Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2w1j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 5.A N GLN 1.A O no hydrogen 2.628 N/A PHE 6.A N GLN 2.A O no hydrogen 3.119 N/A ASP 7.A N ILE 3.A O no hydrogen 2.953 N/A LYS 8.A N ALA 4.A O no hydrogen 2.986 N/A GLU 9.A N ASP 5.A O no hydrogen 2.977 N/A LYS 10.A N PHE 6.A O no hydrogen 2.771 N/A LYS 10.A NZ ASN 137.A O no hydrogen 2.868 N/A LYS 10.A NZ GLU 140.A O no hydrogen 3.515 N/A ALA 11.A N ASP 7.A O no hydrogen 3.087 N/A THR 12.A N GLU 9.A O no hydrogen 2.945 N/A THR 12.A OG1 GLU 9.A O no hydrogen 2.839 N/A LEU 13.A N LYS 10.A O no hydrogen 3.168 N/A ALA 16.A N ASP 14.A OD2 no hydrogen 2.896 N/A ILE 18.A N ASP 14.A O no hydrogen 3.039 N/A ASP 19.A N GLU 15.A O no hydrogen 2.880 N/A GLU 20.A N ALA 16.A O no hydrogen 3.044 N/A ARG 21.A N ASP 17.A O no hydrogen 2.965 N/A ARG 21.A NE ASP 17.A OD1 no hydrogen 2.914 N/A ARG 21.A NH1 MET 56.A O no hydrogen 2.923 N/A ARG 21.A NH1 GLU 58.A O no hydrogen 2.981 N/A MET 22.A N ILE 18.A O no hydrogen 2.853 N/A LYS 23.A N ASP 19.A O no hydrogen 3.056 N/A LEU 24.A N GLU 20.A O no hydrogen 3.202 N/A ALA 25.A N ARG 21.A O no hydrogen 2.965 N/A GLN 26.A N MET 22.A O no hydrogen 2.807 N/A GLN 26.A NE2 GLN 26.A O no hydrogen 3.516 N/A GLN 26.A NE2 ASP 30.A OD1 no hydrogen 2.925 N/A ALA 27.A N LYS 23.A O no hydrogen 2.973 N/A PHE 28.A N LEU 24.A O no hydrogen 3.013 N/A ASN 29.A N ALA 25.A O no hydrogen 3.002 N/A ASN 29.A ND2 LEU 98.A O no hydrogen 3.133 N/A ASP 30.A N GLN 26.A O no hydrogen 2.843 N/A SER 31.A N ALA 27.A O no hydrogen 3.162 N/A SER 31.A OG ALA 27.A O no hydrogen 3.047 N/A SER 31.A OG PHE 28.A O no hydrogen 3.554 N/A LEU 32.A N ASN 29.A O no hydrogen 3.195 N/A ASN 34.A ND2 GLY 95.A O no hydrogen 2.875 N/A VAL 35.A N ASN 33.A O no hydrogen 2.862 N/A SER 37.A N GLU 94.A O no hydrogen 3.075 N/A SER 37.A OG GLU 94.A O no hydrogen 2.823 N/A TRP 41.A NE1 HIS 112.A ND1 no hydrogen 2.996 N/A SER 42.A N ASP 39.A O no hydrogen 2.990 N/A SER 42.A OG ASP 39.A O no hydrogen 2.883 N/A MET 45.A N SER 42.A O no hydrogen 3.169 N/A LYS 46.A N SER 42.A O no hydrogen 2.948 N/A LYS 47.A N GLU 43.A O no hydrogen 3.306 N/A LYS 47.A NZ GLU 43.A OE1 no hydrogen 3.105 N/A LYS 48.A N MET 45.A O no hydrogen 3.227 N/A LYS 48.A NZ GLU 44.A OE2 no hydrogen 3.147 N/A TYR 53.A OH HIS 92.A ND1 no hydrogen 2.706 N/A LEU 57.A N ALA 54.A O no hydrogen 2.930 N/A GLU 58.A N ARG 55.A O no hydrogen 3.081 N/A ILE 59.A N ARG 62.A O no hydrogen 2.921 N/A HIS 60.A ND1 ASP 5.A OD2 no hydrogen 3.035 N/A ARG 62.A N ILE 59.A O no hydrogen 3.068 N/A ARG 62.A NH1 TYR 78.A OH no hydrogen 3.054 N/A ARG 62.A NH2 ASP 5.A OD2 no hydrogen 3.009 N/A MET 63.A N VAL 77.A O no hydrogen 2.846 N/A HIS 65.A N HIS 136.A O no hydrogen 3.131 N/A HIS 65.A ND1 ASP 74.A OD1 no hydrogen 2.719 N/A HIS 