 H new ATOM 0 HG2 GLU A 47 113.293 9.554 -7.717 1.00 0.00 H new ATOM 0 HG3 GLU A 47 112.682 11.026 -8.444 1.00 0.00 H new ATOM 620 N LYS A 48 110.977 12.853 -6.494 1.00 0.00 N ATOM 621 CA LYS A 48 109.760 13.376 -7.181 1.00 0.00 C ATOM 622 C LYS A 48 110.151 14.417 -8.237 1.00 0.00 C ATOM 623 O LYS A 48 111.194 15.037 -8.152 1.00 0.00 O ATOM 624 CB LYS A 48 108.910 14.006 -6.070 1.00 0.00 C ATOM 625 CG LYS A 48 109.637 15.212 -5.466 1.00 0.00 C ATOM 626 CD LYS A 48 108.829 15.753 -4.284 1.00 0.00 C ATOM 627 CE LYS A 48 109.372 17.126 -3.881 1.00 0.00 C ATOM 628 NZ LYS A 48 108.264 17.769 -3.120 1.00 0.00 N ATOM 0 H LYS A 48 111.609 13.567 -6.130 1.00 0.00 H new ATOM 0 HA LYS A 48 109.213 12.593 -7.706 1.00 0.00 H new ATOM 0 HB2 LYS A 48 107.946 14.317 -6.472 1.00 0.00 H new ATOM 0 HB3 LYS A 48 108.708 13.268 -5.294 1.00 0.00 H new ATOM 0 HG2 LYS A 48 110.635 14.922 -5.136 1.00 0.00 H new ATOM 0 HG3 LYS A 48 109.764 15.989 -6.220 1.00 0.00 H new ATOM 0 HD2 LYS A 48 107.776 15.832 -4.555 1.00 0.00 H new ATOM 0 HD3 LYS A 48 108.891 15.064 -3.442 1.00 0.00 H new ATOM 0 HE2 LYS A 48 110.269 17.032 -3.269 1.00 0.00 H new ATOM 0 HE3 LYS A 48 109.644 17.716 -4.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 108.651 18.515 -2.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 107.582 18.187 -3.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 107.784 17.055 -2.536 1.00 0.00 H new ATOM 638 N SER A 49 109.324 14.606 -9.230 1.00 0.00 N ATOM 639 CA SER A 49 109.643 15.601 -10.297 1.00 0.00 C ATOM 640 C SER A 49 108.946 16.931 -10.004 1.00 0.00 C ATOM 641 O SER A 49 107.954 16.980 -9.302 1.00 0.00 O ATOM 642 CB SER A 49 109.102 14.985 -11.586 1.00 0.00 C ATOM 643 OG SER A 49 109.760 13.747 -11.826 1.00 0.00 O ATOM 0 H SER A 49 108.439 14.113 -9.349 1.00 0.00 H new ATOM 0 HA SER A 49 110.711 15.810 -10.362 1.00 0.00 H new ATOM 0 HB2 SER A 49 108.026 14.829 -11.505 1.00 0.00 H new ATOM 0 HB3 SER A 49 109.263 15.664 -12.423 1.00 0.00 H new ATOM 0 HG SER A 49 109.414 13.348 -12.651 1.00 0.00 H new ATOM 648 N ARG A 50 109.462 18.010 -10.531 1.00 0.00 N ATOM 649 CA ARG A 50 108.837 19.341 -10.280 1.00 0.00 C ATOM 650 C ARG A 50 108.880 20.203 -11.547 1.00 0.00 C ATOM 651 O ARG A 50 109.646 19.949 -12.457 1.00 0.00 O ATOM 652 CB ARG A 50 109.681 19.966 -9.163 1.00 0.00 C ATOM 653 CG ARG A 50 111.112 20.197 -9.656 1.00 0.00 C ATOM 654 CD ARG A 50 112.007 20.579 -8.474 1.00 0.00 C ATOM 655 NE ARG A 50 113.319 20.929 -9.084 1.00 0.00 N ATOM 656 CZ ARG A 50 114.328 20.107 -8.980 1.00 0.00 C ATOM 657 NH1 ARG A 50 114.375 19.034 -9.722 1.00 0.00 N ATOM 658 NH2 ARG A 50 115.290 20.359 -8.136 1.00 0.00 N ATOM 0 H ARG A 50 110.291 18.026 -11.125 1.00 0.00 H new ATOM 0 HA ARG A 50 107.787 19.259 -10.000 1.00 0.00 H new ATOM 0 HB2 ARG A 50 109.239 20.911 -8.847 1.00 0.00 H new ATOM 0 HB3 ARG A 50 109.689 19.311 -8.292 1.00 0.00 H new ATOM 0 HG2 ARG A 50 111.492 19.295 -10.136 1.00 0.00 H new ATOM 0 HG3 ARG A 50 111.126 20.988 -10.406 1.00 0.00 H new ATOM 0 HD2 ARG A 50 111.592 21.421 -7.920 1.00 0.00 H new ATOM 0 HD3 ARG A 50 112.106 19.752 -7.770 1.00 0.00 H new ATOM 0 HE ARG A 50 113.430 21.811 -9.583 1.00 0.00 H new ATOM 0 HH11 ARG A 50 113.623 18.838 -10.383 1.00 0.00 H new ATOM 0 HH12 ARG A 50 115.163 18.392 -9.641 1.00 0.00 H new ATOM 0 HH21 ARG A 50 115.254 21.198 -7.557 1.00 0.00 H new ATOM 0 HH22 ARG A 50 116.078 19.717 -8.055 1.00 0.00 H new ATOM 669 N THR A 51 108.060 21.218 -11.610 1.00 0.00 N ATOM 670 CA THR A 51 108.044 22.103 -12.811 1.00 0.00 C ATOM 671 C THR A 51 108.359 23.546 -12.406 1.00 0.00 C ATOM 672 O THR A 51 107.943 24.009 -11.361 1.00 0.00 O ATOM 673 CB THR A 51 106.620 21.997 -13.360 1.00 0.00 C ATOM 674 OG1 THR A 51 106.306 20.631 -13.594 1.00 0.00 O ATOM 675 CG2 THR A 51 106.518 22.778 -14.670 1.00 0.00 C ATOM 0 H THR A 51 107.397 21.473 -10.878 1.00 0.00 H new ATOM 0 HA THR A 51 108.789 21.811 -13.552 1.00 0.00 H new ATOM 0 HB THR A 51 105.918 22.413 -12.637 1.00 0.00 H new ATOM 0 HG1 THR A 51 105.393 20.560 -13.944 1.00 0.00 H new ATOM 0 HG21 THR A 51 105.503 22.702 -15.061 1.00 0.00 H new ATOM 0 HG22 THR A 51 106.760 23.825 -14.489 1.00 0.00 H new ATOM 0 HG23 THR A 51 107.218 22.364 -15.396 1.00 0.00 H new ATOM 683 N ALA A 52 109.091 24.257 -13.224 1.00 0.00 N ATOM 684 CA ALA A 52 109.435 25.673 -12.886 1.00 0.00 C ATOM 685 C ALA A 52 108.158 26.505 -12.738 1.00 0.00 C ATOM 686 O ALA A 52 107.202 26.318 -13.462 1.00 0.00 O ATOM 687 CB ALA A 52 110.268 26.175 -14.067 1.00 0.00 C ATOM 0 H ALA A 52 109.466 23.920 -14.111 1.00 0.00 H new ATOM 0 HA ALA A 52 109.978 25.752 -11.944 1.00 0.00 H new ATOM 0 HB1 ALA A 52 110.559 27.211 -13.893 1.00 0.00 H new ATOM 0 HB2 ALA A 52 111.161 25.559 -14.170 1.00 0.00 H new ATOM 0 HB3 ALA A 52 109.677 26.113 -14.981 1.00 0.00 H new ATOM 693 N SER A 53 108.141 27.424 -11.802 1.00 0.00 N ATOM 694 CA SER A 53 106.929 28.283 -11.581 1.00 0.00 C ATOM 695 C SER A 53 105.715 27.415 -11.224 1.00 0.00 C ATOM 696 O SER A 53 105.435 26.422 -11.866 1.00 0.00 O ATOM 697 CB SER A 53 106.694 29.030 -12.899 1.00 0.00 C ATOM 698 OG SER A 53 107.021 30.402 -12.724 1.00 0.00 O ATOM 0 H SER A 53 108.921 27.619 -11.175 1.00 0.00 H new ATOM 0 HA SER A 53 107.076 28.978 -10.754 1.00 0.00 H new ATOM 0 HB2 SER A 53 107.305 28.596 -13.690 1.00 0.00 H new ATOM 0 HB3 SER A 53 105.654 28.928 -13.208 1.00 0.00 H new ATOM 0 HG SER A 53 106.874 30.883 -13.565 1.00 0.00 H new ATOM 703 N SER A 54 104.992 27.784 -10.196 1.00 0.00 N ATOM 704 CA SER A 54 103.794 26.984 -9.784 1.00 0.00 C ATOM 705 C SER A 54 104.174 25.508 -9.607 1.00 0.00 C ATOM 706 O SER A 54 103.707 24.645 -10.327 1.00 0.00 O ATOM 707 CB SER A 54 102.786 27.150 -10.923 1.00 0.00 C ATOM 708 OG SER A 54 102.022 28.329 -10.705 1.00 0.00 O ATOM 0 H SER A 54 105.179 28.606 -9.622 1.00 0.00 H new ATOM 0 HA SER A 54 103.385 27.321 -8.831 1.00 0.00 H new ATOM 0 HB2 SER A 54 103.306 27.211 -11.879 1.00 0.00 H new ATOM 0 HB3 SER A 54 102.130 26.281 -10.973 1.00 0.00 H new ATOM 0 HG SER A 54 101.376 28.440 -11.434 1.00 0.00 H new ATOM 713 N GLY A 55 105.022 25.217 -8.656 1.00 0.00 N ATOM 714 CA GLY A 55 105.444 23.805 -8.423 1.00 0.00 C ATOM 715 C GLY A 55 106.276 23.736 -7.141 1.00 0.00 C ATOM 716 O GLY A 55 106.364 24.698 -6.402 1.00 0.00 O ATOM 0 H GLY A 55 105.443 25.901 -8.027 1.00 0.00 H new ATOM 0 HA2 GLY A 55 104.569 23.160 -8.339 1.00 0.00 H new ATOM 0 HA3 GLY A 55 106.027 23.442 -9.270 1.00 0.00 H new ATOM 719 N ASP A 56 106.884 22.611 -6.868 1.00 0.00 N ATOM 720 CA ASP A 56 107.707 22.492 -5.626 1.00 0.00 C ATOM 721 C ASP A 56 108.919 23.424 -5.705 1.00 0.00 C ATOM 722 O ASP A 56 109.643 23.435 -6.682 1.00 0.00 O ATOM 723 CB ASP A 56 108.157 21.029 -5.580 1.00 0.00 C ATOM 724 CG ASP A 56 106.940 20.113 -5.398 1.00 0.00 C ATOM 725 OD1 ASP A 56 105.904 20.604 -4.980 1.00 0.00 O ATOM 726 OD2 ASP A 56 107.068 18.933 -5.677 1.00 0.00 O ATOM 0 H ASP A 56 106.847 21.773 -7.448 1.00 0.00 H new ATOM 0 HA ASP A 56 107.147 22.771 -4.734 1.00 0.00 H new ATOM 0 HB2 ASP A 56 108.682 20.772 -6.500 1.00 0.00 H new ATOM 0 HB3 ASP A 56 108.860 20.881 -4.760 1.00 0.00 H new ATOM 730 N TYR A 57 109.141 24.207 -4.682 1.00 0.00 N ATOM 731 CA TYR A 57 110.302 25.145 -4.687 1.00 0.00 C ATOM 732 C TYR A 57 111.583 24.441 -4.207 1.00 0.00 C ATOM 733 O TYR A 57 112.677 24.937 -4.398 1.00 0.00 O ATOM 734 CB TYR A 57 109.903 26.288 -3.738 1.00 0.00 C ATOM 735 CG TYR A 57 109.902 25.813 -2.298 1.00 0.00 C ATOM 736 CD1 TYR A 57 108.738 25.271 -1.736 1.00 0.00 C ATOM 737 CD2 TYR A 57 111.067 25.917 -1.528 1.00 0.00 C ATOM 738 CE1 TYR A 57 108.742 24.833 -0.407 1.00 0.00 C ATOM 739 CE2 TYR A 57 111.069 25.480 -0.199 1.00 0.00 C ATOM 740 CZ TYR A 57 109.906 24.938 0.362 1.00 0.00 C ATOM 741 OH TYR A 57 109.910 24.505 1.673 1.00 0.00 O ATOM 0 H TYR A 57 108.566 24.237 -3.840 1.00 0.00 H new ATOM 0 HA TYR A 57 110.522 25.514 -5.689 1.00 0.00 H new ATOM 0 HB2 TYR A 57 110.597 27.120 -3.851 1.00 0.00 H new ATOM 0 HB3 TYR A 57 108.914 26.660 -4.004 1.00 0.00 H new ATOM 0 HD1 TYR A 57 107.838 25.191 -2.328 1.00 0.00 H new ATOM 0 HD2 TYR A 57 111.964 26.335 -1.960 1.00 0.00 H new ATOM 0 HE1 TYR A 57 107.846 24.414 0.025 1.00 0.00 H new ATOM 0 HE2 TYR A 57 111.968 25.561 0.394 1.00 0.00 H new ATOM 0 HH TYR A 57 110.798 24.649 2.062 1.00 0.00 H new ATOM 750 N ASN A 58 111.455 23.298 -3.581 1.00 0.00 N ATOM 751 CA ASN A 58 112.665 22.577 -3.085 1.00 0.00 C ATOM 752 C ASN A 58 112.686 21.133 -3.598 1.00 0.00 C ATOM 753 O ASN A 58 111.967 20.775 -4.512 1.00 0.00 O ATOM 754 CB ASN A 58 112.554 22.621 -1.555 1.00 0.00 C ATOM 755 CG ASN A 58 111.372 21.766 -1.082 1.00 0.00 C ATOM 756 OD1 ASN A 58 110.522 21.394 -1.867 1.00 0.00 O ATOM 757 ND2 ASN A 58 111.283 21.438 0.177 1.00 0.00 N ATOM 0 H ASN A 58 110.566 22.834 -3.393 1.00 0.00 H new ATOM 0 HA ASN A 58 113.590 23.035 -3.436 1.00 0.00 H new ATOM 0 HB2 ASN A 58 113.478 22.256 -1.106 1.00 0.00 H new ATOM 0 HB3 ASN A 58 112.423 23.651 -1.223 1.00 0.00 H new ATOM 0 HD21 ASN A 58 110.501 20.870 0.502 1.00 0.00 H new ATOM 0 HD22 ASN A 58 111.996 21.750 0.837 1.00 0.00 H new ATOM 763 N LYS A 59 113.499 20.301 -3.002 1.00 0.00 N ATOM 764 CA LYS A 59 113.570 18.874 -3.431 1.00 0.00 C ATOM 765 C LYS A 59 113.794 17.983 -2.206 1.00 0.00 C ATOM 766 O LYS A 59 114.796 18.096 -1.526 1.00 0.00 O ATOM 767 CB LYS A 59 114.769 18.804 -4.376 1.00 0.00 C ATOM 768 CG LYS A 59 114.895 17.388 -4.941 1.00 0.00 C ATOM 769 CD LYS A 59 116.129 17.309 -5.842 1.00 0.00 C ATOM 770 CE LYS A 59 116.158 15.956 -6.559 1.00 0.00 C ATOM 771 NZ LYS A 59 116.442 16.284 -7.984 1.00 0.00 N ATOM 0 H LYS A 59 114.120 20.551 -2.232 1.00 0.00 H new ATOM 0 HA LYS A 59 112.656 18.534 -3.917 1.00 0.00 H new ATOM 0 HB2 LYS A 59 114.647 19.521 -5.188 1.00 0.00 H new ATOM 0 HB3 LYS A 59 115.681 19.077 -3.844 1.00 0.00 H new ATOM 0 HG2 LYS A 59 114.978 16.666 -4.128 1.00 0.00 H new ATOM 0 HG3 LYS A 59 114.000 17.129 -5.507 1.00 0.00 H new ATOM 0 HD2 LYS A 59 116.111 18.118 -6.572 1.00 0.00 H new ATOM 0 HD3 LYS A 59 117.034 17.436 -5.248 1.00 0.00 H new ATOM 0 HE2 LYS A 59 116.926 15.305 -6.143 1.00 0.00 H new ATOM 0 HE3 LYS A 59 115.207 15.434 -6.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 116.478 15.407 -8.