Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1qja_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 2.A N GLU 5.A OE1 no hydrogen 3.214 N/A LYS 3.A NZ GLU 40.A OE1 no hydrogen 2.968 N/A LEU 6.A N ASP 2.A O no hydrogen 2.709 N/A VAL 7.A N LYS 3.A O no hydrogen 2.768 N/A GLN 8.A N ASN 4.A O no hydrogen 2.917 N/A LYS 9.A N GLU 5.A O no hydrogen 2.717 N/A ALA 10.A N LEU 6.A O no hydrogen 2.750 N/A LYS 11.A N VAL 7.A O no hydrogen 3.080 N/A LYS 11.A NZ GLU 39.A OE2 no hydrogen 2.532 N/A LEU 12.A N GLN 8.A O no hydrogen 3.138 N/A ALA 13.A N LYS 9.A O no hydrogen 2.899 N/A GLU 14.A N ALA 10.A O no hydrogen 2.781 N/A GLN 15.A N LYS 11.A O no hydrogen 3.011 N/A ALA 16.A N LEU 12.A O no hydrogen 2.844 N/A GLU 17.A N GLU 14.A O no hydrogen 3.017 N/A ARG 18.A N ALA 13.A O no hydrogen 2.864 N/A ARG 18.A NE ASP 21.A OD2 no hydrogen 2.902 N/A ARG 18.A NH2 ASP 21.A OD2 no hydrogen 3.229 N/A MET 22.A N ARG 18.A O no hydrogen 3.023 N/A ALA 23.A N TYR 19.A O no hydrogen 2.755 N/A ALA 24.A N ASP 20.A O no hydrogen 2.869 N/A CYS 25.A N ASP 21.A O no hydrogen 3.018 N/A CYS 25.A SG ASP 21.A O no hydrogen 3.340 N/A MET 26.A N MET 22.A O no hydrogen 3.020 N/A LYS 27.A N ALA 23.A O no hydrogen 2.748 N/A LYS 27.A NZ ASP 86.A OD1 no hydrogen 2.541 N/A LYS 27.A NZ ASP 86.A OD2 no hydrogen 3.296 N/A SER 28.A N ALA 24.A O no hydrogen 2.957 N/A SER 28.A OG ALA 24.A O no hydrogen 2.991 N/A VAL 29.A N CYS 25.A O no hydrogen 2.965 N/A THR 30.A N MET 26.A O no hydrogen 2.943 N/A THR 30.A OG1 MET 26.A O no hydrogen 2.888 N/A GLU 31.A N LYS 27.A O no hydrogen 2.859 N/A GLN 32.A N VAL 29.A O no hydrogen 3.338 N/A GLY 33.A N THR 30.A O no hydrogen 3.102 N/A SER 37.A N GLU 40.A OE1 no hydrogen 3.130 N/A GLU 40.A N SER 37.A OG no hydrogen 2.823 N/A ARG 41.A N SER 37.A O no hydrogen 2.772 N/A ARG 41.A NH1 GLU 103.A OE2 no hydrogen 2.745 N/A ARG 41.A NH2 ASN 42.A OD1 no hydrogen 2.834 N/A ASN 42.A N ASN 38.A O no hydrogen 3.078 N/A LEU 43.A N GLU 39.A O no hydrogen 3.031 N/A LEU 44.A N GLU 40.A O no hydrogen 2.923 N/A SER 45.A N ARG 41.A O no hydrogen 3.002 N/A VAL 46.A N ASN 42.A O no hydrogen 2.835 N/A ALA 47.A N LEU 43.A O no hydrogen 2.968 N/A TYR 48.A N LEU 44.A O no hydrogen 3.128 N/A TYR 48.A OH ASP 86.A OD2 no hydrogen 3.233 N/A LYS 49.A N SER 45.A O no hydrogen 2.932 N/A ASN 50.A N VAL 46.A O no hydrogen 3.051 N/A ASN 50.A ND2 VAL 46.A O no hydrogen 2.742 N/A VAL 51.A N ALA 47.A O