65.A NE2 ASP 7.A OD1 no hydrogen 2.746 N/A VAL 66.A N LEU 75.A O no hydrogen 2.879 N/A GLU 67.A N TYR 134.A O no hydrogen 2.834 N/A ILE 68.A N VAL 73.A O no hydrogen 2.799 N/A ILE 71.A N ILE 68.A O no hydrogen 3.174 N/A ASP 72.A N PRO 69.A O no hydrogen 3.009 N/A VAL 73.A N ILE 68.A O no hydrogen 3.173 N/A LEU 75.A N VAL 66.A O no hydrogen 2.947 N/A VAL 77.A N GLY 64.A O no hydrogen 2.844 N/A TYR 78.A N ALA 90.A O no hydrogen 2.863 N/A GLY 80.A N TYR 53.A OH no hydrogen 2.927 N/A GLU 83.A N LYS 46.A O no hydrogen 2.929 N/A GLU 84.A N GLU 84.A OE1 no hydrogen 2.724 N/A LEU 86.A N ALA 82.A O no hydrogen 3.193 N/A GLN 87.A N GLU 83.A O no hydrogen 3.101 N/A GLN 88.A N VAL 85.A O no hydrogen 2.916 N/A GLY 89.A N VAL 85.A O no hydrogen 2.957 N/A ALA 90.A N PRO 76.A O no hydrogen 2.903 N/A GLY 91.A N THR 110.A O no hydrogen 2.818 N/A HIS 92.A N TYR 78.A O no hydrogen 2.839 N/A HIS 92.A ND1 TYR 53.A OH no hydrogen 2.706 N/A HIS 92.A NE2 SER 97.A O no hydrogen 2.756 N/A LEU 93.A N VAL 108.A O no hydrogen 2.979 N/A THR 96.A N LEU 93.A O no hydrogen 3.057 N/A THR 96.A OG1 HIS 92.A NE2 no hydrogen 3.208 N/A THR 96.A OG1 LEU 93.A O no hydrogen 2.780 N/A SER 97.A N HIS 106.A O no hydrogen 2.954 N/A SER 97.A OG HIS 106.A O no hydrogen 3.291 N/A LEU 98.A N ASN 29.A OD1 no hydrogen 2.798 N/A ILE 100.A N LEU 98.A O no hydrogen 2.795 N/A GLY 102.A N ASP 167.A OD2 no hydrogen 2.862 N/A THR 105.A N HIS 166.A O no hydrogen 2.989 N/A THR 105.A OG1.A GLY 102.A O no hydrogen 2.725 N/A THR 105.A OG1.B GLY 102.A O no hydrogen 3.075 N/A THR 105.A OG1.B ASN 103.A O no hydrogen 3.255 N/A HIS 106.A N SER 97.A OG no hydrogen 2.902 N/A HIS 106.A ND1 LEU 161.A O no hydrogen 2.847 N/A HIS 106.A NE2 THR 170.A OG1 no hydrogen 2.703 N/A ALA 107.A N TYR 168.A O no hydrogen 3.140 N/A VAL 108.A N THR 96.A OG1 no hydrogen 3.088 N/A ILE 109.A N THR 170.A O no hydrogen 2.914 N/A THR 110.A N GLY 91.A O no hydrogen 2.815 N/A THR 110.A OG1.A GLY 91.A O no hydrogen 3.341 N/A THR 110.A OG1.B GLY 91.A O no hydrogen 3.044 N/A ALA 111.A N LEU 172.A O no hydrogen 3.128 N/A THR 113.A OG1 PHE 121.A O no hydrogen 3.239 N/A THR 113.A OG1 THR 173.A OG1 no hydrogen 2.829 N/A GLY 114.A N THR 122.A OG1 no hydrogen 2.837 N/A LYS 119.A NZ ILE 71.A O no hydrogen 3.563 N/A LYS 119.A NZ ASP 72.A O no hydrogen 2.932 N/A PHE 121.A N HIS 112.A O no hydrogen 2.818 N/A THR 122.A N LYS 119.A O no hydrogen 2.804 N/A THR 122.A OG1 LYS 119.A O no hydrogen 2.828 N/A LEU 124.A N PHE 121.A O no hydrogen 2.952 N/A LYS 126.A N ASP 123.A O no hydrogen 2.879 N/A LEU 127.A N LEU 124.A O no hydrogen 3.077 N/A LYS 128.A N ASP 131.A OD2 no hydrogen 2.828 N/A GLY 130.A N VAL 146.A O no hydrogen 2.819 N/A ASP 131.A N LYS 128.A O no hydrogen 2.966 N/A PHE 133.A N TYR 144.A O no hydrogen 2.952 N/A TYR 134.A N GLU 67.A O no hydrogen 