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 115.690 16.900 -8.355 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 117.356 16.775 -8.052 1.00 0.00 H new ATOM 781 N ASN A 60 112.863 17.117 -1.906 1.00 0.00 N ATOM 782 CA ASN A 60 113.019 16.241 -0.708 1.00 0.00 C ATOM 783 C ASN A 60 113.540 14.856 -1.100 1.00 0.00 C ATOM 784 O ASN A 60 113.261 14.354 -2.171 1.00 0.00 O ATOM 785 CB ASN A 60 111.615 16.133 -0.112 1.00 0.00 C ATOM 786 CG ASN A 60 111.145 17.514 0.352 1.00 0.00 C ATOM 787 OD1 ASN A 60 111.945 18.408 0.551 1.00 0.00 O ATOM 788 ND2 ASN A 60 109.871 17.727 0.536 1.00 0.00 N ATOM 0 H ASN A 60 112.003 16.978 -2.437 1.00 0.00 H new ATOM 0 HA ASN A 60 113.740 16.651 -0.001 1.00 0.00 H new ATOM 0 HB2 ASN A 60 110.924 15.733 -0.854 1.00 0.00 H new ATOM 0 HB3 ASN A 60 111.618 15.438 0.728 1.00 0.00 H new ATOM 0 HD21 ASN A 60 109.547 18.643 0.847 1.00 0.00 H new ATOM 0 HD22 ASN A 60 109.199 16.978 0.369 1.00 0.00 H new ATOM 794 N GLN A 61 114.296 14.238 -0.229 1.00 0.00 N ATOM 795 CA GLN A 61 114.842 12.882 -0.531 1.00 0.00 C ATOM 796 C GLN A 61 114.153 11.839 0.351 1.00 0.00 C ATOM 797 O GLN A 61 113.804 12.113 1.488 1.00 0.00 O ATOM 798 CB GLN A 61 116.332 12.973 -0.195 1.00 0.00 C ATOM 799 CG GLN A 61 116.996 14.021 -1.091 1.00 0.00 C ATOM 800 CD GLN A 61 118.477 14.145 -0.728 1.00 0.00 C ATOM 801 OE1 GLN A 61 118.892 13.740 0.340 1.00 0.00 O ATOM 802 NE2 GLN A 61 119.301 14.691 -1.581 1.00 0.00 N ATOM 0 H GLN A 61 114.559 14.616 0.681 1.00 0.00 H new ATOM 0 HA GLN A 61 114.678 12.585 -1.567 1.00 0.00 H new ATOM 0 HB2 GLN A 61 116.463 13.240 0.854 1.00 0.00 H new ATOM 0 HB3 GLN A 61 116.808 12.003 -0.339 1.00 0.00 H new ATOM 0 HG2 GLN A 61 116.891 13.738 -2.138 1.00 0.00 H new ATOM 0 HG3 GLN A 61 116.500 14.984 -0.970 1.00 0.00 H new ATOM 0 HE21 GLN A 61 118.955 15.032 -2.478 1.00 0.00 H new ATOM 0 HE22 GLN A 61 120.291 14.777 -1.350 1.00 0.00 H new ATOM 809 N TYR A 62 113.943 10.649 -0.162 1.00 0.00 N ATOM 810 CA TYR A 62 113.264 9.598 0.650 1.00 0.00 C ATOM 811 C TYR A 62 114.242 8.481 1.030 1.00 0.00 C ATOM 812 O TYR A 62 114.773 7.784 0.184 1.00 0.00 O ATOM 813 CB TYR A 62 112.162 9.056 -0.256 1.00 0.00 C ATOM 814 CG TYR A 62 111.325 8.057 0.507 1.00 0.00 C ATOM 815 CD1 TYR A 62 110.265 8.501 1.307 1.00 0.00 C ATOM 816 CD2 TYR A 62 111.606 6.688 0.415 1.00 0.00 C ATOM 817 CE1 TYR A 62 109.487 7.577 2.015 1.00 0.00 C ATOM 818 CE2 TYR A 62 110.828 5.764 1.123 1.00 0.00 C ATOM 819 CZ TYR A 62 109.769 6.209 1.923 1.00 0.00 C ATOM 820 OH TYR A 62 109.002 5.297 2.621 1.00 0.00 O ATOM 0 H TYR A 62 114.212 10.365 -1.104 1.00 0.00 H new ATOM 0 HA TYR A 62 112.874 9.997 1.586 1.00 0.00 H new ATOM 0 HB2 TYR A 62 111.535 9.874 -0.613 1.00 0.00 H new ATOM 0 HB3 TYR A 62 112.600 8.583 -1.135 1.00 0.00 H new ATOM 0 HD1 TYR A 62 110.047 9.556 1.378 1.00 0.00 H new ATOM 0 HD2 TYR A 62 112.423 6.345 -0.202 1.00 0.00 H new ATOM 0 HE1 TYR A 62 108.669 7.920 2.632 1.00 0.00 H new ATOM 0 HE2 TYR A 62 111.045 4.708 1.052 1.00 0.00 H new ATOM 0 HH TYR A 62 109.331 4.391 2.446 1.00 0.00 H new ATOM 829 N TYR A 63 114.461 8.315 2.307 1.00 0.00 N ATOM 830 CA TYR A 63 115.388 7.250 2.784 1.00 0.00 C ATOM 831 C TYR A 63 114.606 6.193 3.555 1.00 0.00 C ATOM 832 O TYR A 63 113.761 6.508 4.373 1.00 0.00 O ATOM 833 CB TYR A 63 116.385 7.963 3.693 1.00 0.00 C ATOM 834 CG TYR A 63 117.282 8.849 2.863 1.00 0.00 C ATOM 835 CD1 TYR A 63 118.393 8.303 2.208 1.00 0.00 C ATOM 836 CD2 TYR A 63 117.005 10.216 2.749 1.00 0.00 C ATOM 837 CE1 TYR A 63 119.226 9.123 1.439 1.00 0.00 C ATOM 838 CE2 TYR A 63 117.839 11.037 1.980 1.00 0.00 C ATOM 839 CZ TYR A 63 118.949 10.491 1.325 1.00 0.00 C ATOM 840 OH TYR A 63 119.770 11.301 0.567 1.00 0.00 O ATOM 0 H TYR A 63 114.034 8.876 3.044 1.00 0.00 H new ATOM 0 HA TYR A 63 115.893 6.738 1.965 1.00 0.00 H new ATOM 0 HB2 TYR A 63 115.854 8.559 4.435 1.00 0.00 H new ATOM 0 HB3 TYR A 63 116.982 7.232 4.239 1.00 0.00 H new ATOM 0 HD1 TYR A 63 118.607 7.248 2.297 1.00 0.00 H new ATOM 0 HD2 TYR A 63 116.148 10.638 3.254 1.00 0.00 H new ATOM 0 HE1 TYR A 63 120.082 8.701 0.934 1.00 0.00 H new ATOM 0 HE2 TYR A 63 117.626 12.092 1.892 1.00 0.00 H new ATOM 0 HH TYR A 63 119.588 12.240 0.778 1.00 0.00 H new ATOM 849 N GLY A 64 114.869 4.939 3.296 1.00 0.00 N ATOM 850 CA GLY A 64 114.126 3.868 4.011 1.00 0.00 C ATOM 851 C GLY A 64 115.019 2.648 4.226 1.00 0.00 C ATOM 852 O GLY A 64 115.582 2.097 3.300 1.00 0.00 O ATOM 0 H GLY A 64 115.563 4.614 2.623 1.00 0.00 H new ATOM 0 HA2 GLY A 64 113.774 4.242 4.972 1.00 0.00 H new ATOM 0 HA3 GLY A 64 113.244 3.584 3.437 1.00 0.00 H new ATOM 855 N ILE A 65 115.114 2.207 5.449 1.00 0.00 N ATOM 856 CA ILE A 65 115.927 0.999 5.754 1.00 0.00 C ATOM 857 C ILE A 65 115.008 -0.018 6.413 1.00 0.00 C ATOM 858 O ILE A 65 114.243 0.329 7.286 1.00 0.00 O ATOM 859 CB ILE A 65 117.037 1.463 6.705 1.00 0.00 C ATOM 860 CG1 ILE A 65 117.902 0.264 7.100 1.00 0.00 C ATOM 861 CG2 ILE A 65 116.429 2.085 7.962 1.00 0.00 C ATOM 862 CD1 ILE A 65 119.213 0.759 7.715 1.00 0.00 C ATOM 0 H ILE A 65 114.660 2.635 6.256 1.00 0.00 H new ATOM 0 HA ILE A 65 116.371 0.536 4.873 1.00 0.00 H new ATOM 0 HB ILE A 65 117.649 2.210 6.199 1.00 0.00 H new ATOM 0 HG12 ILE A 65 117.368 -0.364 7.813 1.00 0.00 H new ATOM 0 HG13 ILE A 65 118.109 -0.352 6.225 1.00 0.00 H new ATOM 0 HG21 ILE A 65 117.227 2.411 8.629 1.00 0.00 H new ATOM 0 HG22 ILE A 65 115.816 2.942 7.684 1.00 0.00 H new ATOM 0 HG23 ILE A 65 115.810 1.346 8.470 1.00 0.00 H new ATOM 0 HD11 ILE A 65 119.829 -0.096 7.996 1.00 0.00 H new ATOM 0 HD12 ILE A 65 119.749 1.369 6.987 1.00 0.00 H new ATOM 0 HD13 ILE A 65 118.997 1.357 8.600 1.00 0.00 H new ATOM 873 N THR A 66 115.064 -1.261 6.012 1.00 0.00 N ATOM 874 CA THR A 66 114.165 -2.272 6.639 1.00 0.00 C ATOM 875 C THR A 66 114.823 -3.655 6.638 1.00 0.00 C ATOM 876 O THR A 66 115.505 -4.020 5.703 1.00 0.00 O ATOM 877 CB THR A 66 112.901 -2.296 5.768 1.00 0.00 C ATOM 878 OG1 THR A 66 113.248 -2.061 4.408 1.00 0.00 O ATOM 879 CG2 THR A 66 111.914 -1.224 6.237 1.00 0.00 C ATOM 0 H THR A 66 115.686 -1.616 5.286 1.00 0.00 H new ATOM 0 HA THR A 66 113.945 -2.019 7.676 1.00 0.00 H new ATOM 0 HB THR A 66 112.431 -3.275 5.859 1.00 0.00 H new ATOM 0 HG1 THR A 66 112.813 -2.730 3.839 1.00 0.00 H new ATOM 0 HG21 THR A 66 111.022 -1.252 5.611 1.00 0.00 H new ATOM 0 HG22 THR A 66 111.636 -1.414 7.274 1.00 0.00 H new ATOM 0 HG23 THR A 66 112.380 -0.242 6.161 1.00 0.00 H new ATOM 887 N ALA A 67 114.610 -4.433 7.668 1.00 0.00 N ATOM 888 CA ALA A 67 115.210 -5.797 7.710 1.00 0.00 C ATOM 889 C ALA A 67 114.210 -6.782 8.324 1.00 0.00 C ATOM 890 O ALA A 67 113.394 -6.412 9.147 1.00 0.00 O ATOM 891 CB ALA A 67 116.450 -5.661 8.594 1.00 0.00 C ATOM 0 H ALA A 67 114.047 -4.182 8.480 1.00 0.00 H new ATOM 0 HA ALA A 67 115.464 -6.173 6.719 1.00 0.00 H new ATOM 0 HB1 ALA A 67 116.948 -6.627 8.674 1.00 0.00 H new ATOM 0 HB2 ALA A 67 117.134 -4.936 8.153 1.00 0.00 H new ATOM 0 HB3 ALA A 67 116.154 -5.323 9.587 1.00 0.00 H new ATOM 897 N GLY A 68 114.261 -8.029 7.930 1.00 0.00 N ATOM 898 CA GLY A 68 113.304 -9.029 8.495 1.00 0.00 C ATOM 899 C GLY A 68 113.744 -10.452 8.122 1.00 0.00 C ATOM 900 O GLY A 68 114.609 -10.632 7.288 1.00 0.00 O ATOM 0 H GLY A 68 114.921 -8.397 7.245 1.00 0.00 H new ATOM 0 HA2 GLY A 68 113.258 -8.927 9.579 1.00 0.00 H new ATOM 0 HA3 GLY A 68 112.301 -8.839 8.114 1.00 0.00 H new ATOM 903 N PRO A 69 113.126 -11.424 8.756 1.00 0.00 N ATOM 904 CA PRO A 69 113.457 -12.847 8.482 1.00 0.00 C ATOM 905 C PRO A 69 112.915 -13.275 7.114 1.00 0.00 C ATOM 906 O PRO A 69 112.252 -12.515 6.435 1.00 0.00 O ATOM 907 CB PRO A 69 112.752 -13.604 9.606 1.00 0.00 C ATOM 908 CG PRO A 69 111.631 -12.712 10.029 1.00 0.00 C ATOM 909 CD PRO A 69 112.073 -11.294 9.775 1.00 0.00 C ATOM 0 HA PRO A 69 114.530 -13.036 8.454 1.00 0.00 H new ATOM 0 HB2 PRO A 69 112.380 -14.568 9.260 1.00 0.00 H new ATOM 0 HB3 PRO A 69 113.432 -13.804 10.434 1.00 0.00 H new ATOM 0 HG2 PRO A 69 110.725 -12.939 9.467 1.00 0.00 H new ATOM 0 HG3 PRO A 69 111.398 -12.860 11.084 1.00 0.00 H new ATOM 0 HD2 PRO A 69 111.248 -10.677 9.419 1.00 0.00 H new ATOM 0 HD3 PRO A 69 112.453 -10.826 10.683 1.00 0.00 H new ATOM 914 N ALA A 70 113.186 -14.492 6.712 1.00 0.00 N ATOM 915 CA ALA A 70 112.678 -14.973 5.391 1.00 0.00 C ATOM 916 C ALA A 70 112.611 -16.503 5.357 1.00 0.00 C ATOM 917 O ALA A 70 113.416 -17.181 5.968 1.00 0.00 O ATOM 918 CB ALA A 70 113.691 -14.460 4.368 1.00 0.00 C ATOM 0 H ALA A 70 113.735 -15.171 7.240 1.00 0.00 H new ATOM 0 HA ALA A 70 111.669 -14.614 5.189 1.00 0.00 H new ATOM 0 HB1 ALA A 70 113.389 -14.772 3.368 1.00 0.00 H new ATOM 0 HB2 ALA A 70 113.732 -13.372 4.411 1.00 0.00 H new ATOM 0 HB3 ALA A 70 114.676 -14.870 4.594 1.00 0.00 H new ATOM 924 N TYR A 71 111.665 -17.051 4.634 1.00 0.00 N ATOM 925 CA TYR A 71 111.553 -18.536 4.546 1.00 0.00 C ATOM 926 C TYR A 71 111.739 -18.981 3.093 1.00 0.00 C ATOM 927 O TYR A 71 111.181 -18.398 2.184 1.00 0.00 O ATOM 928 CB TYR A 71 110.141 -18.862 5.035 1.00 0.00 C ATOM 929 CG TYR A 71 110.006 -18.462 6.486 1.00 0.00 C ATOM 930 CD1 TYR A 71 110.485 -19.310 7.492 1.00 0.00 C ATOM 931 CD2 TYR A 71 109.404 -17.244 6.824 1.00 0.00 C ATOM 932 CE1 TYR A 71 110.361 -18.939 8.836 1.00 0.00 C ATOM 933 CE2 TYR A 71 109.281 -16.874 8.168 1.00 0.00 C ATOM 934 CZ TYR A 71 109.758 -17.722 9.175 1.00 0.00 C ATOM 935 OH TYR A 71 109.637 -17.358 10.500 1.00 0.00 O ATOM 0 H TYR A 71 110.967 -16.532 4.102 1.00 0.00 H new ATOM 0 HA TYR A 71 112.310 -19.048 5.140 1.00 0.00 H new ATOM 0 HB2 TYR A 71 109.404 -18.333 4.431 1.00 0.00 H new ATOM 0 HB3 TYR A 71 109.942 -19.927 4.920 1.00 0.00 H new ATOM 0 HD1 TYR A 71 110.950 -20.249 7.231 1.00 0.00 H new ATOM 0 HD2 TYR A 71 109.035 -16.590 6.048 1.00 0.00 H new ATOM 0 HE1 TYR A 71 110.731 -19.592 9.612 1.00 0.00 H new ATOM 0 HE2 TYR A 71 108.818 -15.934 8.429 1.00 0.00 H new ATOM 0 HH TYR A 71 109.197 -16.485 10.560 1.00 0.00 H new ATOM 944 N ARG A 72 112.521 -20.003 2.869 1.00 0.00 N ATOM 945 CA ARG A 72 112.755 -20.482 1.471 1.00 0.00 C ATOM 946 C ARG A 72 111.485 -21.110 0.893 1.00 0.00 C ATOM 947 O ARG A 72 110.666 -21.650 1.609 1.00 0.00 O ATOM 948 CB ARG A 72 113.862 -21.532 1.592 1.00 0.00 C ATOM 949 CG ARG A 72 114.284 -21.993 0.195 1.00 0.00 C ATOM 950 CD ARG A 72 115.350 -23.084 0.316 1.00 0.00 C ATOM 951 NE ARG A 72 115.770 -23.369 -1.083 1.00 0.00 N ATOM 952 CZ ARG A 72 115.093 -24.215 -1.808 1.00 0.00 C ATOM 953 NH1 ARG A 72 114.974 -25.456 -1.424 1.00 0.00 N ATOM 954 NH2 ARG A 72 114.534 -23.820 -2.920 1.00 0.00 N ATOM 0 H ARG A 72 113.010 -20.529 3.593 1.00 0.00 H new ATOM 0 HA ARG A 72 113.031 -19.666 0.803 1.00 0.00 H new ATOM 0 HB2 ARG A 72 114.718 -21.114 2.122 1.00 0.00 H new ATOM 0 HB3 ARG A 72 113.509 -22.382 2.176 1.00 0.00 H new ATOM 0 HG2 ARG A 72 113.420 -22.373 -0.350 1.00 0.00 H new ATOM 0 HG3 ARG A 72 114.675 -21.150 -0.375 1.00 0.00 H new ATOM 0 HD2 ARG A 72 116.192 -22.747 0.920 1.00 0.00 H new ATOM 0 HD3 ARG A 72 114.949 -23.976 0.797 1.00 0.00 H new ATOM 0 HE ARG A 72 116.588 -22.902 -1.475 1.00 0.00 H new ATOM 0 HH11 ARG A 72 115.411 -25.765 -0.556 1.00 0.00 H new ATOM 0 HH12 ARG A 72 114.444 -26.117 -1.992 1.00 0.00 H new ATOM 0 HH21 ARG A 72 114.627 -22.850 -3.221 1.00 0.00 H new ATOM 0 HH22 ARG A 72 114.004 -24.482 -3.488 1.00 0.00 H new ATOM 965 N ILE A 73 111.323 -21.039 -0.404 1.00 0.00 N ATOM 966 CA ILE A 73 110.113 -21.628 -1.050 1.00 0.00 C ATOM 967 C ILE A 73 110.095 -23.148 -0.849 1.00 0.00 C ATOM 968 O ILE A 73 110.495 -23.907 -1.710 1.00 0.00 O ATOM 969 CB ILE A 73 110.237 -21.270 -2.538 1.00 0.00 C ATOM 970 CG1 ILE A 73 109.046 -21.851 -3.308 1.00 0.00 C ATOM 971 CG2 ILE A 73 111.541 -21.839 -3.111 1.00 0.00 C ATOM 972 CD1 ILE A 73 108.971 -21.209 -4.694 1.00 0.00 C ATOM 0 H ILE A 73 111.981 -20.596 -1.046 1.00 0.00 H new ATOM 0 HA ILE A 73 109.186 -21.245 -0.623 1.00 0.00 H new ATOM 0 HB ILE A 73 110.245 -20.185 -2.641 1.00 0.00 H new ATOM 0 HG12 ILE A 73 109.152 -22.932 -3.402 1.00 0.00 H new ATOM 0 HG13 ILE A 73 108.121 -21.668 -2.760 1.00 0.00 H new ATOM 0 HG21 ILE A 73 111.618 -21.579 -4.167 1.00 0.00 H new ATOM 0 HG22 ILE A 73 112.390 -21.419 -2.571 1.00 0.00 H new ATOM 0 HG23 ILE A 73 111.543 -22.924 -3.003 1.00 0.00 H new ATOM 0 HD11 ILE A 73 108.124 -21.623 -5.241 1.00 0.00 H new ATOM 0 HD12 ILE A 73 108.844 -20.131 -4.589 1.00 0.00 H new ATOM 0 HD13 ILE A 73 109.891 -21.415 -5.241 1.00 0.00 H new ATOM 983 N ASN A 74 109.631 -23.590 0.289 1.00 0.00 N ATOM 984 CA ASN A 74 109.581 -25.059 0.566 1.00 0.00 C ATOM 985 C ASN A 74 108.793 -25.785 -0.528 1.00 0.00 C ATOM 986 O ASN A 74 109.095 -26.910 -0.878 1.00 0.00 O ATOM 987 CB ASN A 74 108.867 -25.188 1.913 1.00 0.00 C ATOM 988 CG ASN A 74 109.724 -24.557 3.013 1.00 0.00 C ATOM 989 OD1 ASN A 74 110.912 -24.363 2.842 1.00 0.00 O ATOM 990 ND2 ASN A 74 109.168 -24.225 4.147 1.00 0.00 N ATOM 0 H ASN A 74 109.283 -22.997 1.042 1.00 0.00 H new ATOM 0 HA ASN A 74 110.576 -25.504 0.586 1.00 0.00 H new ATOM 0 HB2 ASN A 74 107.895 -24.697 1.869 1.00 0.00 H new ATOM 0 HB3 ASN A 74 108.683 -26.238 2.139 1.00 0.00 H new ATOM 0 HD21 ASN A 74 109.730 -23.804 4.887 1.00 0.00 H new ATOM 0 HD22 ASN A 74 108.172 -24.387 4.293 1.00 0.00 H new ATOM 996 N ASP A 75 107.785 -25.150 -1.069 1.00 0.00 N ATOM 997 CA ASP A 75 106.979 -25.805 -2.140 1.00 0.00 C ATOM 998 C ASP A 75 106.130 -24.771 -2.889 1.00 0.00 C ATOM 999 O ASP A 75 105.973 -24.843 -4.092 1.00 0.00 O ATOM 1000 CB ASP A 75 106.081 -26.803 -1.404 1.00 0.00 C ATOM 1001 CG ASP A 75 105.308 -27.657 -2.417 1.00 0.00 C ATOM 1002 OD1 ASP A 75 105.716 -27.701 -3.567 1.00 0.00 O ATOM 1003 OD2 ASP A 75 104.321 -28.255 -2.023 1.00 0.00 O ATOM 0 H ASP A 75 107.486 -24.208 -0.815 1.00 0.00 H new ATOM 0 HA ASP A 75 107.609 -26.290 -2.886 1.00 0.00 H new ATOM 0 HB2 ASP A 75 106.685 -27.444 -0.761 1.00 0.00 H new ATOM 0 HB3 ASP A 75 105.384 -26.270 -0.758 1.00 0.00 H new ATOM 1007 N TRP A 76 105.574 -23.817 -2.187 1.00 0.00 N ATOM 1008 CA TRP A 76 104.727 -22.788 -2.861 1.00 0.00 C ATOM 1009 C TRP A 76 105.556 -21.550 -3.222 1.00 0.00 C ATOM 1010 O TRP A 76 105.810 -21.282 -4.380 1.00 0.00 O ATOM 1011 CB TRP A 76 103.646 -22.434 -1.837 1.00 0.00 C ATOM 1012 CG TRP A 76 102.796 -23.637 -1.554 1.00 0.00 C ATOM 1013 CD1 TRP A 76 102.384 -24.537 -2.480 1.00 0.00 C ATOM 1014 CD2 TRP A 76 102.247 -24.083 -0.280 1.00 0.00 C ATOM 1015 NE1 TRP A 76 101.620 -25.505 -1.853 1.00 0.00 N ATOM 1016 CE2 TRP A 76 101.507 -25.268 -0.498 1.00 0.00 C ATOM 1017 CE3 TRP A 76 102.320 -23.579 1.031 1.00 0.00 C ATOM 1018 CZ2 TRP A 76 100.861 -25.931 0.547 1.00 0.00 C ATOM 1019 CZ3 TRP A 76 101.670 -24.242 2.085 1.00 0.00 C ATOM 1020 CH2 TRP A 76 100.942 -25.416 1.844 1.00 0.00 C ATOM 0 H TRP A 76 105.670 -23.706 -1.178 1.00 0.00 H new ATOM 0 HA TRP A 76 104.303 -23.157 -3.795 1.00 0.00 H new ATOM 0 HB2 TRP A 76 104.108 -22.080 -0.916 1.00 0.00 H new ATOM 0 HB3 TRP A 76 103.026 -21.621 -2.216 1.00 0.00 H new ATOM 0 HD1 TRP A 76 102.614 -24.504 -3.535 1.00 0.00 H new ATOM 0 HE1 TRP A 76 101.193 -26.297 -2.333 1.00 0.00 H new ATOM 0 HE3 TRP A 76 102.879 -22.677 1.229 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 100.303 -26.835 0.355 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 101.731 -23.845 3.088 1.00 0.00 H new ATOM 0 HH2 TRP A 76 100.445 -25.921 2.659 1.00 0.00 H new ATOM 1030 N ALA A 77 105.975 -20.792 -2.240 1.00 0.00 N ATOM 1031 CA ALA A 77 106.781 -19.567 -2.531 1.00 0.00 C ATOM 1032 C ALA A 77 107.550 -19.121 -1.283 1.00 0.00 C ATOM 1033 O ALA A 77 107.350 -19.642 -0.202 1.00 0.00 O ATOM 1034 CB ALA A 77 105.757 -18.507 -2.938 1.00 0.00 C ATOM 0 H ALA A 77 105.794 -20.968 -1.252 1.00 0.00 H new ATOM 0 HA ALA A 77 107.523 -19.740 -3.311 1.00 0.00 H new ATOM 0 HB1 ALA A 77 106.271 -17.574 -3.169 1.00 0.00 H new ATOM 0 HB2 ALA A 77 105.211 -18.847 -3.818 1.00 0.00 H new ATOM 0 HB3 ALA A 77 105.058 -18.343 -2.118 1.00 0.00 H new ATOM 1040 N SER A 78 108.423 -18.156 -1.426 1.00 0.00 N ATOM 1041 CA SER A 78 109.204 -17.669 -0.247 1.00 0.00 C ATOM 1042 C SER A 78 108.521 -16.439 0.355 1.00 0.00 C ATOM 1043 O SER A 78 107.988 -15.611 -0.358 1.00 0.00 O ATOM 1044 CB SER A 78 110.577 -17.299 -0.806 1.00 0.00 C ATOM 1045 OG SER A 78 111.427 -16.895 0.258 1.00 0.00 O ATOM 0 H SER A 78 108.629 -17.684 -2.307 1.00 0.00 H new ATOM 0 HA SER A 78 109.277 -18.417 0.543 1.00 0.00 H new ATOM 0 HB2 SER A 78 111.011 -18.151 -1.329 1.00 0.00 H new ATOM 0 HB3 SER A 78 110.480 -16.494 -1.534 1.00 0.00 H new ATOM 0 HG SER A 78 111.076 -17.238 1.106 1.00 0.00 H new ATOM 1050 N ILE A 79 108.526 -16.314 1.658 1.00 0.00 N ATOM 1051 CA ILE A 79 107.866 -15.135 2.298 1.00 0.00 C ATOM 1052 C ILE A 79 108.789 -14.510 3.349 1.00 0.00 C ATOM 1053 O ILE A 79 109.514 -15.203 4.037 1.00 0.00 O ATOM 1054 CB ILE A 79 106.596 -15.695 2.944 1.00 0.00 C ATOM 1055 CG1 ILE A 79 105.810 -14.555 3.598 1.00 0.00 C ATOM 1056 CG2 ILE A 79 106.965 -16.734 4.005 1.00 0.00 C ATOM 1057 CD1 ILE A 79 104.376 -15.014 3.871 1.00 0.00 C ATOM 0 H ILE A 79 108.957 -16.975 2.305 1.00 0.00 H new ATOM 0 HA ILE A 79 107.640 -14.347 1.580 1.00 0.00 H new ATOM 0 HB ILE A 79 105.984 -16.169 2.177 1.00 0.00 H new ATOM 0 HG12 ILE A 79 106.291 -14.255 4.529 1.00 0.00 H new ATOM 0 HG13 ILE A 79 105.806 -13.681 2.946 1.00 0.00 H new ATOM 0 HG21 ILE A 79 106.056 -17.128 4.460 1.00 0.00 H new ATOM 0 HG22 ILE A 79 107.520 -17.548 3.539 1.00 0.00 H new ATOM 0 HG23 ILE A 79 107.582 -16.267 4.773 1.00 0.00 H new ATOM 0 HD11 ILE A 79 103.817 -14.203 4.337 1.00 0.00 H new ATOM 0 HD12 ILE A 79 103.898 -15.292 2.932 1.00 0.00 H new ATOM 0 HD13 ILE A 79 104.391 -15.875 4.540 1.00 0.00 H new ATOM 1068 N TYR A 80 108.762 -13.209 3.483 1.00 0.00 N ATOM 1069 CA TYR A 80 109.633 -12.549 4.497 1.00 0.00 C ATOM 1070 C TYR A 80 108.913 -11.359 5.145 1.00 0.00 C ATOM 1071 O TYR A 80 108.037 -10.750 4.555 1.00 0.00 O ATOM 1072 CB TYR A 80 110.875 -12.095 3.715 1.00 0.00 C ATOM 1073 CG TYR A 80 110.511 -10.997 2.740 1.00 0.00 C ATOM 1074 CD1 TYR A 80 109.973 -11.321 1.489 1.00 0.00 C ATOM 1075 CD2 TYR A 80 110.713 -9.656 3.087 1.00 0.00 C ATOM 1076 CE1 TYR A 80 109.637 -10.306 0.585 1.00 0.00 C ATOM 1077 CE2 TYR A 80 110.378 -8.640 2.183 1.00 0.00 C ATOM 1078 CZ TYR A 80 109.840 -8.966 0.932 1.00 0.00 C ATOM 1079 OH TYR A 80 109.510 -7.965 0.041 1.00 0.00 O ATOM 0 H TYR A 80 108.176 -12.578 2.936 1.00 0.00 H new ATOM 0 HA TYR A 80 109.895 -13.220 5.316 1.00 0.00 H new ATOM 0 HB2 TYR A 80 111.638 -11.738 4.407 1.00 0.00 H new ATOM 0 HB3 TYR A 80 111.303 -12.941 3.177 1.00 0.00 H new ATOM 0 HD1 TYR A 80 109.817 -12.355 1.221 1.00 0.00 H new ATOM 0 HD2 TYR A 80 111.127 -9.405 4.052 1.00 0.00 H new ATOM 0 HE1 TYR A 80 109.221 -10.557 -0.380 1.00 0.00 H new ATOM 0 HE2 TYR A 80 110.535 -7.605 2.451 1.00 0.00 H new ATOM 0 HH TYR A 80 109.713 -7.093 0.439 1.00 0.00 H new ATOM 1088 N GLY A 81 109.292 -11.023 6.352 1.00 0.00 N ATOM 1089 CA GLY A 81 108.656 -9.871 7.056 1.00 0.00 C ATOM 1090 C GLY A 81 109.542 -8.639 6.882 1.00 0.00 C ATOM 1091 O GLY A 81 110.706 -8.751 6.544 1.00 0.00 O ATOM 0 H GLY A 81 110.020 -11.501 6.883 1.00 0.00 H new ATOM 0 HA2 GLY A 81 107.662 -9.682 6.650 1.00 0.00 H new ATOM 0 HA3 GLY A 81 108.529 -10.099 8.114 1.00 0.00 H new ATOM 1094 N VAL A 82 109.011 -7.463 7.099 1.00 0.00 N ATOM 1095 CA VAL A 82 109.844 -6.238 6.929 1.00 0.00 C ATOM 1096 C VAL A 82 109.655 -5.265 8.097 1.00 0.00 C ATOM 1097 O VAL A 82 108.551 -4.946 8.491 1.00 0.00 O ATOM 1098 CB VAL A 82 109.358 -5.600 5.624 1.00 0.00 C ATOM 1099 CG1 VAL A 82 110.205 -4.365 5.309 1.00 0.00 C ATOM 1100 CG2 VAL A 82 109.489 -6.605 4.476 1.00 0.00 C ATOM 0 H VAL A 82 108.045 -7.300 7.384 1.00 0.00 H new ATOM 0 HA VAL A 82 110.906 -6.483 6.903 1.00 0.00 H new ATOM 0 HB VAL A 82 108.313 -5.310 5.737 1.00 0.00 H new ATOM 0 HG11 VAL A 82 109.857 -3.913 4.380 1.00 0.00 H new ATOM 0 HG12 VAL A 82 110.112 -3.644 6.121 1.00 0.00 H new ATOM 0 HG13 VAL A 82 111.249 -4.658 5.201 1.00 0.00 H new ATOM 0 HG21 VAL A 82 109.142 -6.147 3.550 1.00 0.00 H new ATOM 0 HG22 VAL A 82 110.533 -6.899 4.367 1.00 0.00 H new ATOM 0 HG23 VAL A 82 108.885 -7.486 4.693 1.00 0.00 H new ATOM 1110 N VAL A 83 110.741 -4.777 8.621 1.00 0.00 N ATOM 1111 CA VAL A 83 110.692 -3.789 9.739 1.00 0.00 C ATOM 1112 C VAL A 83 111.731 -2.715 9.434 1.00 0.00 C ATOM 1113 O VAL A 83 112.764 -3.025 8.884 1.00 0.00 O ATOM 1114 CB VAL A 83 111.068 -4.575 10.998 1.00 0.00 C ATOM 1115 CG1 VAL A 83 111.017 -3.645 12.213 1.00 0.00 C ATOM 1116 CG2 VAL A 83 110.078 -5.724 11.199 1.00 0.00 C ATOM 0 H VAL A 83 111.683 -5.025 8.317 1.00 0.00 H new ATOM 0 HA VAL A 83 109.720 -3.312 9.867 1.00 0.00 H new ATOM 0 HB VAL A 83 112.075 -4.977 10.886 1.00 0.00 H new ATOM 0 HG11 VAL A 83 111.284 -4.203 13.110 1.00 0.00 H new ATOM 0 HG12 VAL A 83 111.721 -2.825 12.073 1.00 0.00 H new ATOM 0 HG13 VAL A 83 110.009 -3.244 12.322 1.00 0.00 H new ATOM 0 HG21 VAL A 83 110.346 -6.283 12.095 1.00 0.00 H new ATOM 0 HG22 VAL A 83 109.071 -5.322 11.310 1.00 0.00 H new ATOM 0 HG23 VAL A 83 110.110 -6.387 10.335 1.00 0.00 H new ATOM 1126 N GLY A 84 111.502 -1.471 9.778 1.00 0.00 N ATOM 1127 CA GLY A 84 112.529 -0.454 9.473 1.00 0.00 C ATOM 1128 C GLY A 84 112.009 0.952 9.730 1.00 0.00 C ATOM 1129 O GLY A 84 111.009 1.160 10.387 1.00 0.00 O ATOM 0 H GLY A 84 110.663 -1.130 10.247 1.00 0.00 H new ATOM 0 HA2 GLY A 84 113.414 -0.634 10.083 1.00 0.00 H new ATOM 0 HA3 GLY A 84 112.836 -0.546 8.431 1.00 0.00 H new ATOM 1132 N VAL A 85 112.729 1.913 9.237 1.00 0.00 N ATOM 1133 CA VAL A 85 112.352 3.339 9.455 1.00 0.00 C ATOM 1134 C VAL A 85 112.432 4.147 8.155 1.00 0.00 C ATOM 1135 O VAL A 85 112.828 3.654 7.117 1.00 0.00 O ATOM 1136 CB VAL A 85 113.364 3.863 10.478 1.00 0.00 C ATOM 1137 CG1 VAL A 85 113.257 3.050 11.768 1.00 0.00 C ATOM 1138 CG2 VAL A 85 114.783 3.728 9.918 1.00 0.00 C ATOM 0 H VAL A 85 113.575 1.774 8.684 1.00 0.00 H new ATOM 0 HA VAL A 85 111.323 3.432 9.803 1.00 0.00 H new ATOM 0 HB VAL A 85 113.151 4.912 10.685 1.00 0.00 H new ATOM 0 HG11 VAL A 85 113.978 3.424 12.495 1.00 0.00 H new ATOM 0 HG12 VAL A 85 112.250 3.143 12.175 1.00 0.00 H new ATOM 0 HG13 VAL A 85 113.467 2.002 11.556 1.00 0.00 H new ATOM 0 HG21 VAL A 85 115.500 4.102 10.649 1.00 0.00 H new ATOM 0 HG22 VAL A 85 114.993 2.679 9.708 1.00 0.00 H new ATOM 0 HG23 VAL A 85 114.868 4.307 8.998 1.00 0.00 H new ATOM 1148 N GLY A 86 112.063 5.398 8.228 1.00 0.00 N ATOM 1149 CA GLY A 86 112.116 6.279 7.023 1.00 0.00 C ATOM 1150 C GLY A 86 112.607 7.669 7.431 1.00 0.00 C ATOM 1151 O GLY A 86 112.300 8.147 8.506 1.00 0.00 O ATOM 0 H GLY A 86 111.725 5.851 9.077 1.00 0.00 H new ATOM 0 HA2 GLY A 86 112.783 5.851 6.275 1.00 0.00 H new ATOM 0 HA3 GLY A 86 111.129 6.349 6.567 1.00 0.00 H new ATOM 1154 N TYR A 87 113.360 8.330 6.583 1.00 0.00 N ATOM 1155 CA TYR A 87 113.848 9.694 6.941 1.00 0.00 C ATOM 1156 C TYR A 87 113.468 10.682 5.842 1.00 0.00 C ATOM 1157 O TYR A 87 113.671 10.429 4.669 1.00 0.00 O ATOM 1158 CB TYR A 87 115.369 9.575 7.054 