Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2cws_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N.A ALA 2.A O no hydrogen 2.497 N/A LYS 5.A N.B ALA 2.A O no hydrogen 3.146 N/A LYS 5.A NZ.A LYS 5.A O.A no hydrogen 2.548 N/A LYS 5.A NZ.B GLY 30.A O no hydrogen 2.946 N/A ASN 6.A N PRO 3.A O no hydrogen 2.974 N/A SER 10.A N ASP 8.A OD2 no hydrogen 2.998 N/A SER 10.A OG ASP 8.A OD2 no hydrogen 2.682 N/A HIS 11.A ND1 MET 70.A O no hydrogen 2.873 N/A TRP 12.A N LEU 9.A O no hydrogen 3.257 N/A LYS 13.A N ARG 68.A O no hydrogen 2.937 N/A LYS 13.A NZ GLU 23.A OE1 no hydrogen 3.299 N/A LYS 13.A NZ GLU 23.A OE2 no hydrogen 2.786 N/A LEU 14.A N ILE 24.A O no hydrogen 2.970 N/A GLN 15.A N GLU 66.A O no hydrogen 2.836 N/A GLN 15.A NE2 GLU 23.A OE1 no hydrogen 3.100 N/A LEU 16.A N THR 22.A O no hydrogen 2.927 N/A THR 21.A N ASP 18.A O no hydrogen 2.963 N/A THR 22.A N ASP 18.A OD2 no hydrogen 2.792 N/A THR 22.A OG1 ASP 18.A OD1 no hydrogen 2.575 N/A THR 22.A OG1 ASP 18.A OD2 no hydrogen 3.485 N/A ILE 24.A N LEU 14.A O no hydrogen 2.810 N/A SER 26.A OG.B LEU 9.A O no hydrogen 2.760 N/A SER 26.A OG.B SER 10.A O no hydrogen 2.656 N/A SER 26.A OG.C SER 10.A O no hydrogen 3.541 N/A SER 26.A OG.C TRP 12.A O no hydrogen 2.660 N/A ASN 28.A N SER 25.A OG no hydrogen 3.007 N/A LEU 29.A N SER 25.A O no hydrogen 2.917 N/A GLY 30.A N SER 26.A O no hydrogen 2.990 N/A LEU 31.A N ALA 27.A O no hydrogen 2.993 N/A LEU 31.A N ASN 28.A O no hydrogen 3.241 N/A GLY 32.A N LEU 29.A O no hydrogen 3.108 N/A TYR 33.A N ASN 28.A O no hydrogen 3.141 N/A THR 34.A OG1 PHE 38.A O no hydrogen 3.224 N/A SER 35.A N PHE 38.A O no hydrogen 2.880 N/A SER 35.A OG TYR 33.A OH no hydrogen 2.757 N/A GLN 36.A N GLN 36.A OE1.A no hydrogen 2.848 N/A TYR 37.A N SER 35.A OG no hydrogen 3.047 N/A PHE 38.A N SER 35.A O no hydrogen 3.197 N/A TYR 39.A N THR 47.A O no hydrogen 2.939 N/A THR 40.A OG1 ALA 1.A O no hydrogen 2.581 N/A ASP 41.A N ALA 45.A O no hydrogen 2.982 N/A THR 42.A N ASP 41.A OD1 no hydrogen 2.792 N/A GLY 44.A N ASP 41.A O no hydrogen 2.892 N/A ALA 45.A N ASP 43.A OD1 no hydrogen 2.965 N/A MET 46.A N LEU 217.A O no hydrogen 2.868 N/A THR 47.A N TYR 39.A O no hydrogen 2.775 N/A THR 47.A OG1 ALA 45.A O no hydrogen 3.019 N/A PHE 48.A N ALA 215.A O no hydrogen 2.821 N/A TRP 49.A N TYR 37.A O no hydrogen 2.936 N/A TRP 49.A NE1 SER 212.A OG no hydrogen 2.791 N/A ALA 50.A N ALA 213.A O no hydrogen 3.143 N/A THR 52.A N GLY 211.A O no hydrogen 2.928 N/A THR 52.A OG1 THR 207.A O no hydrogen 2.730 N/A THR 52.A OG1 GLY 211.A O no hydrogen 3.465 N/A GLY 54.A N PRO 51.A O no hydrogen 3.014 N/A GLY 55.A N PRO 17.A O no hydrogen 2.970 N/A THR 56.A OG1 SER 60.A O no hydrogen 3.279 N/A SER 60.A N THR 57.A O no hydrogen 3.016 N/A SER 60.A OG TYR 62.A O