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 62 TYR OH : rot 180:sc= 1.01 USER MOD Set 1.2: A 108 SER OG : rot 180:sc= 0 USER MOD Set 1.3: A 130 SER OG : rot 170:sc= 1.23 USER MOD Set 2.1: A 87 TYR OH : rot 180:sc= -0.153 USER MOD Set 2.2: A 89 LYS NZ :NH3+ -119:sc= 0.786 (180deg=-0.0466) USER MOD Set 2.3: A 103 SER OG : rot 176:sc= 0.44 USER MOD Set 3.1: A 58 ASN : amide:sc= -1.58 K(o=-2.1,f=-8.6!) USER MOD Set 3.2: A 61 GLN : amide:sc= -0.518 X(o=-2.1,f=-2) USER MOD Set 4.1: A 51 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 53 SER OG : rot 180:sc= 0 USER MOD Set 5.1: A 19 ASN : amide:sc= -0.506 K(o=-0.85,f=-0.21) USER MOD Set 5.2: A 48 LYS NZ :NH3+ -145:sc= -0.345 (180deg=0) USER MOD Set 6.1: A 42 SER OG : rot -69:sc= 1.19 USER MOD Set 6.2: A 66 THR OG1 : rot 74:sc= 1.15 USER MOD Set 7.1: A 12 SER OG : rot 90:sc= -4.57! USER MOD Set 7.2: A 139 THR OG1 : rot -88:sc= 0.505 USER MOD Single : A 2 THR OG1 : rot -40:sc= 0.146 USER MOD Single : A 3 SER OG : rot 180:sc= -0.202 USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.664 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 MET CE :methyl -151:sc= -0.515 (180deg=-1.88!) USER MOD Single : A 25 ASN : amide:sc= -2.22 K(o=-2.2,f=-6.8!) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= 0.763 K(o=0.76,f=-1.8!) USER MOD Single : A 35 SER OG : rot -170:sc= 0 USER MOD Single : A 44 THR OG1 : rot 37:sc= 0.006 USER MOD Single : A 45 TYR OH : rot 85:sc= 0.998 USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.754 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0.00336 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 ASN : amide:sc= -1.16 K(o=-1.2,f=-1.7) USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= 0.392 K(o=0.39,f=-7.3!) USER MOD Single : A 78 SER OG : rot 180:sc=-0.00698 USER MOD Single : A 80 TYR OH : rot 180:sc= 0.492 USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 25:sc= 0.0748 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 ASN : amide:sc= -0.0527 K(o=-0.053,f=-2.1!) USER MOD Single : A 102 THR OG1 : rot 92:sc= 1.11 USER MOD Single : A 105 TYR OH : rot -119:sc= 0.022 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 GLN : amide:sc= -0.517 X(o=-0.52,f=-0.19) USER MOD Single : A 116 ASN : amide:sc= 0.544 K(o=0.54,f=0) USER MOD Single : A 118 MET CE :methyl 135:sc= -0.174 (180deg=-1.12) USER MOD Single : A 120 ASN : amide:sc= -2.05! C(o=-2.1!,f=-9.2!) USER MOD Single : A 126 SER OG : rot 180:sc= -0.15 USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= -0.0171 K(o=-0.017,f=-0.81) USER MOD Single : A 134 SER OG : rot 180:sc= -0.326 USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 2 124.634 -17.822 -0.141 1.00 0.00 N ATOM 2 CA THR A 2 124.739 -17.056 -1.418 1.00 0.00 C ATOM 3 C THR A 2 124.191 -15.641 -1.221 1.00 0.00 C ATOM 4 O THR A 2 123.657 -15.317 -0.177 1.00 0.00 O ATOM 5 CB THR A 2 123.886 -17.829 -2.428 1.00 0.00 C ATOM 6 OG1 THR A 2 122.535 -17.849 -1.988 1.00 0.00 O ATOM 7 CG2 THR A 2 124.408 -19.263 -2.555 1.00 0.00 C ATOM 0 HA THR A 2 125.770 -16.959 -1.758 1.00 0.00 H new ATOM 0 HB THR A 2 123.944 -17.340 -3.400 1.00 0.00 H new ATOM 0 HG1 THR A 2 122.509 -17.981 -1.017 1.00 0.00 H new ATOM 0 HG21 THR A 2 123.798 -19.810 -3.274 1.00 0.00 H new ATOM 0 HG22 THR A 2 125.443 -19.245 -2.896 1.00 0.00 H new ATOM 0 HG23 THR A 2 124.355 -19.757 -1.585 1.00 0.00 H new ATOM 15 N SER A 3 124.314 -14.797 -2.212 1.00 0.00 N ATOM 16 CA SER A 3 123.795 -13.405 -2.077 1.00 0.00 C ATOM 17 C SER A 3 122.561 -13.232 -2.961 1.00 0.00 C ATOM 18 O SER A 3 122.421 -13.893 -3.970 1.00 0.00 O ATOM 19 CB SER A 3 124.933 -12.509 -2.560 1.00 0.00 C ATOM 20 OG SER A 3 125.151 -12.733 -3.947 1.00 0.00 O ATOM 0 H SER A 3 124.751 -15.012 -3.108 1.00 0.00 H new ATOM 0 HA SER A 3 123.499 -13.164 -1.056 1.00 0.00 H new ATOM 0 HB2 SER A 3 124.687 -11.462 -2.383 1.00 0.00 H new ATOM 0 HB3 SER A 3 125.842 -12.722 -1.998 1.00 0.00 H new ATOM 0 HG SER A 3 125.880 -12.158 -4.261 1.00 0.00 H new ATOM 25 N THR A 4 121.670 -12.348 -2.600 1.00 0.00 N ATOM 26 CA THR A 4 120.455 -12.141 -3.438 1.00 0.00 C ATOM 27 C THR A 4 120.176 -10.646 -3.619 1.00 0.00 C ATOM 28 O THR A 4 120.288 -9.867 -2.693 1.00 0.00 O ATOM 29 CB THR A 4 119.317 -12.814 -2.668 1.00 0.00 C ATOM 30 OG1 THR A 4 119.674 -14.159 -2.381 1.00 0.00 O ATOM 31 CG2 THR A 4 118.042 -12.790 -3.512 1.00 0.00 C ATOM 0 H THR A 4 121.730 -11.764 -1.766 1.00 0.00 H new ATOM 0 HA THR A 4 120.572 -12.560 -4.437 1.00 0.00 H new ATOM 0 HB THR A 4 119.141 -12.277 -1.736 1.00 0.00 H new ATOM 0 HG1 THR A 4 118.947 -14.592 -1.886 1.00 0.00 H new ATOM 0 HG21 THR A 4 117.232 -13.270 -2.962 1.00 0.00 H new ATOM 0 HG22 THR A 4 117.770 -11.757 -3.731 1.00 0.00 H new ATOM 0 HG23 THR A 4 118.214 -13.326 -4.446 1.00 0.00 H new ATOM 39 N VAL A 5 119.804 -10.248 -4.805 1.00 0.00 N ATOM 40 CA VAL A 5 119.502 -8.808 -5.059 1.00 0.00 C ATOM 41 C VAL A 5 118.024 -8.657 -5.422 1.00 0.00 C ATOM 42 O VAL A 5 117.492 -9.428 -6.195 1.00 0.00 O ATOM 43 CB VAL A 5 120.392 -8.411 -6.241 1.00 0.00 C ATOM 44 CG1 VAL A 5 120.190 -6.929 -6.557 1.00 0.00 C ATOM 45 CG2 VAL A 5 121.861 -8.656 -5.883 1.00 0.00 C ATOM 0 H VAL A 5 119.695 -10.860 -5.614 1.00 0.00 H new ATOM 0 HA VAL A 5 119.692 -8.179 -4.189 1.00 0.00 H new ATOM 0 HB VAL A 5 120.124 -9.011 -7.111 1.00 0.00 H new ATOM 0 HG11 VAL A 5 120.823 -6.647 -7.398 1.00 0.00 H new ATOM 0 HG12 VAL A 5 119.146 -6.751 -6.813 1.00 0.00 H new ATOM 0 HG13 VAL A 5 120.457 -6.331 -5.685 1.00 0.00 H new ATOM 0 HG21 VAL A 5 122.493 -8.373 -6.725 1.00 0.00 H new ATOM 0 HG22 VAL A 5 122.128 -8.058 -5.012 1.00 0.00 H new ATOM 0 HG23 VAL A 5 122.009 -9.712 -5.657 1.00 0.00 H new ATOM 55 N THR A 6 117.357 -7.670 -4.880 1.00 0.00 N ATOM 56 CA THR A 6 115.910 -7.479 -5.209 1.00 0.00 C ATOM 57 C THR A 6 115.515 -6.012 -5.028 1.00 0.00 C ATOM 58 O THR A 6 115.783 -5.417 -4.000 1.00 0.00 O ATOM 59 CB THR A 6 115.161 -8.365 -4.210 1.00 0.00 C ATOM 60 OG1 THR A 6 115.613 -9.706 -4.338 1.00 0.00 O ATOM 61 CG2 THR A 6 113.658 -8.300 -4.487 1.00 0.00 C ATOM 0 H THR A 6 117.748 -6.991 -4.227 1.00 0.00 H new ATOM 0 HA THR A 6 115.681 -7.742 -6.242 1.00 0.00 H new ATOM 0 HB THR A 6 115.353 -8.011 -3.197 1.00 0.00 H new ATOM 0 HG1 THR A 6 115.136 -10.275 -3.698 1.00 0.00 H new ATOM 0 HG21 THR A 6 113.129 -8.932 -3.774 1.00 0.00 H new ATOM 0 HG22 THR A 6 113.313 -7.271 -4.385 1.00 0.00 H new ATOM 0 HG23 THR A 6 113.459 -8.651 -5.500 1.00 0.00 H new ATOM 69 N GLY A 7 114.881 -5.418 -6.009 1.00 0.00 N ATOM 70 CA GLY A 7 114.476 -3.990 -5.874 1.00 0.00 C ATOM 71 C GLY A 7 113.459 -3.631 -6.960 1.00 0.00 C ATOM 72 O GLY A 7 113.194 -4.410 -7.855 1.00 0.00 O ATOM 0 H GLY A 7 114.629 -5.860 -6.893 1.00 0.00 H new ATOM 0 HA2 GLY A 7 114.044 -3.817 -4.888 1.00 0.00 H new ATOM 0 HA3 GLY A 7 115.351 -3.346 -5.956 1.00 0.00 H new ATOM 75 N GLY A 8 112.890 -2.453 -6.887 1.00 0.00 N ATOM 76 CA GLY A 8 111.888 -2.039 -7.913 1.00 0.00 C ATOM 77 C GLY A 8 111.417 -0.606 -7.640 1.00 0.00 C ATOM 78 O GLY A 8 112.212 0.288 -7.420 1.00 0.00 O ATOM 0 H GLY A 8 113.077 -1.762 -6.161 1.00 0.00 H new ATOM 0 HA2 GLY A 8 112.328 -2.102 -8.908 1.00 0.00 H new ATOM 0 HA3 GLY A 8 111.037 -2.719 -7.897 1.00 0.00 H new ATOM 81 N TYR A 9 110.128 -0.385 -7.657 1.00 0.00 N ATOM 82 CA TYR A 9 109.586 0.985 -7.403 1.00 0.00 C ATOM 83 C TYR A 9 108.277 0.884 -6.610 1.00 0.00 C ATOM 84 O TYR A 9 107.669 -0.171 -6.557 1.00 0.00 O ATOM 85 CB TYR A 9 109.358 1.588 -8.798 1.00 0.00 C ATOM 86 CG TYR A 9 108.213 0.885 -9.494 1.00 0.00 C ATOM 87 CD1 TYR A 9 108.441 -0.310 -10.187 1.00 0.00 C ATOM 88 CD2 TYR A 9 106.924 1.430 -9.446 1.00 0.00 C ATOM 89 CE1 TYR A 9 107.382 -0.961 -10.830 1.00 0.00 C ATOM 90 CE2 TYR A 9 105.864 0.780 -10.090 1.00 0.00 C ATOM 91 CZ TYR A 9 106.094 -0.415 -10.782 1.00 0.00 C ATOM 92 OH TYR A 9 105.049 -1.057 -11.416 1.00 0.00 O ATOM 0 H TYR A 9 109.422 -1.099 -7.837 1.00 0.00 H new ATOM 0 HA TYR A 9 110.259 1.606 -6.812 1.00 0.00 H new ATOM 0 HB2 TYR A 9 109.140 2.652 -8.710 1.00 0.00 H new ATOM 0 HB3 TYR A 9 110.266 1.496 -9.394 1.00 0.00 H new ATOM 0 HD1 TYR A 9 109.435 -0.730 -10.225 1.00 0.00 H new ATOM 0 HD2 TYR A 9 106.747 2.352 -8.912 1.00 0.00 H new ATOM 0 HE1 TYR A 9 107.558 -1.884 -11.363 1.00 0.00 H new ATOM 0 HE2 TYR A 9 104.870 1.200 -10.053 1.00 0.00 H new ATOM 0 HH TYR A 9 104.223 -0.546 -11.284 1.00 0.00 H new ATOM 101 N ALA A 10 107.836 1.952 -5.983 1.00 0.00 N ATOM 102 CA ALA A 10 106.569 1.851 -5.200 1.00 0.00 C ATOM 103 C ALA A 10 105.727 3.125 -5.299 1.00 0.00 C ATOM 104 O ALA A 10 106.219 4.229 -5.165 1.00 0.00 O ATOM 105 CB ALA A 10 107.024 1.631 -3.758 1.00 0.00 C ATOM 0 H ALA A 10 108.288 2.866 -5.980 1.00 0.00 H new ATOM 0 HA ALA A 10 105.936 1.048 -5.577 1.00 0.00 H new ATOM 0 HB1 ALA A 10 106.152 1.545 -3.110 1.00 0.00 H new ATOM 0 HB2 ALA A 10 107.612 0.715 -3.698 1.00 0.00 H new ATOM 0 HB3 ALA A 10 107.633 2.475 -3.436 1.00 0.00 H new ATOM 111 N GLN A 11 104.444 2.962 -5.490 1.00 0.00 N ATOM 112 CA GLN A 11 103.522 4.132 -5.553 1.00 0.00 C ATOM 113 C GLN A 11 102.706 4.148 -4.261 1.00 0.00 C ATOM 114 O GLN A 11 102.111 3.152 -3.897 1.00 0.00 O ATOM 115 CB GLN A 11 102.623 3.875 -6.764 1.00 0.00 C ATOM 116 CG GLN A 11 101.696 5.074 -6.981 1.00 0.00 C ATOM 117 CD GLN A 11 100.810 4.829 -8.206 1.00 0.00 C ATOM 118 OE1 GLN A 11 101.008 3.879 -8.938 1.00 0.00 O ATOM 119 NE2 GLN A 11 99.832 5.654 -8.461 1.00 0.00 N ATOM 0 H GLN A 11 103.991 2.055 -5.606 1.00 0.00 H new ATOM 0 HA GLN A 11 104.033 5.090 -5.651 1.00 0.00 H new ATOM 0 HB2 GLN A 11 103.232 3.708 -7.652 1.00 0.00 H new ATOM 0 HB3 GLN A 11 102.034 2.971 -6.607 1.00 0.00 H new ATOM 0 HG2 GLN A 11 101.076 5.231 -6.098 1.00 0.00 H new ATOM 0 HG3 GLN A 11 102.285 5.980 -7.122 1.00 0.00 H new ATOM 0 HE21 GLN A 11 99.665 6.452 -7.848 1.00 0.00 H new ATOM 0 HE22 GLN A 11 99.235 5.501 -9.274 1.00 0.00 H new ATOM 126 N SER A 12 102.704 5.236 -3.538 1.00 0.00 N ATOM 127 CA SER A 12 101.957 5.246 -2.246 1.00 0.00 C ATOM 128 C SER A 12 100.970 6.409 -2.141 1.00 0.00 C ATOM 129 O SER A 12 101.206 7.496 -2.634 1.00 0.00 O ATOM 130 CB SER A 12 103.045 5.399 -1.186 1.00 0.00 C ATOM 131 OG SER A 12 104.081 4.461 -1.437 1.00 0.00 O ATOM 0 H SER A 12 103.179 6.106 -3.780 1.00 0.00 H new ATOM 0 HA SER A 12 101.357 4.343 -2.137 1.00 0.00 H new ATOM 0 HB2 SER A 12 103.445 6.413 -1.203 1.00 0.00 H new ATOM 0 HB3 SER A 12 102.626 5.238 -0.193 1.00 0.00 H new ATOM 0 HG SER A 12 104.751 4.864 -2.028 1.00 0.00 H new ATOM 136 N ASP A 13 99.889 6.186 -1.440 1.00 0.00 N ATOM 137 CA ASP A 13 98.889 7.265 -1.212 1.00 0.00 C ATOM 138 C ASP A 13 99.224 7.884 0.141 1.00 0.00 C ATOM 139 O ASP A 13 99.792 7.217 0.981 1.00 0.00 O ATOM 140 CB ASP A 13 97.528 6.565 -1.178 1.00 0.00 C ATOM 141 CG ASP A 13 96.403 7.607 -1.140 1.00 0.00 C ATOM 142 OD1 ASP A 13 96.680 8.770 -1.389 1.00 0.00 O ATOM 143 OD2 ASP A 13 95.278 7.221 -0.862 1.00 0.00 O ATOM 0 H ASP A 13 99.656 5.290 -1.012 1.00 0.00 H new ATOM 0 HA ASP A 13 98.887 8.046 -1.973 1.00 0.00 H new ATOM 0 HB2 ASP A 13 97.415 5.928 -2.055 1.00 0.00 H new ATOM 0 HB3 ASP A 13 97.465 5.917 -0.304 1.00 0.00 H new ATOM 147 N ALA A 14 98.918 9.130 0.372 1.00 0.00 N ATOM 148 CA ALA A 14 99.284 9.723 1.684 1.00 0.00 C ATOM 149 C ALA A 14 98.148 10.550 2.268 1.00 0.00 C ATOM 150 O ALA A 14 97.679 11.505 1.679 1.00 0.00 O ATOM 151 CB ALA A 14 100.492 10.608 1.385 1.00 0.00 C ATOM 0 H ALA A 14 98.439 9.752 -0.279 1.00 0.00 H new ATOM 0 HA ALA A 14 99.499 8.952 2.424 1.00 0.00 H new ATOM 0 HB1 ALA A 14 100.829 11.087 2.304 1.00 0.00 H new ATOM 0 HB2 ALA A 14 101.298 9.998 0.977 1.00 0.00 H new ATOM 0 HB3 ALA A 14 100.213 11.372 0.659 1.00 0.00 H new ATOM 157 N GLN A 15 97.737 10.198 3.449 1.00 0.00 N ATOM 158 CA GLN A 15 96.660 10.961 4.133 1.00 0.00 C ATOM 159 C GLN A 15 97.242 12.291 4.605 1.00 0.00 C ATOM 160 O GLN A 15 98.164 12.329 5.406 1.00 0.00 O ATOM 161 CB GLN A 15 96.242 10.094 5.323 1.00 0.00 C ATOM 162 CG GLN A 15 95.046 10.735 6.028 1.00 0.00 C ATOM 163 CD GLN A 15 94.711 9.940 7.291 1.00 0.00 C ATOM 164 OE1 GLN A 15 95.530 9.814 8.179 1.00 0.00 O ATOM 165 NE2 GLN A 15 93.532 9.393 7.408 1.00 0.00 N ATOM 0 H GLN A 15 98.104 9.406 3.976 1.00 0.00 H new ATOM 0 HA GLN A 15 95.806 11.175 3.490 1.00 0.00 H new ATOM 0 HB2 GLN A 15 95.982 9.092 4.982 1.00 0.00 H new ATOM 0 HB3 GLN A 15 97.074 9.988 6.019 1.00 0.00 H new ATOM 0 HG2 GLN A 15 95.274 11.769 6.286 1.00 0.00 H new ATOM 0 HG3 GLN A 15 94.185 10.756 5.360 1.00 0.00 H new ATOM 0 HE21 GLN A 15 92.844 9.499 6.662 1.00 0.00 H new ATOM 0 HE22 GLN A 15 93.298 8.860 8.245 1.00 0.00 H new ATOM 172 N GLY A 16 96.736 13.370 4.073 1.00 0.00 N ATOM 173 CA GLY A 16 97.262 14.721 4.419 1.00 0.00 C ATOM 174 C GLY A 16 98.074 15.230 3.222 1.00 0.00 C ATOM 175 O GLY A 16 98.121 16.413 2.942 1.00 0.00 O ATOM 0 H GLY A 16 95.968 13.372 3.402 1.00 0.00 H new ATOM 0 HA2 GLY A 16 96.442 15.404 4.643 1.00 0.00 H new ATOM 0 HA3 GLY A 16 97.887 14.671 5.311 1.00 0.00 H new ATOM 178 N GLN A 17 98.680 14.327 2.493 1.00 0.00 N ATOM 179 CA GLN A 17 99.458 14.719 1.281 1.00 0.00 C ATOM 180 C GLN A 17 98.779 14.130 0.038 1.00 0.00 C ATOM 181 O GLN A 17 98.946 12.967 -0.273 1.00 0.00 O ATOM 182 CB GLN A 17 100.849 14.120 1.479 1.00 0.00 C ATOM 183 CG GLN A 17 101.764 14.564 0.334 1.00 0.00 C ATOM 184 CD GLN A 17 103.169 13.990 0.540 1.00 0.00 C ATOM 185 OE1 GLN A 17 103.465 13.419 1.571 1.00 0.00 O ATOM 186 NE2 GLN A 17 104.056 14.120 -0.409 1.00 0.00 N ATOM 0 H GLN A 17 98.668 13.326 2.689 1.00 0.00 H new ATOM 0 HA GLN A 17 99.513 15.799 1.144 1.00 0.00 H new ATOM 0 HB2 GLN A 17 101.262 14.442 2.435 1.00 0.00 H new ATOM 0 HB3 GLN A 17 100.787 13.032 1.508 1.00 0.00 H new ATOM 0 HG2 GLN A 17 101.359 14.225 -0.620 1.00 0.00 H new ATOM 0 HG3 GLN A 17 101.808 15.652 0.293 1.00 0.00 H new ATOM 0 HE21 GLN A 17 103.810 14.599 -1.275 1.00 0.00 H new ATOM 0 HE22 GLN A 17 104.995 13.743 -0.284 1.00 0.00 H new ATOM 193 N MET A 18 98.004 14.917 -0.660 1.00 0.00 N ATOM 194 CA MET A 18 97.297 14.392 -1.872 1.00 0.00 C ATOM 195 C MET A 18 98.296 13.935 -2.940 1.00 0.00 C ATOM 196 O MET A 18 98.092 12.937 -3.605 1.00 0.00 O ATOM 197 CB MET A 18 96.469 15.570 -2.388 1.00 0.00 C ATOM 198 CG MET A 18 95.397 15.930 -1.359 1.00 0.00 C ATOM 199 SD MET A 18 94.345 17.249 -2.019 1.00 0.00 S ATOM 200 CE MET A 18 93.386 17.548 -0.515 1.00 0.00 C ATOM 0 H MET A 18 97.828 15.899 -0.447 1.00 0.00 H new ATOM 0 HA MET A 18 96.682 13.524 -1.634 1.00 0.00 H new ATOM 0 HB2 MET A 18 97.114 16.429 -2.572 1.00 0.00 H new ATOM 0 HB3 MET A 18 96.003 15.312 -3.339 1.00 0.00 H new ATOM 0 HG2 MET A 18 94.794 15.053 -1.124 1.00 0.00 H new ATOM 0 HG3 MET A 18 95.864 16.254 -0.429 1.00 0.00 H new ATOM 0 HE1 MET A 18 92.661 18.341 -0.698 1.00 0.00 H new ATOM 0 HE2 MET A 18 92.862 16.635 -0.230 1.00 0.00 H new ATOM 0 HE3 MET A 18 94.056 17.848 0.290 1.00 0.00 H new ATOM 208 N ASN A 19 99.359 14.671 -3.130 1.00 0.00 N ATOM 209 CA ASN A 19 100.358 14.296 -4.182 1.00 0.00 C ATOM 210 C ASN A 19 100.911 12.885 -3.945 1.00 0.00 C ATOM 211 O ASN A 19 101.514 12.604 -2.927 1.00 0.00 O ATOM 212 CB ASN A 19 101.479 15.331 -4.058 1.00 0.00 C ATOM 213 CG ASN A 19 100.909 16.739 -4.250 1.00 0.00 C ATOM 214 OD1 ASN A 19 101.245 17.648 -3.516 1.00 0.00 O ATOM 215 ND2 ASN A 19 100.054 16.960 -5.212 1.00 0.00 N ATOM 0 H ASN A 19 99.581 15.516 -2.604 1.00 0.00 H new ATOM 0 HA ASN A 19 99.907 14.289 -5.174 1.00 0.00 H new ATOM 0 HB2 ASN A 19 101.953 15.251 -3.080 1.00 0.00 H new ATOM 0 HB3 ASN A 19 102.250 15.136 -4.803 1.00 0.00 H new ATOM 0 HD21 ASN A 19 99.669 17.895 -5.347 1.00 0.00 H new ATOM 0 HD22 ASN A 19 99.772 16.198 -5.828 1.00 0.00 H new ATOM 221 N LYS A 20 100.716 12.003 -4.893 1.00 0.00 N ATOM 222 CA LYS A 20 101.234 10.608 -4.748 1.00 0.00 C ATOM 223 C LYS A 20 102.762 10.608 -4.876 1.00 0.00 C ATOM 224 O LYS A 20 103.348 11.560 -5.356 1.00 0.00 O ATOM 225 CB LYS A 20 100.581 9.813 -5.887 1.00 0.00 C ATOM 226 CG LYS A 20 101.085 10.317 -7.245 1.00 0.00 C ATOM 227 CD LYS A 20 100.325 9.609 -8.368 1.00 0.00 C ATOM 228 CE LYS A 20 101.017 9.879 -9.707 1.00 0.00 C ATOM 229 NZ LYS A 20 99.909 10.145 -10.666 1.00 0.00 N ATOM 0 H LYS A 20 100.219 12.190 -5.764 1.00 0.00 H new ATOM 0 HA LYS A 20 100.998 10.171 -3.778 1.00 0.00 H new ATOM 0 HB2 LYS A 20 100.810 8.753 -5.777 1.00 0.00 H new ATOM 0 HB3 LYS A 20 99.497 9.912 -5.834 1.00 0.00 H new ATOM 0 HG2 LYS A 20 100.944 11.395 -7.320 1.00 0.00 H new ATOM 0 HG3 LYS A 20 102.154 10.128 -7.340 1.00 0.00 H new ATOM 0 HD2 LYS A 20 100.288 8.537 -8.176 1.00 0.00 H new ATOM 0 HD3 LYS A 20 99.294 9.962 -8.402 1.00 0.00 H new ATOM 0 HE2 LYS A 20 101.692 10.732 -9.638 1.00 0.00 H new ATOM 0 HE3 LYS A 20 101.615 9.024 -10.