1.00 0.00 C ATOM 1159 CG TYR A 87 115.734 8.615 8.160 1.00 0.00 C ATOM 1160 CD1 TYR A 87 115.796 9.064 9.484 1.00 0.00 C ATOM 1161 CD2 TYR A 87 116.020 7.277 7.861 1.00 0.00 C ATOM 1162 CE1 TYR A 87 116.147 8.178 10.508 1.00 0.00 C ATOM 1163 CE2 TYR A 87 116.368 6.390 8.886 1.00 0.00 C ATOM 1164 CZ TYR A 87 116.431 6.840 10.210 1.00 0.00 C ATOM 1165 OH TYR A 87 116.781 5.967 11.219 1.00 0.00 O ATOM 0 H TYR A 87 113.654 7.986 5.669 1.00 0.00 H new ATOM 0 HA TYR A 87 113.409 10.055 7.871 1.00 0.00 H new ATOM 0 HB2 TYR A 87 115.786 9.228 6.108 1.00 0.00 H new ATOM 0 HB3 TYR A 87 115.804 10.554 7.254 1.00 0.00 H new ATOM 0 HD1 TYR A 87 115.573 10.095 9.715 1.00 0.00 H new ATOM 0 HD2 TYR A 87 115.972 6.930 6.839 1.00 0.00 H new ATOM 0 HE1 TYR A 87 116.199 8.526 11.529 1.00 0.00 H new ATOM 0 HE2 TYR A 87 116.588 5.358 8.655 1.00 0.00 H new ATOM 0 HH TYR A 87 116.049 5.906 11.868 1.00 0.00 H new ATOM 1174 N GLY A 88 112.922 11.808 6.211 1.00 0.00 N ATOM 1175 CA GLY A 88 112.531 12.817 5.187 1.00 0.00 C ATOM 1176 C GLY A 88 113.463 14.023 5.289 1.00 0.00 C ATOM 1177 O GLY A 88 113.659 14.574 6.359 1.00 0.00 O ATOM 0 H GLY A 88 112.730 12.073 7.177 1.00 0.00 H new ATOM 0 HA2 GLY A 88 112.588 12.381 4.189 1.00 0.00 H new ATOM 0 HA3 GLY A 88 111.497 13.127 5.341 1.00 0.00 H new ATOM 1180 N LYS A 89 114.035 14.440 4.188 1.00 0.00 N ATOM 1181 CA LYS A 89 114.950 15.618 4.226 1.00 0.00 C ATOM 1182 C LYS A 89 114.508 16.647 3.185 1.00 0.00 C ATOM 1183 O LYS A 89 114.239 16.310 2.051 1.00 0.00 O ATOM 1184 CB LYS A 89 116.334 15.066 3.883 1.00 0.00 C ATOM 1185 CG LYS A 89 117.382 16.164 4.082 1.00 0.00 C ATOM 1186 CD LYS A 89 118.760 15.639 3.675 1.00 0.00 C ATOM 1187 CE LYS A 89 119.825 16.693 3.993 1.00 0.00 C ATOM 1188 NZ LYS A 89 120.952 15.932 4.601 1.00 0.00 N ATOM 0 H LYS A 89 113.908 14.017 3.269 1.00 0.00 H new ATOM 0 HA LYS A 89 114.947 16.116 5.196 1.00 0.00 H new ATOM 0 HB2 LYS A 89 116.564 14.209 4.517 1.00 0.00 H new ATOM 0 HB3 LYS A 89 116.352 14.713 2.852 1.00 0.00 H new ATOM 0 HG2 LYS A 89 117.124 17.039 3.485 1.00 0.00 H new ATOM 0 HG3 LYS A 89 117.396 16.482 5.124 1.00 0.00 H new ATOM 0 HD2 LYS A 89 118.980 14.713 4.207 1.00 0.00 H new ATOM 0 HD3 LYS A 89 118.772 15.405 2.610 1.00 0.00 H new ATOM 0 HE2 LYS A 89 120.143 17.217 3.092 1.00 0.00 H new ATOM 0 HE3 LYS A 89 119.441 17.447 4.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 121.721 16.588 4.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 120.621 15.450 5.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 121.301 15.227 3.921 1.00 0.00 H new ATOM 1198 N PHE A 90 114.428 17.895 3.562 1.00 0.00 N ATOM 1199 CA PHE A 90 113.998 18.946 2.594 1.00 0.00 C ATOM 1200 C PHE A 90 114.956 20.141 2.640 1.00 0.00 C ATOM 1201 O PHE A 90 115.754 20.272 3.547 1.00 0.00 O ATOM 1202 CB PHE A 90 112.590 19.353 3.045 1.00 0.00 C ATOM 1203 CG PHE A 90 112.641 19.923 4.444 1.00 0.00 C ATOM 1204 CD1 PHE A 90 112.590 19.068 5.552 1.00 0.00 C ATOM 1205 CD2 PHE A 90 112.739 21.307 4.632 1.00 0.00 C ATOM 1206 CE1 PHE A 90 112.637 19.597 6.847 1.00 0.00 C ATOM 1207 CE2 PHE A 90 112.787 21.836 5.928 1.00 0.00 C ATOM 1208 CZ PHE A 90 112.735 20.980 7.035 1.00 0.00 C ATOM 0 H PHE A 90 114.642 18.233 4.500 1.00 0.00 H new ATOM 0 HA PHE A 90 114.003 18.586 1.565 1.00 0.00 H new ATOM 0 HB2 PHE A 90 112.178 20.091 2.357 1.00 0.00 H new ATOM 0 HB3 PHE A 90 111.927 18.488 3.019 1.00 0.00 H new ATOM 0 HD1 PHE A 90 112.514 18.000 5.407 1.00 0.00 H new ATOM 0 HD2 PHE A 90 112.778 21.967 3.778 1.00 0.00 H new ATOM 0 HE1 PHE A 90 112.598 18.937 7.701 1.00 0.00 H new ATOM 0 HE2 PHE A 90 112.864 22.903 6.073 1.00 0.00 H new ATOM 0 HZ PHE A 90 112.771 21.388 8.035 1.00 0.00 H new ATOM 1217 N GLN A 91 114.882 21.007 1.665 1.00 0.00 N ATOM 1218 CA GLN A 91 115.788 22.193 1.646 1.00 0.00 C ATOM 1219 C GLN A 91 115.020 23.456 2.042 1.00 0.00 C ATOM 1220 O GLN A 91 113.847 23.598 1.757 1.00 0.00 O ATOM 1221 CB GLN A 91 116.279 22.294 0.200 1.00 0.00 C ATOM 1222 CG GLN A 91 117.098 21.049 -0.148 1.00 0.00 C ATOM 1223 CD GLN A 91 117.551 21.122 -1.609 1.00 0.00 C ATOM 1224 OE1 GLN A 91 116.997 21.868 -2.394 1.00 0.00 O ATOM 1225 NE2 GLN A 91 118.541 20.373 -2.009 1.00 0.00 N ATOM 0 H GLN A 91 114.233 20.945 0.880 1.00 0.00 H new ATOM 0 HA GLN A 91 116.613 22.092 2.351 1.00 0.00 H new ATOM 0 HB2 GLN A 91 115.430 22.386 -0.478 1.00 0.00 H new ATOM 0 HB3 GLN A 91 116.887 23.190 0.073 1.00 0.00 H new ATOM 0 HG2 GLN A 91 117.965 20.977 0.509 1.00 0.00 H new ATOM 0 HG3 GLN A 91 116.500 20.152 0.013 1.00 0.00 H new ATOM 0 HE21 GLN A 91 119.006 19.747 -1.351 1.00 0.00 H new ATOM 0 HE22 GLN A 91 118.851 20.413 -2.980 1.00 0.00 H new ATOM 1232 N THR A 92 115.680 24.374 2.697 1.00 0.00 N ATOM 1233 CA THR A 92 115.005 25.636 3.120 1.00 0.00 C ATOM 1234 C THR A 92 115.025 26.652 1.975 1.00 0.00 C ATOM 1235 O THR A 92 115.902 26.634 1.134 1.00 0.00 O ATOM 1236 CB THR A 92 115.827 26.145 4.304 1.00 0.00 C ATOM 1237 OG1 THR A 92 115.952 25.112 5.271 1.00 0.00 O ATOM 1238 CG2 THR A 92 115.131 27.354 4.933 1.00 0.00 C ATOM 0 H THR A 92 116.663 24.303 2.959 1.00 0.00 H new ATOM 0 HA THR A 92 113.960 25.479 3.387 1.00 0.00 H new ATOM 0 HB THR A 92 116.817 26.441 3.957 1.00 0.00 H new ATOM 0 HG1 THR A 92 116.480 25.437 6.030 1.00 0.00 H new ATOM 0 HG21 THR A 92 115.720 27.714 5.777 1.00 0.00 H new ATOM 0 HG22 THR A 92 115.037 28.147 4.191 1.00 0.00 H new ATOM 0 HG23 THR A 92 114.140 27.063 5.280 1.00 0.00 H new ATOM 1246 N THR A 93 114.062 27.537 1.938 1.00 0.00 N ATOM 1247 CA THR A 93 114.022 28.558 0.846 1.00 0.00 C ATOM 1248 C THR A 93 115.321 29.369 0.834 1.00 0.00 C ATOM 1249 O THR A 93 115.903 29.639 1.866 1.00 0.00 O ATOM 1250 CB THR A 93 112.830 29.461 1.183 1.00 0.00 C ATOM 1251 OG1 THR A 93 111.666 28.663 1.343 1.00 0.00 O ATOM 1252 CG2 THR A 93 112.608 30.469 0.053 1.00 0.00 C ATOM 0 H THR A 93 113.302 27.597 2.616 1.00 0.00 H new ATOM 0 HA THR A 93 113.920 28.102 -0.139 1.00 0.00 H new ATOM 0 HB THR A 93 113.035 30.000 2.108 1.00 0.00 H new ATOM 0 HG1 THR A 93 111.762 27.836 0.826 1.00 0.00 H new ATOM 0 HG21 THR A 93 111.760 31.108 0.297 1.00 0.00 H new ATOM 0 HG22 THR A 93 113.501 31.082 -0.069 1.00 0.00 H new ATOM 0 HG23 THR A 93 112.405 29.936 -0.876 1.00 0.00 H new ATOM 1260 N GLU A 94 115.786 29.744 -0.333 1.00 0.00 N ATOM 1261 CA GLU A 94 117.059 30.527 -0.438 1.00 0.00 C ATOM 1262 C GLU A 94 118.206 29.767 0.240 1.00 0.00 C ATOM 1263 O GLU A 94 117.996 28.758 0.886 1.00 0.00 O ATOM 1264 CB GLU A 94 116.790 31.857 0.275 1.00 0.00 C ATOM 1265 CG GLU A 94 115.649 32.596 -0.432 1.00 0.00 C ATOM 1266 CD GLU A 94 115.418 33.959 0.230 1.00 0.00 C ATOM 1267 OE1 GLU A 94 115.963 34.185 1.300 1.00 0.00 O ATOM 1268 OE2 GLU A 94 114.695 34.757 -0.346 1.00 0.00 O ATOM 0 H GLU A 94 115.335 29.540 -1.225 1.00 0.00 H new ATOM 0 HA GLU A 94 117.353 30.687 -1.475 1.00 0.00 H new ATOM 0 HB2 GLU A 94 116.529 31.676 1.318 1.00 0.00 H new ATOM 0 HB3 GLU A 94 117.691 32.471 0.274 1.00 0.00 H new ATOM 0 HG2 GLU A 94 115.890 32.731 -1.486 1.00 0.00 H new ATOM 0 HG3 GLU A 94 114.737 32.001 -0.387 1.00 0.00 H new ATOM 1273 N TYR A 95 119.416 30.237 0.086 1.00 0.00 N ATOM 1274 CA TYR A 95 120.579 29.534 0.710 1.00 0.00 C ATOM 1275 C TYR A 95 120.428 29.500 2.242 1.00 0.00 C ATOM 1276 O TYR A 95 120.451 30.533 2.880 1.00 0.00 O ATOM 1277 CB TYR A 95 121.810 30.359 0.314 1.00 0.00 C ATOM 1278 CG TYR A 95 122.845 29.458 -0.319 1.00 0.00 C ATOM 1279 CD1 TYR A 95 123.563 28.552 0.473 1.00 0.00 C ATOM 1280 CD2 TYR A 95 123.087 29.528 -1.696 1.00 0.00 C ATOM 1281 CE1 TYR A 95 124.521 27.717 -0.115 1.00 0.00 C ATOM 1282 CE2 TYR A 95 124.046 28.692 -2.283 1.00 0.00 C ATOM 1283 CZ TYR A 95 124.763 27.787 -1.492 1.00 0.00 C ATOM 1284 OH TYR A 95 125.708 26.964 -2.070 1.00 0.00 O ATOM 0 H TYR A 95 119.651 31.076 -0.444 1.00 0.00 H new ATOM 0 HA TYR A 95 120.656 28.500 0.375 1.00 0.00 H new ATOM 0 HB2 TYR A 95 121.523 31.146 -0.384 1.00 0.00 H new ATOM 0 HB3 TYR A 95 122.229 30.849 1.193 1.00 0.00 H new ATOM 0 HD1 TYR A 95 123.378 28.498 1.536 1.00 0.00 H new ATOM 0 HD2 TYR A 95 122.534 30.227 -2.306 1.00 0.00 H new ATOM 0 HE1 TYR A 95 125.074 27.018 0.495 1.00 0.00 H new ATOM 0 HE2 TYR A 95 124.232 28.746 -3.346 1.00 0.00 H new ATOM 0 HH TYR A 95 125.750 27.140 -3.033 1.00 0.00 H new ATOM 1293 N PRO A 96 120.283 28.312 2.789 1.00 0.00 N ATOM 1294 CA PRO A 96 120.135 28.171 4.261 1.00 0.00 C ATOM 1295 C PRO A 96 121.451 28.503 4.975 1.00 0.00 C ATOM 1296 O PRO A 96 121.466 28.789 6.156 1.00 0.00 O ATOM 1297 CB PRO A 96 119.772 26.700 4.450 1.00 0.00 C ATOM 1298 CG PRO A 96 120.318 26.013 3.242 1.00 0.00 C ATOM 1299 CD PRO A 96 120.245 27.005 2.112 1.00 0.00 C ATOM 0 HA PRO A 96 119.388 28.847 4.677 1.00 0.00 H new ATOM 0 HB2 PRO A 96 120.209 26.299 5.364 1.00 0.00 H new ATOM 0 HB3 PRO A 96 118.693 26.566 4.527 1.00 0.00 H new ATOM 0 HG2 PRO A 96 121.346 25.693 3.410 1.00 0.00 H new ATOM 0 HG3 PRO A 96 119.739 25.119 3.010 1.00 0.00 H new ATOM 0 HD2 PRO A 96 121.081 26.887 1.422 1.00 0.00 H new ATOM 0 HD3 PRO A 96 119.331 26.882 1.530 1.00 0.00 H new ATOM 1304 N THR A 97 122.556 28.456 4.264 1.00 0.00 N ATOM 1305 CA THR A 97 123.893 28.757 4.879 1.00 0.00 C ATOM 1306 C THR A 97 124.056 28.048 6.232 1.00 0.00 C ATOM 1307 O THR A 97 124.774 28.506 7.099 1.00 0.00 O ATOM 1308 CB THR A 97 123.935 30.281 5.055 1.00 0.00 C ATOM 1309 OG1 THR A 97 122.939 30.687 5.983 1.00 0.00 O ATOM 1310 CG2 THR A 97 123.692 30.966 3.709 1.00 0.00 C ATOM 0 H THR A 97 122.589 28.219 3.272 1.00 0.00 H new ATOM 0 HA THR A 97 124.707 28.401 4.248 1.00 0.00 H new ATOM 0 HB THR A 97 124.916 30.568 5.433 1.00 0.00 H new ATOM 0 HG1 THR A 97 122.615 29.906 6.478 1.00 0.00 H new ATOM 0 HG21 THR A 97 123.723 32.048 3.840 1.00 0.00 H new ATOM 0 HG22 THR A 97 124.465 30.664 3.002 1.00 0.00 H new ATOM 0 HG23 THR A 97 122.715 30.675 3.324 1.00 0.00 H new ATOM 1318 N TYR A 98 123.400 26.930 6.411 1.00 0.00 N ATOM 1319 CA TYR A 98 123.519 26.185 7.699 1.00 0.00 C ATOM 1320 C TYR A 98 123.690 24.687 7.415 1.00 0.00 C ATOM 1321 O TYR A 98 123.004 24.124 6.584 1.00 0.00 O ATOM 1322 CB TYR A 98 122.208 26.463 8.437 1.00 0.00 C ATOM 1323 CG TYR A 98 122.293 25.933 9.849 1.00 0.00 C ATOM 1324 CD1 TYR A 98 123.050 26.618 10.808 1.00 0.00 C ATOM 1325 CD2 TYR A 98 121.616 24.760 10.200 1.00 0.00 C ATOM 1326 CE1 TYR A 98 123.130 26.128 12.117 1.00 0.00 C ATOM 1327 CE2 TYR A 98 121.696 24.270 11.509 1.00 0.00 C ATOM 1328 CZ TYR A 98 122.453 24.954 12.468 1.00 0.00 C ATOM 1329 OH TYR A 98 122.532 24.471 13.758 1.00 0.00 O ATOM 0 H TYR A 98 122.786 26.501 5.719 1.00 0.00 H new ATOM 0 HA TYR A 98 124.381 26.494 8.290 1.00 0.00 H new ATOM 0 HB2 TYR A 98 122.009 27.535 8.452 1.00 0.00 H new ATOM 0 HB3 TYR A 98 121.377 25.992 7.911 1.00 0.00 H new ATOM 0 HD1 TYR A 98 123.572 27.524 10.538 1.00 0.00 H new ATOM 0 HD2 TYR A 98 121.031 24.232 9.461 1.00 0.00 H new ATOM 0 HE1 TYR A 98 123.714 26.656 12.856 1.00 0.00 H new ATOM 0 HE2 TYR A 98 121.174 23.364 11.779 1.00 0.00 H new ATOM 0 HH TYR A 98 122.003 23.649 13.833 1.00 0.00 H new ATOM 1338 N LYS A 99 124.614 24.045 8.085 1.00 0.00 N ATOM 1339 CA LYS A 99 124.850 22.586 7.838 1.00 0.00 C ATOM 1340 C LYS A 99 123.555 21.783 8.013 1.00 0.00 C ATOM 1341 O LYS A 99 123.269 20.889 7.244 1.00 0.00 O ATOM 1342 CB LYS A 99 125.879 22.166 8.891 1.00 0.00 C ATOM 1343 CG LYS A 99 127.201 22.892 8.635 1.00 0.00 C ATOM 1344 CD LYS A 99 128.259 22.386 9.619 1.00 0.00 C ATOM 1345 CE LYS A 99 129.544 23.199 9.451 1.00 0.00 C ATOM 1346 NZ LYS A 99 130.518 22.575 10.389 1.00 0.00 N ATOM 0 H LYS A 99 125.216 24.466 8.793 1.00 0.00 H new ATOM 0 HA LYS A 99 125.197 22.401 6.821 1.00 0.00 H new ATOM 0 HB2 LYS A 99 125.510 22.402 9.889 1.00 0.00 H new ATOM 0 HB3 LYS A 99 126.032 21.087 8.855 1.00 0.00 H new ATOM 0 HG2 LYS A 99 127.530 22.720 7.610 1.00 0.00 H new ATOM 0 HG3 LYS A 99 127.066 23.967 8.750 1.00 0.00 H new ATOM 0 HD2 LYS A 99 127.892 22.474 10.641 1.00 0.00 H new ATOM 0 HD3 LYS A 99 128.459 21.329 9.442 1.00 0.00 H new ATOM 0 HE2 LYS A 99 129.905 23.160 8.423 1.00 0.00 H new ATOM 0 HE3 LYS A 99 129.381 24.250 9.692 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 131.426 23.078 10.