no hydrogen 2.832 N/A VAL 52.A N TYR 48.A O no hydrogen 2.729 N/A GLY 53.A N LYS 49.A O no hydrogen 2.758 N/A ALA 54.A N ASN 50.A O no hydrogen 3.081 N/A ARG 55.A NE GLU 79.A OE1 no hydrogen 3.183 N/A ARG 55.A NH1 ASP 20.A OD1 no hydrogen 3.457 N/A ARG 55.A NH1 VAL 51.A O no hydrogen 2.958 N/A ARG 56.A N VAL 52.A O no hydrogen 2.788 N/A ARG 56.A NE GLU 121.A OE1 no hydrogen 2.900 N/A ARG 56.A NH2 GLU 121.A OE2 no hydrogen 2.872 N/A SER 57.A N GLY 53.A O no hydrogen 2.889 N/A SER 58.A N ALA 54.A O no hydrogen 2.962 N/A SER 58.A OG ALA 54.A O no hydrogen 3.039 N/A TRP 59.A N ARG 55.A O no hydrogen 2.785 N/A TRP 59.A NE1 GLU 77.A OE1 no hydrogen 3.053 N/A ARG 60.A N ARG 56.A O no hydrogen 2.989 N/A VAL 61.A N SER 57.A O no hydrogen 3.143 N/A VAL 62.A N SER 58.A O no hydrogen 3.009 N/A SER 63.A N TRP 59.A O no hydrogen 2.676 N/A SER 63.A OG TRP 59.A O no hydrogen 2.592 N/A SER 63.A OG ARG 60.A O no hydrogen 3.331 N/A SER 64.A N ARG 60.A O no hydrogen 3.026 N/A ILE 65.A N VAL 61.A O no hydrogen 3.003 N/A GLU 66.A N VAL 62.A O no hydrogen 2.833 N/A GLU 71.A N GLN 67.A O no hydrogen 2.946 N/A TYR 72.A N MET 68.A O no hydrogen 3.073 N/A ARG 73.A N ALA 69.A O no hydrogen 2.911 N/A ARG 73.A NE GLU 77.A OE1 no hydrogen 3.160 N/A ARG 73.A NH1 GLU 66.A OE1 no hydrogen 2.704 N/A ARG 73.A NH2 GLU 77.A OE1 no hydrogen 3.219 N/A GLU 74.A N ARG 70.A O no hydrogen 2.778 N/A LYS 75.A N GLU 71.A O no hydrogen 2.818 N/A ILE 76.A N TYR 72.A O no hydrogen 2.705 N/A GLU 77.A N ARG 73.A O no hydrogen 2.666 N/A THR 78.A N GLU 74.A O no hydrogen 3.009 N/A THR 78.A OG1 GLU 74.A O no hydrogen 3.070 N/A GLU 79.A N LYS 75.A O no hydrogen 3.403 N/A LEU 80.A N ILE 76.A O no hydrogen 3.105 N/A ARG 81.A N GLU 77.A O no hydrogen 2.833 N/A ARG 81.A NH2 GLU 77.A OE2 no hydrogen 2.650 N/A ASP 82.A N THR 78.A O no hydrogen 2.887 N/A ILE 83.A N GLU 79.A O no hydrogen 2.772 N/A CYS 84.A N LEU 80.A O no hydrogen 2.951 N/A CYS 84.A SG LEU 80.A O no hydrogen 3.511 N/A CYS 84.A SG TYR 115.A O no hydrogen 3.707 N/A ASN 85.A N ARG 81.A O no hydrogen 2.950 N/A ASP 86.A N ASP 82.A O no hydrogen 2.820 N/A VAL 87.A N ILE 83.A O no hydrogen 2.951 N/A LEU 88.A N CYS 84.A O no hydrogen 2.699 N/A SER 89.A N ASN 85.A O no hydrogen 2.812 N/A LEU 90.A N ASP 86.A O no hydrogen 3.054 N/A LEU 91.A N VAL 87.A O no hydrogen 2.967 N/A GLU 92.A N LEU 88.A O no hydrogen 2.843 N/A LYS 93.A N SER 89.A O no hydrogen 2.736 N/A PHE 