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 100.304 10.339 -11.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 99.286 9.313 -10.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 99.361 10.968 -10.344 1.00 0.00 H new ATOM 239 N MET A 21 103.414 9.562 -4.436 1.00 0.00 N ATOM 240 CA MET A 21 104.905 9.531 -4.524 1.00 0.00 C ATOM 241 C MET A 21 105.400 8.258 -5.225 1.00 0.00 C ATOM 242 O MET A 21 104.722 7.251 -5.270 1.00 0.00 O ATOM 243 CB MET A 21 105.379 9.561 -3.071 1.00 0.00 C ATOM 244 CG MET A 21 104.915 10.859 -2.406 1.00 0.00 C ATOM 245 SD MET A 21 105.630 10.974 -0.747 1.00 0.00 S ATOM 246 CE MET A 21 104.924 9.443 -0.088 1.00 0.00 C ATOM 0 H MET A 21 102.983 8.735 -4.023 1.00 0.00 H new ATOM 0 HA MET A 21 105.292 10.366 -5.109 1.00 0.00 H new ATOM 0 HB2 MET A 21 104.982 8.702 -2.531 1.00 0.00 H new ATOM 0 HB3 MET A 21 106.466 9.488 -3.031 1.00 0.00 H new ATOM 0 HG2 MET A 21 105.220 11.717 -3.006 1.00 0.00 H new ATOM 0 HG3 MET A 21 103.827 10.882 -2.347 1.00 0.00 H new ATOM 0 HE1 MET A 21 104.783 9.541 0.988 1.00 0.00 H new ATOM 0 HE2 MET A 21 103.962 9.252 -0.564 1.00 0.00 H new ATOM 0 HE3 MET A 21 105.601 8.613 -0.291 1.00 0.00 H new ATOM 254 N GLY A 22 106.593 8.309 -5.759 1.00 0.00 N ATOM 255 CA GLY A 22 107.174 7.117 -6.451 1.00 0.00 C ATOM 256 C GLY A 22 108.673 7.046 -6.147 1.00 0.00 C ATOM 257 O GLY A 22 109.400 7.995 -6.372 1.00 0.00 O ATOM 0 H GLY A 22 107.195 9.132 -5.746 1.00 0.00 H new ATOM 0 HA2 GLY A 22 106.678 6.207 -6.114 1.00 0.00 H new ATOM 0 HA3 GLY A 22 107.011 7.189 -7.526 1.00 0.00 H new ATOM 260 N GLY A 23 109.143 5.943 -5.613 1.00 0.00 N ATOM 261 CA GLY A 23 110.594 5.849 -5.275 1.00 0.00 C ATOM 262 C GLY A 23 111.147 4.484 -5.670 1.00 0.00 C ATOM 263 O GLY A 23 110.467 3.680 -6.276 1.00 0.00 O ATOM 0 H GLY A 23 108.589 5.114 -5.400 1.00 0.00 H new ATOM 0 HA2 GLY A 23 111.145 6.635 -5.792 1.00 0.00 H new ATOM 0 HA3 GLY A 23 110.736 6.010 -4.206 1.00 0.00 H new ATOM 266 N PHE A 24 112.382 4.221 -5.329 1.00 0.00 N ATOM 267 CA PHE A 24 112.999 2.908 -5.678 1.00 0.00 C ATOM 268 C PHE A 24 113.497 2.206 -4.412 1.00 0.00 C ATOM 269 O PHE A 24 113.693 2.824 -3.383 1.00 0.00 O ATOM 270 CB PHE A 24 114.164 3.247 -6.609 1.00 0.00 C ATOM 271 CG PHE A 24 113.633 3.904 -7.862 1.00 0.00 C ATOM 272 CD1 PHE A 24 113.188 3.116 -8.930 1.00 0.00 C ATOM 273 CD2 PHE A 24 113.586 5.299 -7.953 1.00 0.00 C ATOM 274 CE1 PHE A 24 112.696 3.724 -10.091 1.00 0.00 C ATOM 275 CE2 PHE A 24 113.093 5.908 -9.114 1.00 0.00 C ATOM 276 CZ PHE A 24 112.649 5.121 -10.183 1.00 0.00 C ATOM 0 H PHE A 24 112.992 4.862 -4.822 1.00 0.00 H new ATOM 0 HA PHE A 24 112.290 2.231 -6.154 1.00 0.00 H new ATOM 0 HB2 PHE A 24 114.864 3.913 -6.105 1.00 0.00 H new ATOM 0 HB3 PHE A 24 114.714 2.341 -6.865 1.00 0.00 H new ATOM 0 HD1 PHE A 24 113.224 2.039 -8.858 1.00 0.00 H new ATOM 0 HD2 PHE A 24 113.930 5.906 -7.129 1.00 0.00 H new ATOM 0 HE1 PHE A 24 112.353 3.116 -10.915 1.00 0.00 H new ATOM 0 HE2 PHE A 24 113.055 6.985 -9.184 1.00 0.00 H new ATOM 0 HZ PHE A 24 112.270 5.591 -11.079 1.00 0.00 H new ATOM 285 N ASN A 25 113.698 0.918 -4.484 1.00 0.00 N ATOM 286 CA ASN A 25 114.180 0.168 -3.286 1.00 0.00 C ATOM 287 C ASN A 25 115.203 -0.902 -3.680 1.00 0.00 C ATOM 288 O ASN A 25 114.980 -1.679 -4.583 1.00 0.00 O ATOM 289 CB ASN A 25 112.923 -0.479 -2.700 1.00 0.00 C ATOM 290 CG ASN A 25 113.185 -0.898 -1.251 1.00 0.00 C ATOM 291 OD1 ASN A 25 114.319 -0.954 -0.815 1.00 0.00 O ATOM 292 ND2 ASN A 25 112.176 -1.190 -0.478 1.00 0.00 N ATOM 0 H ASN A 25 113.550 0.352 -5.319 1.00 0.00 H new ATOM 0 HA ASN A 25 114.682 0.821 -2.572 1.00 0.00 H new ATOM 0 HB2 ASN A 25 112.089 0.222 -2.741 1.00 0.00 H new ATOM 0 HB3 ASN A 25 112.639 -1.348 -3.294 1.00 0.00 H new ATOM 0 HD21 ASN A 25 112.339 -1.465 0.491 1.00 0.00 H new ATOM 0 HD22 ASN A 25 111.224 -1.143 -0.842 1.00 0.00 H new ATOM 298 N LEU A 26 116.313 -0.954 -2.991 1.00 0.00 N ATOM 299 CA LEU A 26 117.350 -1.987 -3.298 1.00 0.00 C ATOM 300 C LEU A 26 117.609 -2.779 -2.020 1.00 0.00 C ATOM 301 O LEU A 26 117.756 -2.196 -0.962 1.00 0.00 O ATOM 302 CB LEU A 26 118.594 -1.195 -3.722 1.00 0.00 C ATOM 303 CG LEU A 26 119.548 -2.085 -4.533 1.00 0.00 C ATOM 304 CD1 LEU A 26 119.987 -3.290 -3.696 1.00 0.00 C ATOM 305 CD2 LEU A 26 118.839 -2.577 -5.799 1.00 0.00 C ATOM 0 H LEU A 26 116.548 -0.323 -2.225 1.00 0.00 H new ATOM 0 HA LEU A 26 117.057 -2.688 -4.080 1.00 0.00 H new ATOM 0 HB2 LEU A 26 118.297 -0.332 -4.318 1.00 0.00 H new ATOM 0 HB3 LEU A 26 119.107 -0.812 -2.840 1.00 0.00 H new ATOM 0 HG LEU A 26 120.427 -1.502 -4.807 1.00 0.00 H new ATOM 0 HD11 LEU A 26 120.663 -3.913 -4.282 1.00 0.00 H new ATOM 0 HD12 LEU A 26 120.500 -2.943 -2.799 1.00 0.00 H new ATOM 0 HD13 LEU A 26 119.111 -3.873 -3.411 1.00 0.00 H new ATOM 0 HD21 LEU A 26 119.517 -3.208 -6.374 1.00 0.00 H new ATOM 0 HD22 LEU A 26 117.956 -3.152 -5.521 1.00 0.00 H new ATOM 0 HD23 LEU A 26 118.540 -1.721 -6.404 1.00 0.00 H new ATOM 316 N LYS A 27 117.639 -4.090 -2.071 1.00 0.00 N ATOM 317 CA LYS A 27 117.856 -4.856 -0.809 1.00 0.00 C ATOM 318 C LYS A 27 118.944 -5.921 -0.976 1.00 0.00 C ATOM 319 O LYS A 27 119.068 -6.545 -2.015 1.00 0.00 O ATOM 320 CB LYS A 27 116.514 -5.539 -0.533 1.00 0.00 C ATOM 321 CG LYS A 27 115.385 -4.506 -0.537 1.00 0.00 C ATOM 322 CD LYS A 27 114.085 -5.170 -0.076 1.00 0.00 C ATOM 323 CE LYS A 27 112.925 -4.182 -0.222 1.00 0.00 C ATOM 324 NZ LYS A 27 111.849 -4.720 0.656 1.00 0.00 N ATOM 0 H LYS A 27 117.525 -4.651 -2.915 1.00 0.00 H new ATOM 0 HA LYS A 27 118.181 -4.201 -0.001 1.00 0.00 H new ATOM 0 HB2 LYS A 27 116.323 -6.300 -1.289 1.00 0.00 H new ATOM 0 HB3 LYS A 27 116.548 -6.048 0.430 1.00 0.00 H new ATOM 0 HG2 LYS A 27 115.635 -3.675 0.123 1.00 0.00 H new ATOM 0 HG3 LYS A 27 115.260 -4.092 -1.538 1.00 0.00 H new ATOM 0 HD2 LYS A 27 113.891 -6.064 -0.669 1.00 0.00 H new ATOM 0 HD3 LYS A 27 114.176 -5.489 0.962 1.00 0.00 H new ATOM 0 HE2 LYS A 27 113.220 -3.179 0.085 1.00 0.00 H new ATOM 0 HE3 LYS A 27 112.592 -4.114 -1.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 111.018 -4.096 0.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 111.584 -5.673 0.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 112.192 -4.767 1.637 1.00 0.00 H new ATOM 334 N TYR A 28 119.700 -6.155 0.064 1.00 0.00 N ATOM 335 CA TYR A 28 120.759 -7.206 0.018 1.00 0.00 C ATOM 336 C TYR A 28 120.399 -8.291 1.037 1.00 0.00 C ATOM 337 O TYR A 28 120.050 -7.991 2.163 1.00 0.00 O ATOM 338 CB TYR A 28 122.056 -6.499 0.414 1.00 0.00 C ATOM 339 CG TYR A 28 122.366 -5.413 -0.588 1.00 0.00 C ATOM 340 CD1 TYR A 28 122.990 -5.735 -1.798 1.00 0.00 C ATOM 341 CD2 TYR A 28 122.030 -4.083 -0.306 1.00 0.00 C ATOM 342 CE1 TYR A 28 123.278 -4.728 -2.728 1.00 0.00 C ATOM 343 CE2 TYR A 28 122.319 -3.076 -1.235 1.00 0.00 C ATOM 344 CZ TYR A 28 122.943 -3.399 -2.446 1.00 0.00 C ATOM 345 OH TYR A 28 123.228 -2.407 -3.361 1.00 0.00 O ATOM 0 H TYR A 28 119.628 -5.658 0.952 1.00 0.00 H new ATOM 0 HA TYR A 28 120.858 -7.675 -0.961 1.00 0.00 H new ATOM 0 HB2 TYR A 28 121.959 -6.071 1.412 1.00 0.00 H new ATOM 0 HB3 TYR A 28 122.876 -7.216 0.454 1.00 0.00 H new ATOM 0 HD1 TYR A 28 123.250 -6.761 -2.015 1.00 0.00 H new ATOM 0 HD2 TYR A 28 121.548 -3.834 0.628 1.00 0.00 H new ATOM 0 HE1 TYR A 28 123.759 -4.977 -3.663 1.00 0.00 H new ATOM 0 HE2 TYR A 28 122.061 -2.050 -1.017 1.00 0.00 H new ATOM 0 HH TYR A 28 122.929 -1.542 -3.010 1.00 0.00 H new ATOM 354 N ARG A 29 120.450 -9.541 0.656 1.00 0.00 N ATOM 355 CA ARG A 29 120.070 -10.617 1.621 1.00 0.00 C ATOM 356 C ARG A 29 121.177 -11.663 1.785 1.00 0.00 C ATOM 357 O ARG A 29 121.801 -12.092 0.833 1.00 0.00 O ATOM 358 CB ARG A 29 118.824 -11.257 1.009 1.00 0.00 C ATOM 359 CG ARG A 29 118.297 -12.360 1.930 1.00 0.00 C ATOM 360 CD ARG A 29 117.143 -13.087 1.238 1.00 0.00 C ATOM 361 NE ARG A 29 116.674 -14.100 2.224 1.00 0.00 N ATOM 362 CZ ARG A 29 116.328 -15.291 1.817 1.00 0.00 C ATOM 363 NH1 ARG A 29 115.555 -15.425 0.773 1.00 0.00 N ATOM 364 NH2 ARG A 29 116.757 -16.349 2.449 1.00 0.00 N ATOM 0 H ARG A 29 120.735 -9.861 -0.270 1.00 0.00 H new ATOM 0 HA ARG A 29 119.898 -10.212 2.618 1.00 0.00 H new ATOM 0 HB2 ARG A 29 118.054 -10.501 0.856 1.00 0.00 H new ATOM 0 HB3 ARG A 29 119.062 -11.672 0.030 1.00 0.00 H new ATOM 0 HG2 ARG A 29 119.095 -13.063 2.168 1.00 0.00 H new ATOM 0 HG3 ARG A 29 117.959 -11.931 2.873 1.00 0.00 H new ATOM 0 HD2 ARG A 29 116.343 -12.395 0.974 1.00 0.00 H new ATOM 0 HD3 ARG A 29 117.473 -13.561 0.314 1.00 0.00 H new ATOM 0 HE ARG A 29 116.623 -13.864 3.215 1.00 0.00 H new ATOM 0 HH11 ARG A 29 115.222 -14.599 0.276 1.00 0.00 H new ATOM 0 HH12 ARG A 29 115.285 -16.356 0.455 1.00 0.00 H new ATOM 0 HH21 ARG A 29 117.364 -16.246 3.262 1.00 0.00 H new ATOM 0 HH22 ARG A 29 116.486 -17.279 2.130 1.00 0.00 H new ATOM 375 N TYR A 30 121.391 -12.083 3.002 1.00 0.00 N ATOM 376 CA TYR A 30 122.420 -13.121 3.291 1.00 0.00 C ATOM 377 C TYR A 30 121.734 -14.336 3.922 1.00 0.00 C ATOM 378 O TYR A 30 120.852 -14.192 4.746 1.00 0.00 O ATOM 379 CB TYR A 30 123.379 -12.463 4.284 1.00 0.00 C ATOM 380 CG TYR A 30 124.523 -13.402 4.582 1.00 0.00 C ATOM 381 CD1 TYR A 30 125.636 -13.441 3.734 1.00 0.00 C ATOM 382 CD2 TYR A 30 124.469 -14.235 5.706 1.00 0.00 C ATOM 383 CE1 TYR A 30 126.697 -14.312 4.011 1.00 0.00 C ATOM 384 CE2 TYR A 30 125.530 -15.106 5.983 1.00 0.00 C ATOM 385 CZ TYR A 30 126.643 -15.145 5.136 1.00 0.00 C ATOM 386 OH TYR A 30 127.688 -16.003 5.409 1.00 0.00 O ATOM 0 H TYR A 30 120.887 -11.744 3.822 1.00 0.00 H new ATOM 0 HA TYR A 30 122.946 -13.464 2.400 1.00 0.00 H new ATOM 0 HB2 TYR A 30 123.760 -11.529 3.872 1.00 0.00 H new ATOM 0 HB3 TYR A 30 122.851 -12.214 5.204 1.00 0.00 H new ATOM 0 HD1 TYR A 30 125.676 -12.799 2.866 1.00 0.00 H new ATOM 0 HD2 TYR A 30 123.609 -14.206 6.359 1.00 0.00 H new ATOM 0 HE1 TYR A 30 127.556 -14.342 3.358 1.00 0.00 H new ATOM 0 HE2 TYR A 30 125.489 -15.748 6.851 1.00 0.00 H new ATOM 0 HH TYR A 30 127.492 -16.508 6.225 1.00 0.00 H new ATOM 395 N GLU A 31 122.117 -15.528 3.542 1.00 0.00 N ATOM 396 CA GLU A 31 121.463 -16.738 4.125 1.00 0.00 C ATOM 397 C GLU A 31 122.445 -17.911 4.189 1.00 0.00 C ATOM 398 O GLU A 31 123.471 -17.910 3.536 1.00 0.00 O ATOM 399 CB GLU A 31 120.304 -17.055 3.174 1.00 0.00 C ATOM 400 CG GLU A 31 120.849 -17.356 1.772 1.00 0.00 C ATOM 401 CD GLU A 31 119.690 -17.583 0.794 1.00 0.00 C ATOM 402 OE1 GLU A 31 118.572 -17.757 1.252 1.00 0.00 O ATOM 403 OE2 GLU A 31 119.943 -17.578 -0.399 1.00 0.00 O ATOM 0 H GLU A 31 122.850 -15.715 2.858 1.00 0.00 H new ATOM 0 HA GLU A 31 121.123 -16.566 5.146 1.00 0.00 H new ATOM 0 HB2 GLU A 31 119.740 -17.910 3.546 1.00 0.00 H new ATOM 0 HB3 GLU A 31 119.614 -16.212 3.133 1.00 0.00 H new ATOM 0 HG2 GLU A 31 121.468 -16.527 1.428 1.00 0.00 H new ATOM 0 HG3 GLU A 31 121.487 -18.239 1.803 1.00 0.00 H new ATOM 408 N GLU A 32 122.126 -18.918 4.961 1.00 0.00 N ATOM 409 CA GLU A 32 123.021 -20.101 5.060 1.00 0.00 C ATOM 410 C GLU A 32 122.314 -21.312 4.444 1.00 0.00 C ATOM 411 O GLU A 32 121.173 -21.597 4.753 1.00 0.00 O ATOM 412 CB GLU A 32 123.247 -20.297 6.561 1.00 0.00 C ATOM 413 CG GLU A 32 124.371 -21.313 6.788 1.00 0.00 C ATOM 414 CD GLU A 32 124.537 -21.589 8.288 1.00 0.00 C ATOM 415 OE1 GLU A 32 123.778 -21.034 9.068 1.00 0.00 O ATOM 416 OE2 GLU A 32 125.425 -22.352 8.632 1.00 0.00 O ATOM 0 H GLU A 32 121.280 -18.968 5.528 1.00 0.00 H new ATOM 0 HA GLU A 32 123.966 -19.974 4.532 1.00 0.00 H new ATOM 0 HB2 GLU A 32 123.505 -19.346 7.027 1.00 0.00 H new ATOM 0 HB3 GLU A 32 122.329 -20.645 7.034 1.00 0.00 H new ATOM 0 HG2 GLU A 32 124.145 -22.241 6.262 1.00 0.00 H new ATOM 0 HG3 GLU A 32 125.305 -20.932 6.375 1.00 0.00 H new ATOM 421 N ASP A 33 122.977 -22.016 3.569 1.00 0.00 N ATOM 422 CA ASP A 33 122.342 -23.203 2.915 1.00 0.00 C ATOM 423 C ASP A 33 121.895 -24.227 3.964 1.00 0.00 C ATOM 424 O ASP A 33 120.996 -25.013 3.733 1.00 0.00 O ATOM 425 CB ASP A 33 123.433 -23.799 2.021 1.00 0.00 C ATOM 426 CG ASP A 33 123.761 -22.827 0.880 1.00 0.00 C ATOM 427 OD1 ASP A 33 122.958 -21.943 0.625 1.00 0.00 O ATOM 428 OD2 ASP A 33 124.811 -22.986 0.279 1.00 0.00 O ATOM 0 H ASP A 33 123.934 -21.823 3.275 1.00 0.00 H new ATOM 0 HA ASP A 33 121.453 -22.925 2.349 1.00 0.00 H new ATOM 0 HB2 ASP A 33 124.329 -23.999 2.609 1.00 0.00 H new ATOM 0 HB3 ASP A 33 123.100 -24.753 1.613 1.00 0.00 H new ATOM 432 N ASN A 34 122.527 -24.233 5.106 1.00 0.00 N ATOM 433 CA ASN A 34 122.155 -25.219 6.167 1.00 0.00 C ATOM 434 C ASN A 34 120.701 -25.028 6.612 1.00 0.00 C ATOM 435 O ASN A 34 120.002 -25.988 6.881 1.00 0.00 O ATOM 436 CB ASN A 34 123.110 -24.932 7.329 1.00 0.00 C ATOM 437 CG ASN A 34 124.548 -25.227 6.897 1.00 0.00 C ATOM 438 OD1 ASN A 34 124.776 -25.926 5.930 1.00 0.00 O ATOM 439 ND2 ASN A 34 125.537 -24.720 7.581 1.00 0.00 N ATOM 0 H ASN A 34 123.286 -23.598 5.353 1.00 0.00 H new ATOM 0 HA ASN A 34 122.236 -26.245 5.808 1.00 0.00 H new ATOM 0 HB2 ASN A 34 123.019 -23.891 7.639 1.00 0.00 H new ATOM 0 HB3 ASN A 34 122.845 -25.545 8.190 1.00 0.00 H new ATOM 0 HD21 ASN A 34 126.500 -24.911 7.303 1.00 0.00 H new ATOM 0 HD22 ASN A 34 125.347 -24.133 8.393 1.00 0.00 H new ATOM 445 N SER A 35 120.240 -23.808 6.701 1.00 0.00 N ATOM 446 CA SER A 35 118.831 -23.574 7.141 1.00 0.00 C ATOM 447 C SER A 35 118.141 -22.545 6.234 1.00 0.00 C ATOM 448 O SER A 35 118.793 -21.864 5.468 1.00 0.00 O ATOM 449 CB SER A 35 118.948 -23.035 8.566 1.00 0.00 C ATOM 450 OG SER A 35 119.988 -22.068 8.619 1.00 0.00 O ATOM 0 H SER A 35 120.775 -22.966 6.489 1.00 0.00 H new ATOM 0 HA SER A 35 118.233 -24.484 7.091 1.00 0.00 H new ATOM 0 HB2 SER A 35 118.004 -22.588 8.876 1.00 0.00 H new ATOM 0 HB3 SER A 35 119.158 -23.850 9.259 1.00 0.00 H new ATOM 0 HG SER A 35 120.172 -21.837 9.553 1.00 0.00 H new ATOM 455 N PRO A 36 116.833 -22.462 6.353 1.00 0.00 N ATOM 456 CA PRO A 36 116.050 -21.505 5.539 1.00 0.00 C ATOM 457 C PRO A 36 115.973 -20.131 6.223 1.00 0.00 C ATOM 458 O PRO A 36 114.986 -19.430 6.104 1.00 0.00 O ATOM 459 CB PRO A 36 114.670 -22.150 5.480 1.00 0.00 C ATOM 460 CG PRO A 36 114.570 -23.018 6.702 1.00 0.00 C ATOM 461 CD PRO A 36 115.966 -23.247 7.239 1.00 0.00 C ATOM 0 HA PRO A 36 116.488 -21.325 4.557 1.00 0.00 H new ATOM 0 HB2 PRO A 36 113.885 -21.394 5.473 1.00 0.00 H new ATOM 0 HB3 PRO A 36 114.553 -22.740 4.571 1.00 0.00 H new ATOM 0 HG2 PRO A 36 113.947 -22.540 7.457 1.00 0.00 H new ATOM 0 HG3 PRO A 36 114.098 -23.969 6.455 1.00 0.00 H new ATOM 0 HD2 PRO A 36 116.052 -22.916 8.274 1.00 0.00 H new ATOM 0 HD3 PRO A 36 116.231 -24.304 7.219 1.00 0.00 H new ATOM 466 N LEU A 37 117.001 -19.741 6.932 1.00 0.00 N ATOM 467 CA LEU A 37 116.980 -18.413 7.614 1.00 0.00 C ATOM 468 C LEU A 37 117.522 -17.337 6.671 1.00 0.00 C ATOM 469 O LEU A 37 118.481 -17.556 5.956 1.00 0.00 O ATOM 470 CB LEU A 37 117.897 -18.570 8.833 1.00 0.00 C ATOM 471 CG LEU A 37 117.398 -19.716 9.720 1.00 0.00 C ATOM 472 CD1 LEU A 37 118.334 -19.873 10.920 1.00 0.00 C ATOM 473 CD2 LEU A 37 115.985 -19.404 10.221 1.00 0.00 C ATOM 0 H LEU A 37 117.853 -20.285 7.068 1.00 0.00 H new ATOM 0 HA LEU A 37 115.973 -18.112 7.904 1.00 0.00 H new ATOM 0 HB2 LEU A 37 118.918 -18.769 8.507 1.00 0.00 H new ATOM 0 HB3 LEU A 37 117.920 -17.641 9.403 1.00 0.00 H new ATOM 0 HG LEU A 37 117.382 -20.639 9.141 1.00 0.00 H new ATOM 0 HD11 LEU A 37 117.981 -20.688 11.553 1.00 0.00 H new ATOM 0 HD12 LEU A 37 119.341 -20.096 10.569 1.00 0.00 H new ATOM 0 HD13 LEU A 37 118.347 -18.947 11.495 1.00 0.00 H new ATOM 0 HD21 LEU A 37 115.634 -20.221 10.851 1.00 0.00 H new ATOM 