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 130.151 22.633 11.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 130.658 21.577 10.131 1.00 0.00 H new ATOM 1356 N ASN A 100 122.772 22.104 9.011 1.00 0.00 N ATOM 1357 CA ASN A 100 121.486 21.369 9.248 1.00 0.00 C ATOM 1358 C ASN A 100 121.706 19.842 9.236 1.00 0.00 C ATOM 1359 O ASN A 100 121.982 19.247 10.260 1.00 0.00 O ATOM 1360 CB ASN A 100 120.562 21.818 8.109 1.00 0.00 C ATOM 1361 CG ASN A 100 119.199 21.139 8.254 1.00 0.00 C ATOM 1362 OD1 ASN A 100 118.886 20.218 7.528 1.00 0.00 O ATOM 1363 ND2 ASN A 100 118.369 21.558 9.171 1.00 0.00 N ATOM 0 H ASN A 100 122.968 22.850 9.679 1.00 0.00 H new ATOM 0 HA ASN A 100 121.058 21.592 10.225 1.00 0.00 H new ATOM 0 HB2 ASN A 100 120.444 22.901 8.129 1.00 0.00 H new ATOM 0 HB3 ASN A 100 121.005 21.564 7.146 1.00 0.00 H new ATOM 0 HD21 ASN A 100 117.458 21.111 9.277 1.00 0.00 H new ATOM 0 HD22 ASN A 100 118.632 22.332 9.781 1.00 0.00 H new ATOM 1369 N ASP A 101 121.591 19.200 8.092 1.00 0.00 N ATOM 1370 CA ASP A 101 121.799 17.717 8.023 1.00 0.00 C ATOM 1371 C ASP A 101 120.909 16.993 9.041 1.00 0.00 C ATOM 1372 O ASP A 101 121.360 16.116 9.755 1.00 0.00 O ATOM 1373 CB ASP A 101 123.280 17.499 8.351 1.00 0.00 C ATOM 1374 CG ASP A 101 124.154 18.150 7.272 1.00 0.00 C ATOM 1375 OD1 ASP A 101 123.648 18.391 6.186 1.00 0.00 O ATOM 1376 OD2 ASP A 101 125.316 18.396 7.550 1.00 0.00 O ATOM 0 H ASP A 101 121.361 19.643 7.202 1.00 0.00 H new ATOM 0 HA ASP A 101 121.536 17.319 7.043 1.00 0.00 H new ATOM 0 HB2 ASP A 101 123.512 17.926 9.326 1.00 0.00 H new ATOM 0 HB3 ASP A 101 123.495 16.432 8.411 1.00 0.00 H new ATOM 1380 N THR A 102 119.651 17.344 9.107 1.00 0.00 N ATOM 1381 CA THR A 102 118.736 16.665 10.074 1.00 0.00 C ATOM 1382 C THR A 102 117.517 16.097 9.340 1.00 0.00 C ATOM 1383 O THR A 102 117.010 16.691 8.408 1.00 0.00 O ATOM 1384 CB THR A 102 118.306 17.758 11.059 1.00 0.00 C ATOM 1385 OG1 THR A 102 117.584 18.763 10.362 1.00 0.00 O ATOM 1386 CG2 THR A 102 119.539 18.379 11.723 1.00 0.00 C ATOM 0 H THR A 102 119.218 18.069 8.535 1.00 0.00 H new ATOM 0 HA THR A 102 119.222 15.831 10.580 1.00 0.00 H new ATOM 0 HB THR A 102 117.672 17.318 11.829 1.00 0.00 H new ATOM 0 HG1 THR A 102 117.307 19.462 10.990 1.00 0.00 H new ATOM 0 HG21 THR A 102 119.224 19.155 12.421 1.00 0.00 H new ATOM 0 HG22 THR A 102 120.090 17.608 12.261 1.00 0.00 H new ATOM 0 HG23 THR A 102 120.182 18.817 10.959 1.00 0.00 H new ATOM 1394 N SER A 103 117.045 14.950 9.756 1.00 0.00 N ATOM 1395 CA SER A 103 115.860 14.335 9.087 1.00 0.00 C ATOM 1396 C SER A 103 114.880 13.793 10.132 1.00 0.00 C ATOM 1397 O SER A 103 115.268 13.418 11.222 1.00 0.00 O ATOM 1398 CB SER A 103 116.430 13.195 8.247 1.00 0.00 C ATOM 1399 OG SER A 103 117.367 13.720 7.315 1.00 0.00 O ATOM 0 H SER A 103 117.430 14.412 10.532 1.00 0.00 H new ATOM 0 HA SER A 103 115.309 15.055 8.481 1.00 0.00 H new ATOM 0 HB2 SER A 103 116.913 12.460 8.891 1.00 0.00 H new ATOM 0 HB3 SER A 103 115.627 12.679 7.721 1.00 0.00 H new ATOM 0 HG SER A 103 117.736 12.990 6.775 1.00 0.00 H new ATOM 1404 N ASP A 104 113.616 13.733 9.801 1.00 0.00 N ATOM 1405 CA ASP A 104 112.613 13.195 10.771 1.00 0.00 C ATOM 1406 C ASP A 104 112.592 11.666 10.692 1.00 0.00 C ATOM 1407 O ASP A 104 112.533 11.099 9.617 1.00 0.00 O ATOM 1408 CB ASP A 104 111.270 13.778 10.324 1.00 0.00 C ATOM 1409 CG ASP A 104 111.272 15.299 10.518 1.00 0.00 C ATOM 1410 OD1 ASP A 104 112.078 15.782 11.300 1.00 0.00 O ATOM 1411 OD2 ASP A 104 110.467 15.957 9.880 1.00 0.00 O ATOM 0 H ASP A 104 113.235 14.032 8.904 1.00 0.00 H new ATOM 0 HA ASP A 104 112.842 13.463 11.802 1.00 0.00 H new ATOM 0 HB2 ASP A 104 111.089 13.536 9.277 1.00 0.00 H new ATOM 0 HB3 ASP A 104 110.460 13.330 10.899 1.00 0.00 H new ATOM 1415 N TYR A 105 112.662 10.988 11.813 1.00 0.00 N ATOM 1416 CA TYR A 105 112.673 9.489 11.809 1.00 0.00 C ATOM 1417 C TYR A 105 111.252 8.917 11.683 1.00 0.00 C ATOM 1418 O TYR A 105 110.348 9.308 12.397 1.00 0.00 O ATOM 1419 CB TYR A 105 113.278 9.156 13.182 1.00 0.00 C ATOM 1420 CG TYR A 105 113.220 7.677 13.477 1.00 0.00 C ATOM 1421 CD1 TYR A 105 112.070 7.131 14.062 1.00 0.00 C ATOM 1422 CD2 TYR A 105 114.319 6.858 13.198 1.00 0.00 C ATOM 1423 CE1 TYR A 105 112.019 5.766 14.364 1.00 0.00 C ATOM 1424 CE2 TYR A 105 114.270 5.495 13.505 1.00 0.00 C ATOM 1425 CZ TYR A 105 113.119 4.948 14.089 1.00 0.00 C ATOM 1426 OH TYR A 105 113.072 3.604 14.399 1.00 0.00 O ATOM 0 H TYR A 105 112.712 11.413 12.739 1.00 0.00 H new ATOM 0 HA TYR A 105 113.227 9.066 10.971 1.00 0.00 H new ATOM 0 HB2 TYR A 105 114.314 9.492 13.214 1.00 0.00 H new ATOM 0 HB3 TYR A 105 112.742 9.703 13.958 1.00 0.00 H new ATOM 0 HD1 TYR A 105 111.223 7.764 14.280 1.00 0.00 H new ATOM 0 HD2 TYR A 105 115.205 7.278 12.746 1.00 0.00 H new ATOM 0 HE1 TYR A 105 111.130 5.344 14.809 1.00 0.00 H new ATOM 0 HE2 TYR A 105 115.120 4.863 13.292 1.00 0.00 H new ATOM 0 HH TYR A 105 112.147 3.287 14.340 1.00 0.00 H new ATOM 1435 N GLY A 106 111.058 7.987 10.780 1.00 0.00 N ATOM 1436 CA GLY A 106 109.707 7.376 10.600 1.00 0.00 C ATOM 1437 C GLY A 106 109.772 5.875 10.904 1.00 0.00 C ATOM 1438 O GLY A 106 110.724 5.394 11.488 1.00 0.00 O ATOM 0 H GLY A 106 111.781 7.624 10.158 1.00 0.00 H new ATOM 0 HA2 GLY A 106 108.988 7.860 11.261 1.00 0.00 H new ATOM 0 HA3 GLY A 106 109.359 7.535 9.579 1.00 0.00 H new ATOM 1441 N PHE A 107 108.773 5.131 10.496 1.00 0.00 N ATOM 1442 CA PHE A 107 108.774 3.655 10.747 1.00 0.00 C ATOM 1443 C PHE A 107 108.211 2.917 9.526 1.00 0.00 C ATOM 1444 O PHE A 107 107.364 3.436 8.825 1.00 0.00 O ATOM 1445 CB PHE A 107 107.864 3.459 11.958 1.00 0.00 C ATOM 1446 CG PHE A 107 107.901 2.012 12.387 1.00 0.00 C ATOM 1447 CD1 PHE A 107 108.907 1.565 13.250 1.00 0.00 C ATOM 1448 CD2 PHE A 107 106.929 1.118 11.921 1.00 0.00 C ATOM 1449 CE1 PHE A 107 108.943 0.223 13.649 1.00 0.00 C ATOM 1450 CE2 PHE A 107 106.965 -0.224 12.319 1.00 0.00 C ATOM 1451 CZ PHE A 107 107.972 -0.671 13.184 1.00 0.00 C ATOM 0 H PHE A 107 107.955 5.483 9.999 1.00 0.00 H new ATOM 0 HA PHE A 107 109.776 3.264 10.925 1.00 0.00 H new ATOM 0 HB2 PHE A 107 108.188 4.101 12.777 1.00 0.00 H new ATOM 0 HB3 PHE A 107 106.843 3.750 11.710 1.00 0.00 H new ATOM 0 HD1 PHE A 107 109.656 2.255 13.609 1.00 0.00 H new ATOM 0 HD2 PHE A 107 106.152 1.463 11.255 1.00 0.00 H new ATOM 0 HE1 PHE A 107 109.720 -0.122 14.315 1.00 0.00 H new ATOM 0 HE2 PHE A 107 106.216 -0.914 11.959 1.00 0.00 H new ATOM 0 HZ PHE A 107 107.999 -1.706 13.492 1.00 0.00 H new ATOM 1460 N SER A 108 108.667 1.713 9.264 1.00 0.00 N ATOM 1461 CA SER A 108 108.140 0.958 8.085 1.00 0.00 C ATOM 1462 C SER A 108 107.869 -0.506 8.451 1.00 0.00 C ATOM 1463 O SER A 108 108.602 -1.112 9.209 1.00 0.00 O ATOM 1464 CB SER A 108 109.245 1.051 7.033 1.00 0.00 C ATOM 1465 OG SER A 108 109.491 2.419 6.730 1.00 0.00 O ATOM 0 H SER A 108 109.376 1.225 9.812 1.00 0.00 H new ATOM 0 HA SER A 108 107.195 1.368 7.729 1.00 0.00 H new ATOM 0 HB2 SER A 108 110.155 0.579 7.402 1.00 0.00 H new ATOM 0 HB3 SER A 108 108.951 0.514 6.131 1.00 0.00 H new ATOM 0 HG SER A 108 108.864 2.719 6.039 1.00 0.00 H new ATOM 1470 N TYR A 109 106.828 -1.080 7.903 1.00 0.00 N ATOM 1471 CA TYR A 109 106.509 -2.512 8.201 1.00 0.00 C ATOM 1472 C TYR A 109 105.772 -3.144 7.013 1.00 0.00 C ATOM 1473 O TYR A 109 104.942 -2.511 6.394 1.00 0.00 O ATOM 1474 CB TYR A 109 105.605 -2.469 9.433 1.00 0.00 C ATOM 1475 CG TYR A 109 105.326 -3.877 9.902 1.00 0.00 C ATOM 1476 CD1 TYR A 109 106.241 -4.531 10.737 1.00 0.00 C ATOM 1477 CD2 TYR A 109 104.155 -4.530 9.501 1.00 0.00 C ATOM 1478 CE1 TYR A 109 105.984 -5.836 11.171 1.00 0.00 C ATOM 1479 CE2 TYR A 109 103.898 -5.836 9.934 1.00 0.00 C ATOM 1480 CZ TYR A 109 104.813 -6.489 10.769 1.00 0.00 C ATOM 1481 OH TYR A 109 104.559 -7.777 11.196 1.00 0.00 O ATOM 0 H TYR A 109 106.183 -0.619 7.261 1.00 0.00 H new ATOM 0 HA TYR A 109 107.404 -3.109 8.376 1.00 0.00 H new ATOM 0 HB2 TYR A 109 106.083 -1.897 10.228 1.00 0.00 H new ATOM 0 HB3 TYR A 109 104.670 -1.962 9.194 1.00 0.00 H new ATOM 0 HD1 TYR A 109 107.145 -4.028 11.046 1.00 0.00 H new ATOM 0 HD2 TYR A 109 103.449 -4.026 8.857 1.00 0.00 H new ATOM 0 HE1 TYR A 109 106.689 -6.339 11.816 1.00 0.00 H new ATOM 0 HE2 TYR A 109 102.994 -6.340 9.624 1.00 0.00 H new ATOM 0 HH TYR A 109 103.704 -8.081 10.827 1.00 0.00 H new ATOM 1490 N GLY A 110 106.059 -4.386 6.692 1.00 0.00 N ATOM 1491 CA GLY A 110 105.354 -5.035 5.542 1.00 0.00 C ATOM 1492 C GLY A 110 105.936 -6.428 5.274 1.00 0.00 C ATOM 1493 O GLY A 110 106.791 -6.904 5.987 1.00 0.00 O ATOM 0 H GLY A 110 106.743 -4.971 7.172 1.00 0.00 H new ATOM 0 HA2 GLY A 110 104.289 -5.115 5.759 1.00 0.00 H new ATOM 0 HA3 GLY A 110 105.452 -4.415 4.651 1.00 0.00 H new ATOM 1496 N ALA A 111 105.466 -7.081 4.242 1.00 0.00 N ATOM 1497 CA ALA A 111 105.978 -8.448 3.898 1.00 0.00 C ATOM 1498 C ALA A 111 105.454 -8.843 2.515 1.00 0.00 C ATOM 1499 O ALA A 111 104.497 -8.264 2.036 1.00 0.00 O ATOM 1500 CB ALA A 111 105.410 -9.372 4.977 1.00 0.00 C ATOM 0 H ALA A 111 104.743 -6.725 3.616 1.00 0.00 H new ATOM 0 HA ALA A 111 107.066 -8.499 3.866 1.00 0.00 H new ATOM 0 HB1 ALA A 111 105.742 -10.394 4.793 1.00 0.00 H new ATOM 0 HB2 ALA A 111 105.762 -9.047 5.956 1.00 0.00 H new ATOM 0 HB3 ALA A 111 104.321 -9.334 4.952 1.00 0.00 H new ATOM 1506 N GLY A 112 106.053 -9.809 1.852 1.00 0.00 N ATOM 1507 CA GLY A 112 105.546 -10.191 0.497 1.00 0.00 C ATOM 1508 C GLY A 112 105.948 -11.638 0.176 1.00 0.00 C ATOM 1509 O GLY A 112 106.501 -12.337 1.005 1.00 0.00 O ATOM 0 H GLY A 112 106.857 -10.340 2.186 1.00 0.00 H new ATOM 0 HA2 GLY A 112 104.461 -10.090 0.464 1.00 0.00 H new ATOM 0 HA3 GLY A 112 105.952 -9.516 -0.256 1.00 0.00 H new ATOM 1512 N LEU A 113 105.666 -12.091 -1.022 1.00 0.00 N ATOM 1513 CA LEU A 113 106.023 -13.498 -1.402 1.00 0.00 C ATOM 1514 C LEU A 113 106.897 -13.497 -2.658 1.00 0.00 C ATOM 1515 O LEU A 113 106.932 -12.524 -3.384 1.00 0.00 O ATOM 1516 CB