no hydrogen 3.180 N/A SER 60.A OG TYR 202.A OH no hydrogen 2.719 N/A SER 61.A OG.A ASN 206.A OD1 no hydrogen 3.438 N/A TYR 62.A N SER 60.A OG no hydrogen 3.001 N/A ARG 64.A NH1 GLU 66.A OE1 no hydrogen 2.836 N/A SER 65.A N ASN 201.A O no hydrogen 2.887 N/A SER 65.A OG TYR 37.A O no hydrogen 2.872 N/A GLU 66.A N GLN 15.A O no hydrogen 2.915 N/A LEU 67.A N ALA 199.A O no hydrogen 2.778 N/A ARG 68.A N LYS 13.A O no hydrogen 2.824 N/A ARG 68.A NH1 GLU 69.A O no hydrogen 2.812 N/A ARG 68.A NH2 SER 76.A O no hydrogen 2.921 N/A GLU 69.A N PHE 197.A O no hydrogen 2.858 N/A MET 70.A N HIS 11.A O no hydrogen 2.825 N/A SER 74.A N ASP 72.A OD1 no hydrogen 2.805 N/A SER 74.A OG ASP 72.A OD1 no hydrogen 2.679 N/A ASN 75.A N ASP 72.A O no hydrogen 2.892 N/A VAL 78.A N ASN 75.A O no hydrogen 3.191 N/A TRP 80.A N TYR 195.A O no hydrogen 3.056 N/A TRP 80.A NE1 GLU 69.A OE1 no hydrogen 2.762 N/A GLY 84.A N ASP 167.A OD2 no hydrogen 2.856 N/A THR 85.A N SER 225.A O no hydrogen 2.990 N/A THR 85.A OG1 THR 166.A OG1 no hydrogen 2.854 N/A HIS 86.A N VAL 165.A O no hydrogen 2.863 N/A HIS 86.A ND1 HIS 224.A ND1 no hydrogen 2.697 N/A HIS 86.A NE2 GLN 83.A O no hydrogen 2.787 N/A THR 87.A N SER 223.A O no hydrogen 2.849 N/A MET 88.A N ILE 163.A O no hydrogen 2.887 N/A LYS 89.A N SER 221.A O no hydrogen 2.948 N/A LEU 90.A N MET 161.A O no hydrogen 2.963 N/A SER 91.A N SER 219.A O no hydrogen 3.064 N/A SER 91.A OG.A TYR 159.A O no hydrogen 3.523 N/A SER 91.A OG.A ASN 160.A OD1 no hydrogen 2.988 N/A SER 91.A OG.B SER 219.A OG no hydrogen 2.754 N/A GLY 92.A N TYR 159.A O no hydrogen 2.938 N/A LYS 93.A N LYS 216.A O no hydrogen 2.971 N/A LYS 93.A NZ.A GLY 156.A O no hydrogen 2.918 N/A LYS 93.A NZ.B GLY 156.A O no hydrogen 3.101 N/A THR 94.A OG1 TYR 159.A OH no hydrogen 3.024 N/A VAL 95.A N ILE 214.A O no hydrogen 2.840 N/A GLN 96.A N ILE 214.A O no hydrogen 3.256 N/A GLN 96.A NE2 SER 212.A O no hydrogen 3.052 N/A SER 99.A N GLY 210.A O no hydrogen 2.816 N/A SER 99.A OG GLY 210.A O no hydrogen 3.402 N/A SER 100.A N ASP 205.A OD1 no hydrogen 2.842 N/A SER 100.A OG GLN 204.A O no hydrogen 2.771 N/A GLY 101.A N PRO 98.A O no hydrogen 2.953 N/A LYS 102.A N SER 100.A OG no hydrogen 3.242 N/A ILE 103.A N PHE 126.A O no hydrogen 3.212 N/A ILE 104.A N TYR 202.A O no hydrogen 2.816 N/A VAL 105.A N ALA 124.A O no hydrogen 2.935 N/A GLN 107.A N LYS 198.A O no hydrogen 2.889 N/A GLN 107.A NE2 GLU 66.A OE2 no hydrogen 2.920 N/A ILE 108.A N VAL 122.A O no hydrogen 2.899 N/A HIS 109.A N TYR 196.A O no hydrogen 2.808 N/A HIS 109.A ND1 GLY 110.A O no hydrogen 2.738 N/A GLY 110.A N PRO 119.A O no hydrogen 2.852 N/A ILE 111.A N LYS 194.A O no hydrogen 2.815 N/A MET 112.A N THR 116.A O no hydrogen 2.808 N/A GLY 115.A N MET 112.A O no hydrogen 2.875 N/A