0 HD22 LEU A 37 116.000 -18.480 10.799 1.00 0.00 H new ATOM 0 HD23 LEU A 37 115.314 -19.288 9.370 1.00 0.00 H new ATOM 484 N GLY A 38 116.914 -16.179 6.661 1.00 0.00 N ATOM 485 CA GLY A 38 117.402 -15.100 5.754 1.00 0.00 C ATOM 486 C GLY A 38 117.161 -13.718 6.365 1.00 0.00 C ATOM 487 O GLY A 38 116.130 -13.450 6.946 1.00 0.00 O ATOM 0 H GLY A 38 116.108 -15.936 7.237 1.00 0.00 H new ATOM 0 HA2 GLY A 38 118.466 -15.236 5.562 1.00 0.00 H new ATOM 0 HA3 GLY A 38 116.893 -15.170 4.793 1.00 0.00 H new ATOM 490 N VAL A 39 118.107 -12.833 6.203 1.00 0.00 N ATOM 491 CA VAL A 39 117.954 -11.444 6.729 1.00 0.00 C ATOM 492 C VAL A 39 118.284 -10.468 5.598 1.00 0.00 C ATOM 493 O VAL A 39 119.299 -10.606 4.941 1.00 0.00 O ATOM 494 CB VAL A 39 118.969 -11.323 7.866 1.00 0.00 C ATOM 495 CG1 VAL A 39 118.867 -9.932 8.495 1.00 0.00 C ATOM 496 CG2 VAL A 39 118.673 -12.381 8.933 1.00 0.00 C ATOM 0 H VAL A 39 118.989 -13.014 5.724 1.00 0.00 H new ATOM 0 HA VAL A 39 116.947 -11.225 7.086 1.00 0.00 H new ATOM 0 HB VAL A 39 119.973 -11.474 7.470 1.00 0.00 H new ATOM 0 HG11 VAL A 39 119.590 -9.845 9.306 1.00 0.00 H new ATOM 0 HG12 VAL A 39 119.076 -9.175 7.739 1.00 0.00 H new ATOM 0 HG13 VAL A 39 117.861 -9.784 8.889 1.00 0.00 H new ATOM 0 HG21 VAL A 39 119.397 -12.294 9.743 1.00 0.00 H new ATOM 0 HG22 VAL A 39 117.668 -12.229 9.327 1.00 0.00 H new ATOM 0 HG23 VAL A 39 118.743 -13.374 8.490 1.00 0.00 H new ATOM 506 N ILE A 40 117.440 -9.504 5.338 1.00 0.00 N ATOM 507 CA ILE A 40 117.723 -8.556 4.220 1.00 0.00 C ATOM 508 C ILE A 40 117.605 -7.100 4.681 1.00 0.00 C ATOM 509 O ILE A 40 116.743 -6.753 5.467 1.00 0.00 O ATOM 510 CB ILE A 40 116.659 -8.884 3.164 1.00 0.00 C ATOM 511 CG1 ILE A 40 116.852 -7.984 1.938 1.00 0.00 C ATOM 512 CG2 ILE A 40 115.254 -8.663 3.744 1.00 0.00 C ATOM 513 CD1 ILE A 40 116.022 -8.522 0.769 1.00 0.00 C ATOM 0 H ILE A 40 116.573 -9.333 5.847 1.00 0.00 H new ATOM 0 HA ILE A 40 118.738 -8.664 3.838 1.00 0.00 H new ATOM 0 HB ILE A 40 116.765 -9.928 2.870 1.00 0.00 H new ATOM 0 HG12 ILE A 40 116.549 -6.963 2.172 1.00 0.00 H new ATOM 0 HG13 ILE A 40 117.906 -7.949 1.663 1.00 0.00 H new ATOM 0 HG21 ILE A 40 114.506 -8.899 2.986 1.00 0.00 H new ATOM 0 HG22 ILE A 40 115.111 -9.311 4.609 1.00 0.00 H new ATOM 0 HG23 ILE A 40 115.146 -7.622 4.049 1.00 0.00 H new ATOM 0 HD11 ILE A 40 116.161 -7.881 -0.101 1.00 0.00 H new ATOM 0 HD12 ILE A 40 116.346 -9.535 0.529 1.00 0.00 H new ATOM 0 HD13 ILE A 40 114.968 -8.534 1.046 1.00 0.00 H new ATOM 524 N GLY A 41 118.448 -6.242 4.167 1.00 0.00 N ATOM 525 CA GLY A 41 118.377 -4.798 4.534 1.00 0.00 C ATOM 526 C GLY A 41 117.829 -4.040 3.327 1.00 0.00 C ATOM 527 O GLY A 41 118.222 -4.295 2.206 1.00 0.00 O ATOM 0 H GLY A 41 119.186 -6.482 3.505 1.00 0.00 H new ATOM 0 HA2 GLY A 41 117.732 -4.655 5.401 1.00 0.00 H new ATOM 0 HA3 GLY A 41 119.364 -4.423 4.806 1.00 0.00 H new ATOM 530 N SER A 42 116.910 -3.132 3.531 1.00 0.00 N ATOM 531 CA SER A 42 116.334 -2.397 2.366 1.00 0.00 C ATOM 532 C SER A 42 116.344 -0.884 2.589 1.00 0.00 C ATOM 533 O SER A 42 116.090 -0.401 3.676 1.00 0.00 O ATOM 534 CB SER A 42 114.897 -2.905 2.267 1.00 0.00 C ATOM 535 OG SER A 42 114.232 -2.689 3.502 1.00 0.00 O ATOM 0 H SER A 42 116.537 -2.870 4.443 1.00 0.00 H new ATOM 0 HA SER A 42 116.912 -2.570 1.458 1.00 0.00 H new ATOM 0 HB2 SER A 42 114.372 -2.388 1.464 1.00 0.00 H new ATOM 0 HB3 SER A 42 114.892 -3.967 2.020 1.00 0.00 H new ATOM 0 HG SER A 42 114.609 -3.283 4.185 1.00 0.00 H new ATOM 540 N PHE A 43 116.602 -0.135 1.548 1.00 0.00 N ATOM 541 CA PHE A 43 116.592 1.350 1.663 1.00 0.00 C ATOM 542 C PHE A 43 115.650 1.895 0.595 1.00 0.00 C ATOM 543 O PHE A 43 115.684 1.450 -0.536 1.00 0.00 O ATOM 544 CB PHE A 43 118.034 1.788 1.398 1.00 0.00 C ATOM 545 CG PHE A 43 118.941 1.201 2.453 1.00 0.00 C ATOM 546 CD1 PHE A 43 119.139 1.880 3.661 1.00 0.00 C ATOM 547 CD2 PHE A 43 119.582 -0.022 2.224 1.00 0.00 C ATOM 548 CE1 PHE A 43 119.979 1.334 4.640 1.00 0.00 C ATOM 549 CE2 PHE A 43 120.422 -0.566 3.202 1.00 0.00 C ATOM 550 CZ PHE A 43 120.621 0.112 4.411 1.00 0.00 C ATOM 0 H PHE A 43 116.820 -0.493 0.618 1.00 0.00 H new ATOM 0 HA PHE A 43 116.254 1.711 2.634 1.00 0.00 H new ATOM 0 HB2 PHE A 43 118.349 1.458 0.408 1.00 0.00 H new ATOM 0 HB3 PHE A 43 118.103 2.876 1.409 1.00 0.00 H new ATOM 0 HD1 PHE A 43 118.645 2.824 3.838 1.00 0.00 H new ATOM 0 HD2 PHE A 43 119.428 -0.546 1.292 1.00 0.00 H new ATOM 0 HE1 PHE A 43 120.131 1.857 5.573 1.00 0.00 H new ATOM 0 HE2 PHE A 43 120.917 -1.509 3.024 1.00 0.00 H new ATOM 0 HZ PHE A 43 121.269 -0.308 5.166 1.00 0.00 H new ATOM 559 N THR A 44 114.802 2.836 0.921 1.00 0.00 N ATOM 560 CA THR A 44 113.872 3.355 -0.125 1.00 0.00 C ATOM 561 C THR A 44 113.785 4.878 -0.090 1.00 0.00 C ATOM 562 O THR A 44 113.873 5.490 0.954 1.00 0.00 O ATOM 563 CB THR A 44 112.517 2.718 0.206 1.00 0.00 C ATOM 564 OG1 THR A 44 111.591 3.014 -0.830 1.00 0.00 O ATOM 565 CG2 THR A 44 111.990 3.257 1.540 1.00 0.00 C ATOM 0 H THR A 44 114.713 3.260 1.845 1.00 0.00 H new ATOM 0 HA THR A 44 114.212 3.104 -1.130 1.00 0.00 H new ATOM 0 HB THR A 44 112.641 1.638 0.288 1.00 0.00 H new ATOM 0 HG1 THR A 44 112.053 3.004 -1.694 1.00 0.00 H new ATOM 0 HG21 THR A 44 111.027 2.797 1.764 1.00 0.00 H new ATOM 0 HG22 THR A 44 112.699 3.020 2.334 1.00 0.00 H new ATOM 0 HG23 THR A 44 111.869 4.338 1.473 1.00 0.00 H new ATOM 573 N TYR A 45 113.575 5.487 -1.227 1.00 0.00 N ATOM 574 CA TYR A 45 113.435 6.967 -1.277 1.00 0.00 C ATOM 575 C TYR A 45 112.354 7.316 -2.305 1.00 0.00 C ATOM 576 O TYR A 45 112.516 7.104 -3.491 1.00 0.00 O ATOM 577 CB TYR A 45 114.820 7.505 -1.676 1.00 0.00 C ATOM 578 CG TYR A 45 115.196 7.051 -3.069 1.00 0.00 C ATOM 579 CD1 TYR A 45 115.739 5.777 -3.265 1.00 0.00 C ATOM 580 CD2 TYR A 45 115.010 7.909 -4.160 1.00 0.00 C ATOM 581 CE1 TYR A 45 116.094 5.358 -4.551 1.00 0.00 C ATOM 582 CE2 TYR A 45 115.367 7.491 -5.448 1.00 0.00 C ATOM 583 CZ TYR A 45 115.909 6.216 -5.643 1.00 0.00 C ATOM 584 OH TYR A 45 116.261 5.803 -6.912 1.00 0.00 O ATOM 0 H TYR A 45 113.494 5.017 -2.128 1.00 0.00 H new ATOM 0 HA TYR A 45 113.130 7.409 -0.328 1.00 0.00 H new ATOM 0 HB2 TYR A 45 114.818 8.594 -1.633 1.00 0.00 H new ATOM 0 HB3 TYR A 45 115.568 7.159 -0.962 1.00 0.00 H new ATOM 0 HD1 TYR A 45 115.884 5.117 -2.423 1.00 0.00 H new ATOM 0 HD2 TYR A 45 114.591 8.893 -4.008 1.00 0.00 H new ATOM 0 HE1 TYR A 45 116.511 4.373 -4.702 1.00 0.00 H new ATOM 0 HE2 TYR A 45 115.224 8.152 -6.290 1.00 0.00 H new ATOM 0 HH TYR A 45 115.523 5.292 -7.306 1.00 0.00 H new ATOM 593 N THR A 46 111.237 7.820 -1.854 1.00 0.00 N ATOM 594 CA THR A 46 110.133 8.152 -2.799 1.00 0.00 C ATOM 595 C THR A 46 109.760 9.631 -2.695 1.00 0.00 C ATOM 596 O THR A 46 109.664 10.184 -1.617 1.00 0.00 O ATOM 597 CB THR A 46 108.966 7.263 -2.356 1.00 0.00 C ATOM 598 OG1 THR A 46 109.377 5.903 -2.380 1.00 0.00 O ATOM 599 CG2 THR A 46 107.780 7.456 -3.298 1.00 0.00 C ATOM 0 H THR A 46 111.042 8.016 -0.872 1.00 0.00 H new ATOM 0 HA THR A 46 110.411 7.979 -3.839 1.00 0.00 H new ATOM 0 HB THR A 46 108.666 7.538 -1.345 1.00 0.00 H new ATOM 0 HG1 THR A 46 108.633 5.331 -2.096 1.00 0.00 H new ATOM 0 HG21 THR A 46 106.954 6.821 -2.978 1.00 0.00 H new ATOM 0 HG22 THR A 46 107.465 8.499 -3.278 1.00 0.00 H new ATOM 0 HG23 THR A 46 108.073 7.185 -4.312 1.00 0.00 H new ATOM 607 N GLU A 47 109.552 10.273 -3.815 1.00 0.00 N ATOM 608 CA GLU A 47 109.187 11.719 -3.802 1.00 0.00 C ATOM 609 C GLU A 47 108.431 12.069 -5.088 1.00 0.00 C ATOM 610 O GLU A 47 108.452 11.325 -6.050 1.00 0.00 O ATOM 611 CB GLU A 47 110.527 12.456 -3.742 1.00 0.00 C ATOM 612 CG GLU A 47 110.286 13.962 -3.595 1.00 0.00 C ATOM 613 CD GLU A 47 111.625 14.711 -3.613 1.00 0.00 C ATOM 614 OE1 GLU A 47 112.651 14.064 -3.756 1.00 0.00 O ATOM 615 OE2 GLU A 47 111.600 15.924 -3.484 1.00 0.00 O ATOM 0 H GLU A 47 109.620 9.855 -4.743 1.00 0.00 H new ATOM 0 HA GLU A 47 108.540 11.987 -2.967 1.00 0.00 H new ATOM 0 HB2 GLU A 47 111.117 12.089 -2.902 1.00 0.00 H new ATOM 0 HB3 GLU A 47 111.102 12.257 -4.646 1.00 0.00 H new ATOM 0 HG2 GLU A 47 109.650 14.318 -4.405 1.00 0.00 H new ATOM 0 HG3 GLU A 47 109.759 14.165 -2.663 1.00 0.00 H new ATOM 620 N LYS A 48 107.766 13.196 -5.114 1.00 0.00 N ATOM 621 CA LYS A 48 107.018 13.595 -6.343 1.00 0.00 C ATOM 622 C LYS A 48 108.005 13.927 -7.466 1.00 0.00 C ATOM 623 O LYS A 48 109.060 14.483 -7.230 1.00 0.00 O ATOM 624 CB LYS A 48 106.222 14.839 -5.949 1.00 0.00 C ATOM 625 CG LYS A 48 105.308 15.246 -7.106 1.00 0.00 C ATOM 626 CD LYS A 48 104.576 16.542 -6.751 1.00 0.00 C ATOM 627 CE LYS A 48 103.586 16.891 -7.864 1.00 0.00 C ATOM 628 NZ LYS A 48 102.293 16.296 -7.428 1.00 0.00 N ATOM 0 H LYS A 48 107.709 13.856 -4.338 1.00 0.00 H new ATOM 0 HA LYS A 48 106.367 12.799 -6.705 1.00 0.00 H new ATOM 0 HB2 LYS A 48 105.629 14.637 -5.057 1.00 0.00 H new ATOM 0 HB3 LYS A 48 106.901 15.656 -5.703 1.00 0.00 H new ATOM 0 HG2 LYS A 48 105.894 15.385 -8.014 1.00 0.00 H new ATOM 0 HG3 LYS A 48 104.588 14.454 -7.310 1.00 0.00 H new ATOM 0 HD2 LYS A 48 104.049 16.427 -5.804 1.00 0.00 H new ATOM 0 HD3 LYS A 48 105.293 17.353 -6.620 1.00 0.00 H new ATOM 0 HE2 LYS A 48 103.501 17.970 -7.993 1.00 0.00 H new ATOM 0 HE3 LYS A 48 103.907 16.480 -8.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 101.770 15.954 -8.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 102.477 15.501 -6.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 101.728 17.017 -6.936 1.00 0.00 H new ATOM 638 N SER A 49 107.673 13.586 -8.684 1.00 0.00 N ATOM 639 CA SER A 49 108.598 13.877 -9.821 1.00 0.00 C ATOM 640 C SER A 49 108.420 15.320 -10.302 1.00 0.00 C ATOM 641 O SER A 49 107.321 15.838 -10.348 1.00 0.00 O ATOM 642 CB SER A 49 108.195 12.894 -10.919 1.00 0.00 C ATOM 643 OG SER A 49 109.089 13.023 -12.017 1.00 0.00 O ATOM 0 H SER A 49 106.803 13.119 -8.941 1.00 0.00 H new ATOM 0 HA SER A 49 109.644 13.768 -9.536 1.00 0.00 H new ATOM 0 HB2 SER A 49 108.217 11.874 -10.536 1.00 0.00 H new ATOM 0 HB3 SER A 49 107.173 13.091 -11.242 1.00 0.00 H new ATOM 0 HG SER A 49 108.834 12.392 -12.722 1.00 0.00 H new ATOM 648 N ARG A 50 109.497 15.968 -10.662 1.00 0.00 N ATOM 649 CA ARG A 50 109.407 17.379 -11.145 1.00 0.00 C ATOM 650 C ARG A 50 110.056 17.509 -12.524 1.00 0.00 C ATOM 651 O ARG A 50 110.868 16.693 -12.916 1.00 0.00 O ATOM 652 CB ARG A 50 110.177 18.207 -10.115 1.00 0.00 C ATOM 653 CG ARG A 50 109.460 18.152 -8.766 1.00 0.00 C ATOM 654 CD ARG A 50 110.155 19.098 -7.784 1.00 0.00 C ATOM 655 NE ARG A 50 109.512 18.833 -6.467 1.00 0.00 N ATOM 656 CZ ARG A 50 109.861 17.788 -5.768 1.00 0.00 C ATOM 657 NH1 ARG A 50 111.124 17.493 -5.622 1.00 0.00 N ATOM 658 NH2 ARG A 50 108.948 17.040 -5.213 1.00 0.00 N ATOM 0 H ARG A 50 110.440 15.579 -10.642 1.00 0.00 H new ATOM 0 HA ARG A 50 108.374 17.712 -11.245 1.00 0.00 H new ATOM 0 HB2 ARG A 50 111.193 17.825 -10.013 1.00 0.00 H new ATOM 0 HB3 ARG A 50 110.258 19.240 -10.452 1.00 0.00 H new ATOM 0 HG2 ARG A 50 108.415 18.437 -8.885 1.00 0.00 H new ATOM 0 HG3 ARG A 50 109.471 17.134 -8.377 1.00 0.00 H new ATOM 0 HD2 ARG A 50 111.227 18.907 -7.745 1.00 0.00 H new ATOM 0 HD3 ARG A 50 110.028 20.139 -8.082 1.00 0.00 H new ATOM 0 HE ARG A 50 108.798 19.469 -6.111 1.00 0.00 H new ATOM 0 HH11 ARG A 50 111.838 18.079 -6.054 1.00 0.00 H new ATOM 0 HH12 ARG A 50 111.397 16.676 -5.076 1.00 0.00 H new ATOM 0 HH21 ARG A 50 107.961 17.272 -5.325 1.00 0.00 H new ATOM 0 HH22 ARG A 50 109.221 16.223 -4.667 1.00 0.00 H new ATOM 669 N THR A 51 109.709 18.532 -13.260 1.00 0.00 N ATOM 670 CA THR A 51 110.309 18.723 -14.615 1.00 0.00 C ATOM 671 C THR A 51 111.744 19.243 -14.479 1.00 0.00 C ATOM 672 O THR A 51 112.148 19.701 -13.428 1.00 0.00 O ATOM 673 CB THR A 51 109.427 19.765 -15.312 1.00 0.00 C ATOM 674 OG1 THR A 51 109.525 21.003 -14.621 1.00 0.00 O ATOM 675 CG2 THR A 51 107.970 19.293 -15.319 1.00 0.00 C ATOM 0 H THR A 51 109.035 19.245 -12.981 1.00 0.00 H new ATOM 0 HA THR A 51 110.351 17.792 -15.180 1.00 0.00 H new ATOM 0 HB THR A 51 109.764 19.893 -16.341 1.00 0.00 H new ATOM 0 HG1 THR A 51 108.963 21.671 -15.066 1.00 0.00 H new ATOM 0 HG21 THR A 51 107.349 20.038 -15.816 1.00 0.00 H new ATOM 0 HG22 THR A 51 107.897 18.345 -15.853 1.00 0.00 H new ATOM 0 HG23 THR A 51 107.626 19.159 -14.293 1.00 0.00 H new ATOM 683 N ALA A 52 112.515 19.171 -15.532 1.00 0.00 N ATOM 684 CA ALA A 52 113.927 19.658 -15.459 1.00 0.00 C ATOM 685 C ALA A 52 113.954 21.183 -15.321 1.00 0.00 C ATOM 686 O ALA A 52 113.866 21.905 -16.295 1.00 0.00 O ATOM 687 CB ALA A 52 114.567 19.228 -16.781 1.00 0.00 C ATOM 0 H ALA A 52 112.231 18.797 -16.438 1.00 0.00 H new ATOM 0 HA ALA A 52 114.459 19.251 -14.599 1.00 0.00 H new ATOM 0 HB1 ALA A 52 115.608 19.551 -16.803 1.00 0.00 H new ATOM 0 HB2 ALA A 52 114.521 18.143 -16.871 1.00 0.00 H new ATOM 0 HB3 ALA A 52 114.028 19.684 -17.611 1.00 0.00 H new ATOM 693 N SER A 53 114.077 21.671 -14.115 1.00 0.00 N ATOM 694 CA SER A 53 114.113 23.147 -13.899 1.00 0.00 C ATOM 695 C SER A 53 115.360 23.533 -13.097 1.00 0.00 C ATOM 696 O SER A 53 115.870 22.753 -12.314 1.00 0.00 O ATOM 697 CB SER A 53 112.847 23.463 -13.106 1.00 0.00 C ATOM 698 OG SER A 53 111.712 23.019 -13.839 1.00 0.00 O ATOM 0 H SER A 53 114.154 21.109 -13.267 1.00 0.00 H new ATOM 0 HA SER A 53 114.154 23.701 -14.837 1.00 0.00 H new ATOM 0 HB2 SER A 53 112.881 22.972 -12.133 1.00 0.00 H new ATOM 0 HB3 SER A 53 112.778 24.535 -12.920 1.00 0.00 H new ATOM 0 HG SER A 53 110.897 23.218 -13.333 1.00 0.00 H new ATOM 703 N SER A 54 115.852 24.732 -13.281 1.00 0.00 N ATOM 704 CA SER A 54 117.067 25.172 -12.525 1.00 0.00 C ATOM 705 C SER A 54 116.823 25.050 -11.018 1.00 0.00 C ATOM 706 O SER A 54 117.723 24.749 -10.256 1.00 0.00 O ATOM 707 CB SER A 54 117.273 26.635 -12.917 1.00 0.00 C ATOM 708 OG SER A 54 117.378 26.732 -14.332 1.00 0.00 O ATOM 0 H SER A 54 115.466 25.426 -13.921 1.00 0.00 H new ATOM 0 HA SER A 54 117.940 24.563 -12.757 1.00 0.00 H new ATOM 0 HB2 SER A 54 116.439 27.240 -12.560 1.00 0.00 H new ATOM 0 HB3 SER A 54 118.175 27.026 -12.446 1.00 0.00 H new ATOM 0 HG SER A 54 117.508 27.669 -14.587 1.00 0.00 H new ATOM 713 N GLY A 55 115.609 25.270 -10.589 1.00 0.00 N ATOM 714 CA GLY A 55 115.292 25.159 -9.136 1.00 0.00 C ATOM 715 C GLY A 55 114.610 23.815 -8.873 1.00 0.00 C ATOM 716 O GLY A 55 113.441 23.638 -9.157 1.00 0.00 O ATOM 0 H GLY A 55 114.821 25.523 -11.185 1.00 0.00 H new ATOM 0 HA2 GLY A 55 116.204 25.240 -8.545 1.00 0.00 H new ATOM 0 HA3 GLY A 55 114.640 25.977 -8.830 1.00 0.00 H new ATOM 719 N ASP A 56 115.335 22.864 -8.340 1.00 0.00 N ATOM 720 CA ASP A 56 114.731 21.524 -8.067 1.00 0.00 C ATOM 721 C ASP A 56 113.526 21.656 -7.130 1.00 0.00 C ATOM 722 O ASP A 56 112.516 21.007 -7.316 1.00 0.00 O ATOM 723 CB ASP A 56 115.844 20.712 -7.397 1.00 0.00 C ATOM 724 CG ASP A 56 116.979 20.456 -8.394 1.00 0.00 C ATOM 725 OD1 ASP A 56 116.758 20.638 -9.582 1.00 0.00 O ATOM 726 OD2 ASP A 56 118.053 20.082 -7.953 1.00 0.00 O ATOM 0 H ASP A 56 116.318 22.957 -8.082 1.00 0.00 H new ATOM 0 HA ASP A 56 114.369 21.048 -8.978 1.00 0.00 H new ATOM 0 HB2 ASP A 56 116.226 21.250 -6.529 1.00 0.00 H new ATOM 0 HB3 ASP A 56 115.446 19.764 -7.035 1.00 0.00 H new ATOM 730 N TYR A 57 113.626 22.497 -6.128 1.00 0.00 N ATOM 731 CA TYR A 57 112.489 22.685 -5.168 1.00 0.00 C ATOM 732 C TYR A 57 111.947 21.332 -4.689 1.00 0.00 C ATOM 733 O TYR A 57 111.086 20.743 -5.317 1.00 0.00 O ATOM 734 CB TYR A 57 111.422 23.437 -5.964 1.00 0.00 C ATOM 735 CG TYR A 57 110.273 23.795 -5.053 1.00 0.00 C ATOM 736 CD1 TYR A 57 110.329 24.962 -4.281 1.00 0.00 C ATOM 737 CD2 TYR A 57 109.151 22.961 -4.978 1.00 0.00 C ATOM 738 CE1 TYR A 57 109.264 25.295 -3.436 1.00 0.00 C ATOM 739 CE2 TYR A 57 108.086 23.294 -4.133 1.00 0.00 C ATOM 740 CZ TYR A 57 108.143 24.461 -3.362 1.00 0.00 C ATOM 741 OH TYR A 57 107.093 24.788 -2.529 1.00 0.00 O ATOM 0 H TYR A 57 114.450 23.065 -5.932 1.00 0.00 H new ATOM 0 HA TYR A 57 112.798 23.228 -4.275 1.00 0.00 H new ATOM 0 HB2 TYR A 57 111.848 24.340 -6.401 1.00 0.00 H new ATOM 0 HB3 TYR A 57 111.067 22.820 -6.790 1.00 0.00 H new ATOM 0 HD1 TYR A 57 111.195 25.606 -4.338 1.00 0.00 H new ATOM 0 HD2 TYR A 57 109.107 22.060 -5.572 1.00 0.00 H new ATOM 0 HE1 TYR A 57 109.308 26.195 -2.841 1.00 0.00 H new ATOM 0 HE2 TYR A 57 107.220 22.651 -4.076 1.00 0.00 H new ATOM 0 HH TYR A 57 106.395 24.104 -2.598 1.00 0.00 H new ATOM 750 N ASN A 58 112.443 20.834 -3.587 1.00 0.00 N ATOM 751 CA ASN A 58 111.955 19.519 -3.074 1.00 0.00 C ATOM 752 C ASN A 58 111.088 19.712 -1.823 1.00 0.00 C ATOM 753 O ASN A 58 111.568 20.102 -0.775 1.00 0.00 O ATOM 754 CB ASN A 58 113.227 18.724 -2.748 1.00 0.00 C ATOM 755 CG ASN A 58 114.024 19.432 -1.648 1.00 0.00 C ATOM 756 OD1 ASN A 58 113.928 20.632 -1.485 1.00 0.00 O ATOM 757 ND2 ASN A 58 114.808 18.732 -0.875 1.00 0.00 N ATOM 0 H ASN A 58 113.164 21.280 -3.020 1.00 0.00 H new ATOM 0 HA ASN A 58 111.329 19.001 -3.800 1.00 0.00 H new ATOM 0 HB2 ASN A 58 112.963 17.717 -2.425 1.00 0.00 H new ATOM 0 HB3 ASN A 58 113.840 18.621 -3.643 1.00 0.00 H new ATOM 0 HD21 ASN A 58 115.339 19.192 -0.136 1.00 0.00 H new ATOM 0 HD22 ASN A 58 114.890 17.724 -1.010 1.00 0.00 H new ATOM 763 N LYS A 59 109.813 19.442 -1.928 1.00 0.00 N ATOM 764 CA LYS A 59 108.917 19.609 -0.746 1.00 0.00 C ATOM 765 C LYS A 59 109.187 18.491 0.281 1.00 0.00 C ATOM 766 O LYS A 59 110.136 18.567 1.037 1.00 0.00 O ATOM 767 CB LYS A 59 107.495 19.546 -1.315 1.00 0.00 C ATOM 768 CG LYS A 59 106.482 19.762 -0.190 1.00 0.00 C ATOM 769 CD LYS A 59 105.063 19.640 -0.749 1.00 0.00 C ATOM 770 CE LYS A 59 104.052 20.027 0.332 1.00 0.00 C ATOM 771 NZ LYS A 59 102.726 19.640 -0.226 1.00 0.00 N ATOM 0 H LYS A 59 109.355 19.114 -2.778 1.00 0.00 H new ATOM 0 HA LYS A 59 109.080 20.547 -0.215 1.00 0.00 H new ATOM 0 HB2 LYS A 59 107.366 20.307 -2.085 1.00 0.00 H new ATOM 0 HB3 LYS A 59 107.325 18.580 -1.790 1.00 0.00 H new ATOM 0 HG2 LYS A 59 106.637 19.027 0.600 1.00 0.00 H new ATOM 0 HG3 LYS A 59 106.624 20.746 0.258 1.00 0.00 H new ATOM 0 HD2 LYS A 59 104.947 20.287 -1.619 1.00 0.00 H new ATOM 0 HD3 LYS A 59 104.880 18.619 -1.084 1.00 0.00 H new ATOM 0 HE2 LYS A 59 104.255 19.505 1.267 1.00 0.00 H new ATOM 0 HE3 LYS A 59 104.093 21.095 0.