LEU A 113 104.685 -14.196 -1.675 1.00 0.00 C ATOM 1517 CG LEU A 113 103.915 -13.445 -2.769 1.00 0.00 C ATOM 1518 CD1 LEU A 113 103.284 -14.451 -3.734 1.00 0.00 C ATOM 1519 CD2 LEU A 113 102.811 -12.599 -2.129 1.00 0.00 C ATOM 0 H LEU A 113 105.205 -11.550 -1.753 1.00 0.00 H new ATOM 0 HA LEU A 113 106.589 -14.005 -0.620 1.00 0.00 H new ATOM 0 HB2 LEU A 113 104.859 -15.227 -1.984 1.00 0.00 H new ATOM 0 HB3 LEU A 113 104.092 -14.233 -0.761 1.00 0.00 H new ATOM 0 HG LEU A 113 104.602 -12.798 -3.314 1.00 0.00 H new ATOM 0 HD11 LEU A 113 102.737 -13.916 -4.511 1.00 0.00 H new ATOM 0 HD12 LEU A 113 104.067 -15.056 -4.192 1.00 0.00 H new ATOM 0 HD13 LEU A 113 102.598 -15.098 -3.188 1.00 0.00 H new ATOM 0 HD21 LEU A 113 102.264 -12.066 -2.907 1.00 0.00 H new ATOM 0 HD22 LEU A 113 102.126 -13.248 -1.583 1.00 0.00 H new ATOM 0 HD23 LEU A 113 103.256 -11.881 -1.441 1.00 0.00 H new ATOM 1530 N GLN A 114 107.592 -14.577 -2.943 1.00 0.00 N ATOM 1531 CA GLN A 114 108.445 -14.614 -4.170 1.00 0.00 C ATOM 1532 C GLN A 114 107.952 -15.741 -5.089 1.00 0.00 C ATOM 1533 O GLN A 114 107.744 -16.856 -4.647 1.00 0.00 O ATOM 1534 CB GLN A 114 109.859 -14.938 -3.674 1.00 0.00 C ATOM 1535 CG GLN A 114 110.288 -13.945 -2.585 1.00 0.00 C ATOM 1536 CD GLN A 114 111.689 -14.306 -2.079 1.00 0.00 C ATOM 1537 OE1 GLN A 114 112.197 -15.373 -2.361 1.00 0.00 O ATOM 1538 NE2 GLN A 114 112.339 -13.449 -1.339 1.00 0.00 N ATOM 0 H GLN A 114 107.603 -15.428 -2.380 1.00 0.00 H new ATOM 0 HA GLN A 114 108.414 -13.677 -4.726 1.00 0.00 H new ATOM 0 HB2 GLN A 114 109.889 -15.954 -3.280 1.00 0.00 H new ATOM 0 HB3 GLN A 114 110.561 -14.899 -4.507 1.00 0.00 H new ATOM 0 HG2 GLN A 114 110.285 -12.930 -2.983 1.00 0.00 H new ATOM 0 HG3 GLN A 114 109.576 -13.966 -1.760 1.00 0.00 H new ATOM 0 HE21 GLN A 114 111.913 -12.553 -1.102 1.00 0.00 H new ATOM 0 HE22 GLN A 114 113.273 -13.675 -0.998 1.00 0.00 H new ATOM 1545 N PHE A 115 107.770 -15.467 -6.356 1.00 0.00 N ATOM 1546 CA PHE A 115 107.296 -16.531 -7.294 1.00 0.00 C ATOM 1547 C PHE A 115 108.199 -16.602 -8.531 1.00 0.00 C ATOM 1548 O PHE A 115 108.460 -15.605 -9.177 1.00 0.00 O ATOM 1549 CB PHE A 115 105.882 -16.105 -7.688 1.00 0.00 C ATOM 1550 CG PHE A 115 105.257 -17.176 -8.552 1.00 0.00 C ATOM 1551 CD1 PHE A 115 104.621 -18.272 -7.957 1.00 0.00 C ATOM 1552 CD2 PHE A 115 105.315 -17.071 -9.947 1.00 0.00 C ATOM 1553 CE1 PHE A 115 104.043 -19.265 -8.758 1.00 0.00 C ATOM 1554 CE2 PHE A 115 104.737 -18.064 -10.748 1.00 0.00 C ATOM 1555 CZ PHE A 115 104.101 -19.160 -10.154 1.00 0.00 C ATOM 0 H PHE A 115 107.929 -14.554 -6.782 1.00 0.00 H new ATOM 0 HA PHE A 115 107.316 -17.520 -6.836 1.00 0.00 H new ATOM 0 HB2 PHE A 115 105.277 -15.943 -6.796 1.00 0.00 H new ATOM 0 HB3 PHE A 115 105.913 -15.159 -8.228 1.00 0.00 H new ATOM 0 HD1 PHE A 115 104.576 -18.352 -6.881 1.00 0.00 H new ATOM 0 HD2 PHE A 115 105.805 -16.225 -10.405 1.00 0.00 H new ATOM 0 HE1 PHE A 115 103.553 -20.111 -8.300 1.00 0.00 H new ATOM 0 HE2 PHE A 115 104.782 -17.984 -11.824 1.00 0.00 H new ATOM 0 HZ PHE A 115 103.655 -19.925 -10.772 1.00 0.00 H new ATOM 1564 N ASN A 116 108.669 -17.778 -8.872 1.00 0.00 N ATOM 1565 CA ASN A 116 109.549 -17.922 -10.076 1.00 0.00 C ATOM 1566 C ASN A 116 109.913 -19.397 -10.302 1.00 0.00 C ATOM 1567 O ASN A 116 109.991 -20.161 -9.360 1.00 0.00 O ATOM 1568 CB ASN A 116 110.809 -17.104 -9.761 1.00 0.00 C ATOM 1569 CG ASN A 116 111.027 -16.055 -10.852 1.00 0.00 C ATOM 1570 OD1 ASN A 116 111.752 -16.285 -11.799 1.00 0.00 O ATOM 1571 ND2 ASN A 116 110.425 -14.902 -10.759 1.00 0.00 N ATOM 0 H ASN A 116 108.481 -18.645 -8.369 1.00 0.00 H new ATOM 0 HA ASN A 116 109.054 -17.574 -10.982 1.00 0.00 H new ATOM 0 HB2 ASN A 116 110.706 -16.618 -8.791 1.00 0.00 H new ATOM 0 HB3 ASN A 116 111.675 -17.762 -9.697 1.00 0.00 H new ATOM 0 HD21 ASN A 116 110.563 -14.195 -11.481 1.00 0.00 H new ATOM 0 HD22 ASN A 116 109.816 -14.707 -9.964 1.00 0.00 H new ATOM 1577 N PRO A 117 110.137 -19.753 -11.547 1.00 0.00 N ATOM 1578 CA PRO A 117 110.507 -21.150 -11.871 1.00 0.00 C ATOM 1579 C PRO A 117 111.980 -21.401 -11.521 1.00 0.00 C ATOM 1580 O PRO A 117 112.284 -22.009 -10.513 1.00 0.00 O ATOM 1581 CB PRO A 117 110.261 -21.248 -13.375 1.00 0.00 C ATOM 1582 CG PRO A 117 110.359 -19.845 -13.894 1.00 0.00 C ATOM 1583 CD PRO A 117 110.065 -18.907 -12.748 1.00 0.00 C ATOM 0 HA PRO A 117 109.937 -21.893 -11.313 1.00 0.00 H new ATOM 0 HB2 PRO A 117 110.999 -21.894 -13.851 1.00 0.00 H new ATOM 0 HB3 PRO A 117 109.280 -21.675 -13.584 1.00 0.00 H new ATOM 0 HG2 PRO A 117 111.354 -19.656 -14.297 1.00 0.00 H new ATOM 0 HG3 PRO A 117 109.650 -19.688 -14.707 1.00 0.00 H new ATOM 0 HD2 PRO A 117 110.791 -18.095 -12.705 1.00 0.00 H new ATOM 0 HD3 PRO A 117 109.081 -18.450 -12.852 1.00 0.00 H new ATOM 1588 N MET A 118 112.896 -20.946 -12.346 1.00 0.00 N ATOM 1589 CA MET A 118 114.345 -21.151 -12.077 1.00 0.00 C ATOM 1590 C MET A 118 114.678 -20.795 -10.632 1.00 0.00 C ATOM 1591 O MET A 118 114.482 -19.688 -10.172 1.00 0.00 O ATOM 1592 CB MET A 118 115.071 -20.223 -13.055 1.00 0.00 C ATOM 1593 CG MET A 118 114.894 -20.746 -14.482 1.00 0.00 C ATOM 1594 SD MET A 118 115.919 -19.773 -15.613 1.00 0.00 S ATOM 1595 CE MET A 118 117.518 -20.476 -15.138 1.00 0.00 C ATOM 0 H MET A 118 112.691 -20.435 -13.205 1.00 0.00 H new ATOM 0 HA MET A 118 114.644 -22.190 -12.213 1.00 0.00 H new ATOM 0 HB2 MET A 118 114.674 -19.211 -12.975 1.00 0.00 H new ATOM 0 HB3 MET A 118 116.131 -20.170 -12.804 1.00 0.00 H new ATOM 0 HG2 MET A 118 115.176 -21.798 -14.533 1.00 0.00 H new ATOM 0 HG3 MET A 118 113.847 -20.682 -14.777 1.00 0.00 H new ATOM 0 HE1 MET A 118 118.097 -20.700 -16.034 1.00 0.00 H new ATOM 0 HE2 MET A 118 118.063 -19.759 -14.524 1.00 0.00 H new ATOM 0 HE3 MET A 118 117.358 -21.393 -14.570 1.00 0.00 H new ATOM 1603 N GLU A 119 115.154 -21.762 -9.927 1.00 0.00 N ATOM 1604 CA GLU A 119 115.498 -21.580 -8.484 1.00 0.00 C ATOM 1605 C GLU A 119 116.593 -20.524 -8.271 1.00 0.00 C ATOM 1606 O GLU A 119 116.840 -20.119 -7.150 1.00 0.00 O ATOM 1607 CB GLU A 119 115.994 -22.951 -8.019 1.00 0.00 C ATOM 1608 CG GLU A 119 114.856 -23.970 -8.123 1.00 0.00 C ATOM 1609 CD GLU A 119 115.318 -25.329 -7.583 1.00 0.00 C ATOM 1610 OE1 GLU A 119 116.507 -25.490 -7.358 1.00 0.00 O ATOM 1611 OE2 GLU A 119 114.471 -26.189 -7.404 1.00 0.00 O ATOM 0 H GLU A 119 115.328 -22.700 -10.288 1.00 0.00 H new ATOM 0 HA GLU A 119 114.633 -21.226 -7.923 1.00 0.00 H new ATOM 0 HB2 GLU A 119 116.839 -23.270 -8.630 1.00 0.00 H new ATOM 0 HB3 GLU A 119 116.349 -22.891 -6.990 1.00 0.00 H new ATOM 0 HG2 GLU A 119 113.991 -23.620 -7.559 1.00 0.00 H new ATOM 0 HG3 GLU A 119 114.540 -24.070 -9.161 1.00 0.00 H new ATOM 1616 N ASN A 120 117.248 -20.057 -9.308 1.00 0.00 N ATOM 1617 CA ASN A 120 118.308 -19.020 -9.105 1.00 0.00 C ATOM 1618 C ASN A 120 117.718 -17.604 -9.237 1.00 0.00 C ATOM 1619 O ASN A 120 118.405 -16.620 -9.040 1.00 0.00 O ATOM 1620 CB ASN A 120 119.328 -19.277 -10.215 1.00 0.00 C ATOM 1621 CG ASN A 120 119.924 -20.678 -10.051 1.00 0.00 C ATOM 1622 OD1 ASN A 120 119.882 -21.250 -8.980 1.00 0.00 O ATOM 1623 ND2 ASN A 120 120.480 -21.259 -11.078 1.00 0.00 N ATOM 0 H ASN A 120 117.097 -20.345 -10.275 1.00 0.00 H new ATOM 0 HA ASN A 120 118.753 -19.082 -8.112 1.00 0.00 H new ATOM 0 HB2 ASN A 120 118.850 -19.186 -11.190 1.00 0.00 H new ATOM 0 HB3 ASN A 120 120.119 -18.528 -10.177 1.00 0.00 H new ATOM 0 HD21 ASN A 120 120.879 -22.193 -10.981 1.00 0.00 H new ATOM 0 HD22 ASN A 120 120.516 -20.780 -11.978 1.00 0.00 H new ATOM 1629 N VAL A 121 116.457 -17.497 -9.575 1.00 0.00 N ATOM 1630 CA VAL A 121 115.830 -16.148 -9.722 1.00 0.00 C ATOM 1631 C VAL A 121 114.539 -16.064 -8.902 1.00 0.00 C ATOM 1632 O VAL A 121 113.962 -17.069 -8.533 1.00 0.00 O ATOM 1633 CB VAL A 121 115.536 -15.998 -11.218 1.00 0.00 C ATOM 1634 CG1 VAL A 121 116.846 -16.075 -12.004 1.00 0.00 C ATOM 1635 CG2 VAL A 121 114.608 -17.122 -11.674 1.00 0.00 C ATOM 0 H VAL A 121 115.835 -18.285 -9.755 1.00 0.00 H new ATOM 0 HA VAL A 121 116.482 -15.354 -9.359 1.00 0.00 H new ATOM 0 HB VAL A 121 115.056 -15.036 -11.397 1.00 0.00 H new ATOM 0 HG11 VAL A 121 116.638 -15.968 -13.069 1.00 0.00 H new ATOM 0 HG12 VAL A 121 117.511 -15.274 -11.682 1.00 0.00 H new ATOM 0 HG13 VAL A 121 117.323 -17.038 -11.822 1.00 0.00 H new ATOM 0 HG21 VAL A 121 114.400 -17.013 -12.738 1.00 0.00 H new ATOM 0 HG22 VAL A 121 115.087 -18.085 -11.494 1.00 0.00 H new ATOM 0 HG23 VAL A 121 113.674 -17.072 -11.115 1.00 0.00 H new ATOM 1645 N ALA A 122 114.084 -14.869 -8.620 1.00 0.00 N ATOM 1646 CA ALA A 122 112.828 -14.725 -7.827 1.00 0.00 C ATOM 1647 C ALA A 122 112.147 -13.377 -8.085 1.00 0.00 C ATOM 1648 O ALA A 122 112.783 -12.346 -8.133 1.00 0.00 O ATOM 1649 CB ALA A 122 113.276 -14.822 -6.368 1.00 0.00 C ATOM 0 H ALA A 122 114.525 -13.994 -8.903 1.00 0.00 H new ATOM 0 HA ALA A 122 112.097 -15.487 -8.096 1.00 0.00 H new ATOM 0 HB1 ALA A 122 112.409 -14.725 -5.714 1.00 0.00 H new ATOM 0 HB2 ALA A 122 113.754 -15.787 -6.197 1.00 0.00 H new ATOM 0 HB3 ALA A 122 113.985 -14.023 -6.151 1.00 0.00 H new ATOM 1655 N LEU A 123 110.847 -13.383 -8.204 1.00 0.00 N ATOM 1656 CA LEU A 123 110.088 -12.113 -8.404 1.00 0.00 C ATOM 1657 C LEU A 123 109.124 -11.972 -7.228 1.00 0.00 C ATOM 1658 O LEU A 123 108.464 -12.926 -6.868 1.00 0.00 O ATOM 1659 CB LEU A 123 109.325 -12.297 -9.718 1.00 0.00 C ATOM 1660 CG LEU A 123 108.623 -10.990 -10.090 1.00 0.00 C ATOM 1661 CD1 LEU A 123 109.647 -9.998 -10.649 1.00 0.00 C ATOM 1662 CD2 LEU A 123 107.553 -11.272 -11.149 1.00 0.00 C ATOM 0 H LEU A 123 110.271 -14.224 -8.171 1.00 0.00 H new ATOM 0 HA LEU A 123 110.717 -11.224 -8.450 1.00 0.00 H new ATOM 0 HB2 LEU A 123 110.012 -12.591 -10.511 1.00 0.00 H new ATOM 0 HB3 LEU A 123 108.593 -13.099 -9.616 1.00 0.00 H new ATOM 0 HG LEU A 123 108.155 -10.564 -9.203 1.00 0.00 H new ATOM 0 HD11 LEU A 123 109.145 -9.067 -10.914 1.00 0.00 H new ATOM 0 HD12 LEU A 123 110.409 -9.798 -9.895 1.00 0.00 H new ATOM 0 HD13 LEU A 123 110.117 -10.422 -11.536 1.00 0.00 H new ATOM 0 HD21 LEU A 123 107.051 -10.342 -11.416 1.00 0.00 H new ATOM 0 HD22 LEU A 123 108.022 -11.699 -12.036 1.00 0.00 H new ATOM 0 HD23 LEU A 123 106.823 -11.977 -10.750 1.00 0.00 H new ATOM 1673 N ASP A 124 109.047 -10.833 -6.590 1.00 0.00 N ATOM 1674 CA ASP A 124 108.132 -10.747 -5.412 1.00 0.00 C ATOM 1675 C ASP A 124 107.432 -9.395 -5.272 1.00 0.00 C ATOM 1676 O ASP A 124 107.894 -8.373 -5.744 1.00 0.00 O ATOM 1677 CB ASP A 124 109.042 -10.998 -4.208 1.00 0.00 C ATOM 1678 CG ASP A 124 110.168 -9.955 -4.154 1.00 0.00 C ATOM 1679 OD1 ASP A 124 110.105 -8.990 -4.897 1.00 0.00 O ATOM 1680 OD2 ASP A 124 111.078 -10.143 -3.363 1.00 0.00 O ATOM 0 H ASP A 124 109.560 -9.983 -6.823 1.00 0.00 H new ATOM 0 HA ASP A 124 107.319 -11.466 -5.510 1.00 0.00 H new ATOM 0 HB2 ASP A 124 108.457 -10.958 -3.289 1.00 0.00 H new ATOM 0 HB3 ASP A 124 109.469 -11.999 -4.271 1.00 0.00 H new ATOM 1684 N PHE A 125 106.314 -9.408 -4.592 1.00 0.00 N ATOM 1685 CA PHE A 125 105.544 -8.158 -4.353 1.00 0.00 C ATOM 1686 C PHE A 125 105.344 -7.997 -2.847 1.00 