2.829 N/A VAL 135.A N MET 142.A O no hydrogen 2.814 N/A HIS 136.A N HIS 65.A O no hydrogen 2.845 N/A HIS 136.A NE2 GLU 67.A OE1 no hydrogen 2.818 N/A ASN 137.A N GLU 140.A O no hydrogen 2.980 N/A ASN 137.A ND2 PRO 99.A O no hydrogen 3.003 N/A LYS 139.A N ASN 137.A OD1 no hydrogen 2.841 N/A GLU 140.A N ASN 137.A OD1 no hydrogen 2.970 N/A MET 142.A N VAL 135.A O no hydrogen 2.831 N/A TYR 144.A N PHE 133.A O no hydrogen 2.853 N/A TYR 144.A OH ASP 167.A OD1 no hydrogen 2.747 N/A GLN 145.A N HIS 189.A O no hydrogen 2.858 N/A VAL 146.A N ASP 131.A O no hydrogen 2.823 N/A ASP 147.A N ARG 187.A O no hydrogen 2.846 N/A GLN 148.A N ARG 187.A O no hydrogen 3.428 N/A LYS 150.A N LEU 185.A O no hydrogen 2.954 N/A LYS 150.A NZ ASP 159.A OD1 no hydrogen 3.052 N/A LYS 150.A NZ ASP 159.A OD2 no hydrogen 3.298 N/A ILE 152.A N ARG 183.A O no hydrogen 2.931 N/A ASN 156.A N GLU 153.A O no hydrogen 3.196 N/A ASP 158.A N ASN 156.A OD1 no hydrogen 3.076 N/A LEU 160.A N PHE 157.A O no hydrogen 2.890 N/A ILE 162.A N ASN 34.A OD1 no hydrogen 2.861 N/A GLY 165.A N SER 104.A OG no hydrogen 2.850 N/A HIS 166.A N VAL 163.A O no hydrogen 3.177 N/A TYR 168.A N THR 105.A O no hydrogen 2.955 N/A VAL 169.A N GLY 188.A O no hydrogen 3.032 N/A THR 170.A N ALA 107.A O no hydrogen 2.970 N/A THR 170.A OG1 HIS 106.A NE2 no hydrogen 2.703 N/A LEU 171.A N VAL 186.A O no hydrogen 2.835 N/A LEU 172.A N ILE 109.A O no hydrogen 2.888 N/A THR 173.A N LEU 184.A O no hydrogen 3.056 N/A THR 173.A OG1 ALA 111.A O no hydrogen 2.697 N/A THR 173.A OG1 THR 113.A OG1 no hydrogen 2.829 N/A CYS 174.A SG.B THR 113.A O no hydrogen 3.783 N/A CYS 174.A SG.B ASN 180.A OD1 no hydrogen 3.316 N/A THR 175.A N HIS 182.A O no hydrogen 2.989 N/A ILE 179.A N PRO 176.A O no hydrogen 2.920 N/A ASN 180.A N PRO 176.A O no hydrogen 2.967 N/A THR 181.A OG1 HIS 182.A ND1 no hydrogen 2.741 N/A HIS 182.A N THR 175.A O no hydrogen 2.809 N/A HIS 182.A ND1 THR 181.A OG1 no hydrogen 2.741 N/A ARG 183.A N ILE 152.A O no hydrogen 2.867 N/A ARG 183.A NE ASP 39.A OD1 no hydrogen 3.061 N/A ARG 183.A NH1 ASN 180.A O no hydrogen 3.034 N/A ARG 183.A NH1 HIS 182.A O no hydrogen 2.858 N/A ARG 183.A NH2 ASP 39.A OD1 no hydrogen 3.349 N/A ARG 183.A NH2 ASP 39.A OD2 no hydrogen 2.800 N/A LEU 184.A N THR 173.A O no hydrogen 2.845 N/A LEU 185.A N LYS 150.A O no hydrogen 2.859 N/A VAL 186.A N LEU 171.A O no hydrogen 2.881 N/A ARG 187.A N GLN 148.A O no hydrogen 2.830 N/A ARG 187.A NE ASP 147.A OD1 no hydrogen 2.940 N/A ARG 187.A NH2 ASP 147.A OD1 no hydrogen 3.363 N/A ARG 187.A NH2 ASP 147.A OD2 no hydrogen 2.937 N/A GLY 188.A N VAL 169.A O no hydrogen 2.848 N/A HIS 189.A N GLN 145.A O no hydrogen 2.949 N/A ARG 190.A N ASP 167.A O no hydrogen 2.891 N/A ARG 190.A NH1 ASP 167.A OD2 no hydrogen 3.099 N/A ILE 191.A N ALA 143.A O no hydrogen 2.935 N/A