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 101.979 19.874 0.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 102.558 20.158 -1.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 102.714 18.617 -0.415 1.00 0.00 H new ATOM 781 N ASN A 60 108.372 17.460 0.329 1.00 0.00 N ATOM 782 CA ASN A 60 108.609 16.368 1.321 1.00 0.00 C ATOM 783 C ASN A 60 109.225 15.144 0.637 1.00 0.00 C ATOM 784 O ASN A 60 108.882 14.804 -0.478 1.00 0.00 O ATOM 785 CB ASN A 60 107.223 16.027 1.872 1.00 0.00 C ATOM 786 CG ASN A 60 106.632 17.254 2.569 1.00 0.00 C ATOM 787 OD1 ASN A 60 107.322 17.949 3.288 1.00 0.00 O ATOM 788 ND2 ASN A 60 105.375 17.552 2.385 1.00 0.00 N ATOM 0 H ASN A 60 107.559 17.331 -0.273 1.00 0.00 H new ATOM 0 HA ASN A 60 109.302 16.673 2.106 1.00 0.00 H new ATOM 0 HB2 ASN A 60 106.568 15.705 1.063 1.00 0.00 H new ATOM 0 HB3 ASN A 60 107.294 15.196 2.574 1.00 0.00 H new ATOM 0 HD21 ASN A 60 104.972 18.368 2.845 1.00 0.00 H new ATOM 0 HD22 ASN A 60 104.796 16.969 1.781 1.00 0.00 H new ATOM 794 N GLN A 61 110.123 14.472 1.310 1.00 0.00 N ATOM 795 CA GLN A 61 110.759 13.257 0.718 1.00 0.00 C ATOM 796 C GLN A 61 110.452 12.039 1.589 1.00 0.00 C ATOM 797 O GLN A 61 110.298 12.153 2.792 1.00 0.00 O ATOM 798 CB GLN A 61 112.260 13.546 0.714 1.00 0.00 C ATOM 799 CG GLN A 61 112.557 14.715 -0.225 1.00 0.00 C ATOM 800 CD GLN A 61 114.060 14.995 -0.229 1.00 0.00 C ATOM 801 OE1 GLN A 61 114.733 14.781 0.760 1.00 0.00 O ATOM 802 NE2 GLN A 61 114.621 15.462 -1.311 1.00 0.00 N ATOM 0 H GLN A 61 110.444 14.713 2.247 1.00 0.00 H new ATOM 0 HA GLN A 61 110.389 13.043 -0.285 1.00 0.00 H new ATOM 0 HB2 GLN A 61 112.597 13.783 1.723 1.00 0.00 H new ATOM 0 HB3 GLN A 61 112.810 12.661 0.394 1.00 0.00 H new ATOM 0 HG2 GLN A 61 112.217 14.481 -1.234 1.00 0.00 H new ATOM 0 HG3 GLN A 61 112.012 15.602 0.097 1.00 0.00 H new ATOM 0 HE21 GLN A 61 114.056 15.642 -2.141 1.00 0.00 H new ATOM 0 HE22 GLN A 61 115.624 15.647 -1.326 1.00 0.00 H new ATOM 809 N TYR A 62 110.360 10.875 0.996 1.00 0.00 N ATOM 810 CA TYR A 62 110.060 9.653 1.797 1.00 0.00 C ATOM 811 C TYR A 62 111.266 8.705 1.807 1.00 0.00 C ATOM 812 O TYR A 62 111.401 7.841 0.964 1.00 0.00 O ATOM 813 CB TYR A 62 108.872 9.003 1.088 1.00 0.00 C ATOM 814 CG TYR A 62 108.423 7.785 1.861 1.00 0.00 C ATOM 815 CD1 TYR A 62 107.517 7.922 2.919 1.00 0.00 C ATOM 816 CD2 TYR A 62 108.914 6.519 1.519 1.00 0.00 C ATOM 817 CE1 TYR A 62 107.100 6.792 3.634 1.00 0.00 C ATOM 818 CE2 TYR A 62 108.498 5.390 2.234 1.00 0.00 C ATOM 819 CZ TYR A 62 107.591 5.527 3.291 1.00 0.00 C ATOM 820 OH TYR A 62 107.181 4.414 3.997 1.00 0.00 O ATOM 0 H TYR A 62 110.480 10.720 -0.005 1.00 0.00 H new ATOM 0 HA TYR A 62 109.840 9.888 2.838 1.00 0.00 H new ATOM 0 HB2 TYR A 62 108.051 9.716 1.004 1.00 0.00 H new ATOM 0 HB3 TYR A 62 109.152 8.719 0.074 1.00 0.00 H new ATOM 0 HD1 TYR A 62 107.140 8.899 3.184 1.00 0.00 H new ATOM 0 HD2 TYR A 62 109.614 6.414 0.703 1.00 0.00 H new ATOM 0 HE1 TYR A 62 106.400 6.897 4.450 1.00 0.00 H new ATOM 0 HE2 TYR A 62 108.877 4.414 1.970 1.00 0.00 H new ATOM 0 HH TYR A 62 107.615 3.616 3.630 1.00 0.00 H new ATOM 829 N TYR A 63 112.132 8.867 2.769 1.00 0.00 N ATOM 830 CA TYR A 63 113.335 7.988 2.869 1.00 0.00 C ATOM 831 C TYR A 63 113.259 7.200 4.171 1.00 0.00 C ATOM 832 O TYR A 63 112.827 7.730 5.178 1.00 0.00 O ATOM 833 CB TYR A 63 114.526 8.948 2.886 1.00 0.00 C ATOM 834 CG TYR A 63 115.814 8.160 2.909 1.00 0.00 C ATOM 835 CD1 TYR A 63 116.402 7.746 1.710 1.00 0.00 C ATOM 836 CD2 TYR A 63 116.420 7.845 4.132 1.00 0.00 C ATOM 837 CE1 TYR A 63 117.598 7.018 1.731 1.00 0.00 C ATOM 838 CE2 TYR A 63 117.615 7.117 4.154 1.00 0.00 C ATOM 839 CZ TYR A 63 118.205 6.703 2.953 1.00 0.00 C ATOM 840 OH TYR A 63 119.383 5.986 2.975 1.00 0.00 O ATOM 0 H TYR A 63 112.058 9.577 3.498 1.00 0.00 H new ATOM 0 HA TYR A 63 113.414 7.272 2.051 1.00 0.00 H new ATOM 0 HB2 TYR A 63 114.498 9.593 2.008 1.00 0.00 H new ATOM 0 HB3 TYR A 63 114.470 9.597 3.760 1.00 0.00 H new ATOM 0 HD1 TYR A 63 115.934 7.988 0.767 1.00 0.00 H new ATOM 0 HD2 TYR A 63 115.965 8.164 5.058 1.00 0.00 H new ATOM 0 HE1 TYR A 63 118.052 6.699 0.805 1.00 0.00 H new ATOM 0 HE2 TYR A 63 118.082 6.874 5.097 1.00 0.00 H new ATOM 0 HH TYR A 63 119.669 5.855 3.903 1.00 0.00 H new ATOM 849 N GLY A 64 113.649 5.947 4.187 1.00 0.00 N ATOM 850 CA GLY A 64 113.548 5.200 5.469 1.00 0.00 C ATOM 851 C GLY A 64 114.388 3.919 5.463 1.00 0.00 C ATOM 852 O GLY A 64 114.877 3.459 4.446 1.00 0.00 O ATOM 0 H GLY A 64 114.021 5.427 3.392 1.00 0.00 H new ATOM 0 HA2 GLY A 64 113.874 5.842 6.288 1.00 0.00 H new ATOM 0 HA3 GLY A 64 112.505 4.947 5.658 1.00 0.00 H new ATOM 855 N ILE A 65 114.521 3.354 6.632 1.00 0.00 N ATOM 856 CA ILE A 65 115.298 2.093 6.792 1.00 0.00 C ATOM 857 C ILE A 65 114.332 0.930 7.002 1.00 0.00 C ATOM 858 O ILE A 65 113.334 1.064 7.679 1.00 0.00 O ATOM 859 CB ILE A 65 116.191 2.302 8.022 1.00 0.00 C ATOM 860 CG1 ILE A 65 115.330 2.545 9.265 1.00 0.00 C ATOM 861 CG2 ILE A 65 117.105 3.509 7.794 1.00 0.00 C ATOM 862 CD1 ILE A 65 116.222 2.560 10.507 1.00 0.00 C ATOM 0 H ILE A 65 114.118 3.719 7.495 1.00 0.00 H new ATOM 0 HA ILE A 65 115.902 1.860 5.915 1.00 0.00 H new ATOM 0 HB ILE A 65 116.795 1.408 8.175 1.00 0.00 H new ATOM 0 HG12 ILE A 65 114.799 3.493 9.174 1.00 0.00 H new ATOM 0 HG13 ILE A 65 114.575 1.764 9.356 1.00 0.00 H new ATOM 0 HG21 ILE A 65 117.739 3.656 8.669 1.00 0.00 H new ATOM 0 HG22 ILE A 65 117.730 3.332 6.919 1.00 0.00 H new ATOM 0 HG23 ILE A 65 116.498 4.400 7.632 1.00 0.00 H new ATOM 0 HD11 ILE A 65 115.610 2.733 11.392 1.00 0.00 H new ATOM 0 HD12 ILE A 65 116.732 1.601 10.600 1.00 0.00 H new ATOM 0 HD13 ILE A 65 116.960 3.357 10.415 1.00 0.00 H new ATOM 873 N THR A 66 114.609 -0.206 6.419 1.00 0.00 N ATOM 874 CA THR A 66 113.690 -1.367 6.594 1.00 0.00 C ATOM 875 C THR A 66 114.461 -2.684 6.494 1.00 0.00 C ATOM 876 O THR A 66 115.360 -2.827 5.691 1.00 0.00 O ATOM 877 CB THR A 66 112.665 -1.248 5.460 1.00 0.00 C ATOM 878 OG1 THR A 66 113.257 -0.606 4.337 1.00 0.00 O ATOM 879 CG2 THR A 66 111.466 -0.430 5.942 1.00 0.00 C ATOM 0 H THR A 66 115.426 -0.379 5.833 1.00 0.00 H new ATOM 0 HA THR A 66 113.210 -1.362 7.573 1.00 0.00 H new ATOM 0 HB THR A 66 112.335 -2.245 5.169 1.00 0.00 H new ATOM 0 HG1 THR A 66 113.871 -1.227 3.891 1.00 0.00 H new ATOM 0 HG21 THR A 66 110.736 -0.345 5.137 1.00 0.00 H new ATOM 0 HG22 THR A 66 111.007 -0.927 6.797 1.00 0.00 H new ATOM 0 HG23 THR A 66 111.799 0.565 6.237 1.00 0.00 H new ATOM 887 N ALA A 67 114.111 -3.648 7.302 1.00 0.00 N ATOM 888 CA ALA A 67 114.809 -4.965 7.259 1.00 0.00 C ATOM 889 C ALA A 67 113.885 -6.036 7.841 1.00 0.00 C ATOM 890 O ALA A 67 113.016 -5.737 8.637 1.00 0.00 O ATOM 891 CB ALA A 67 116.052 -4.789 8.132 1.00 0.00 C ATOM 0 H ALA A 67 113.366 -3.579 7.995 1.00 0.00 H new ATOM 0 HA ALA A 67 115.076 -5.272 6.248 1.00 0.00 H new ATOM 0 HB1 ALA A 67 116.619 -5.720 8.150 1.00 0.00 H new ATOM 0 HB2 ALA A 67 116.674 -3.993 7.723 1.00 0.00 H new ATOM 0 HB3 ALA A 67 115.750 -4.529 9.147 1.00 0.00 H new ATOM 897 N GLY A 68 114.053 -7.275 7.460 1.00 0.00 N ATOM 898 CA GLY A 68 113.166 -8.339 8.011 1.00 0.00 C ATOM 899 C GLY A 68 113.742 -9.723 7.701 1.00 0.00 C ATOM 900 O GLY A 68 114.597 -9.861 6.850 1.00 0.00 O ATOM 0 H GLY A 68 114.760 -7.594 6.797 1.00 0.00 H new ATOM 0 HA2 GLY A 68 113.062 -8.214 9.089 1.00 0.00 H new ATOM 0 HA3 GLY A 68 112.168 -8.248 7.582 1.00 0.00 H new ATOM 903 N PRO A 69 113.246 -10.711 8.407 1.00 0.00 N ATOM 904 CA PRO A 69 113.715 -12.101 8.201 1.00 0.00 C ATOM 905 C PRO A 69 113.169 -12.667 6.886 1.00 0.00 C ATOM 906 O PRO A 69 112.346 -12.057 6.226 1.00 0.00 O ATOM 907 CB PRO A 69 113.141 -12.858 9.396 1.00 0.00 C ATOM 908 CG PRO A 69 111.947 -12.067 9.819 1.00 0.00 C ATOM 909 CD PRO A 69 112.213 -10.630 9.453 1.00 0.00 C ATOM 0 HA PRO A 69 114.800 -12.177 8.135 1.00 0.00 H new ATOM 0 HB2 PRO A 69 112.863 -13.876 9.122 1.00 0.00 H new ATOM 0 HB3 PRO A 69 113.870 -12.933 10.203 1.00 0.00 H new ATOM 0 HG2 PRO A 69 111.048 -12.431 9.321 1.00 0.00 H new ATOM 0 HG3 PRO A 69 111.780 -12.166 10.891 1.00 0.00 H new ATOM 0 HD2 PRO A 69 111.312 -10.139 9.086 1.00 0.00 H new ATOM 0 HD3 PRO A 69 112.560 -10.057 10.313 1.00 0.00 H new ATOM 914 N ALA A 70 113.620 -13.836 6.515 1.00 0.00 N ATOM 915 CA ALA A 70 113.138 -14.471 5.256 1.00 0.00 C ATOM 916 C ALA A 70 112.969 -15.977 5.472 1.00 0.00 C ATOM 917 O ALA A 70 113.804 -16.622 6.081 1.00 0.00 O ATOM 918 CB ALA A 70 114.233 -14.196 4.227 1.00 0.00 C ATOM 0 H ALA A 70 114.307 -14.381 7.035 1.00 0.00 H new ATOM 0 HA ALA A 70 112.174 -14.079 4.932 1.00 0.00 H new ATOM 0 HB1 ALA A 70 113.951 -14.634 3.270 1.00 0.00 H new ATOM 0 HB2 ALA A 70 114.361 -13.120 4.110 1.00 0.00 H new ATOM 0 HB3 ALA A 70 115.170 -14.638 4.566 1.00 0.00 H new ATOM 924 N TYR A 71 111.889 -16.534 4.988 1.00 0.00 N ATOM 925 CA TYR A 71 111.648 -17.996 5.172 1.00 0.00 C ATOM 926 C TYR A 71 111.385 -18.674 3.825 1.00 0.00 C ATOM 927 O TYR A 71 110.783 -18.100 2.938 1.00 0.00 O ATOM 928 CB TYR A 71 110.409 -18.087 6.064 1.00 0.00 C ATOM 929 CG TYR A 71 110.680 -17.402 7.383 1.00 0.00 C ATOM 930 CD1 TYR A 71 111.393 -18.070 8.386 1.00 0.00 C ATOM 931 CD2 TYR A 71 110.219 -16.099 7.602 1.00 0.00 C ATOM 932 CE1 TYR A 71 111.644 -17.435 9.608 1.00 0.00 C ATOM 933 CE2 TYR A 71 110.470 -15.463 8.824 1.00 0.00 C ATOM 934 CZ TYR A 71 111.182 -16.131 9.827 1.00 0.00 C ATOM 935 OH TYR A 71 111.430 -15.505 11.031 1.00 0.00 O ATOM 0 H TYR A 71 111.162 -16.038 4.472 1.00 0.00 H new ATOM 0 HA TYR A 71 112.510 -18.497 5.613 1.00 0.00 H new ATOM 0 HB2 TYR A 71 109.558 -17.620 5.569 1.00 0.00 H new ATOM 0 HB3 TYR A 71 110.146 -19.131 6.233 1.00 0.00 H new ATOM 0 HD1 TYR A 71 111.749 -19.075 8.217 1.00 0.00 H new ATOM 0 HD2 TYR A 71 109.669 -15.584 6.828 1.00 0.00 H new ATOM 0 HE1 TYR A 71 112.194 -17.950 10.382 1.00 0.00 H new ATOM 0 HE2 TYR A 71 110.114 -14.457 8.993 1.00 0.00 H new ATOM 0 HH TYR A 71 111.042 -14.605 11.018 1.00 0.00 H new ATOM 944 N ARG A 72 111.818 -19.898 3.675 1.00 0.00 N ATOM 945 CA ARG A 72 111.577 -20.625 2.395 1.00 0.00 C ATOM 946 C ARG A 72 110.357 -21.538 2.546 1.00 0.00 C ATOM 947 O ARG A 72 110.476 -22.695 2.902 1.00 0.00 O ATOM 948 CB ARG A 72 112.842 -21.451 2.157 1.00 0.00 C ATOM 949 CG ARG A 72 112.766 -22.118 0.783 1.00 0.00 C ATOM 950 CD ARG A 72 114.044 -22.922 0.531 1.00 0.00 C ATOM 951 NE ARG A 72 113.968 -24.070 1.475 1.00 0.00 N ATOM 952 CZ ARG A 72 113.307 -25.146 1.143 1.00 0.00 C ATOM 953 NH1 ARG A 72 113.846 -26.020 0.336 1.00 0.00 N ATOM 954 NH2 ARG A 72 112.107 -25.347 1.617 1.00 0.00 N ATOM 0 H ARG A 72 112.328 -20.425 4.384 1.00 0.00 H new ATOM 0 HA ARG A 72 111.377 -19.951 1.562 1.00 0.00 H new ATOM 0 HB2 ARG A 72 113.723 -20.811 2.214 1.00 0.00 H new ATOM 0 HB3 ARG A 72 112.947 -22.207 2.935 1.00 0.00 H new ATOM 0 HG2 ARG A 72 111.896 -22.773 0.733 1.00 0.00 H new ATOM 0 HG3 ARG A 72 112.641 -21.363 0.007 1.00 0.00 H new ATOM 0 HD2 ARG A 72 114.098 -23.264 -0.503 1.00 0.00 H new ATOM 0 HD3 ARG A 72 114.933 -22.318 0.714 1.00 0.00 H new ATOM 0 HE ARG A 72 114.432 -24.016 2.382 1.00 0.00 H new ATOM 0 HH11 ARG A 72 114.783 -25.862 -0.035 1.00 0.00 H new ATOM 0 HH12 ARG A 72 113.330 -26.861 0.076 1.00 0.00 H new ATOM 0 HH21 ARG A 72 111.686 -24.664 2.246 1.00 0.00 H new ATOM 0 HH22 ARG A 72 111.590 -26.187 1.358 1.00 0.00 H new ATOM 965 N ILE A 73 109.184 -21.021 2.286 1.00 0.00 N ATOM 966 CA ILE A 73 107.948 -21.850 2.420 1.00 0.00 C ATOM 967 C ILE A 73 107.926 -22.970 1.373 1.00 0.00 C ATOM 968 O ILE A 73 107.431 -24.053 1.621 1.00 0.00 O ATOM 969 CB ILE A 73 106.787 -20.871 2.209 1.00 0.00 C ATOM 970 CG1 ILE A 73 105.463 -21.582 2.500 1.00 0.00 C ATOM 971 CG2 ILE A 73 106.786 -20.354 0.767 1.00 0.00 C ATOM 972 CD1 ILE A 73 104.355 -20.543 2.687 1.00 0.00 C ATOM 0 H ILE A 73 109.028 -20.059 1.986 1.00 0.00 H new ATOM 0 HA ILE A 73 107.889 -22.343 3.390 1.00 0.00 H new ATOM 0 HB ILE A 73 106.907 -20.026 2.887 1.00 0.00 H new ATOM 0 HG12 ILE A 73 105.211 -22.254 1.680 1.00 0.00 H new ATOM 0 HG13 ILE A 73 105.557 -22.195 3.397 1.00 0.00 H new ATOM 0 HG21 ILE A 73 105.957 -19.660 0.630 1.00 0.00 H new ATOM 0 HG22 ILE A 73 107.726 -19.841 0.564 1.00 0.00 H new ATOM 0 HG23 ILE A 73 106.674 -21.193 0.080 1.00 0.00 H new ATOM 0 HD11 ILE A 73 103.412 -21.050 2.894 1.00 0.00 H new ATOM 0 HD12 ILE A 73 104.607 -19.889 3.522 1.00 0.00 H new ATOM 0 HD13 ILE A 73 104.256 -19.949 1.778 1.00 0.00 H new ATOM 983 N ASN A 74 108.458 -22.714 0.207 1.00 0.00 N ATOM 984 CA ASN A 74 108.465 -23.759 -0.858 1.00 0.00 C ATOM 985 C ASN A 74 109.604 -23.497 -1.846 1.00 0.00 C ATOM 986 O ASN A 74 110.267 -22.479 -1.785 1.00 0.00 O ATOM 987 CB ASN A 74 107.108 -23.627 -1.553 1.00 0.00 C ATOM 988 CG ASN A 74 106.820 -24.885 -2.377 1.00 0.00 C ATOM 989 OD1 ASN A 74 107.646 -25.770 -2.474 1.00 0.00 O ATOM 990 ND2 ASN A 74 105.668 -25.002 -2.980 1.00 0.00 N ATOM 0 H ASN A 74 108.888 -21.827 -0.054 1.00 0.00 H new ATOM 0 HA ASN A 74 108.619 -24.760 -0.455 1.00 0.00 H new ATOM 0 HB2 ASN A 74 106.323 -23.480 -0.812 1.00 0.00 H new ATOM 0 HB3 ASN A 74 107.105 -22.749 -2.200 1.00 0.00 H new ATOM 0 HD21 ASN A 74 105.463 -25.835 -3.531 1.00 0.00 H new ATOM 0 HD22 ASN A 74 104.973 -24.260 -2.900 1.00 0.00 H new ATOM 996 N ASP A 75 109.830 -24.406 -2.758 1.00 0.00 N ATOM 997 CA ASP A 75 110.924 -24.210 -3.755 1.00 0.00 C ATOM 998 C ASP A 75 110.598 -23.021 -4.662 1.00 0.00 C ATOM 999 O ASP A 75 109.451 -22.754 -4.962 1.00 0.00 O ATOM 1000 CB ASP A 75 110.968 -25.509 -4.565 1.00 0.00 C ATOM 1001 CG ASP A 75 111.369 -26.677 -3.658 1.00 0.00 C ATOM 1002 OD1 ASP A 75 111.928 -26.424 -2.602 1.00 0.00 O ATOM 1003 OD2 ASP A 75 111.111 -27.808 -4.037 1.00 0.00 O ATOM 0 H ASP A 75 109.305 -25.275 -2.856 1.00 0.00 H new ATOM 0 HA ASP A 75 111.882 -23.998 -3.281 1.00 0.00 H new ATOM 0 HB2 ASP A 75 109.993 -25.702 -5.011 1.00 0.00 H new ATOM 0 HB3 ASP A 75 111.680 -25.413 -5.384 1.00 0.00 H new ATOM 1007 N TRP A 76 111.602 -22.302 -5.098 1.00 0.00 N ATOM 1008 CA TRP A 76 111.368 -21.119 -5.987 1.00 0.00 C ATOM 1009 C TRP A 76 110.355 -20.153 -5.357 1.00 0.00 C ATOM 1010 O TRP A 76 109.718 -19.378 -6.044 1.00 0.00 O ATOM 1011 CB TRP A 76 110.818 -21.698 -7.295 1.00 0.00 C ATOM 1012 CG TRP A 76 111.867 -22.539 -7.949 1.00 0.00 C ATOM 1013 CD1 TRP A 76 112.996 -22.066 -8.524 1.00 0.00 C ATOM 1014 CD2 TRP A 76 111.902 -23.987 -8.107 1.00 0.00 C ATOM 1015 NE1 TRP A 76 113.724 -23.131 -9.022 1.00 0.00 N ATOM 1016 CE2 TRP A 76 113.090 -24.336 -8.790 1.00 0.00 C ATOM 1017 CE3 TRP A 76 111.027 -25.019 -7.726 1.00 0.00 C ATOM 1018 CZ2 TRP A 76 113.401 -25.665 -9.085 1.00 0.00 C ATOM 1019 CZ3 TRP A 76 111.335 -26.357 -8.023 1.00 0.00 C ATOM 1020 CH2 TRP A 76 112.519 -26.679 -8.701 1.00 0.00 C ATOM 0 H TRP A 76 112.581 -22.484 -4.876 1.00 0.00 H new ATOM 0 HA TRP A 76 112.283 -20.548 -6.146 1.00 0.00 H new ATOM 0 HB2 TRP A 76 109.930 -22.297 -7.095 1.00 0.00 H new ATOM 0 HB3 TRP A 76 110.515 -20.892 -7.963 1.00 0.00 H new ATOM 0 HD1 TRP A 76 113.282 -21.026 -8.584 1.00 0.00 H new ATOM 0 HE1 TRP A 76 114.619 -23.038 -9.502 1.00 0.00 H new ATOM 0 HE3 TRP A 76 110.113 -24.782 -7.202 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 114.316 -25.907 -9.606 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 110.655 -27.143 -7.727 1.00 0.00 H new ATOM 0 HH2 TRP A 76 112.749 -27.710 -8.926 1.00 0.00 H new ATOM 1030 N ALA A 77 110.207 -20.189 -4.057 1.00 0.00 N ATOM 1031 CA ALA A 77 109.241 -19.269 -3.385 1.00 0.00 C ATOM 1032 C ALA A 77 109.789 -18.829 -2.025 1.00 0.00 C ATOM 1033 O ALA A 77 110.202 -19.644 -1.221 1.00 0.00 O ATOM 1034 CB ALA A 77 107.967 -20.096 -3.207 1.00 0.00 C ATOM 0 H ALA A 77 110.714 -20.816 -3.432 1.00 0.00 H new ATOM 0 HA ALA A 77 109.062 -18.363 -3.964 1.00 0.00 H new ATOM 0 HB1 ALA A 77 107.205 -19.489 -2.718 1.00 0.00 H new ATOM 0 HB2 ALA A 77 107.603 -20.419 -4.183 1.00 0.00 H new ATOM 0 HB3 ALA A 77 108.184 -20.970 -2.593 1.00 0.00 H new ATOM 1040 N SER A 78 109.799 -17.547 -1.761 1.00 0.00 N ATOM 1041 CA SER A 78 110.324 -17.055 -0.450 1.00 0.00 C ATOM 1042 C SER A 78 109.445 -15.923 0.091 1.00 0.00 C ATOM 1043 O SER A 78 108.786 -15.227 -0.657 1.00 0.00 O ATOM 1044 CB SER A 78 111.729 -16.539 -0.757 1.00 0.00 C ATOM 1045 OG SER A 78 112.507 -17.594 -1.307 1.00 0.00 O ATOM 0 H SER A 78 109.467 -16.820 -2.395 1.00 0.00 H new ATOM 0 HA SER A 78 110.330 -17.838 0.308 1.00 0.00 H new ATOM 0 HB2 SER A 78 111.678 -15.706 -1.458 1.00 0.00 H new ATOM 0 HB3 SER A 78 112.197 -16.162 0.152 1.00 0.00 H new ATOM 0 HG SER A 78 113.409 -17.266 -1.507 1.00 0.00 H new ATOM 1050 N ILE A 79 109.441 -15.725 1.386 1.00 0.00 N ATOM 1051 CA ILE A 79 108.615 -14.625 1.972 1.00 0.00 C ATOM 1052 C ILE A 79 109.518 -13.654 2.742 1.00 0.00 C ATOM 1053 O ILE A 79 110.492 -14.052 3.351 1.00 0.00 O ATOM 1054 CB ILE A 79 107.618 -15.319 2.911 1.00 0.00 C ATOM 1055 CG1 ILE A 79 108.370 -16.044 4.033 1.00 0.00 C ATOM 1056 CG2 ILE A 79 106.789 -16.335 2.120 1.00 0.00 C ATOM 1057 CD1 ILE A 79 107.366 -16.576 5.061 1.00 0.00 C ATOM 0 H ILE A 79 109.972 -16.276 2.061 1.00 0.00 H new ATOM 0 HA ILE A 79 108.097 -14.041 1.212 1.00 0.00 H new ATOM 0 HB ILE A 79 106.960 -14.567 3.346 1.00 0.00 H new ATOM 0 HG12 ILE A 79 108.955 -16.866 3.621 1.00 0.00 H new ATOM 0 HG13 ILE A 79 109.072 -15.363 4.514 1.00 0.00 H new ATOM 0 HG21 ILE A 79 106.082 -16.827 2.788 1.00 0.00 H new ATOM 0 HG22 ILE A 79 106.243 -15.822 1.328 1.00 0.00 H new ATOM 0 HG23 ILE A 79 107.451 -17.081 1.680 1.00 0.00 H new ATOM 0 HD11 ILE A 79 107.901 -17.092 5.859 1.00 0.00 H new ATOM 0 HD12 ILE A 79 106.801 -15.744 5.482 1.00 0.00 H new ATOM 0 HD13 ILE A 79 106.681 -17.271 4.575 1.00 0.00 H new ATOM 1068 N TYR A 80 109.210 -12.382 2.707 1.00 0.00 N ATOM 1069 CA TYR A 80 110.063 -11.386 3.425 1.00 0.00 C ATOM 1070 C TYR A 80 109.210 -10.427 4.259 1.00 0.00 C ATOM 1071 O TYR A 80 108.060 -10.175 3.955 1.00 0.00 O ATOM 1072 CB TYR A 80 110.786 -10.613 2.320 1.00 0.00 C ATOM 1073 CG TYR A 80 111.612 -11.562 1.484 1.00 0.00 C ATOM 1074 CD1 TYR A 80 112.873 -11.969 1.930 1.00 0.00 C ATOM 1075 CD2 TYR A 80 111.116 -12.030 0.262 1.00 0.00 C ATOM 1076 CE1 TYR A 80 113.639 -12.847 1.155 1.00 0.00 C ATOM 1077 CE2 TYR A 80 111.881 -12.907 -0.514 1.00 0.00 C ATOM 1078 CZ TYR A 80 113.143 -13.316 -0.068 1.00 0.00 C ATOM 1079 OH TYR A 80 113.899 -14.182 -0.832 1.00 0.00 O ATOM 0 H TYR A 80 108.407 -11.991 2.214 1.00 0.00 H new ATOM 0 HA TYR A 80 110.751 -11.875 4.115 1.00 0.00 H new ATOM 0 HB2 TYR A 80 110.061 -10.097 1.691 1.00 0.00 H new ATOM 0 HB3 TYR A 80 111.427 -9.849 2.759 1.00 0.00 H new ATOM 0 HD1 TYR A 80 113.256 -11.606 2.872 1.00 0.00 H new ATOM 0 HD2 TYR A 80 110.142 -11.714 -0.082 1.00 0.00 H new ATOM 0 HE1 TYR A 80 114.612 -13.163 1.500 1.00 0.00 H new ATOM 0 HE2 TYR A 80 111.498 -13.268 -1.457 1.00 0.00 H new ATOM 0 HH TYR A 80 113.408 -14.411 -1.649 1.00 0.00 H new ATOM 1088 N GLY A 81 109.782 -9.870 5.296 1.00 0.00 N ATOM 1089 CA GLY A 81 109.030 -8.898 6.145 1.00 0.00 C ATOM 1090 C GLY A 81 109.825 -7.591 6.191 1.00 0.00 C ATOM 1091 O GLY A 81 110.996 -7.568 5.864 1.00 0.00 O ATOM 0 H GLY A 81 110.742 -10.048 5.592 1.00 0.00 H new ATOM 0 HA2 GLY A 81 108.035 -8.724 5.734 1.00 0.00 H new ATOM 0 HA3 GLY A 81 108.894 -9.296 7.150 1.00 0.00 H new ATOM 1094 N VAL A 82 109.212 -6.500 6.579 1.00 0.00 N ATOM 1095 CA VAL A 82 109.972 -5.212 6.621 1.00 0.00 C ATOM 1096 C VAL A 82 109.561 -4.351 7.820 1.00 0.00 C ATOM 1097 O VAL A 82 108.393 -4.138 8.074 1.00 0.00 O ATOM 1098 CB VAL A 82 109.617 -4.504 5.311 1.00 0.00 C ATOM 1099 CG1 VAL A 82 110.086 -5.355 4.128 1.00 0.00 C ATOM 1100 CG2 VAL A 82 108.097 -4.296 5.225 1.00 0.00 C ATOM 0 H VAL A 82 108.234 -6.444 6.864 1.00 0.00 H new ATOM 0 HA VAL A 82 111.043 -5.386 6.729 1.00 0.00 H new ATOM 0 HB VAL A 82 110.113 -3.534 5.281 1.00 0.00 H new ATOM 0 HG11 VAL A 82 109.834 -4.851 3.195 1.00 0.00 H new ATOM 0 HG12 VAL A 82 111.166 -5.494 4.185 1.00 0.00 H new ATOM 0 HG13 VAL A 82 109.593 -6.327 4.161 1.00 0.00 H new ATOM 0 HG21 VAL A 82 107.851 -3.792 4.290 1.00 0.00 H new ATOM 0 HG22 VAL A 82 107.595 -5.263 5.259 1.00 0.00 H new ATOM 0 HG23 VAL A 82 107.765 -3.686 6.065 1.00 0.00 H new ATOM 1110 N VAL A 83 110.524 -3.838 8.537 1.00 0.00 N ATOM 1111 CA VAL A 83 110.223 -2.961 9.708 1.00 0.00 C ATOM 1112 C VAL A 83 111.267 -1.842 9.783 1.00 0.00 C ATOM 1113 O VAL A 83 112.399 -2.027 9.384 1.00 0.00 O ATOM 1114 CB VAL A 83 110.303 -3.874 10.937 1.00 0.00 C ATOM 1115 CG1 VAL A 83 109.228 -4.957 10.836 1.00 0.00 C ATOM 1116 CG2 VAL A 83 111.682 -4.539 11.008 1.00 0.00 C ATOM 0 H VAL A 83 111.517 -3.990 8.360 1.00 0.00 H new ATOM 0 HA VAL A 83 109.244 -2.487 9.638 1.00 0.00 H new ATOM 0 HB VAL A 83 110.145 -3.277 11.835 1.00 0.00 H new ATOM 0 HG11 VAL A 83 109.283 -5.607 11.709 1.00 0.00 H new ATOM 0 HG12 VAL A 83 108.244 -4.490 10.793 1.00 0.00 H new ATOM 0 HG13 VAL A 83 109.389 -5.547 9.934 1.00 0.00 H new ATOM 0 HG21 VAL A 83 111.729 -5.186 11.884 1.00 0.00 H new ATOM 0 HG22 VAL A 83 111.846 -5.133 10.109 1.00 0.00 H new ATOM 0 HG23 VAL A 83 112.453 -3.772 11.081 1.00 0.00 H new ATOM 1126 N GLY A 84 110.915 -0.692 10.303 1.00 0.00 N ATOM 1127 CA GLY A 84 111.907 0.401 10.401 1.00 0.00 C ATOM 1128 C GLY A 84 111.195 1.745 10.509 1.00 0.00 C ATOM 1129 O GLY A 84 110.110 1.849 11.048 1.00 0.00 O ATOM 0 H GLY A 84 109.985 -0.472 10.660 1.00 0.00 H new ATOM 0 HA2 GLY A 84 112.545 0.247 11.272 1.00 0.00 H new ATOM 0 HA3 GLY A 84 112.556 0.394 9.525 1.00 0.00 H new ATOM 1132 N VAL A 85 111.830 2.774 10.034 1.00 0.00 N ATOM 1133 CA VAL A 85 111.226 4.134 10.144 1.00 0.00 C ATOM 1134 C VAL A 85 111.202 4.905 8.811 1.00 0.00 C ATOM 1135 O VAL A 85 112.099 4.825 7.994 1.00 0.00 O ATOM 1136 CB VAL A 85 112.088 4.862 11.183 1.00 0.00 C ATOM 1137 CG1 VAL A 85 113.529 4.983 10.685 1.00 0.00 C ATOM 1138 CG2 VAL A 85 111.520 6.262 11.437 1.00 0.00 C ATOM 0 H VAL A 85 112.740 2.737 9.574 1.00 0.00 H new ATOM 0 HA VAL A 85 110.177 4.064 10.433 1.00 0.00 H new ATOM 0 HB VAL A 85 112.078 4.288 12.110 1.00 0.00 H new ATOM 0 HG11 VAL A 85 114.130 5.502 11.432 1.00 0.00 H new ATOM 0 HG12 VAL A 85 113.940 3.988 10.516 1.00 0.00 H new ATOM 0 HG13 VAL A 85 113.545 5.546 9.752 1.00 0.00 H new ATOM 0 HG21 VAL A 85 112.135 6.776 12.176 1.00 0.00 H new ATOM 0 HG22 VAL A 85 111.521 6.829 10.506 1.00 0.00 H new ATOM 0 HG23 VAL A 85 110.499 6.178 11.810 1.00 0.00 H new ATOM 1148 N GLY A 86 110.157 5.669 8.631 1.00 0.00 N ATOM 1149 CA GLY A 86 110.005 6.500 7.400 1.00 0.00 C ATOM 1150 C GLY A 86 110.454 7.926 7.731 1.00 0.00 C ATOM 1151 O GLY A 86 110.341 8.360 8.861 1.00 0.00 O ATOM 0 H GLY A 86 109.389 5.754 9.297 1.00 0.00 H new ATOM 0 HA2 GLY A 86 110.606 6.091 6.588 1.00 0.00 H new ATOM 0 HA3 GLY A 86 108.968 6.496 7.063 1.00 0.00 H new ATOM 1154 N TYR A 87 110.981 8.656 6.776 1.00 0.00 N ATOM 1155 CA TYR A 87 111.445 10.039 7.091 1.00 0.00 C ATOM 1156 C TYR A 87 110.829 11.069 6.142 1.00 0.00 C ATOM 1157 O TYR A 87 110.889 10.937 4.935 1.00 0.00 O ATOM 1158 CB TYR A 87 112.964 9.991 6.918 1.00 0.00 C ATOM 1159 CG TYR A 87 113.565 11.311 7.339 1.00 0.00 C ATOM 1160 CD1 TYR A 87 113.552 11.685 8.687 1.00 0.00 C ATOM 1161 CD2 TYR A 87 114.143 12.156 6.383 1.00 0.00 C ATOM 1162 CE1 TYR A 87 114.116 12.904 9.081 1.00 0.00 C ATOM 1163 CE2 TYR A 87 114.706 13.376 6.778 1.00 0.00 C ATOM 1164 CZ TYR A 87 114.693 13.750 8.126 1.00 0.00 C ATOM 1165 OH TYR A 87 115.248 14.951 8.515 1.00 0.00 O ATOM 0 H TYR A 87 111.107 8.358 5.809 1.00 0.00 H new ATOM 0 HA TYR A 87 111.148 10.342 8.095 1.00 0.00 H new ATOM 0 HB2 TYR A 87 113.383 9.182 7.517 1.00 0.00 H new ATOM 0 HB3 TYR A 87 113.215 9.781 5.878 1.00 0.00 H new ATOM 0 HD1 TYR A 87 113.107 11.033 9.424 1.00 0.00 H new ATOM 0 HD2 TYR A 87 114.154 11.867 5.342 1.00 0.00 H new ATOM 0 HE1 TYR A 87 114.106 13.192 10.122 1.00 0.00 H new ATOM 0 HE2 TYR A 87 115.151 14.029 6.041 1.00 0.00 H new ATOM 0 HH TYR A 87 115.606 15.416 7.730 1.00 0.00 H new ATOM 1174 N GLY A 88 110.264 12.111 6.691 1.00 0.00 N ATOM 1175 CA GLY A 88 109.668 13.184 5.849 1.00 0.00 C ATOM 1176 C GLY A 88 110.551 14.423 5.972 1.00 0.00 C ATOM 1177 O GLY A 88 110.669 15.004 7.038 1.00 0.00 O ATOM 0 H GLY A 88 110.190 12.264 7.697 1.00 0.00 H new ATOM 0 HA2 GLY A 88 109.605 12.862 4.809 1.00 0.00 H new ATOM 0 HA3 GLY A 88 108.652 13.406 6.176 1.00 0.00 H new ATOM 1180 N LYS A 89 111.199 14.815 4.904 1.00 0.00 N ATOM 1181 CA LYS A 89 112.105 16.001 4.979 1.00 0.00 C ATOM 1182 C LYS A 89 111.554 17.184 4.175 1.00 0.00 C ATOM 1183 O LYS A 89 111.270 17.074 2.999 1.00 0.00 O ATOM 1184 CB LYS A 89 113.421 15.518 4.372 1.00 0.00 C ATOM 1185 CG LYS A 89 114.514 16.561 4.620 1.00 0.00 C ATOM 1186 CD LYS A 89 115.817 16.100 3.965 1.00 0.00 C ATOM 1187 CE LYS A 89 116.954 17.037 4.376 1.00 0.00 C ATOM 1188 NZ LYS A 89 117.421 16.518 5.692 1.00 0.00 N ATOM 0 H LYS A 89 111.141 14.368 3.989 1.00 0.00 H new ATOM 0 HA LYS A 89 112.215 16.357 6.003 1.00 0.00 H new ATOM 0 HB2 LYS A 89 113.708 14.564 4.813 1.00 0.00 H new ATOM 0 HB3 LYS A 89 113.300 15.351 3.302 1.00 0.00 H new ATOM 0 HG2 LYS A 89 114.211 17.525 4.212 1.00 0.00 H new ATOM 0 HG3 LYS A 89 114.662 16.700 5.691 1.00 0.00 H new ATOM 0 HD2 LYS A 89 116.047 15.078 4.267 1.00 0.00 H new ATOM 0 HD3 LYS A 89 115.709 16.095 2.880 1.00 0.00 H new ATOM 0 HE2 LYS A 89 117.758 17.029 3.640 1.00 0.00 H new ATOM 0 HE3 LYS A 89 116.607 18.067 4.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 117.293 17.250 6.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 116.869 15.675 5.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 118.428 16.266 5.628 1.00 0.00 H new ATOM 1198 N PHE A 90 111.430 18.321 4.809 1.00 0.00 N ATOM 1199 CA PHE A 90 110.928 19.535 4.101 1.00 0.00 C ATOM 1200 C PHE A 90 112.038 20.590 4.053 1.00 0.00 C ATOM 1201 O PHE A 90 112.715 20.825 5.034 1.00 0.00 O ATOM 1202 CB PHE A 90 109.750 20.030 4.943 1.00 0.00 C ATOM 1203 CG PHE A 90 109.124 21.235 4.279 1.00 0.00 C ATOM 1204 CD1 PHE A 90 108.191 21.063 3.250 1.00 0.00 C ATOM 1205 CD2 PHE A 90 109.479 22.524 4.694 1.00 0.00 C ATOM 1206 CE1 PHE A 90 107.612 22.181 2.637 1.00 0.00 C ATOM 1207 CE2 PHE A 90 108.899 23.641 4.081 1.00 0.00 C ATOM 1208 CZ PHE A 90 107.966 23.470 3.052 1.00 0.00 C ATOM 0 H PHE A 90 111.657 18.461 5.794 1.00 0.00 H new ATOM 0 HA PHE A 90 110.627 19.330 3.074 1.00 0.00 H new ATOM 0 HB2 PHE A 90 109.010 19.237 5.053 1.00 0.00 H new ATOM 0 HB3 PHE A 90 110.090 20.290 5.945 1.00 0.00 H new ATOM 0 HD1 PHE A 90 107.918 20.069 2.929 1.00 0.00 H new ATOM 0 HD2 PHE A 90 110.200 22.657 5.487 1.00 0.00 H new ATOM 0 HE1 PHE A 90 106.892 22.049 1.843 1.00 0.00 H new ATOM 0 HE2 PHE A 90 109.172 24.635 4.402 1.00 0.00 H new ATOM 0 HZ PHE A 90 107.520 24.332 2.579 1.00 0.00 H new ATOM 1217 N GLN A 91 112.239 21.220 2.920 1.00 0.00 N ATOM 1218 CA GLN A 91 113.317 22.257 2.802 1.00 0.00 C ATOM 1219 C GLN A 91 114.683 21.641 3.127 1.00 0.00 C ATOM 1220 O GLN A 91 114.999 21.370 4.269 1.00 0.00 O ATOM 1221 CB GLN A 91 112.960 23.352 3.814 1.00 0.00 C ATOM 1222 CG GLN A 91 113.862 24.568 3.588 1.00 0.00 C ATOM 1223 CD GLN A 91 113.580 25.621 4.661 1.00 0.00 C ATOM 1224 OE1 GLN A 91 113.799 25.384 5.833 1.00 0.00 O ATOM 1225 NE2 GLN A 91 113.099 26.781 4.308 1.00 0.00 N ATOM 0 H GLN A 91 111.701 21.061 2.068 1.00 0.00 H new ATOM 0 HA GLN A 91 113.381 22.660 1.791 1.00 0.00 H new ATOM 0 HB2 GLN A 91 111.914 23.636 3.704 1.00 0.00 H new ATOM 0 HB3 GLN A 91 113.084 22.978 4.830 1.00 0.00 H new ATOM 0 HG2 GLN A 91 114.909 24.268 3.624 1.00 0.00 H new ATOM 0 HG3 GLN A 91 113.684 24.987 2.597 1.00 0.00 H new ATOM 0 HE21 GLN A 91 112.916 26.979 3.324 1.00 0.00 H new ATOM 0 HE22 GLN A 91 112.906 27.490 5.016 1.00 0.00 H new ATOM 1232 N THR A 92 115.491 21.413 2.122 1.00 0.00 N ATOM 1233 CA THR A 92 116.838 20.805 2.354 1.00 0.00 C ATOM 1234 C THR A 92 117.652 21.642 3.348 1.00 0.00 C ATOM 1235 O THR A 92 118.356 21.109 4.185 1.00 0.00 O ATOM 1236 CB THR A 92 117.519 20.794 0.979 1.00 0.00 C ATOM 1237 OG1 THR A 92 118.812 20.219 1.102 1.00 0.00 O ATOM 1238 CG2 THR A 92 117.644 22.223 0.444 1.00 0.00 C ATOM 0 H THR A 92 115.275 21.622 1.147 1.00 0.00 H new ATOM 0 HA THR A 92 116.759 19.805 2.780 1.00 0.00 H new ATOM 0 HB THR A 92 116.918 20.207 0.285 1.00 0.00 H new ATOM 0 HG1 THR A 92 119.250 20.209 0.225 1.00 0.00 H new ATOM 0 HG21 THR A 92 118.129 22.205 -0.532 1.00 0.00 H new ATOM 0 HG22 THR A 92 116.652 22.664 0.349 1.00 0.00 H new ATOM 0 HG23 THR A 92 118.241 22.819 1.134 1.00 0.00 H new ATOM 1246 N THR A 93 117.568 22.944 3.258 1.00 0.00 N ATOM 1247 CA THR A 93 118.345 23.807 4.196 1.00 0.00 C ATOM 1248 C THR A 93 117.732 23.753 5.598 1.00 0.00 C ATOM 1249 O THR A 93 116.540 23.916 5.773 1.00 0.00 O ATOM 1250 CB THR A 93 118.241 25.220 3.619 1.00 0.00 C ATOM 1251 OG1 THR A 93 118.677 25.211 2.267 1.00 0.00 O ATOM 1252 CG2 THR A 93 119.117 26.173 4.433 1.00 0.00 C ATOM 0 H THR A 93 116.997 23.445 2.578 1.00 0.00 H new ATOM 0 HA THR A 93 119.381 23.482 4.290 1.00 0.00 H new ATOM 0 HB THR A 93 117.205 25.555 3.665 1.00 0.00 H new ATOM 0 HG1 THR A 93 118.609 26.115 1.895 1.00 0.00 H new ATOM 0 HG21 THR A 93 119.041 27.179 4.020 1.00 0.00 H new ATOM 0 HG22 THR A 93 118.781 26.180 5.470 1.00 0.00 H new ATOM 0 HG23 THR A 93 120.154 25.840 4.390 1.00 0.00 H new ATOM 1260 N GLU A 94 118.545 23.528 6.597 1.00 0.00 N ATOM 1261 CA GLU A 94 118.024 23.463 7.993 1.00 0.00 C ATOM 1262 C GLU A 94 118.790 24.443 8.886 1.00 0.00 C ATOM 1263 O GLU A 94 119.920 24.795 8.606 1.00 0.00 O ATOM 1264 CB GLU A 94 118.269 22.021 8.443 1.00 0.00 C ATOM 1265 CG GLU A 94 117.497 21.061 7.533 1.00 0.00 C ATOM 1266 CD GLU A 94 117.677 19.617 8.019 1.00 0.00 C ATOM 1267 OE1 GLU A 94 118.532 19.391 8.861 1.00 0.00 O ATOM 1268 OE2 GLU A 94 116.956 18.759 7.535 1.00 0.00 O ATOM 0 H GLU A 94 119.551 23.386 6.505 1.00 0.00 H new ATOM 0 HA GLU A 94 116.970 23.733 8.054 1.00 0.00 H new ATOM 0 HB2 GLU A 94 119.335 21.794 8.407 1.00 0.00 H new ATOM 0 HB3 GLU A 94 117.950 21.893 9.477 1.00 0.00 H new ATOM 0 HG2 GLU A 94 116.439 21.323 7.529 1.00 0.00 H new ATOM 0 HG3 GLU A 94 117.852 21.155 6.507 1.00 0.00 H new ATOM 1273 N TYR A 95 