0.00 C ATOM 1687 O PHE A 125 105.008 -8.945 -2.162 1.00 0.00 O ATOM 1688 CB PHE A 125 104.203 -8.369 -5.060 1.00 0.00 C ATOM 1689 CG PHE A 125 104.432 -8.568 -6.538 1.00 0.00 C ATOM 1690 CD1 PHE A 125 104.512 -7.461 -7.390 1.00 0.00 C ATOM 1691 CD2 PHE A 125 104.565 -9.861 -7.058 1.00 0.00 C ATOM 1692 CE1 PHE A 125 104.725 -7.645 -8.762 1.00 0.00 C ATOM 1693 CE2 PHE A 125 104.776 -10.047 -8.429 1.00 0.00 C ATOM 1694 CZ PHE A 125 104.856 -8.938 -9.281 1.00 0.00 C ATOM 0 H PHE A 125 105.899 -10.247 -4.187 1.00 0.00 H new ATOM 0 HA PHE A 125 106.045 -7.264 -4.725 1.00 0.00 H new ATOM 0 HB2 PHE A 125 103.693 -9.237 -4.641 1.00 0.00 H new ATOM 0 HB3 PHE A 125 103.555 -7.508 -4.895 1.00 0.00 H new ATOM 0 HD1 PHE A 125 104.409 -6.463 -6.989 1.00 0.00 H new ATOM 0 HD2 PHE A 125 104.505 -10.716 -6.401 1.00 0.00 H new ATOM 0 HE1 PHE A 125 104.788 -6.790 -9.419 1.00 0.00 H new ATOM 0 HE2 PHE A 125 104.877 -11.045 -8.830 1.00 0.00 H new ATOM 0 HZ PHE A 125 105.019 -9.081 -10.339 1.00 0.00 H new ATOM 1703 N SER A 126 105.553 -6.822 -2.320 1.00 0.00 N ATOM 1704 CA SER A 126 105.380 -6.636 -0.850 1.00 0.00 C ATOM 1705 C SER A 126 104.673 -5.316 -0.544 1.00 0.00 C ATOM 1706 O SER A 126 104.904 -4.311 -1.187 1.00 0.00 O ATOM 1707 CB SER A 126 106.801 -6.624 -0.287 1.00 0.00 C ATOM 1708 OG SER A 126 106.742 -6.559 1.132 1.00 0.00 O ATOM 0 H SER A 126 105.834 -5.989 -2.837 1.00 0.00 H new ATOM 0 HA SER A 126 104.766 -7.422 -0.411 1.00 0.00 H new ATOM 0 HB2 SER A 126 107.336 -7.521 -0.600 1.00 0.00 H new ATOM 0 HB3 SER A 126 107.353 -5.770 -0.679 1.00 0.00 H new ATOM 0 HG SER A 126 107.651 -6.553 1.497 1.00 0.00 H new ATOM 1713 N TYR A 127 103.827 -5.316 0.450 1.00 0.00 N ATOM 1714 CA TYR A 127 103.113 -4.066 0.828 1.00 0.00 C ATOM 1715 C TYR A 127 103.657 -3.560 2.163 1.00 0.00 C ATOM 1716 O TYR A 127 103.722 -4.293 3.134 1.00 0.00 O ATOM 1717 CB TYR A 127 101.642 -4.465 0.961 1.00 0.00 C ATOM 1718 CG TYR A 127 100.816 -3.247 1.305 1.00 0.00 C ATOM 1719 CD1 TYR A 127 100.385 -2.383 0.291 1.00 0.00 C ATOM 1720 CD2 TYR A 127 100.479 -2.984 2.638 1.00 0.00 C ATOM 1721 CE1 TYR A 127 99.618 -1.255 0.610 1.00 0.00 C ATOM 1722 CE2 TYR A 127 99.712 -1.856 2.957 1.00 0.00 C ATOM 1723 CZ TYR A 127 99.282 -0.992 1.943 1.00 0.00 C ATOM 1724 OH TYR A 127 98.526 0.119 2.257 1.00 0.00 O ATOM 0 H TYR A 127 103.600 -6.132 1.018 1.00 0.00 H new ATOM 0 HA TYR A 127 103.243 -3.269 0.096 1.00 0.00 H new ATOM 0 HB2 TYR A 127 101.288 -4.905 0.029 1.00 0.00 H new ATOM 0 HB3 TYR A 127 101.529 -5.224 1.735 1.00 0.00 H new ATOM 0 HD1 TYR A 127 100.644 -2.586 -0.738 1.00 0.00 H new ATOM 0 HD2 TYR A 127 100.810 -3.651 3.420 1.00 0.00 H new ATOM 0 HE1 TYR A 127 99.286 -0.589 -0.172 1.00 0.00 H new ATOM 0 HE2 TYR A 127 99.452 -1.653 3.985 1.00 0.00 H new ATOM 0 HH TYR A 127 97.778 -0.146 2.832 1.00 0.00 H new ATOM 1733 N GLU A 128 104.057 -2.318 2.217 1.00 0.00 N ATOM 1734 CA GLU A 128 104.602 -1.765 3.488 1.00 0.00 C ATOM 1735 C GLU A 128 104.149 -0.316 3.677 1.00 0.00 C ATOM 1736 O GLU A 128 103.984 0.420 2.724 1.00 0.00 O ATOM 1737 CB GLU A 128 106.124 -1.852 3.339 1.00 0.00 C ATOM 1738 CG GLU A 128 106.582 -0.994 2.153 1.00 0.00 C ATOM 1739 CD GLU A 128 108.086 -1.177 1.921 1.00 0.00 C ATOM 1740 OE1 GLU A 128 108.732 -1.789 2.758 1.00 0.00 O ATOM 1741 OE2 GLU A 128 108.568 -0.702 0.906 1.00 0.00 O ATOM 0 H GLU A 128 104.029 -1.663 1.435 1.00 0.00 H new ATOM 0 HA GLU A 128 104.251 -2.314 4.362 1.00 0.00 H new ATOM 0 HB2 GLU A 128 106.608 -1.511 4.254 1.00 0.00 H new ATOM 0 HB3 GLU A 128 106.425 -2.889 3.187 1.00 0.00 H new ATOM 0 HG2 GLU A 128 106.031 -1.276 1.256 1.00 0.00 H new ATOM 0 HG3 GLU A 128 106.361 0.056 2.347 1.00 0.00 H new ATOM 1746 N GLN A 129 103.952 0.096 4.901 1.00 0.00 N ATOM 1747 CA GLN A 129 103.514 1.498 5.155 1.00 0.00 C ATOM 1748 C GLN A 129 104.629 2.279 5.855 1.00 0.00 C ATOM 1749 O GLN A 129 105.240 1.800 6.791 1.00 0.00 O ATOM 1750 CB GLN A 129 102.295 1.372 6.070 1.00 0.00 C ATOM 1751 CG GLN A 129 101.179 0.627 5.334 1.00 0.00 C ATOM 1752 CD GLN A 129 99.976 0.451 6.266 1.00 0.00 C ATOM 1753 OE1 GLN A 129 100.095 0.595 7.467 1.00 0.00 O ATOM 1754 NE2 GLN A 129 98.814 0.141 5.758 1.00 0.00 N ATOM 0 H GLN A 129 104.076 -0.478 5.735 1.00 0.00 H new ATOM 0 HA GLN A 129 103.280 2.032 4.234 1.00 0.00 H new ATOM 0 HB2 GLN A 129 102.564 0.837 6.981 1.00 0.00 H new ATOM 0 HB3 GLN A 129 101.949 2.361 6.371 1.00 0.00 H new ATOM 0 HG2 GLN A 129 100.884 1.182 4.444 1.00 0.00 H new ATOM 0 HG3 GLN A 129 101.537 -0.346 4.999 1.00 0.00 H new ATOM 0 HE21 GLN A 129 98.714 0.020 4.750 1.00 0.00 H new ATOM 0 HE22 GLN A 129 98.006 0.020 6.369 1.00 0.00 H new ATOM 1761 N SER A 130 104.887 3.480 5.412 1.00 0.00 N ATOM 1762 CA SER A 130 105.952 4.306 6.054 1.00 0.00 C ATOM 1763 C SER A 130 105.382 5.677 6.410 1.00 0.00 C ATOM 1764 O SER A 130 104.571 6.221 5.684 1.00 0.00 O ATOM 1765 CB SER A 130 107.049 4.432 4.999 1.00 0.00 C ATOM 1766 OG SER A 130 107.503 3.136 4.635 1.00 0.00 O ATOM 0 H SER A 130 104.405 3.926 4.631 1.00 0.00 H new ATOM 0 HA SER A 130 106.334 3.863 6.974 1.00 0.00 H new ATOM 0 HB2 SER A 130 106.668 4.956 4.122 1.00 0.00 H new ATOM 0 HB3 SER A 130 107.877 5.024 5.388 1.00 0.00 H new ATOM 0 HG SER A 130 108.135 3.208 3.889 1.00 0.00 H new ATOM 1771 N ARG A 131 105.789 6.246 7.516 1.00 0.00 N ATOM 1772 CA ARG A 131 105.244 7.585 7.888 1.00 0.00 C ATOM 1773 C ARG A 131 106.279 8.434 8.631 1.00 0.00 C ATOM 1774 O ARG A 131 107.080 7.927 9.396 1.00 0.00 O ATOM 1775 CB ARG A 131 104.037 7.285 8.783 1.00 0.00 C ATOM 1776 CG ARG A 131 104.496 6.564 10.055 1.00 0.00 C ATOM 1777 CD ARG A 131 103.273 6.054 10.823 1.00 0.00 C ATOM 1778 NE ARG A 131 103.817 5.486 12.089 1.00 0.00 N ATOM 1779 CZ ARG A 131 103.015 4.905 12.939 1.00 0.00 C ATOM 1780 NH1 ARG A 131 102.216 3.954 12.539 1.00 0.00 N ATOM 1781 NH2 ARG A 131 103.011 5.276 14.191 1.00 0.00 N ATOM 0 H ARG A 131 106.465 5.848 8.168 1.00 0.00 H new ATOM 0 HA ARG A 131 104.971 8.164 7.006 1.00 0.00 H new ATOM 0 HB2 ARG A 131 103.528 8.213 9.044 1.00 0.00 H new ATOM 0 HB3 ARG A 131 103.318 6.668 8.244 1.00 0.00 H new ATOM 0 HG2 ARG A 131 105.150 5.731 9.798 1.00 0.00 H new ATOM 0 HG3 ARG A 131 105.075 7.242 10.681 1.00 0.00 H new ATOM 0 HD2 ARG A 131 102.569 6.862 11.024 1.00 0.00 H new ATOM 0 HD3 ARG A 131 102.736 5.298 10.251 1.00 0.00 H new ATOM 0 HE ARG A 131 104.815 5.551 12.291 1.00 0.00 H new ATOM 0 HH11 ARG A 131 102.218 3.664 11.561 1.00 0.00 H new ATOM 0 HH12 ARG A 131 101.590 3.501 13.204 1.00 0.00 H new ATOM 0 HH21 ARG A 131 103.635 6.020 14.505 1.00 0.00 H new ATOM 0 HH22 ARG A 131 102.384 4.822 14.855 1.00 0.00 H new ATOM 1792 N ILE A 132 106.268 9.728 8.405 1.00 0.00 N ATOM 1793 CA ILE A 132 107.246 10.618 9.090 1.00 0.00 C ATOM 1794 C ILE A 132 106.506 11.699 9.882 1.00 0.00 C ATOM 1795 O ILE A 132 106.229 12.761 9.367 1.00 0.00 O ATOM 1796 CB ILE A 132 108.059 11.270 7.961 1.00 0.00 C ATOM 1797 CG1 ILE A 132 108.645 10.197 7.027 1.00 0.00 C ATOM 1798 CG2 ILE A 132 109.199 12.095 8.565 1.00 0.00 C ATOM 1799 CD1 ILE A 132 109.527 9.223 7.815 1.00 0.00 C ATOM 0 H ILE A 132 105.621 10.201 7.774 1.00 0.00 H new ATOM 0 HA ILE A 132 107.876 10.068 9.789 1.00 0.00 H new ATOM 0 HB ILE A 132 107.399 11.916 7.383 1.00 0.00 H new ATOM 0 HG12 ILE A 132 107.838 9.652 6.538 1.00 0.00 H new ATOM 0 HG13 ILE A 132 109.231 10.672 6.240 1.00 0.00 H new ATOM 0 HG21 ILE A 132 109.777 12.558 7.765 1.00 0.00 H new ATOM 0 HG22 ILE A 132 108.785 12.871 9.209 1.00 0.00 H new ATOM 0 HG23 ILE A 132 109.848 11.444 9.151 1.00 0.00 H new ATOM 0 HD11 ILE A 132 109.933 8.471 7.138 1.00 0.00 H new ATOM 0 HD12 ILE A 132 110.346 9.770 8.283 1.00 0.00 H new ATOM 0 HD13 ILE A 132 108.931 8.734 8.585 1.00 0.00 H new ATOM 1810 N ARG A 133 106.201 11.439 11.131 1.00 0.00 N ATOM 1811 CA ARG A 133 105.491 12.440 11.995 1.00 0.00 C ATOM 1812 C ARG A 133 104.101 12.798 11.453 1.00 0.00 C ATOM 1813 O ARG A 133 103.098 12.506 12.077 1.00 0.00 O ATOM 1814 CB ARG A 133 106.393 13.680 12.041 1.00 0.00 C ATOM 1815 CG ARG A 133 107.712 13.322 12.730 1.00 0.00 C ATOM 1816 CD ARG A 133 108.563 14.583 12.896 1.00 0.00 C ATOM 1817 NE ARG A 133 109.877 14.093 13.398 1.00 0.00 N ATOM 1818 CZ ARG A 133 110.383 14.588 14.494 1.00 0.00 C ATOM 1819 NH1 ARG A 133 111.067 15.699 14.453 1.00 0.00 N ATOM 1820 NH2 ARG A 133 110.204 13.973 15.631 1.00 0.00 N ATOM 0 H ARG A 133 106.418 10.559 11.598 1.00 0.00 H new ATOM 0 HA ARG A 133 105.320 12.026 12.989 1.00 0.00 H new ATOM 0 HB2 ARG A 133 106.584 14.042 11.031 1.00 0.00 H new ATOM 0 HB3 ARG A 133 105.895 14.486 12.580 1.00 0.00 H new ATOM 0 HG2 ARG A 133 107.515 12.873 13.704 1.00 0.00 H new ATOM 0 HG3 ARG A 133 108.252 12.581 12.141 1.00 0.00 H new ATOM 0 HD2 ARG A 133 108.674 15.113 11.950 1.00 0.00 H new ATOM 0 HD3 ARG A 133 108.106 15.279 13.599 1.00 0.00 H new ATOM 0 HE ARG A 133 110.381 13.370 12.885 1.00 0.00 H new ATOM 0 HH11 ARG A 133 111.206 16.180 13.564 1.00 0.00 H new ATOM 0 HH12 ARG A 133 111.463 16.086 15.310 1.00 0.00 H new ATOM 0 HH21 ARG A 133 109.669 13.105 15.663 1.00 0.00 H new ATOM 0 HH22 ARG A 133 110.600 14.360 16.488 1.00 0.00 H new ATOM 1831 N SER A 134 104.025 13.440 10.319 1.00 0.00 N ATOM 1832 CA SER A 134 102.689 13.826 9.771 1.00 0.00 C ATOM 1833 C SER A 134 102.514 13.310 8.342 1.00 0.00 C ATOM 1834 O SER A 134 101.704 13.819 7.591 1.00 0.00 O ATOM 1835 CB SER A 134 102.681 15.355 9.793 1.00 0.00 C ATOM 1836 OG SER A 134 103.454 15.848 8.706 1.00 0.00 O ATOM 0 H SER A 134 104.825 13.714 9.749 1.00 0.00 H new ATOM 0 HA SER A 134 101.873 13.400 10.354 1.00 0.00 H new ATOM 0 HB2 SER A 134 101.658 15.725 9.723 1.00 0.00 H new ATOM 0 HB3 SER A 134 103.088 15.718 10.737 1.00 0.00 H new ATOM 0 HG SER A 134 103.448 16.828 8.718 1.00 0.00 H new ATOM 1841 N VAL A 135 103.268 12.319 7.956 1.00 0.00 N ATOM 1842 CA VAL A 135 103.132 11.798 6.564 1.00 0.00 C ATOM 1843 C VAL A 135 102.845 10.299 6.566 1.00 0.00 C ATOM 1844 O VAL A 135 103.484 9.542 7.258 1.00 0.00 O ATOM 1845 CB VAL A 135 104.483 12.079 5.901 1.00 0.00 C ATOM 1846 CG1 VAL A 135 104.443 11.615 4.442 1.00 0.00 C ATOM 1847 CG2 VAL A 135 104.775 13.582 5.944 1.00 0.00 C ATOM 0 H VAL A 135 103.965 11.851 8.535 1.00 0.00 H new ATOM 0 HA VAL A 135 102.304 12.272 6.036 1.00 0.00 H new ATOM 0 HB VAL A 135 105.265 11.540 6.436 1.00 0.00 H new ATOM 0 HG11 VAL A 135 105.405 11.815 3.970 1.00 0.00 H new ATOM 0 HG12 VAL A 135 104.237 10.545 4.406 1.00 0.00 H new ATOM 0 HG13 VAL A 135 103.659 12.154 3.910 1.00 0.00 H new ATOM 0 HG21 VAL A 135 105.737 13.779 5.471 1.00 0.00 H new ATOM 0 HG22 VAL A 135 103.992 14.120 5.411 1.00 0.00 H new ATOM 0 HG23 VAL A 135 104.804 13.917 6.981 1.00 0.00 H new ATOM 1857 N ASP A 136 101.891 9.869 5.783 1.00 0.00 N ATOM 1858 CA ASP A 136 101.571 8.413 5.716 1.00 0.00 C ATOM 1859 C ASP A 136 101.549 8.002 4.249 1.00 0.00 C ATOM 1860 O ASP A 136 100.699 8.440 3.498 1.00 0.00 O ATOM 1861 CB ASP A 136 100.181 8.273 6.342 1.00 0.00 C ATOM 1862 CG ASP A 136 99.804 6.791 6.453 1.00 0.00 C ATOM 1863 OD1 ASP A 136 100.689 5.958 6.337 1.00 0.00 O ATOM 1864 OD2 