THR 116.A N ASP 114.A OD1 no hydrogen 2.915 N/A THR 116.A OG1 ASP 114.A OD1 no hydrogen 2.720 N/A LEU 121.A N ILE 108.A O no hydrogen 2.807 N/A VAL 122.A N ILE 108.A O no hydrogen 3.006 N/A LYS 123.A N GLN 134.A O no hydrogen 2.887 N/A LYS 123.A NZ ASP 145.A OD1.A no hydrogen 2.735 N/A LYS 123.A NZ ASP 145.A OD1.B no hydrogen 3.313 N/A ALA 124.A N ALA 106.A O no hydrogen 2.864 N/A VAL 125.A N ASP 132.A O no hydrogen 2.867 N/A PHE 126.A N ILE 103.A O no hydrogen 2.791 N/A GLN 127.A N GLN 130.A O no hydrogen 2.923 N/A GLN 127.A NE2.B GLY 101.A O no hydrogen 3.300 N/A GLY 129.A N ILE 153.A O.A no hydrogen 2.712 N/A GLY 129.A N ILE 153.A O.B no hydrogen 3.110 N/A GLN 130.A N GLN 127.A O no hydrogen 3.149 N/A LEU 131.A N PHE 150.A O no hydrogen 3.054 N/A ASP 132.A N VAL 125.A O no hydrogen 2.850 N/A MET 133.A N ASN 148.A O no hydrogen 2.883 N/A GLN 134.A N LYS 123.A O no hydrogen 2.867 N/A VAL 135.A N VAL 146.A O no hydrogen 2.862 N/A LYS 136.A N LEU 121.A O no hydrogen 2.842 N/A LYS 136.A NZ ASN 138.A O no hydrogen 2.829 N/A LYS 136.A NZ ASP 140.A O no hydrogen 2.788 N/A GLN 137.A N SER 144.A O.A no hydrogen 2.959 N/A ASN 138.A ND2 THR 142.A OG1 no hydrogen 2.824 N/A SER 139.A N ASP 187.A OD1 no hydrogen 2.745 N/A SER 139.A OG ASP 187.A OD1 no hydrogen 2.761 N/A THR 142.A N ASP 140.A OD2 no hydrogen 3.043 N/A THR 142.A OG1 ASP 140.A OD2 no hydrogen 2.654 N/A SER 144.A OG.A ASP 145.A O.A no hydrogen 3.481 N/A VAL 146.A N VAL 135.A O no hydrogen 2.745 N/A HIS 147.A ND1 ASP 132.A OD2 no hydrogen 2.663 N/A ASN 148.A N ASP 132.A OD1 no hydrogen 2.949 N/A ASN 148.A ND2 MET 133.A O no hydrogen 2.861 N/A PHE 150.A N LEU 131.A O no hydrogen 2.798 N/A GLY 152.A N GLY 129.A O no hydrogen 2.889 N/A LYS 154.A N ASP 157.A OD2 no hydrogen 2.967 N/A LEU 155.A N ASP 128.A OD1 no hydrogen 2.834 N/A GLY 156.A N THR 94.A O no hydrogen 2.821 N/A ASP 157.A N LYS 154.A O no hydrogen 2.964 N/A TYR 159.A N GLY 92.A O no hydrogen 2.806 N/A TYR 159.A OH THR 94.A OG1 no hydrogen 3.024 N/A ASN 160.A N ASN 175.A OD1 no hydrogen 2.893 N/A MET 161.A N LEU 90.A O no hydrogen 2.810 N/A GLU 162.A N THR 173.A O no hydrogen 2.964 N/A ILE 163.A N MET 88.A O no hydrogen 2.891 N/A ARG 164.A N TYR 171.A O no hydrogen 2.895 N/A ARG 164.A NH1 THR 166.A OG1 no hydrogen 2.840 N/A VAL 165.A N HIS 86.A O no hydrogen 2.826 N/A THR 166.A N VAL 169.A O no hydrogen 2.998 N/A THR 166.A OG1 THR 85.A OG1 no hydrogen 2.854 N/A ASP 167.A N GLY 84.A O no hydrogen 3.031 N/A VAL 169.A N THR 166.A O no hydrogen 3.080 N/A ALA 170.A N VAL 181.A O no hydrogen 2.846 N/A TYR 171.A N ARG 164.A O no hydrogen 2.764 N/A VAL 172.A N ARG 179.A O no hydrogen 2.831 N/A THR 173.A N GLU 162.A O no hydrogen 2.863 N/A THR 173.A OG1 THR 178.A OG1 no hydrogen 2.642 N/A MET 174.A