118.186 24.881 9.960 1.00 0.00 N ATOM 1274 CA TYR A 95 118.881 25.834 10.875 1.00 0.00 C ATOM 1275 C TYR A 95 119.784 25.061 11.848 1.00 0.00 C ATOM 1276 O TYR A 95 119.454 23.962 12.247 1.00 0.00 O ATOM 1277 CB TYR A 95 117.761 26.548 11.631 1.00 0.00 C ATOM 1278 CG TYR A 95 116.990 27.425 10.675 1.00 0.00 C ATOM 1279 CD1 TYR A 95 115.934 26.888 9.929 1.00 0.00 C ATOM 1280 CD2 TYR A 95 117.332 28.774 10.533 1.00 0.00 C ATOM 1281 CE1 TYR A 95 115.219 27.702 9.041 1.00 0.00 C ATOM 1282 CE2 TYR A 95 116.617 29.588 9.646 1.00 0.00 C ATOM 1283 CZ TYR A 95 115.561 29.052 8.901 1.00 0.00 C ATOM 1284 OH TYR A 95 114.856 29.854 8.026 1.00 0.00 O ATOM 0 H TYR A 95 117.241 24.620 10.243 1.00 0.00 H new ATOM 0 HA TYR A 95 119.518 26.537 10.338 1.00 0.00 H new ATOM 0 HB2 TYR A 95 117.094 25.818 12.090 1.00 0.00 H new ATOM 0 HB3 TYR A 95 118.178 27.150 12.438 1.00 0.00 H new ATOM 0 HD1 TYR A 95 115.671 25.846 10.038 1.00 0.00 H new ATOM 0 HD2 TYR A 95 118.148 29.188 11.108 1.00 0.00 H new ATOM 0 HE1 TYR A 95 114.405 27.288 8.465 1.00 0.00 H new ATOM 0 HE2 TYR A 95 116.881 30.630 9.537 1.00 0.00 H new ATOM 0 HH TYR A 95 115.220 30.763 8.050 1.00 0.00 H new ATOM 1293 N PRO A 96 120.900 25.656 12.201 1.00 0.00 N ATOM 1294 CA PRO A 96 121.843 24.990 13.136 1.00 0.00 C ATOM 1295 C PRO A 96 121.255 24.944 14.550 1.00 0.00 C ATOM 1296 O PRO A 96 120.829 25.945 15.085 1.00 0.00 O ATOM 1297 CB PRO A 96 123.085 25.877 13.089 1.00 0.00 C ATOM 1298 CG PRO A 96 122.581 27.219 12.667 1.00 0.00 C ATOM 1299 CD PRO A 96 121.388 26.978 11.781 1.00 0.00 C ATOM 0 HA PRO A 96 122.055 23.956 12.864 1.00 0.00 H new ATOM 0 HB2 PRO A 96 123.573 25.926 14.062 1.00 0.00 H new ATOM 0 HB3 PRO A 96 123.820 25.491 12.383 1.00 0.00 H new ATOM 0 HG2 PRO A 96 122.303 27.818 13.534 1.00 0.00 H new ATOM 0 HG3 PRO A 96 123.354 27.771 12.133 1.00 0.00 H new ATOM 0 HD2 PRO A 96 120.627 27.747 11.917 1.00 0.00 H new ATOM 0 HD3 PRO A 96 121.665 26.986 10.727 1.00 0.00 H new ATOM 1304 N THR A 97 121.240 23.780 15.154 1.00 0.00 N ATOM 1305 CA THR A 97 120.692 23.624 16.545 1.00 0.00 C ATOM 1306 C THR A 97 119.376 24.396 16.744 1.00 0.00 C ATOM 1307 O THR A 97 119.029 24.758 17.851 1.00 0.00 O ATOM 1308 CB THR A 97 121.782 24.176 17.471 1.00 0.00 C ATOM 1309 OG1 THR A 97 122.023 25.542 17.167 1.00 0.00 O ATOM 1310 CG2 THR A 97 123.072 23.375 17.280 1.00 0.00 C ATOM 0 H THR A 97 121.589 22.917 14.738 1.00 0.00 H new ATOM 0 HA THR A 97 120.454 22.581 16.752 1.00 0.00 H new ATOM 0 HB THR A 97 121.451 24.090 18.506 1.00 0.00 H new ATOM 0 HG1 THR A 97 121.222 25.932 16.758 1.00 0.00 H new ATOM 0 HG21 THR A 97 123.846 23.769 17.939 1.00 0.00 H new ATOM 0 HG22 THR A 97 122.889 22.328 17.520 1.00 0.00 H new ATOM 0 HG23 THR A 97 123.401 23.457 16.244 1.00 0.00 H new ATOM 1318 N TYR A 98 118.638 24.640 15.690 1.00 0.00 N ATOM 1319 CA TYR A 98 117.342 25.372 15.836 1.00 0.00 C ATOM 1320 C TYR A 98 116.247 24.692 15.009 1.00 0.00 C ATOM 1321 O TYR A 98 116.499 24.169 13.942 1.00 0.00 O ATOM 1322 CB TYR A 98 117.606 26.789 15.317 1.00 0.00 C ATOM 1323 CG TYR A 98 118.494 27.541 16.288 1.00 0.00 C ATOM 1324 CD1 TYR A 98 118.201 27.537 17.660 1.00 0.00 C ATOM 1325 CD2 TYR A 98 119.605 28.247 15.813 1.00 0.00 C ATOM 1326 CE1 TYR A 98 119.021 28.237 18.552 1.00 0.00 C ATOM 1327 CE2 TYR A 98 120.425 28.947 16.707 1.00 0.00 C ATOM 1328 CZ TYR A 98 120.132 28.942 18.076 1.00 0.00 C ATOM 1329 OH TYR A 98 120.940 29.632 18.957 1.00 0.00 O ATOM 0 H TYR A 98 118.876 24.365 14.737 1.00 0.00 H new ATOM 0 HA TYR A 98 116.999 25.381 16.871 1.00 0.00 H new ATOM 0 HB2 TYR A 98 118.082 26.743 14.337 1.00 0.00 H new ATOM 0 HB3 TYR A 98 116.663 27.320 15.189 1.00 0.00 H new ATOM 0 HD1 TYR A 98 117.343 26.994 18.028 1.00 0.00 H new ATOM 0 HD2 TYR A 98 119.830 28.252 14.757 1.00 0.00 H new ATOM 0 HE1 TYR A 98 118.796 28.233 19.608 1.00 0.00 H new ATOM 0 HE2 TYR A 98 121.283 29.491 16.340 1.00 0.00 H new ATOM 0 HH TYR A 98 121.667 30.066 18.463 1.00 0.00 H new ATOM 1338 N LYS A 99 115.032 24.698 15.500 1.00 0.00 N ATOM 1339 CA LYS A 99 113.901 24.057 14.755 1.00 0.00 C ATOM 1340 C LYS A 99 114.216 22.588 14.458 1.00 0.00 C ATOM 1341 O LYS A 99 114.034 22.114 13.355 1.00 0.00 O ATOM 1342 CB LYS A 99 113.752 24.859 13.456 1.00 0.00 C ATOM 1343 CG LYS A 99 113.388 26.307 13.793 1.00 0.00 C ATOM 1344 CD LYS A 99 113.121 27.082 12.501 1.00 0.00 C ATOM 1345 CE LYS A 99 112.873 28.555 12.832 1.00 0.00 C ATOM 1346 NZ LYS A 99 113.558 29.313 11.748 1.00 0.00 N ATOM 0 H LYS A 99 114.772 25.122 16.391 1.00 0.00 H new ATOM 0 HA LYS A 99 112.979 24.066 15.336 1.00 0.00 H new ATOM 0 HB2 LYS A 99 114.682 24.829 12.888 1.00 0.00 H new ATOM 0 HB3 LYS A 99 112.980 24.415 12.828 1.00 0.00 H new ATOM 0 HG2 LYS A 99 112.506 26.332 14.433 1.00 0.00 H new ATOM 0 HG3 LYS A 99 114.199 26.776 14.350 1.00 0.00 H new ATOM 0 HD2 LYS A 99 113.971 26.988 11.826 1.00 0.00 H new ATOM 0 HD3 LYS A 99 112.257 26.664 11.985 1.00 0.00 H new ATOM 0 HE2 LYS A 99 111.807 28.780 12.858 1.00 0.00 H new ATOM 0 HE3 LYS A 99 113.277 28.813 13.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 113.433 30.333 11.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 114.572 29.084 11.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 113.148 29.052 10.829 1.00 0.00 H new ATOM 1356 N ASN A 100 114.685 21.867 15.441 1.00 0.00 N ATOM 1357 CA ASN A 100 115.013 20.423 15.235 1.00 0.00 C ATOM 1358 C ASN A 100 113.783 19.653 14.736 1.00 0.00 C ATOM 1359 O ASN A 100 113.899 18.586 14.164 1.00 0.00 O ATOM 1360 CB ASN A 100 115.443 19.909 16.612 1.00 0.00 C ATOM 1361 CG ASN A 100 116.160 18.564 16.462 1.00 0.00 C ATOM 1362 OD1 ASN A 100 116.541 18.180 15.373 1.00 0.00 O ATOM 1363 ND2 ASN A 100 116.362 17.828 17.520 1.00 0.00 N ATOM 0 H ASN A 100 114.857 22.217 16.384 1.00 0.00 H new ATOM 0 HA ASN A 100 115.793 20.288 14.485 1.00 0.00 H new ATOM 0 HB2 ASN A 100 116.103 20.632 17.091 1.00 0.00 H new ATOM 0 HB3 ASN A 100 114.572 19.797 17.257 1.00 0.00 H new ATOM 0 HD21 ASN A 100 116.839 16.931 17.434 1.00 0.00 H new ATOM 0 HD22 ASN A 100 116.043 18.150 18.434 1.00 0.00 H new ATOM 1369 N ASP A 101 112.605 20.177 14.966 1.00 0.00 N ATOM 1370 CA ASP A 101 111.361 19.471 14.525 1.00 0.00 C ATOM 1371 C ASP A 101 111.030 19.759 13.051 1.00 0.00 C ATOM 1372 O ASP A 101 109.918 19.535 12.614 1.00 0.00 O ATOM 1373 CB ASP A 101 110.259 20.020 15.433 1.00 0.00 C ATOM 1374 CG ASP A 101 110.531 19.618 16.886 1.00 0.00 C ATOM 1375 OD1 ASP A 101 111.285 18.680 17.096 1.00 0.00 O ATOM 1376 OD2 ASP A 101 109.980 20.257 17.768 1.00 0.00 O ATOM 0 H ASP A 101 112.450 21.066 15.442 1.00 0.00 H new ATOM 0 HA ASP A 101 111.472 18.389 14.600 1.00 0.00 H new ATOM 0 HB2 ASP A 101 110.214 21.106 15.349 1.00 0.00 H new ATOM 0 HB3 ASP A 101 109.290 19.636 15.116 1.00 0.00 H new ATOM 1380 N THR A 102 111.976 20.235 12.277 1.00 0.00 N ATOM 1381 CA THR A 102 111.690 20.507 10.833 1.00 0.00 C ATOM 1382 C THR A 102 111.286 19.207 10.130 1.00 0.00 C ATOM 1383 O THR A 102 110.468 19.202 9.231 1.00 0.00 O ATOM 1384 CB THR A 102 112.997 21.048 10.251 1.00 0.00 C ATOM 1385 OG1 THR A 102 113.400 22.197 10.981 1.00 0.00 O ATOM 1386 CG2 THR A 102 112.790 21.422 8.783 1.00 0.00 C ATOM 0 H THR A 102 112.927 20.446 12.580 1.00 0.00 H new ATOM 0 HA THR A 102 110.872 21.215 10.702 1.00 0.00 H new ATOM 0 HB THR A 102 113.769 20.282 10.323 1.00 0.00 H new ATOM 0 HG1 THR A 102 113.992 21.928 11.714 1.00 0.00 H new ATOM 0 HG21 THR A 102 113.723 21.807 8.371 1.00 0.00 H new ATOM 0 HG22 THR A 102 112.483 20.539 8.222 1.00 0.00 H new ATOM 0 HG23 THR A 102 112.017 22.187 8.708 1.00 0.00 H new ATOM 1394 N SER A 103 111.854 18.106 10.546 1.00 0.00 N ATOM 1395 CA SER A 103 111.513 16.794 9.924 1.00 0.00 C ATOM 1396 C SER A 103 110.856 15.886 10.968 1.00 0.00 C ATOM 1397 O SER A 103 110.990 16.105 12.156 1.00 0.00 O ATOM 1398 CB SER A 103 112.849 16.210 9.467 1.00 0.00 C ATOM 1399 OG SER A 103 113.654 15.933 10.606 1.00 0.00 O ATOM 0 H SER A 103 112.544 18.060 11.295 1.00 0.00 H new ATOM 0 HA SER A 103 110.813 16.893 9.094 1.00 0.00 H new ATOM 0 HB2 SER A 103 112.683 15.298 8.894 1.00 0.00 H new ATOM 0 HB3 SER A 103 113.360 16.912 8.808 1.00 0.00 H new ATOM 0 HG SER A 103 114.485 15.499 10.321 1.00 0.00 H new ATOM 1404 N ASP A 104 110.145 14.875 10.539 1.00 0.00 N ATOM 1405 CA ASP A 104 109.481 13.966 11.522 1.00 0.00 C ATOM 1406 C ASP A 104 109.696 12.503 11.127 1.00 0.00 C ATOM 1407 O ASP A 104 109.911 12.190 9.970 1.00 0.00 O ATOM 1408 CB ASP A 104 107.995 14.330 11.461 1.00 0.00 C ATOM 1409 CG ASP A 104 107.245 13.672 12.625 1.00 0.00 C ATOM 1410 OD1 ASP A 104 107.899 13.162 13.523 1.00 0.00 O ATOM 1411 OD2 ASP A 104 106.025 13.689 12.600 1.00 0.00 O ATOM 0 H ASP A 104 109.996 14.640 9.558 1.00 0.00 H new ATOM 0 HA ASP A 104 109.887 14.082 12.527 1.00 0.00 H new ATOM 0 HB2 ASP A 104 107.875 15.412 11.506 1.00 0.00 H new ATOM 0 HB3 ASP A 104 107.570 14.002 10.512 1.00 0.00 H new ATOM 1415 N TYR A 105 109.654 11.606 12.079 1.00 0.00 N ATOM 1416 CA TYR A 105 109.869 10.161 11.766 1.00 0.00 C ATOM 1417 C TYR A 105 108.575 9.366 11.973 1.00 0.00 C ATOM 1418 O TYR A 105 107.705 9.757 12.725 1.00 0.00 O ATOM 1419 CB TYR A 105 110.931 9.693 12.764 1.00 0.00 C ATOM 1420 CG TYR A 105 112.201 10.489 12.581 1.00 0.00 C ATOM 1421 CD1 TYR A 105 112.388 11.682 13.291 1.00 0.00 C ATOM 1422 CD2 TYR A 105 113.194 10.035 11.704 1.00 0.00 C ATOM 1423 CE1 TYR A 105 113.566 12.419 13.124 1.00 0.00 C ATOM 1424 CE2 TYR A 105 114.372 10.771 11.538 1.00 0.00 C ATOM 1425 CZ TYR A 105 114.559 11.964 12.248 1.00 0.00 C ATOM 1426 OH TYR A 105 115.721 12.689 12.085 1.00 0.00 O ATOM 0 H TYR A 105 109.480 11.813 13.062 1.00 0.00 H new ATOM 0 HA TYR A 105 110.175 10.013 10.730 1.00 0.00 H new ATOM 0 HB2 TYR A 105 110.562 9.812 13.783 1.00 0.00 H new ATOM 0 HB3 TYR A 105 111.134 8.632 12.620 1.00 0.00 H new ATOM 0 HD1 TYR A 105 111.623 12.033 13.967 1.00 0.00 H new ATOM 0 HD2 TYR A 105 113.050 9.116 11.155 1.00 0.00 H new ATOM 0 HE1 TYR A 105 113.709 13.339 13.671 1.00 0.00 H new ATOM 0 HE2 TYR A 105 115.138 10.419 10.862 1.00 0.00 H new ATOM 0 HH TYR A 105 115.803 12.970 11.150 1.00 0.00 H new ATOM 1435 N GLY A 106 108.461 8.239 11.320 1.00 0.00 N ATOM 1436 CA GLY A 106 107.246 7.386 11.477 1.00 0.00 C ATOM 1437 C GLY A 106 107.679 5.922 11.412 1.00 0.00 C ATOM 1438 O GLY A 106 108.759 5.620 10.951 1.00 0.00 O ATOM 0 H GLY A 106 109.164 7.870 10.679 1.00 0.00 H new ATOM 0 HA2 GLY A 106 106.755 7.595 12.427 1.00 0.00 H new ATOM 0 HA3 GLY A 106 106.524 7.604 10.690 1.00 0.00 H new ATOM 1441 N PHE A 107 106.869 5.008 11.882 1.00 0.00 N ATOM 1442 CA PHE A 107 107.277 3.569 11.852 1.00 0.00 C ATOM 1443 C PHE A 107 106.674 2.854 10.638 1.00 0.00 C ATOM 1444 O PHE A 107 105.575 3.152 10.213 1.00 0.00 O ATOM 1445 CB PHE A 107 106.725 2.976 13.147 1.00 0.00 C ATOM 1446 CG PHE A 107 107.396 3.637 14.329 1.00 0.00 C ATOM 1447 CD1 PHE A 107 108.617 3.146 14.805 1.00 0.00 C ATOM 1448 CD2 PHE A 107 106.796 4.740 14.946 1.00 0.00 C ATOM 1449 CE1 PHE A 107 109.238 3.758 15.900 1.00 0.00 C ATOM 1450 CE2 PHE A 107 107.417 5.353 16.041 1.00 0.00 C ATOM 1451 CZ PHE A 107 108.638 4.862 16.517 1.00 0.00 C ATOM 0 H PHE A 107 105.949 5.193 12.283 1.00 0.00 H new ATOM 0 HA PHE A 107 108.358 3.456 11.772 1.00 0.00 H new ATOM 0 HB2 PHE A 107 105.646 3.125 13.197 1.00 0.00 H new ATOM 0 HB3 PHE A 107 106.900 1.900 13.171 1.00 0.00 H new ATOM 0 HD1 PHE A 107 109.080 2.295 14.328 1.00 0.00 H new ATOM 0 HD2 PHE A 107 105.854 5.119 14.578 1.00 0.00 H new ATOM 0 HE1 PHE A 107 110.180 3.379 16.269 1.00 0.00 H new ATOM 0 HE2 PHE A 107 106.954 6.204 16.518 1.00 0.00 H new ATOM 0 HZ PHE A 107 109.118 5.335 17.361 1.00 0.00 H new ATOM 1460 N SER A 108 107.391 1.911 10.079 1.00 0.00 N ATOM 1461 CA SER A 108 106.871 1.170 8.892 1.00 0.00 C ATOM 1462 C SER A 108 106.826 -0.334 9.182 1.00 0.00 C ATOM 1463 O SER A 108 107.642 -0.857 9.915 1.00 0.00 O ATOM 1464 CB SER A 108 107.864 1.470 7.771 1.00 0.00 C ATOM 1465 OG SER A 108 107.385 0.909 6.556 1.00 0.00 O ATOM 0 H SER A 108 108.317 1.623 10.396 1.00 0.00 H new ATOM 0 HA SER A 108 105.857 1.472 8.630 1.00 0.00 H new ATOM 0 HB2 SER A 108 107.992 2.547 7.662 1.00 0.00 H new ATOM 0 HB3 SER A 108 108.842 1.056 8.016 1.00 0.00 H new ATOM 0 HG SER A 108 108.019 1.101 5.834 1.00 0.00 H new ATOM 1470 N TYR A 109 105.887 -1.032 8.596 1.00 0.00 N ATOM 1471 CA TYR A 109 105.793 -2.506 8.818 1.00 0.00 C ATOM 1472 C TYR A 109 105.112 -3.166 7.615 1.00 0.00 C ATOM 1473 O TYR A 109 104.226 -2.591 7.011 1.00 0.00 O ATOM 1474 CB TYR A 109 104.939 -2.668 10.076 1.00 0.00 C ATOM 1475 CG TYR A 109 104.904 -4.125 10.473 1.00 0.00 C ATOM 1476 CD1 TYR A 109 105.938 -4.662 11.250 1.00 0.00 C ATOM 1477 CD2 TYR A 109 103.842 -4.938 10.063 1.00 0.00 C ATOM 1478 CE1 TYR A 109 105.909 -6.013 11.616 1.00 0.00 C ATOM 1479 CE2 TYR A 109 103.812 -6.289 10.430 1.00 0.00 C ATOM 1480 CZ TYR A 109 104.846 -6.827 11.206 1.00 0.00 C ATOM 1481 OH TYR A 109 104.818 -8.158 11.567 1.00 0.00 O ATOM 0 H TYR A 109 105.180 -0.643 7.972 1.00 0.00 H new ATOM 0 HA TYR A 109 106.771 -2.974 8.934 1.00 0.00 H new ATOM 0 HB2 TYR A 109 105.350 -2.068 10.888 1.00 0.00 H new ATOM 0 HB3 TYR A 109 103.928 -2.305 9.892 1.00 0.00 H new ATOM 0 HD1 TYR A 109 106.758 -4.034 11.567 1.00 0.00 H new ATOM 0 HD2 TYR A 109 103.045 -4.524 9.463 1.00 0.00 H new ATOM 0 HE1 TYR A 109 106.707 -6.427 12.215 1.00 0.00 H new ATOM 0 HE2 TYR A 109 102.991 -6.916 10.115 1.00 0.00 H new ATOM 0 HH TYR A 109 104.012 -8.579 11.202 1.00 0.00 H new ATOM 1490 N GLY A 110 105.505 -4.366 7.262 1.00 0.00 N ATOM 1491 CA GLY A 110 104.854 -5.036 6.097 1.00 0.00 C ATOM 1492 C GLY A 110 105.588 -6.329 5.730 1.00 0.00 C ATOM 1493 O GLY A 110 106.554 -6.716 6.356 1.00 0.00 O ATOM 0 H GLY A 110 106.239 -4.903 7.724 1.00 0.00 H new ATOM 0 HA2 GLY A 110 103.814 -5.259 6.335 1.00 0.00 H new ATOM 0 HA3 GLY A 110 104.848 -4.361 5.241 1.00 0.00 H new ATOM 1496 N ALA A 111 105.119 -6.993 4.706 1.00 0.00 N ATOM 1497 CA ALA A 111 105.756 -8.267 4.254 1.00 0.00 C ATOM 1498 C ALA A 111 105.203 -8.633 2.873 1.00 0.00 C ATOM 1499 O ALA A 111 104.188 -8.104 2.458 1.00 0.00 O ATOM 1500 CB ALA A 111 105.352 -9.310 5.295 1.00 0.00 C ATOM 0 H ALA A 111 104.311 -6.703 4.156 1.00 0.00 H new ATOM 0 HA ALA A 111 106.840 -8.196 4.169 1.00 0.00 H new ATOM 0 HB1 ALA A 111 105.784 -10.275 5.030 1.00 0.00 H new ATOM 0 HB2 ALA A 111 105.718 -9.006 6.276 1.00 0.00 H new ATOM 0 HB3 ALA A 111 104.266 -9.394 5.323 1.00 0.00 H new ATOM 1506 N GLY A 112 105.843 -9.519 2.149 1.00 0.00 N ATOM 1507 CA GLY A 112 105.322 -9.885 0.798 1.00 0.00 C ATOM 1508 C GLY A 112 105.823 -11.280 0.410 1.00 0.00 C ATOM 1509 O GLY A 112 106.440 -11.969 1.198 1.00 0.00 O ATOM 0 H GLY A 112 106.696 -10.000 2.433 1.00 0.00 H new ATOM 0 HA2 GLY A 112 104.232 -9.868 0.801 1.00 0.00 H new ATOM 0 HA3 GLY A 112 105.650 -9.152 0.061 1.00 0.00 H new ATOM 1512 N LEU A 113 105.566 -11.697 -0.805 1.00 0.00 N ATOM 1513 CA LEU A 113 106.029 -13.046 -1.261 1.00 0.00 C ATOM 1514 C LEU A 113 106.787 -12.900 -2.582 1.00 0.00 C ATOM 1515 O LEU A 113 106.533 -11.983 -3.340 1.00 0.00 O ATOM 1516 CB LEU A 113 104.750 -13.868 -1.467 1.00 0.00 C ATOM 1517 CG LEU A 113 103.916 -13.877 -0.181 1.00 0.00 C ATOM 1518 CD1 LEU A 113 102.616 -14.647 -0.422 1.00 0.00 C ATOM 1519 CD2 LEU A 113 104.703 -14.562 0.940 1.00 0.00 C ATOM 0 H LEU A 113 105.053 -11.159 -1.504 1.00 0.00 H new ATOM 0 HA LEU A 113 106.698 -13.522 -0.544 1.00 0.00 H new ATOM 0 HB2 LEU A 113 104.166 -13.447 -2.285 1.00 0.00 H new ATOM 0 HB3 LEU A 113 105.006 -14.889 -1.750 1.00 0.00 H new ATOM 0 HG LEU A 113 103.690 -12.850 0.106 1.00 0.00 H new ATOM 0 HD11 LEU A 113 102.022 -14.654 0.492 1.00 0.00 H new ATOM 0 HD12 LEU A 113 102.050 -14.165 -1.219 1.00 0.00 H new ATOM 0 HD13 LEU A 113 102.848 -15.672 -0.711 1.00 0.00 H new ATOM 0 HD21 LEU A 113 104.107 -14.567 1.853 1.00 0.00 H new ATOM 0 HD22 LEU A 113 104.931 -15.588 0.650 1.00 0.00 H new ATOM 0 HD23 LEU A 113 105.632 -14.020 1.116 1.00 0.00 H new ATOM 1530 N GLN A 114 107.705 -13.785 -2.883 1.00 0.00 N ATOM 1531 CA GLN A 114 108.455 -13.672 -4.169 1.00 