ASP A 136 98.632 6.515 6.651 1.00 0.00 O ATOM 0 H ASP A 136 101.318 10.465 5.186 1.00 0.00 H new ATOM 0 HA ASP A 136 102.294 7.785 6.236 1.00 0.00 H new ATOM 0 HB2 ASP A 136 100.169 8.735 7.329 1.00 0.00 H new ATOM 0 HB3 ASP A 136 99.445 8.800 5.735 1.00 0.00 H new ATOM 1868 N VAL A 137 102.486 7.199 3.807 1.00 0.00 N ATOM 1869 CA VAL A 137 102.520 6.816 2.363 1.00 0.00 C ATOM 1870 C VAL A 137 102.222 5.323 2.176 1.00 0.00 C ATOM 1871 O VAL A 137 102.643 4.491 2.956 1.00 0.00 O ATOM 1872 CB VAL A 137 103.964 7.092 1.907 1.00 0.00 C ATOM 1873 CG1 VAL A 137 104.056 6.952 0.385 1.00 0.00 C ATOM 1874 CG2 VAL A 137 104.416 8.503 2.321 1.00 0.00 C ATOM 0 H VAL A 137 103.225 6.794 4.382 1.00 0.00 H new ATOM 0 HA VAL A 137 101.774 7.372 1.796 1.00 0.00 H new ATOM 0 HB VAL A 137 104.620 6.366 2.388 1.00 0.00 H new ATOM 0 HG11 VAL A 137 105.079 7.148 0.063 1.00 0.00 H new ATOM 0 HG12 VAL A 137 103.771 5.941 0.095 1.00 0.00 H new ATOM 0 HG13 VAL A 137 103.384 7.668 -0.088 1.00 0.00 H new ATOM 0 HG21 VAL A 137 105.440 8.670 1.986 1.00 0.00 H new ATOM 0 HG22 VAL A 137 103.759 9.244 1.865 1.00 0.00 H new ATOM 0 HG23 VAL A 137 104.370 8.596 3.406 1.00 0.00 H new ATOM 1884 N GLY A 138 101.537 4.984 1.117 1.00 0.00 N ATOM 1885 CA GLY A 138 101.245 3.554 0.821 1.00 0.00 C ATOM 1886 C GLY A 138 101.929 3.220 -0.504 1.00 0.00 C ATOM 1887 O GLY A 138 101.515 3.677 -1.553 1.00 0.00 O ATOM 0 H GLY A 138 101.163 5.646 0.437 1.00 0.00 H new ATOM 0 HA2 GLY A 138 101.617 2.912 1.619 1.00 0.00 H new ATOM 0 HA3 GLY A 138 100.170 3.387 0.752 1.00 0.00 H new ATOM 1890 N THR A 139 102.998 2.468 -0.466 1.00 0.00 N ATOM 1891 CA THR A 139 103.729 2.155 -1.731 1.00 0.00 C ATOM 1892 C THR A 139 103.821 0.647 -1.984 1.00 0.00 C ATOM 1893 O THR A 139 104.024 -0.140 -1.080 1.00 0.00 O ATOM 1894 CB THR A 139 105.128 2.739 -1.515 1.00 0.00 C ATOM 1895 OG1 THR A 139 105.020 4.128 -1.239 1.00 0.00 O ATOM 1896 CG2 THR A 139 105.984 2.530 -2.767 1.00 0.00 C ATOM 0 H THR A 139 103.395 2.059 0.380 1.00 0.00 H new ATOM 0 HA THR A 139 103.218 2.570 -2.599 1.00 0.00 H new ATOM 0 HB THR A 139 105.602 2.233 -0.674 1.00 0.00 H new ATOM 0 HG1 THR A 139 105.833 4.585 -1.538 1.00 0.00 H new ATOM 0 HG21 THR A 139 106.977 2.949 -2.603 1.00 0.00 H new ATOM 0 HG22 THR A 139 106.070 1.464 -2.975 1.00 0.00 H new ATOM 0 HG23 THR A 139 105.515 3.029 -3.615 1.00 0.00 H new ATOM 1904 N TRP A 140 103.706 0.256 -3.227 1.00 0.00 N ATOM 1905 CA TRP A 140 103.821 -1.185 -3.585 1.00 0.00 C ATOM 1906 C TRP A 140 105.179 -1.407 -4.253 1.00 0.00 C ATOM 1907 O TRP A 140 105.595 -0.624 -5.085 1.00 0.00 O ATOM 1908 CB TRP A 140 102.682 -1.443 -4.574 1.00 0.00 C ATOM 1909 CG TRP A 140 101.370 -1.239 -3.889 1.00 0.00 C ATOM 1910 CD1 TRP A 140 100.724 -0.055 -3.787 1.00 0.00 C ATOM 1911 CD2 TRP A 140 100.532 -2.223 -3.217 1.00 0.00 C ATOM 1912 NE1 TRP A 140 99.545 -0.247 -3.090 1.00 0.00 N ATOM 1913 CE2 TRP A 140 99.381 -1.568 -2.718 1.00 0.00 C ATOM 1914 CE3 TRP A 140 100.657 -3.606 -2.994 1.00 0.00 C ATOM 1915 CZ2 TRP A 140 98.390 -2.259 -2.022 1.00 0.00 C ATOM 1916 CZ3 TRP A 140 99.660 -4.305 -2.293 1.00 0.00 C ATOM 1917 CH2 TRP A 140 98.530 -3.632 -1.807 1.00 0.00 C ATOM 0 H TRP A 140 103.536 0.881 -4.015 1.00 0.00 H new ATOM 0 HA TRP A 140 103.753 -1.852 -2.726 1.00 0.00 H new ATOM 0 HB2 TRP A 140 102.767 -0.770 -5.427 1.00 0.00 H new ATOM 0 HB3 TRP A 140 102.747 -2.459 -4.963 1.00 0.00 H new ATOM 0 HD1 TRP A 140 101.072 0.887 -4.185 1.00 0.00 H new ATOM 0 HE1 TRP A 140 98.878 0.495 -2.877 1.00 0.00 H new ATOM 0 HE3 TRP A 140 101.524 -4.133 -3.364 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 97.520 -1.736 -1.652 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 99.765 -5.367 -2.127 1.00 0.00 H new ATOM 0 HH2 TRP A 140 97.768 -4.175 -1.267 1.00 0.00 H new ATOM 1927 N ILE A 141 105.883 -2.447 -3.892 1.00 0.00 N ATOM 1928 CA ILE A 141 107.225 -2.677 -4.509 1.00 0.00 C ATOM 1929 C ILE A 141 107.274 -4.015 -5.252 1.00 0.00 C ATOM 1930 O ILE A 141 106.603 -4.964 -4.896 1.00 0.00 O ATOM 1931 CB ILE A 141 108.212 -2.674 -3.334 1.00 0.00 C ATOM 1932 CG1 ILE A 141 107.882 -3.823 -2.374 1.00 0.00 C ATOM 1933 CG2 ILE A 141 108.126 -1.340 -2.584 1.00 0.00 C ATOM 1934 CD1 ILE A 141 108.968 -3.921 -1.300 1.00 0.00 C ATOM 0 H ILE A 141 105.592 -3.141 -3.204 1.00 0.00 H new ATOM 0 HA ILE A 141 107.462 -1.912 -5.248 1.00 0.00 H new ATOM 0 HB ILE A 141 109.223 -2.805 -3.721 1.00 0.00 H new ATOM 0 HG12 ILE A 141 106.911 -3.655 -1.909 1.00 0.00 H new ATOM 0 HG13 ILE A 141 107.814 -4.762 -2.924 1.00 0.00 H new ATOM 0 HG21 ILE A 141 108.829 -1.345 -1.751 1.00 0.00 H new ATOM 0 HG22 ILE A 141 108.373 -0.524 -3.263 1.00 0.00 H new ATOM 0 HG23 ILE A 141 107.114 -1.201 -2.204 1.00 0.00 H new ATOM 0 HD11 ILE A 141 108.733 -4.738 -0.618 1.00 0.00 H new ATOM 0 HD12 ILE A 141 109.932 -4.110 -1.773 1.00 0.00 H new ATOM 0 HD13 ILE A 141 109.014 -2.985 -0.743 1.00 0.00 H new ATOM 1945 N ALA A 142 108.082 -4.091 -6.276 1.00 0.00 N ATOM 1946 CA ALA A 142 108.210 -5.360 -7.050 1.00 0.00 C ATOM 1947 C ALA A 142 109.608 -5.429 -7.659 1.00 0.00 C ATOM 1948 O ALA A 142 110.131 -4.434 -8.125 1.00 0.00 O ATOM 1949 CB ALA A 142 107.146 -5.268 -8.145 1.00 0.00 C ATOM 0 H ALA A 142 108.663 -3.323 -6.612 1.00 0.00 H new ATOM 0 HA ALA A 142 108.072 -6.250 -6.437 1.00 0.00 H new ATOM 0 HB1 ALA A 142 107.177 -6.168 -8.759 1.00 0.00 H new ATOM 0 HB2 ALA A 142 106.161 -5.174 -7.688 1.00 0.00 H new ATOM 0 HB3 ALA A 142 107.341 -4.396 -8.769 1.00 0.00 H new ATOM 1955 N GLY A 143 110.235 -6.578 -7.646 1.00 0.00 N ATOM 1956 CA GLY A 143 111.611 -6.655 -8.215 1.00 0.00 C ATOM 1957 C GLY A 143 112.037 -8.101 -8.474 1.00 0.00 C ATOM 1958 O GLY A 143 111.226 -8.994 -8.630 1.00 0.00 O ATOM 0 H GLY A 143 109.861 -7.450 -7.273 1.00 0.00 H new ATOM 0 HA2 GLY A 143 111.651 -6.091 -9.147 1.00 0.00 H new ATOM 0 HA3 GLY A 143 112.315 -6.186 -7.528 1.00 0.00 H new ATOM 1961 N VAL A 144 113.326 -8.314 -8.532 1.00 0.00 N ATOM 1962 CA VAL A 144 113.869 -9.678 -8.799 1.00 0.00 C ATOM 1963 C VAL A 144 114.696 -10.167 -7.604 1.00 0.00 C ATOM 1964 O VAL A 144 114.929 -9.438 -6.660 1.00 0.00 O ATOM 1965 CB VAL A 144 114.754 -9.520 -10.040 1.00 0.00 C ATOM 1966 CG1 VAL A 144 113.901 -9.048 -11.219 1.00 0.00 C ATOM 1967 CG2 VAL A 144 115.853 -8.486 -9.768 1.00 0.00 C ATOM 0 H VAL A 144 114.034 -7.591 -8.404 1.00 0.00 H new ATOM 0 HA VAL A 144 113.078 -10.412 -8.955 1.00 0.00 H new ATOM 0 HB VAL A 144 115.211 -10.481 -10.277 1.00 0.00 H new ATOM 0 HG11 VAL A 144 114.531 -8.936 -12.102 1.00 0.00 H new ATOM 0 HG12 VAL A 144 113.121 -9.782 -11.421 1.00 0.00 H new ATOM 0 HG13 VAL A 144 113.443 -8.089 -10.976 1.00 0.00 H new ATOM 0 HG21 VAL A 144 116.479 -8.378 -10.654 1.00 0.00 H new ATOM 0 HG22 VAL A 144 115.397 -7.526 -9.527 1.00 0.00 H new ATOM 0 HG23 VAL A 144 116.465 -8.818 -8.930 1.00 0.00 H new ATOM 1977 N GLY A 145 115.133 -11.402 -7.640 1.00 0.00 N ATOM 1978 CA GLY A 145 115.936 -11.939 -6.503 1.00 0.00 C ATOM 1979 C GLY A 145 116.880 -13.045 -6.982 1.00 0.00 C ATOM 1980 O GLY A 145 116.513 -13.892 -7.771 1.00 0.00 O ATOM 0 H GLY A 145 114.968 -12.057 -8.404 1.00 0.00 H new ATOM 0 HA2 GLY A 145 116.512 -11.134 -6.046 1.00 0.00 H new ATOM 0 HA3 GLY A 145 115.270 -12.330 -5.734 1.00 0.00 H new ATOM 1983 N TYR A 146 118.093 -13.048 -6.487 1.00 0.00 N ATOM 1984 CA TYR A 146 119.076 -14.103 -6.881 1.00 0.00 C ATOM 1985 C TYR A 146 119.649 -14.760 -5.620 1.00 0.00 C ATOM 1986 O TYR A 146 119.795 -14.119 -4.598 1.00 0.00 O ATOM 1987 CB TYR A 146 120.177 -13.368 -7.650 1.00 0.00 C ATOM 1988 CG TYR A 146 119.584 -12.672 -8.853 1.00 0.00 C ATOM 1989 CD1 TYR A 146 119.222 -13.413 -9.984 1.00 0.00 C ATOM 1990 CD2 TYR A 146 119.394 -11.286 -8.835 1.00 0.00 C ATOM 1991 CE1 TYR A 146 118.672 -12.767 -11.098 1.00 0.00 C ATOM 1992 CE2 TYR A 146 118.844 -10.639 -9.948 1.00 0.00 C ATOM 1993 CZ TYR A 146 118.483 -11.380 -11.080 1.00 0.00 C ATOM 1994 OH TYR A 146 117.942 -10.743 -12.178 1.00 0.00 O ATOM 0 H TYR A 146 118.446 -12.360 -5.822 1.00 0.00 H new ATOM 0 HA TYR A 146 118.624 -14.889 -7.487 1.00 0.00 H new ATOM 0 HB2 TYR A 146 120.663 -12.640 -7.000 1.00 0.00 H new ATOM 0 HB3 TYR A 146 120.944 -14.074 -7.968 1.00 0.00 H new ATOM 0 HD1 TYR A 146 119.367 -14.483 -9.997 1.00 0.00 H new ATOM 0 HD2 TYR A 146 119.672 -10.715 -7.962 1.00 0.00 H new ATOM 0 HE1 TYR A 146 118.394 -13.339 -11.971 1.00 0.00 H new ATOM 0 HE2 TYR A 146 118.698 -9.569 -9.934 1.00 0.00 H new ATOM 0 HH TYR A 146 117.878 -9.781 -12.000 1.00 0.00 H new ATOM 2003 N ARG A 147 119.972 -16.028 -5.676 1.00 0.00 N ATOM 2004 CA ARG A 147 120.529 -16.706 -4.463 1.00 0.00 C ATOM 2005 C ARG A 147 121.825 -17.455 -4.797 1.00 0.00 C ATOM 2006 O ARG A 147 121.854 -18.313 -5.659 1.00 0.00 O ATOM 2007 CB ARG A 147 119.442 -17.690 -4.033 1.00 0.00 C ATOM 2008 CG ARG A 147 119.839 -18.341 -2.706 1.00 0.00 C ATOM 2009 CD ARG A 147 118.802 -19.402 -2.325 1.00 0.00 C ATOM 2010 NE ARG A 147 117.522 -18.655 -2.177 1.00 0.00 N ATOM 2011 CZ ARG A 147 116.461 -19.047 -2.827 1.00 0.00 C ATOM 2012 NH1 ARG A 147 116.146 -20.312 -2.861 1.00 0.00 N ATOM 2013 NH2 ARG A 147 115.714 -18.171 -3.444 1.00 0.00 N ATOM 0 H ARG A 147 119.876 -16.620 -6.501 1.00 0.00 H new ATOM 0 HA ARG A 147 120.780 -15.992 -3.678 1.00 0.00 H new ATOM 0 HB2 ARG A 147 118.489 -17.172 -3.925 1.00 0.00 H new ATOM 0 HB3 ARG A 147 119.305 -18.454 -4.798 1.00 0.00 H new ATOM 0 HG2 ARG A 147 120.825 -18.797 -2.793 1.00 0.00 H new ATOM 0 HG3 ARG A 147 119.905 -17.585 -1.924 1.00 0.00 H new ATOM 0 HD2 ARG A 147 118.724 -20.171 -3.094 1.00 0.00 H new ATOM 0 HD3 ARG A 147 119.075 -19.905 -1.397 1.00 0.00 H new ATOM 0 HE ARG A 147 117.475 -17.838 -1.568 1.00 0.00 H new ATOM 0 HH11 ARG A 147 116.729 -20.996 -2.379 1.00 0.00 H new ATOM 0 HH12 ARG A 147 115.316 -20.617 -3.369 1.00 0.00 H new ATOM 0 HH21 ARG A 147 115.960 -17.182 -3.417 1.00 0.00 H new ATOM 0 HH22 ARG A 147 114.884 -18.476 -3.953 1.00 0.00 H new ATOM 2024 N PHE A 148 122.897 -17.134 -4.115 1.00 0.00 N ATOM 2025 CA PHE A 148 124.194 -17.823 -4.383 1.00 0.00 C ATOM 2026 C PHE A 148 124.614 -18.651 -3.166 1.00 0.00 C ATOM 2027 CB PHE A 148 125.197 -16.697 -4.635 1.00 0.00 C ATOM 2028 CG PHE A 148 126.530 -17.289 -5.031 1.00 0.00 C ATOM 2029 CD1 PHE A 148 126.780 -17.619 -6.368 1.00 0.00 C ATOM 2030 CD2 PHE A 148 127.514 -17.510 -4.060 1.00 0.00 C ATOM 2031 CE1 PHE A 148 128.015 -18.169 -6.734 1.00 0.00 C ATOM 2032 CE2 PHE A 148 128.749 -18.060 -4.426 1.00 0.00 C ATOM 2033 CZ PHE A 148 128.998 -18.389 -5.763 1.00 0.00 C ATOM 0 H PHE A 148 122.928 -16.424 -3.384 1.00 0.00 H new ATOM 0 HA PHE A 148 124.130 -18.509 -5.228 1.00 0.00 H new ATOM 0 HB2 PHE A 148 124.831 -16.039 -5.423 1.00 0.00 H new ATOM 0 HB3 PHE A 148 125.309 -16.088 -3.738 1.00 0.00 H new ATOM 0 HD1 PHE A 148 126.021 -17.450 -7.117 1.00 0.00 H new ATOM 0 HD2 PHE A 148 127.321 -17.256 -3.028 1.00 0.00 H new ATOM 0 HE1 PHE A 148 128.208 -18.423 -7.766 1.00 0.00 H new ATOM 0 HE2 PHE A 148 129.508 -18.230 -3.677 1.00 0.00 H new ATOM 0 HZ PHE A 148 129.950 -18.813 -6.046 1.00 0.00 H new TER 2042 PHE A 148