N ASP 177.A O no hydrogen 3.075 N/A ASN 175.A N ASN 160.A O.A no hydrogen 2.813 N/A ASN 175.A N ASN 160.A O.B no hydrogen 2.817 N/A ASP 177.A N MET 174.A O no hydrogen 2.959 N/A THR 178.A OG1 THR 173.A OG1 no hydrogen 2.642 N/A ARG 179.A N VAL 172.A O no hydrogen 2.861 N/A ARG 179.A NE ASP 177.A OD1 no hydrogen 2.853 N/A ARG 179.A NH1 TYR 149.A O no hydrogen 2.996 N/A ARG 179.A NH1 ASP 177.A OD2 no hydrogen 2.924 N/A ARG 179.A NH2 TYR 149.A O no hydrogen 2.937 N/A VAL 181.A N ALA 170.A O no hydrogen 2.862 N/A VAL 184.A N GLY 168.A O no hydrogen 3.040 N/A GLY 185.A N ASP 182.A OD1 no hydrogen 2.830 N/A LYS 186.A N ASP 182.A O no hydrogen 3.083 N/A LYS 186.A N PHE 183.A O no hydrogen 3.021 N/A ASP 187.A N PHE 183.A O no hydrogen 3.008 N/A GLY 189.A N ASP 187.A OD2 no hydrogen 2.819 N/A TRP 190.A N ASP 187.A O no hydrogen 3.002 N/A TRP 190.A NE1 GLN 137.A O no hydrogen 2.924 N/A LYS 191.A N ALA 188.A O no hydrogen 2.953 N/A ASN 192.A N GLY 189.A O no hydrogen 2.910 N/A LEU 193.A N TRP 190.A O no hydrogen 3.269 N/A LYS 194.A N ILE 111.A O no hydrogen 2.824 N/A LYS 194.A NZ.A ASN 79.A O no hydrogen 3.206 N/A TYR 195.A N TRP 80.A O no hydrogen 2.794 N/A TYR 195.A OH TRP 190.A O no hydrogen 2.691 N/A TYR 196.A N HIS 109.A O no hydrogen 2.977 N/A PHE 197.A N GLU 69.A OE1 no hydrogen 2.843 N/A LYS 198.A N GLN 107.A O no hydrogen 2.907 N/A LYS 198.A NZ GLN 15.A OE1 no hydrogen 2.677 N/A LYS 198.A NZ GLU 66.A OE1 no hydrogen 2.775 N/A ALA 199.A N LEU 67.A O no hydrogen 3.094 N/A GLY 200.A N VAL 105.A O no hydrogen 3.112 N/A ASN 201.A N SER 65.A O no hydrogen 2.804 N/A TYR 202.A N ILE 104.A O no hydrogen 2.896 N/A TYR 202.A OH SER 60.A OG no hydrogen 2.719 N/A VAL 203.A N PRO 63.A O no hydrogen 2.856 N/A GLN 204.A N LYS 102.A O no hydrogen 3.001 N/A GLN 204.A NE2 TYR 202.A O no hydrogen 3.045 N/A THR 207.A N ASP 205.A OD2 no hydrogen 2.882 N/A THR 207.A OG1 ASP 205.A OD2 no hydrogen 2.689 N/A GLY 210.A N THR 207.A O no hydrogen 3.418 N/A ALA 213.A N ALA 50.A O no hydrogen 3.031 N/A ILE 214.A N GLN 96.A O no hydrogen 2.912 N/A ALA 215.A N PHE 48.A O no hydrogen 3.012 N/A LYS 216.A N LYS 93.A O no hydrogen 2.790 N/A LYS 216.A NZ ASP 41.A OD2 no hydrogen 2.830 N/A LYS 216.A NZ ASP 43.A OD1 no hydrogen 3.406 N/A LYS 216.A NZ ASP 43.A OD2 no hydrogen 2.857 N/A LEU 217.A N MET 46.A O no hydrogen 2.830 N/A TYR 218.A N SER 91.A O no hydrogen 2.773 N/A TYR 218.A OH ASP 43.A OD2 no hydrogen 2.678 N/A SER 219.A N SER 91.A O no hydrogen 3.446 N/A SER 219.A OG SER 91.A OG.B no hydrogen 2.754 N/A SER 221.A N LYS 89.A O no hydrogen 2.905 N/A SER 223.A N THR 87.A O no hydrogen 2.844 N/A HIS 224.A ND1 HIS 86.A ND1 no hydrogen 2.697 N/A HIS 224.A NE2 GLU 69.A OE2 no hydrogen 2.774 N/A SER 225.A N THR 85.A O no hydrogen 2.805 N/A