0.00 C ATOM 1532 C GLN A 114 108.220 -14.923 -5.024 1.00 0.00 C ATOM 1533 O GLN A 114 108.167 -16.028 -4.516 1.00 0.00 O ATOM 1534 CB GLN A 114 109.925 -13.566 -3.762 1.00 0.00 C ATOM 1535 CG GLN A 114 110.784 -13.318 -5.003 1.00 0.00 C ATOM 1536 CD GLN A 114 112.263 -13.360 -4.617 1.00 0.00 C ATOM 1537 OE1 GLN A 114 112.735 -14.343 -4.080 1.00 0.00 O ATOM 1538 NE2 GLN A 114 113.021 -12.328 -4.869 1.00 0.00 N ATOM 0 H GLN A 114 107.966 -14.577 -2.296 1.00 0.00 H new ATOM 0 HA GLN A 114 108.136 -12.815 -4.763 1.00 0.00 H new ATOM 0 HB2 GLN A 114 110.057 -12.754 -3.047 1.00 0.00 H new ATOM 0 HB3 GLN A 114 110.242 -14.483 -3.265 1.00 0.00 H new ATOM 0 HG2 GLN A 114 110.573 -14.073 -5.761 1.00 0.00 H new ATOM 0 HG3 GLN A 114 110.539 -12.350 -5.440 1.00 0.00 H new ATOM 0 HE21 GLN A 114 112.626 -11.503 -5.320 1.00 0.00 H new ATOM 0 HE22 GLN A 114 114.009 -12.347 -4.615 1.00 0.00 H new ATOM 1545 N PHE A 115 108.080 -14.756 -6.315 1.00 0.00 N ATOM 1546 CA PHE A 115 107.846 -15.930 -7.209 1.00 0.00 C ATOM 1547 C PHE A 115 109.004 -16.074 -8.201 1.00 0.00 C ATOM 1548 O PHE A 115 109.753 -15.145 -8.426 1.00 0.00 O ATOM 1549 CB PHE A 115 106.545 -15.617 -7.947 1.00 0.00 C ATOM 1550 CG PHE A 115 105.414 -15.500 -6.955 1.00 0.00 C ATOM 1551 CD1 PHE A 115 104.738 -16.648 -6.523 1.00 0.00 C ATOM 1552 CD2 PHE A 115 105.039 -14.242 -6.466 1.00 0.00 C ATOM 1553 CE1 PHE A 115 103.688 -16.539 -5.604 1.00 0.00 C ATOM 1554 CE2 PHE A 115 103.990 -14.134 -5.546 1.00 0.00 C ATOM 1555 CZ PHE A 115 103.314 -15.281 -5.115 1.00 0.00 C ATOM 0 H PHE A 115 108.118 -13.854 -6.789 1.00 0.00 H new ATOM 0 HA PHE A 115 107.782 -16.866 -6.654 1.00 0.00 H new ATOM 0 HB2 PHE A 115 106.648 -14.688 -8.507 1.00 0.00 H new ATOM 0 HB3 PHE A 115 106.328 -16.403 -8.670 1.00 0.00 H new ATOM 0 HD1 PHE A 115 105.027 -17.618 -6.899 1.00 0.00 H new ATOM 0 HD2 PHE A 115 105.559 -13.356 -6.799 1.00 0.00 H new ATOM 0 HE1 PHE A 115 103.166 -17.425 -5.272 1.00 0.00 H new ATOM 0 HE2 PHE A 115 103.702 -13.164 -5.168 1.00 0.00 H new ATOM 0 HZ PHE A 115 102.504 -15.196 -4.406 1.00 0.00 H new ATOM 1564 N ASN A 116 109.157 -17.232 -8.789 1.00 0.00 N ATOM 1565 CA ASN A 116 110.273 -17.439 -9.763 1.00 0.00 C ATOM 1566 C ASN A 116 109.718 -17.842 -11.138 1.00 0.00 C ATOM 1567 O ASN A 116 109.608 -19.015 -11.437 1.00 0.00 O ATOM 1568 CB ASN A 116 111.113 -18.573 -9.166 1.00 0.00 C ATOM 1569 CG ASN A 116 112.493 -18.041 -8.769 1.00 0.00 C ATOM 1570 OD1 ASN A 116 112.683 -17.581 -7.661 1.00 0.00 O ATOM 1571 ND2 ASN A 116 113.469 -18.087 -9.633 1.00 0.00 N ATOM 0 H ASN A 116 108.558 -18.044 -8.638 1.00 0.00 H new ATOM 0 HA ASN A 116 110.859 -16.533 -9.916 1.00 0.00 H new ATOM 0 HB2 ASN A 116 110.610 -18.991 -8.294 1.00 0.00 H new ATOM 0 HB3 ASN A 116 111.219 -19.380 -9.891 1.00 0.00 H new ATOM 0 HD21 ASN A 116 114.392 -17.737 -9.378 1.00 0.00 H new ATOM 0 HD22 ASN A 116 113.309 -18.473 -10.563 1.00 0.00 H new ATOM 1577 N PRO A 117 109.386 -16.853 -11.936 1.00 0.00 N ATOM 1578 CA PRO A 117 108.840 -17.117 -13.296 1.00 0.00 C ATOM 1579 C PRO A 117 109.913 -17.700 -14.232 1.00 0.00 C ATOM 1580 O PRO A 117 109.616 -18.120 -15.333 1.00 0.00 O ATOM 1581 CB PRO A 117 108.390 -15.739 -13.777 1.00 0.00 C ATOM 1582 CG PRO A 117 109.219 -14.772 -12.998 1.00 0.00 C ATOM 1583 CD PRO A 117 109.484 -15.411 -11.661 1.00 0.00 C ATOM 0 HA PRO A 117 108.034 -17.851 -13.286 1.00 0.00 H new ATOM 0 HB2 PRO A 117 108.550 -15.623 -14.849 1.00 0.00 H new ATOM 0 HB3 PRO A 117 107.327 -15.585 -13.595 1.00 0.00 H new ATOM 0 HG2 PRO A 117 110.153 -14.557 -13.517 1.00 0.00 H new ATOM 0 HG3 PRO A 117 108.696 -13.823 -12.877 1.00 0.00 H new ATOM 0 HD2 PRO A 117 110.468 -15.143 -11.277 1.00 0.00 H new ATOM 0 HD3 PRO A 117 108.755 -15.095 -10.915 1.00 0.00 H new ATOM 1588 N MET A 118 111.150 -17.750 -13.800 1.00 0.00 N ATOM 1589 CA MET A 118 112.222 -18.322 -14.644 1.00 0.00 C ATOM 1590 C MET A 118 113.281 -18.931 -13.732 1.00 0.00 C ATOM 1591 O MET A 118 113.208 -18.835 -12.523 1.00 0.00 O ATOM 1592 CB MET A 118 112.812 -17.160 -15.445 1.00 0.00 C ATOM 1593 CG MET A 118 111.719 -16.494 -16.284 1.00 0.00 C ATOM 1594 SD MET A 118 112.473 -15.286 -17.402 1.00 0.00 S ATOM 1595 CE MET A 118 113.250 -16.471 -18.527 1.00 0.00 C ATOM 0 H MET A 118 111.456 -17.413 -12.887 1.00 0.00 H new ATOM 0 HA MET A 118 111.852 -19.098 -15.314 1.00 0.00 H new ATOM 0 HB2 MET A 118 113.258 -16.431 -14.769 1.00 0.00 H new ATOM 0 HB3 MET A 118 113.610 -17.523 -16.094 1.00 0.00 H new ATOM 0 HG2 MET A 118 111.175 -17.246 -16.856 1.00 0.00 H new ATOM 0 HG3 MET A 118 110.995 -16.002 -15.634 1.00 0.00 H new ATOM 0 HE1 MET A 118 113.072 -16.165 -19.558 1.00 0.00 H new ATOM 0 HE2 MET A 118 114.323 -16.502 -18.338 1.00 0.00 H new ATOM 0 HE3 MET A 118 112.824 -17.461 -18.364 1.00 0.00 H new ATOM 1603 N GLU A 119 114.253 -19.554 -14.307 1.00 0.00 N ATOM 1604 CA GLU A 119 115.333 -20.185 -13.495 1.00 0.00 C ATOM 1605 C GLU A 119 116.107 -19.129 -12.694 1.00 0.00 C ATOM 1606 O GLU A 119 116.483 -19.361 -11.561 1.00 0.00 O ATOM 1607 CB GLU A 119 116.254 -20.860 -14.514 1.00 0.00 C ATOM 1608 CG GLU A 119 117.334 -21.658 -13.776 1.00 0.00 C ATOM 1609 CD GLU A 119 118.328 -22.257 -14.781 1.00 0.00 C ATOM 1610 OE1 GLU A 119 118.170 -22.013 -15.969 1.00 0.00 O ATOM 1611 OE2 GLU A 119 119.232 -22.949 -14.344 1.00 0.00 O ATOM 0 H GLU A 119 114.356 -19.660 -15.316 1.00 0.00 H new ATOM 0 HA GLU A 119 114.930 -20.891 -12.769 1.00 0.00 H new ATOM 0 HB2 GLU A 119 115.676 -21.521 -15.161 1.00 0.00 H new ATOM 0 HB3 GLU A 119 116.716 -20.110 -15.156 1.00 0.00 H new ATOM 0 HG2 GLU A 119 117.860 -21.010 -13.075 1.00 0.00 H new ATOM 0 HG3 GLU A 119 116.873 -22.454 -13.191 1.00 0.00 H new ATOM 1616 N ASN A 120 116.371 -17.985 -13.276 1.00 0.00 N ATOM 1617 CA ASN A 120 117.147 -16.939 -12.539 1.00 0.00 C ATOM 1618 C ASN A 120 116.370 -15.617 -12.417 1.00 0.00 C ATOM 1619 O ASN A 120 116.949 -14.584 -12.142 1.00 0.00 O ATOM 1620 CB ASN A 120 118.425 -16.747 -13.366 1.00 0.00 C ATOM 1621 CG ASN A 120 118.087 -16.133 -14.729 1.00 0.00 C ATOM 1622 OD1 ASN A 120 116.943 -16.117 -15.137 1.00 0.00 O ATOM 1623 ND2 ASN A 120 119.045 -15.620 -15.454 1.00 0.00 N ATOM 0 H ASN A 120 116.086 -17.731 -14.222 1.00 0.00 H new ATOM 0 HA ASN A 120 117.352 -17.247 -11.514 1.00 0.00 H new ATOM 0 HB2 ASN A 120 119.120 -16.100 -12.830 1.00 0.00 H new ATOM 0 HB3 ASN A 120 118.924 -17.706 -13.505 1.00 0.00 H new ATOM 0 HD21 ASN A 120 118.832 -15.206 -16.362 1.00 0.00 H new ATOM 0 HD22 ASN A 120 120.006 -15.633 -15.112 1.00 0.00 H new ATOM 1629 N VAL A 121 115.074 -15.633 -12.604 1.00 0.00 N ATOM 1630 CA VAL A 121 114.292 -14.362 -12.476 1.00 0.00 C ATOM 1631 C VAL A 121 113.271 -14.496 -11.347 1.00 0.00 C ATOM 1632 O VAL A 121 112.650 -15.528 -11.182 1.00 0.00 O ATOM 1633 CB VAL A 121 113.576 -14.156 -13.815 1.00 0.00 C ATOM 1634 CG1 VAL A 121 112.924 -12.773 -13.830 1.00 0.00 C ATOM 1635 CG2 VAL A 121 114.581 -14.254 -14.967 1.00 0.00 C ATOM 0 H VAL A 121 114.527 -16.461 -12.837 1.00 0.00 H new ATOM 0 HA VAL A 121 114.939 -13.516 -12.243 1.00 0.00 H new ATOM 0 HB VAL A 121 112.815 -14.927 -13.937 1.00 0.00 H new ATOM 0 HG11 VAL A 121 112.413 -12.622 -14.781 1.00 0.00 H new ATOM 0 HG12 VAL A 121 112.203 -12.702 -13.016 1.00 0.00 H new ATOM 0 HG13 VAL A 121 113.690 -12.008 -13.704 1.00 0.00 H new ATOM 0 HG21 VAL A 121 114.063 -14.106 -15.915 1.00 0.00 H new ATOM 0 HG22 VAL A 121 115.346 -13.487 -14.848 1.00 0.00 H new ATOM 0 HG23 VAL A 121 115.049 -15.238 -14.959 1.00 0.00 H new ATOM 1645 N ALA A 122 113.101 -13.464 -10.565 1.00 0.00 N ATOM 1646 CA ALA A 122 112.122 -13.544 -9.442 1.00 0.00 C ATOM 1647 C ALA A 122 111.357 -12.230 -9.262 1.00 0.00 C ATOM 1648 O ALA A 122 111.920 -11.159 -9.303 1.00 0.00 O ATOM 1649 CB ALA A 122 112.969 -13.838 -8.205 1.00 0.00 C ATOM 0 H ALA A 122 113.593 -12.575 -10.654 1.00 0.00 H new ATOM 0 HA ALA A 122 111.367 -14.308 -9.627 1.00 0.00 H new ATOM 0 HB1 ALA A 122 112.322 -13.913 -7.331 1.00 0.00 H new ATOM 0 HB2 ALA A 122 113.502 -14.779 -8.344 1.00 0.00 H new ATOM 0 HB3 ALA A 122 113.688 -13.033 -8.057 1.00 0.00 H new ATOM 1655 N LEU A 123 110.073 -12.321 -9.037 1.00 0.00 N ATOM 1656 CA LEU A 123 109.246 -11.097 -8.817 1.00 0.00 C ATOM 1657 C LEU A 123 108.772 -11.100 -7.364 1.00 0.00 C ATOM 1658 O LEU A 123 108.632 -12.152 -6.773 1.00 0.00 O ATOM 1659 CB LEU A 123 108.057 -11.223 -9.779 1.00 0.00 C ATOM 1660 CG LEU A 123 108.459 -10.773 -11.192 1.00 0.00 C ATOM 1661 CD1 LEU A 123 108.897 -9.307 -11.164 1.00 0.00 C ATOM 1662 CD2 LEU A 123 109.610 -11.640 -11.712 1.00 0.00 C ATOM 0 H LEU A 123 109.556 -13.200 -8.996 1.00 0.00 H new ATOM 0 HA LEU A 123 109.791 -10.170 -8.998 1.00 0.00 H new ATOM 0 HB2 LEU A 123 107.710 -12.256 -9.805 1.00 0.00 H new ATOM 0 HB3 LEU A 123 107.225 -10.616 -9.420 1.00 0.00 H new ATOM 0 HG LEU A 123 107.600 -10.883 -11.854 1.00 0.00 H new ATOM 0 HD11 LEU A 123 109.181 -8.993 -12.168 1.00 0.00 H new ATOM 0 HD12 LEU A 123 108.073 -8.688 -10.810 1.00 0.00 H new ATOM 0 HD13 LEU A 123 109.749 -9.195 -10.494 1.00 0.00 H new ATOM 0 HD21 LEU A 123 109.888 -11.313 -12.714 1.00 0.00 H new ATOM 0 HD22 LEU A 123 110.468 -11.542 -11.047 1.00 0.00 H new ATOM 0 HD23 LEU A 123 109.294 -12.683 -11.745 1.00 0.00 H new ATOM 1673 N ASP A 124 108.523 -9.960 -6.769 1.00 0.00 N ATOM 1674 CA ASP A 124 108.062 -9.967 -5.346 1.00 0.00 C ATOM 1675 C ASP A 124 107.070 -8.829 -5.092 1.00 0.00 C ATOM 1676 O ASP A 124 107.253 -7.720 -5.559 1.00 0.00 O ATOM 1677 CB ASP A 124 109.336 -9.758 -4.522 1.00 0.00 C ATOM 1678 CG ASP A 124 109.017 -9.852 -3.023 1.00 0.00 C ATOM 1679 OD1 ASP A 124 107.852 -9.988 -2.684 1.00 0.00 O ATOM 1680 OD2 ASP A 124 109.950 -9.783 -2.239 1.00 0.00 O ATOM 0 H ASP A 124 108.617 -9.039 -7.198 1.00 0.00 H new ATOM 0 HA ASP A 124 107.547 -10.892 -5.087 1.00 0.00 H new ATOM 0 HB2 ASP A 124 110.079 -10.508 -4.791 1.00 0.00 H new ATOM 0 HB3 ASP A 124 109.769 -8.784 -4.749 1.00 0.00 H new ATOM 1684 N PHE A 125 106.029 -9.087 -4.336 1.00 0.00 N ATOM 1685 CA PHE A 125 105.038 -8.014 -4.031 1.00 0.00 C ATOM 1686 C PHE A 125 104.892 -7.881 -2.513 1.00 0.00 C ATOM 1687 O PHE A 125 104.634 -8.850 -1.826 1.00 0.00 O ATOM 1688 CB PHE A 125 103.727 -8.489 -4.658 1.00 0.00 C ATOM 1689 CG PHE A 125 103.894 -8.594 -6.155 1.00 0.00 C ATOM 1690 CD1 PHE A 125 103.719 -7.462 -6.960 1.00 0.00 C ATOM 1691 CD2 PHE A 125 104.224 -9.823 -6.739 1.00 0.00 C ATOM 1692 CE1 PHE A 125 103.875 -7.559 -8.348 1.00 0.00 C ATOM 1693 CE2 PHE A 125 104.380 -9.920 -8.127 1.00 0.00 C ATOM 1694 CZ PHE A 125 104.205 -8.788 -8.931 1.00 0.00 C ATOM 0 H PHE A 125 105.826 -9.995 -3.919 1.00 0.00 H new ATOM 0 HA PHE A 125 105.336 -7.041 -4.420 1.00 0.00 H new ATOM 0 HB2 PHE A 125 103.443 -9.457 -4.244 1.00 0.00 H new ATOM 0 HB3 PHE A 125 102.924 -7.792 -4.419 1.00 0.00 H new ATOM 0 HD1 PHE A 125 103.464 -6.514 -6.510 1.00 0.00 H new ATOM 0 HD2 PHE A 125 104.358 -10.697 -6.118 1.00 0.00 H new ATOM 0 HE1 PHE A 125 103.741 -6.686 -8.969 1.00 0.00 H new ATOM 0 HE2 PHE A 125 104.635 -10.868 -8.577 1.00 0.00 H new ATOM 0 HZ PHE A 125 104.325 -8.863 -10.002 1.00 0.00 H new ATOM 1703 N SER A 126 105.062 -6.698 -1.983 1.00 0.00 N ATOM 1704 CA SER A 126 104.943 -6.522 -0.504 1.00 0.00 C ATOM 1705 C SER A 126 104.022 -5.349 -0.159 1.00 0.00 C ATOM 1706 O SER A 126 103.908 -4.395 -0.905 1.00 0.00 O ATOM 1707 CB SER A 126 106.367 -6.238 -0.027 1.00 0.00 C ATOM 1708 OG SER A 126 107.208 -7.326 -0.388 1.00 0.00 O ATOM 0 H SER A 126 105.277 -5.850 -2.507 1.00 0.00 H new ATOM 0 HA SER A 126 104.511 -7.402 -0.027 1.00 0.00 H new ATOM 0 HB2 SER A 126 106.735 -5.315 -0.474 1.00 0.00 H new ATOM 0 HB3 SER A 126 106.380 -6.096 1.054 1.00 0.00 H new ATOM 0 HG SER A 126 108.123 -7.147 -0.085 1.00 0.00 H new ATOM 1713 N TYR A 127 103.378 -5.411 0.977 1.00 0.00 N ATOM 1714 CA TYR A 127 102.474 -4.300 1.396 1.00 0.00 C ATOM 1715 C TYR A 127 103.055 -3.620 2.639 1.00 0.00 C ATOM 1716 O TYR A 127 103.363 -4.272 3.620 1.00 0.00 O ATOM 1717 CB TYR A 127 101.140 -4.973 1.728 1.00 0.00 C ATOM 1718 CG TYR A 127 100.606 -5.680 0.503 1.00 0.00 C ATOM 1719 CD1 TYR A 127 100.952 -7.014 0.258 1.00 0.00 C ATOM 1720 CD2 TYR A 127 99.766 -5.000 -0.387 1.00 0.00 C ATOM 1721 CE1 TYR A 127 100.459 -7.668 -0.877 1.00 0.00 C ATOM 1722 CE2 TYR A 127 99.274 -5.654 -1.524 1.00 0.00 C ATOM 1723 CZ TYR A 127 99.620 -6.988 -1.768 1.00 0.00 C ATOM 1724 OH TYR A 127 99.135 -7.633 -2.887 1.00 0.00 O ATOM 0 H TYR A 127 103.440 -6.187 1.636 1.00 0.00 H new ATOM 0 HA TYR A 127 102.357 -3.538 0.626 1.00 0.00 H new ATOM 0 HB2 TYR A 127 101.274 -5.686 2.541 1.00 0.00 H new ATOM 0 HB3 TYR A 127 100.422 -4.229 2.072 1.00 0.00 H new ATOM 0 HD1 TYR A 127 101.599 -7.539 0.945 1.00 0.00 H new ATOM 0 HD2 TYR A 127 99.497 -3.971 -0.197 1.00 0.00 H new ATOM 0 HE1 TYR A 127 100.726 -8.697 -1.066 1.00 0.00 H new ATOM 0 HE2 TYR A 127 98.628 -5.129 -2.212 1.00 0.00 H new ATOM 0 HH TYR A 127 98.567 -7.019 -3.398 1.00 0.00 H new ATOM 1733 N GLU A 128 103.220 -2.322 2.605 1.00 0.00 N ATOM 1734 CA GLU A 128 103.795 -1.611 3.788 1.00 0.00 C ATOM 1735 C GLU A 128 103.044 -0.307 4.068 1.00 0.00 C ATOM 1736 O GLU A 128 102.500 0.315 3.176 1.00 0.00 O ATOM 1737 CB GLU A 128 105.245 -1.307 3.402 1.00 0.00 C ATOM 1738 CG GLU A 128 105.995 -2.613 3.125 1.00 0.00 C ATOM 1739 CD GLU A 128 107.470 -2.316 2.828 1.00 0.00 C ATOM 1740 OE1 GLU A 128 107.819 -1.149 2.730 1.00 0.00 O ATOM 1741 OE2 GLU A 128 108.228 -3.262 2.703 1.00 0.00 O ATOM 0 H GLU A 128 102.983 -1.725 1.813 1.00 0.00 H new ATOM 0 HA GLU A 128 103.719 -2.215 4.692 1.00 0.00 H new ATOM 0 HB2 GLU A 128 105.269 -0.669 2.519 1.00 0.00 H new ATOM 0 HB3 GLU A 128 105.737 -0.758 4.205 1.00 0.00 H new ATOM 0 HG2 GLU A 128 105.915 -3.278 3.985 1.00 0.00 H new ATOM 0 HG3 GLU A 128 105.542 -3.130 2.279 1.00 0.00 H new ATOM 1746 N GLN A 129 103.034 0.117 5.304 1.00 0.00 N ATOM 1747 CA GLN A 129 102.346 1.392 5.663 1.00 0.00 C ATOM 1748 C GLN A 129 103.207 2.171 6.665 1.00 0.00 C ATOM 1749 O GLN A 129 103.911 1.587 7.468 1.00 0.00 O ATOM 1750 CB GLN A 129 101.015 0.964 6.292 1.00 0.00 C ATOM 1751 CG GLN A 129 101.275 0.150 7.564 1.00 0.00 C ATOM 1752 CD GLN A 129 99.965 -0.478 8.046 1.00 0.00 C ATOM 1753 OE1 GLN A 129 99.179 -0.957 7.253 1.00 0.00 O ATOM 1754 NE2 GLN A 129 99.697 -0.495 9.323 1.00 0.00 N ATOM 0 H GLN A 129 103.476 -0.368 6.085 1.00 0.00 H new ATOM 0 HA GLN A 129 102.185 2.044 4.805 1.00 0.00 H new ATOM 0 HB2 GLN A 129 100.416 1.843 6.529 1.00 0.00 H new ATOM 0 HB3 GLN A 129 100.441 0.370 5.581 1.00 0.00 H new ATOM 0 HG2 GLN A 129 102.012 -0.628 7.366 1.00 0.00 H new ATOM 0 HG3 GLN A 129 101.690 0.792 8.341 1.00 0.00 H new ATOM 0 HE21 GLN A 129 100.357 -0.093 9.988 1.00 0.00 H new ATOM 0 HE22 GLN A 129 98.827 -0.911 9.656 1.00 0.00 H new ATOM 1761 N SER A 130 103.164 3.479 6.626 1.00 0.00 N ATOM 1762 CA SER A 130 103.991 4.276 7.580 1.00 0.00 C ATOM 1763 C SER A 130 103.169 5.411 8.196 1.00 0.00 C ATOM 1764 O SER A 130 102.314 5.991 7.555 1.00 0.00 O ATOM 1765 CB SER A 130 105.132 4.840 6.736 1.00 0.00 C ATOM 1766 OG SER A 130 105.867 3.767 6.164 1.00 0.00 O ATOM 0 H SER A 130 102.596 4.026 5.979 1.00 0.00 H new ATOM 0 HA SER A 130 104.353 3.669 8.410 1.00 0.00 H new ATOM 0 HB2 SER A 130 104.735 5.484 5.951 1.00 0.00 H new ATOM 0 HB3 SER A 130 105.786 5.456 7.353 1.00 0.00 H new ATOM 0 HG SER A 130 106.499 4.119 5.503 1.00 0.00 H new ATOM 1771 N ARG A 131 103.435 5.739 9.433 1.00 0.00 N ATOM 1772 CA ARG A 131 102.688 6.846 10.096 1.00 0.00 C ATOM 1773 C ARG A 131 103.670 7.786 10.801 1.00 0.00 C ATOM 1774 O ARG A 131 104.514 7.353 11.565 1.00 0.00 O ATOM 1775 CB ARG A 131 101.778 6.158 11.114 1.00 0.00 C ATOM 1776 CG ARG A 131 100.760 5.284 10.379 1.00 0.00 C ATOM 1777 CD ARG A 131 99.784 4.676 11.390 1.00 0.00 C ATOM 1778 NE ARG A 131 98.994 3.680 10.614 1.00 0.00 N ATOM 1779 CZ ARG A 131 98.334 2.742 11.237 1.00 0.00 C ATOM 1780 NH1 ARG A 131 98.980 1.811 11.885 1.00 0.00 N ATOM 1781 NH2 ARG A 131 97.030 2.736 11.214 1.00 0.00 N ATOM 0 H ARG A 131 104.140 5.286 10.014 1.00 0.00 H new ATOM 0 HA ARG A 131 102.119 7.448 9.387 1.00 0.00 H new ATOM 0 HB2 ARG A 131 102.372 5.549 11.795 1.00 0.00 H new ATOM 0 HB3 ARG A 131 101.263 6.904 11.720 1.00 0.00 H new ATOM 0 HG2 ARG A 131 100.216 5.879 9.645 1.00 0.00 H new ATOM 0 HG3 ARG A 131 101.272 4.493 9.831 1.00 0.00 H new ATOM 0 HD2 ARG A 131 100.315 4.202 12.215 1.00 0.00 H new ATOM 0 HD3 ARG A 131 99.139 5.440 11.824 1.00 0.00 H new ATOM 0 HE ARG A 131 98.969 3.731 9.596 1.00 0.00 H new ATOM 0 HH11 ARG A 131 100.000 1.817 11.904 1.00 0.00 H new ATOM 0 HH12 ARG A 131 98.465 1.078 12.372 1.00 0.00 H new ATOM 0 HH21 ARG A 131 96.525 3.465 10.709 1.00 0.00 H new ATOM 0 HH22 ARG A 131 96.515 2.003 11.701 1.00 0.00 H new ATOM 1792 N ILE A 132 103.572 9.067 10.545 1.00 0.00 N ATOM 1793 CA ILE A 132 104.500 10.036 11.188 1.00 0.00 C ATOM 1794 C ILE A 132 103.702 11.039 12.021 1.00 0.00 C ATOM 1795 O ILE A 132 103.759 12.229 11.789 1.00 0.00 O ATOM 1796 CB ILE A 132 105.208 10.737 10.024 1.00 0.00 C ATOM 1797 CG1 ILE A 132 105.978 9.706 9.196 1.00 0.00 C ATOM 1798 CG2 ILE A 132 106.186 11.779 10.569 1.00 0.00 C ATOM 1799 CD1 ILE A 132 106.519 10.370 7.928 1.00 0.00 C ATOM 0 H ILE A 132 102.885 9.481 9.915 1.00 0.00 H new ATOM 0 HA ILE A 132 105.211 9.555 11.860 1.00 0.00 H new ATOM 0 HB ILE A 132 104.465 11.228 9.396 1.00 0.00 H new ATOM 0 HG12 ILE A 132 106.799 9.294 9.782 1.00 0.00 H new ATOM 0 HG13 ILE A 132 105.325 8.874 8.933 1.00 0.00 H new ATOM 0 HG21 ILE A 132 106.688 12.276 9.739 1.00 0.00 H new ATOM 0 HG22 ILE A 132 105.641 12.517 11.158 1.00 0.00 H new ATOM 0 HG23 ILE A 132 106.927 11.288 11.200 1.00 0.00 H new ATOM 0 HD11 ILE A 132 107.067 9.635 7.338 1.00 0.00 H new ATOM 0 HD12 ILE A 132 105.689 10.761 7.340 1.00 0.00 H new ATOM 0 HD13 ILE A 132 107.186 11.187 8.202 1.00 0.00 H new ATOM 1810 N ARG A 133 102.959 10.556 12.988 1.00 0.00 N ATOM 1811 CA ARG A 133 102.132 11.445 13.875 1.00 0.00 C ATOM 1812 C ARG A 133 101.024 12.165 13.092 1.00 0.00 C ATOM 1813 O ARG A 133 99.859 12.047 13.421 1.00 0.00 O ATOM 1814 CB ARG A 133 103.105 12.457 14.497 1.00 0.00 C ATOM 1815 CG ARG A 133 104.159 11.714 15.320 1.00 0.00 C ATOM 1816 CD ARG A 133 105.066 12.725 16.024 1.00 0.00 C ATOM 1817 NE ARG A 133 106.156 11.909 16.626 1.00 0.00 N ATOM 1818 CZ ARG A 133 105.952 11.273 17.747 1.00 0.00 C ATOM 1819 NH1 ARG A 133 105.444 11.903 18.771 1.00 0.00 N ATOM 1820 NH2 ARG A 133 106.255 10.008 17.844 1.00 0.00 N ATOM 0 H ARG A 133 102.888 9.562 13.207 1.00 0.00 H new ATOM 0 HA ARG A 133 101.624 10.855 14.638 1.00 0.00 H new ATOM 0 HB2 ARG A 133 103.587 13.043 13.714 1.00 0.00 H new ATOM 0 HB3 ARG A 133 102.561 13.158 15.131 1.00 0.00 H new ATOM 0 HG2 ARG A 133 103.675 11.071 16.055 1.00 0.00 H new ATOM 0 HG3 ARG A 133 104.752 11.068 14.673 1.00 0.00 H new ATOM 0 HD2 ARG A 133 105.463 13.457 15.320 1.00 0.00 H new ATOM 0 HD3 ARG A 133 104.521 13.280 16.787 1.00 0.00 H new ATOM 0 HE ARG A 133 107.062 11.847 16.162 1.00 0.00 H new ATOM 0 HH11 ARG A 133 105.207 12.892 18.695 1.00 0.00 H new ATOM 0 HH12 ARG A 133 105.284 11.406 19.647 1.00 0.00 H new ATOM 0 HH21 ARG A 133 106.652 9.516 17.043 1.00 0.00 H new ATOM 0 HH22 ARG A 133 106.095 9.511 18.720 1.00 0.00 H new ATOM 1831 N SER A 134 101.364 12.918 12.077 1.00 0.00 N ATOM 1832 CA SER A 134 100.312 13.646 11.307 1.00 0.00 C ATOM 1833 C SER A 134 100.263 13.184 9.845 1.00 0.00 C ATOM 1834 O SER A 134 99.427 13.631 9.083 1.00 0.00 O ATOM 1835 CB SER A 134 100.718 15.118 11.386 1.00 0.00 C ATOM 1836 OG SER A 134 101.803 15.354 10.497 1.00 0.00 O ATOM 0 H SER A 134 102.320 13.059 11.750 1.00 0.00 H new ATOM 0 HA SER A 134 99.318 13.462 11.716 1.00 0.00 H new ATOM 0 HB2 SER A 134 99.873 15.755 11.124 1.00 0.00 H new ATOM 0 HB3 SER A 134 101.006 15.374 12.406 1.00 0.00 H new ATOM 0 HG SER A 134 102.065 16.297 10.544 1.00 0.00 H new ATOM 1841 N VAL A 135 101.143 12.304 9.440 1.00 0.00 N ATOM 1842 CA VAL A 135 101.121 11.841 8.019 1.00 0.00 C ATOM 1843 C VAL A 135 101.015 10.315 7.955 1.00 0.00 C ATOM 1844 O VAL A 135 101.747 9.606 8.615 1.00 0.00 O ATOM 1845 CB VAL A 135 102.450 12.314 7.422 1.00 0.00 C ATOM 1846 CG1 VAL A 135 102.524 11.909 5.947 1.00 0.00 C ATOM 1847 CG2 VAL A 135 102.550 13.840 7.528 1.00 0.00 C ATOM 0 H VAL A 135 101.869 11.889 10.025 1.00 0.00 H new ATOM 0 HA VAL A 135 100.266 12.239 7.473 1.00 0.00 H new ATOM 0 HB VAL A 135 103.271 11.854 7.971 1.00 0.00 H new ATOM 0 HG11 VAL A 135 103.470 12.246 5.524 1.00 0.00 H new ATOM 0 HG12 VAL A 135 102.456 10.824 5.864 1.00 0.00 H new ATOM 0 HG13 VAL A 135 101.699 12.368 5.402 1.00 0.00 H new ATOM 0 HG21 VAL A 135 103.497 14.173 7.102 1.00 0.00 H new ATOM 0 HG22 VAL A 135 101.725 14.298 6.981 1.00 0.00 H new ATOM 0 HG23 VAL A 135 102.499 14.136 8.576 1.00 0.00 H new ATOM 1857 N ASP A 136 100.114 9.806 7.157 1.00 0.00 N ATOM 1858 CA ASP A 136 99.970 8.325 7.043 1.00 0.00 C ATOM 1859 C ASP A 136 99.932 7.938 5.569 1.00 0.00 C ATOM 1860 O ASP A 136 98.994 8.255 4.868 1.00 0.00 O ATOM 1861 CB ASP A 136 98.638 7.999 7.723 1.00 0.00 C ATOM 1862 CG ASP A 136 98.435 6.479 7.774 1.00 0.00 C ATOM 1863 OD1 ASP A 136 99.400 5.758 7.572 1.00 0.00 O ATOM 1864 OD2 ASP A 136 97.313 6.063 8.015 1.00 0.00 O ATOM 0 H ASP A 136 99.473 10.350 6.580 1.00 0.00 H new ATOM 0 HA ASP A 136 100.795 7.782 7.504 1.00 0.00 H new ATOM 0 HB2 ASP A 136 98.625 8.410 8.732 1.00 0.00 H new ATOM 0 HB3 ASP A 136 97.818 8.466 7.178 1.00 0.00 H new ATOM 1868 N VAL A 137 100.944 7.272 5.084 1.00 0.00 N ATOM 1869 CA VAL A 137 100.968 6.889 3.643 1.00 0.00 C ATOM 1870 C VAL A 137 101.024 5.365 3.493 1.00 0.00 C ATOM 1871 O VAL A 137 101.649 4.678 4.279 1.00 0.00 O ATOM 1872 CB VAL A 137 102.253 7.529 3.099 1.00 0.00 C ATOM 1873 CG1 VAL A 137 102.396 7.230 1.604 1.00 0.00 C ATOM 1874 CG2 VAL A 137 102.205 9.046 3.311 1.00 0.00 C ATOM 0 H VAL A 137 101.757 6.976 5.624 1.00 0.00 H new ATOM 0 HA VAL A 137 100.078 7.222 3.109 1.00 0.00 H new ATOM 0 HB VAL A 137 103.108 7.112 3.632 1.00 0.00 H new ATOM 0 HG11 VAL A 137 103.310 7.688 1.227 1.00 0.00 H new ATOM 0 HG12 VAL A 137 102.441 6.152 1.451 1.00 0.00 H new ATOM 0 HG13 VAL A 137 101.539 7.637 1.068 1.00 0.00 H new ATOM 0 HG21 VAL A 137 103.119 9.497 2.924 1.00 0.00 H new ATOM 0 HG22 VAL A 137 101.345 9.460 2.785 1.00 0.00 H new ATOM 0 HG23 VAL A 137 102.117 9.262 4.376 1.00 0.00 H new ATOM 1884 N GLY A 138 100.398 4.836 2.472 1.00 0.00 N ATOM 1885 CA GLY A 138 100.438 3.361 2.249 1.00 0.00 C ATOM 1886 C GLY A 138 101.348 3.094 1.052 1.00 0.00 C ATOM 1887 O GLY A 138 101.109 3.591 -0.032 1.00 0.00 O ATOM 0 H GLY A 138 99.861 5.363 1.784 1.00 0.00 H new ATOM 0 HA2 GLY A 138 100.814 2.851 3.136 1.00 0.00 H new ATOM 0 HA3 GLY A 138 99.436 2.976 2.060 1.00 0.00 H new ATOM 1890 N THR A 139 102.402 2.345 1.236 1.00 0.00 N ATOM 1891 CA THR A 139 103.333 2.092 0.096 1.00 0.00 C ATOM 1892 C THR A 139 103.412 0.606 -0.257 1.00 0.00 C ATOM 1893 O THR A 139 103.508 -0.250 0.601 1.00 0.00 O ATOM 1894 CB THR A 139 104.692 2.592 0.590 1.00 0.00 C ATOM 1895 OG1 THR A 139 104.578 3.950 0.991 1.00 0.00 O ATOM 1896 CG2 THR A 139 105.725 2.475 -0.533 1.00 0.00 C ATOM 0 H THR A 139 102.658 1.900 2.118 1.00 0.00 H new ATOM 0 HA THR A 139 102.998 2.596 -0.811 1.00 0.00 H new ATOM 0 HB THR A 139 105.013 1.987 1.438 1.00 0.00 H new ATOM 0 HG1 THR A 139 104.734 4.533 0.219 1.00 0.00 H new ATOM 0 HG21 THR A 139 106.691 2.832 -0.177 1.00 0.00 H new ATOM 0 HG22 THR A 139 105.814 1.433 -0.839 1.00 0.00 H new ATOM 0 HG23 THR A 139 105.407 3.077 -1.384 1.00 0.00 H new ATOM 1904 N TRP A 140 103.400 0.309 -1.529 1.00 0.00 N ATOM 1905 CA TRP A 140 103.505 -1.105 -1.983 1.00 0.00 C ATOM 1906 C TRP A 140 104.821 -1.281 -2.741 1.00 0.00 C ATOM 1907 O TRP A 140 105.228 -0.411 -3.488 1.00 0.00 O ATOM 1908 CB TRP A 140 102.311 -1.319 -2.916 1.00 0.00 C ATOM 1909 CG TRP A 140 101.040 -1.137 -2.151 1.00 0.00 C ATOM 1910 CD1 TRP A 140 100.583 -1.976 -1.194 1.00 0.00 C ATOM 1911 CD2 TRP A 140 100.054 -0.069 -2.264 1.00 0.00 C ATOM 1912 NE1 TRP A 140 99.382 -1.490 -0.710 1.00 0.00 N ATOM 1913 CE2 TRP A 140 99.013 -0.317 -1.339 1.00 0.00 C ATOM 1914 CE3 TRP A 140 99.964 1.079 -3.072 1.00 0.00 C ATOM 1915 CZ2 TRP A 140 97.921 0.544 -1.218 1.00 0.00 C ATOM 1916 CZ3 TRP A 140 98.866 1.948 -2.953 1.00 0.00 C ATOM 1917 CH2 TRP A 140 97.847 1.680 -2.028 1.00 0.00 C ATOM 0 H TRP A 140 103.321 0.995 -2.280 1.00 0.00 H new ATOM 0 HA TRP A 140 103.495 -1.819 -1.160 1.00 0.00 H new ATOM 0 HB2 TRP A 140 102.353 -0.613 -3.745 1.00 0.00 H new ATOM 0 HB3 TRP A 140 102.348 -2.319 -3.347 1.00 0.00 H new ATOM 0 HD1 TRP A 140 101.075 -2.878 -0.862 1.00 0.00 H new ATOM 0 HE1 TRP A 140 98.835 -1.943 0.022 1.00 0.00 H new ATOM 0 HE3 TRP A 140 100.743 1.294 -3.788 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 97.139 0.334 -0.503 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 98.807 2.827 -3.578 1.00 0.00 H new ATOM 0 HH2 TRP A 140 97.005 2.351 -1.942 1.00 0.00 H new ATOM 1927 N ILE A 141 105.500 -2.381 -2.553 1.00 0.00 N ATOM 1928 CA ILE A 141 106.798 -2.577 -3.266 1.00 0.00 C ATOM 1929 C ILE A 141 106.699 -3.723 -4.275 1.00 0.00 C ATOM 1930 O ILE A 141 106.218 -4.797 -3.969 1.00 0.00 O ATOM 1931 CB ILE A 141 107.813 -2.917 -2.171 1.00 0.00 C ATOM 1932 CG1 ILE A 141 107.857 -1.787 -1.138 1.00 0.00 C ATOM 1933 CG2 ILE A 141 109.201 -3.086 -2.797 1.00 0.00 C ATOM 1934 CD1 ILE A 141 108.772 -2.187 0.019 1.00 0.00 C ATOM 0 H ILE A 141 105.216 -3.147 -1.942 1.00 0.00 H new ATOM 0 HA ILE A 141 107.084 -1.689 -3.830 1.00 0.00 H new ATOM 0 HB ILE A 141 107.516 -3.844 -1.681 1.00 0.00 H new ATOM 0 HG12 ILE A 141 108.220 -0.870 -1.602 1.00 0.00 H new ATOM 0 HG13 ILE A 141 106.853 -1.580 -0.767 1.00 0.00 H new ATOM 0 HG21 ILE A 141 109.924 -3.328 -2.018 1.00 0.00 H new ATOM 0 HG22 ILE A 141 109.174 -3.892 -3.530 1.00 0.00 H new ATOM 0 HG23 ILE A 141 109.494 -2.158 -3.289 1.00 0.00 H new ATOM 0 HD11 ILE A 141 108.803 -1.382 0.754 1.00 0.00 H new ATOM 0 HD12 ILE A 141 108.389 -3.093 0.489 1.00 0.00 H new ATOM 0 HD13 ILE A 141 109.777 -2.371 -0.359 1.00 0.00 H new ATOM 1945 N ALA A 142 107.174 -3.501 -5.472 1.00 0.00 N ATOM 1946 CA ALA A 142 107.136 -4.571 -6.508 1.00 0.00 C ATOM 1947 C ALA A 142 108.387 -4.465 -7.378 1.00 0.00 C ATOM 1948 O ALA A 142 108.764 -3.385 -7.795 1.00 0.00 O ATOM 1949 CB ALA A 142 105.876 -4.293 -7.331 1.00 0.00 C ATOM 0 H ALA A 142 107.588 -2.620 -5.777 1.00 0.00 H new ATOM 0 HA ALA A 142 107.114 -5.574 -6.082 1.00 0.00 H new ATOM 0 HB1 ALA A 142 105.781 -5.043 -8.116 1.00 0.00 H new ATOM 0 HB2 ALA A 142 105.001 -4.334 -6.682 1.00 0.00 H new ATOM 0 HB3 ALA A 142 105.947 -3.303 -7.782 1.00 0.00 H new ATOM 1955 N GLY A 143 109.047 -5.562 -7.646 1.00 0.00 N ATOM 1956 CA GLY A 143 110.281 -5.479 -8.477 1.00 0.00 C ATOM 1957 C GLY A 143 110.781 -6.867 -8.878 1.00 0.00 C ATOM 1958 O GLY A 143 110.014 -7.784 -9.110 1.00 0.00 O ATOM 0 H GLY A 143 108.789 -6.497 -7.330 1.00 0.00 H new ATOM 0 HA2 GLY A 143 110.079 -4.891 -9.372 1.00 0.00 H new ATOM 0 HA3 GLY A 143 111.060 -4.957 -7.922 1.00 0.00 H new ATOM 1961 N VAL A 144 112.078 -7.006 -8.968 1.00 0.00 N ATOM 1962 CA VAL A 144 112.680 -8.308 -9.377 1.00 0.00 C ATOM 1963 C VAL A 144 113.548 -8.891 -8.258 1.00 0.00 C ATOM 1964 O VAL A 144 113.728 -8.290 -7.217 1.00 0.00 O ATOM 1965 CB VAL A 144 113.535 -7.985 -10.606 1.00 0.00 C ATOM 1966 CG1 VAL A 144 112.641 -7.440 -11.722 1.00 0.00 C ATOM 1967 CG2 VAL A 144 114.590 -6.934 -10.242 1.00 0.00 C ATOM 0 H VAL A 144 112.752 -6.265 -8.773 1.00 0.00 H new ATOM 0 HA VAL A 144 111.915 -9.054 -9.592 1.00 0.00 H new ATOM 0 HB VAL A 144 114.032 -8.894 -10.946 1.00 0.00 H new ATOM 0 HG11 VAL A 144 113.250 -7.210 -12.596 1.00 0.00 H new ATOM 0 HG12 VAL A 144 111.893 -8.187 -11.987 1.00 0.00 H new ATOM 0 HG13 VAL A 144 112.142 -6.534 -11.379 1.00 0.00 H new ATOM 0 HG21 VAL A 144 115.196 -6.707 -11.119 1.00 0.00 H new ATOM 0 HG22 VAL A 144 114.095 -6.026 -9.898 1.00 0.00 H new ATOM 0 HG23 VAL A 144 115.230 -7.321 -9.449 1.00 0.00 H new ATOM 1977 N GLY A 145 114.083 -10.064 -8.477 1.00 0.00 N ATOM 1978 CA GLY A 145 114.939 -10.708 -7.441 1.00 0.00 C ATOM 1979 C GLY A 145 115.937 -11.658 -8.108 1.00 0.00 C ATOM 1980 O GLY A 145 115.602 -12.383 -9.026 1.00 0.00 O ATOM 0 H GLY A 145 113.962 -10.605 -9.333 1.00 0.00 H new ATOM 0 HA2 GLY A 145 115.473 -9.946 -6.873 1.00 0.00 H new ATOM 0 HA3 GLY A 145 114.318 -11.257 -6.733 1.00 0.00 H new ATOM 1983 N TYR A 146 117.161 -11.658 -7.647 1.00 0.00 N ATOM 1984 CA TYR A 146 118.195 -12.557 -8.239 1.00 0.00 C ATOM 1985 C TYR A 146 118.987 -13.241 -7.120 1.00 0.00 C ATOM 1986 O TYR A 146 119.105 -12.720 -6.030 1.00 0.00 O ATOM 1987 CB TYR A 146 119.101 -11.638 -9.057 1.00 0.00 C ATOM 1988 CG TYR A 146 120.112 -12.468 -9.811 1.00 0.00 C ATOM 1989 CD1 TYR A 146 119.767 -13.047 -11.038 1.00 0.00 C ATOM 1990 CD2 TYR A 146 121.395 -12.658 -9.284 1.00 0.00 C ATOM 1991 CE1 TYR A 146 120.704 -13.818 -11.737 1.00 0.00 C ATOM 1992 CE2 TYR A 146 122.332 -13.428 -9.983 1.00 0.00 C ATOM 1993 CZ TYR A 146 121.986 -14.008 -11.209 1.00 0.00 C ATOM 1994 OH TYR A 146 122.911 -14.767 -11.898 1.00 0.00 O ATOM 0 H TYR A 146 117.490 -11.070 -6.881 1.00 0.00 H new ATOM 0 HA TYR A 146 117.761 -13.345 -8.855 1.00 0.00 H new ATOM 0 HB2 TYR A 146 118.505 -11.049 -9.755 1.00 0.00 H new ATOM 0 HB3 TYR A 146 119.611 -10.933 -8.400 1.00 0.00 H new ATOM 0 HD1 TYR A 146 118.778 -12.899 -11.446 1.00 0.00 H new ATOM 0 HD2 TYR A 146 121.662 -12.210 -8.338 1.00 0.00 H new ATOM 0 HE1 TYR A 146 120.437 -14.266 -12.683 1.00 0.00 H new ATOM 0 HE2 TYR A 146 123.322 -13.575 -9.576 1.00 0.00 H new ATOM 0 HH TYR A 146 123.750 -14.797 -11.393 1.00 0.00 H new ATOM 2003 N ARG A 147 119.532 -14.402 -7.383 1.00 0.00 N ATOM 2004 CA ARG A 147 120.320 -15.110 -6.328 1.00 0.00 C ATOM 2005 C ARG A 147 121.646 -15.639 -6.894 1.00 0.00 C ATOM 2006 O ARG A 147 121.668 -16.401 -7.840 1.00 0.00 O ATOM 2007 CB ARG A 147 119.417 -16.261 -5.865 1.00 0.00 C ATOM 2008 CG ARG A 147 119.178 -17.244 -7.014 1.00 0.00 C ATOM 2009 CD ARG A 147 118.049 -18.206 -6.635 1.00 0.00 C ATOM 2010 NE ARG A 147 118.020 -19.214 -7.730 1.00 0.00 N ATOM 2011 CZ ARG A 147 118.846 -20.224 -7.707 1.00 0.00 C ATOM 2012 NH1 ARG A 147 118.599 -21.249 -6.938 1.00 0.00 N ATOM 2013 NH2 ARG A 147 119.918 -20.208 -8.449 1.00 0.00 N ATOM 0 H ARG A 147 119.466 -14.888 -8.277 1.00 0.00 H new ATOM 0 HA ARG A 147 120.589 -14.448 -5.505 1.00 0.00 H new ATOM 0 HB2 ARG A 147 119.879 -16.779 -5.024 1.00 0.00 H new ATOM 0 HB3 ARG A 147 118.465 -15.866 -5.512 1.00 0.00 H new ATOM 0 HG2 ARG A 147 118.918 -16.701 -7.923 1.00 0.00 H new ATOM 0 HG3 ARG A 147 120.090 -17.802 -7.225 1.00 0.00 H new ATOM 0 HD2 ARG A 147 118.238 -18.676 -5.670 1.00 0.00 H new ATOM 0 HD3 ARG A 147 117.096 -17.684 -6.554 1.00 0.00 H new ATOM 0 HE ARG A 147 117.355 -19.115 -8.497 1.00 0.00 H new ATOM 0 HH11 ARG A 147 117.761 -21.260 -6.356 1.00 0.00 H new ATOM 0 HH12 ARG A 147 119.244 -22.039 -6.919 1.00 0.00 H new ATOM 0 HH21 ARG A 147 120.112 -19.406 -9.048 1.00 0.00 H new ATOM 0 HH22 ARG A 147 120.563 -20.998 -8.430 1.00 0.00 H new ATOM 2024 N PHE A 148 122.750 -15.228 -6.321 1.00 0.00 N ATOM 2025 CA PHE A 148 124.076 -15.695 -6.823 1.00 0.00 C ATOM 2026 C PHE A 148 124.736 -16.616 -5.795 1.00 0.00 C ATOM 2027 CB PHE A 148 124.897 -14.419 -7.008 1.00 0.00 C ATOM 2028 CG PHE A 148 126.213 -14.756 -7.667 1.00 0.00 C ATOM 2029 CD1 PHE A 148 126.289 -14.875 -9.060 1.00 0.00 C ATOM 2030 CD2 PHE A 148 127.359 -14.949 -6.886 1.00 0.00 C ATOM 2031 CE1 PHE A 148 127.509 -15.188 -9.671 1.00 0.00 C ATOM 2032 CE2 PHE A 148 128.579 -15.262 -7.496 1.00 0.00 C ATOM 2033 CZ PHE A 148 128.655 -15.380 -8.889 1.00 0.00 C ATOM 0 H PHE A 148 122.789 -14.589 -5.527 1.00 0.00 H new ATOM 0 HA PHE A 148 123.992 -16.264 -7.749 1.00 0.00 H new ATOM 0 HB2 PHE A 148 124.345 -13.705 -7.619 1.00 0.00 H new ATOM 0 HB3 PHE A 148 125.073 -13.944 -6.043 1.00 0.00 H new ATOM 0 HD1 PHE A 148 125.406 -14.725 -9.663 1.00 0.00 H new ATOM 0 HD2 PHE A 148 127.301 -14.856 -5.812 1.00 0.00 H new ATOM 0 HE1 PHE A 148 127.567 -15.281 -10.745 1.00 0.00 H new ATOM 0 HE2 PHE A 148 129.462 -15.413 -6.892 1.00 0.00 H new ATOM 0 HZ PHE A 148 129.597 -15.619 -9.360 1.00 0.00 H new TER 2042 PHE A 148