94.A N LEU 90.A O no hydrogen 2.863 N/A LEU 95.A N LEU 90.A O no hydrogen 3.147 N/A ILE 96.A N LEU 91.A O no hydrogen 2.845 N/A ASN 98.A N PHE 94.A O no hydrogen 3.077 N/A ALA 99.A N ILE 96.A O no hydrogen 3.072 N/A SER 100.A OG ALA 99.A O no hydrogen 2.504 N/A GLN 101.A N ALA 99.A O no hydrogen 2.963 N/A LYS 105.A N GLN 101.A O no hydrogen 3.004 N/A VAL 106.A N ALA 102.A O no hydrogen 2.844 N/A PHE 107.A N GLU 103.A O no hydrogen 2.803 N/A TYR 108.A N SER 104.A O no hydrogen 2.813 N/A LEU 109.A N LYS 105.A O no hydrogen 2.841 N/A LYS 110.A N VAL 106.A O no hydrogen 2.800 N/A LYS 110.A NZ ASP 114.A OD2 no hydrogen 2.943 N/A MET 111.A N PHE 107.A O no hydrogen 2.996 N/A LYS 112.A N TYR 108.A O no hydrogen 2.810 N/A LYS 112.A NZ GLU 92.A OE2 no hydrogen 2.872 N/A GLY 113.A N LEU 109.A O no hydrogen 2.876 N/A ASP 114.A N LYS 110.A O no hydrogen 2.820 N/A TYR 115.A N MET 111.A O no hydrogen 2.950 N/A TYR 116.A N LYS 112.A O no hydrogen 2.891 N/A ARG 117.A N GLY 113.A O no hydrogen 2.763 N/A ARG 117.A NE TYR 136.A OH no hydrogen 2.716 N/A ARG 117.A NH1 GLU 167.A OE2 no hydrogen 2.969 N/A ARG 117.A NH2 ASP 114.A OD1 no hydrogen 3.212 N/A ARG 117.A NH2 TYR 136.A OH no hydrogen 3.349 N/A TYR 118.A N ASP 114.A O no hydrogen 2.760 N/A LEU 119.A N TYR 115.A O no hydrogen 2.966 N/A ALA 120.A N TYR 116.A O no hydrogen 2.728 N/A GLU 121.A N ARG 117.A O no hydrogen 2.948 N/A VAL 122.A N LEU 119.A O no hydrogen 3.148 N/A ALA 123.A N ALA 120.A O no hydrogen 3.199 N/A ILE 128.A N ASP 124.A O no hydrogen 3.240 N/A VAL 129.A N LYS 125.A O no hydrogen 3.120 N/A ASP 130.A N LYS 126.A O no hydrogen 3.015 N/A GLN 131.A N GLY 127.A O no hydrogen 2.852 N/A SER 132.A N ILE 128.A O no hydrogen 2.731 N/A SER 132.A OG GLY 113.A O no hydrogen 2.857 N/A GLN 133.A N VAL 129.A O no hydrogen 2.782 N/A GLN 133.A NE2 TYR 165.A OH no hydrogen 3.510 N/A GLN 134.A N ASP 130.A O no hydrogen 2.858 N/A ALA 135.A N GLN 131.A O no hydrogen 3.123 N/A TYR 136.A N SER 132.A O no hydrogen 3.078 N/A TYR 136.A OH ASP 114.A OD1 no hydrogen 2.548 N/A GLN 137.A N GLN 133.A O no hydrogen 2.856 N/A GLN 137.A NE2 GLU 141.A OE2 no hydrogen 3.211 N/A GLU 138.A N GLN 134.A O no hydrogen 3.152 N/A ALA 139.A N ALA 135.A O no hydrogen 2.825 N/A PHE 140.A N TYR 136.A O no hydrogen 2.658 N/A GLU 141.A N GLN 137.A O no hydrogen 2.837 N/A ILE 142.A N GLU 138.A O no hydrogen 3.074 N/A SER 143.A N ALA 139.A O no hydrogen 2.941 N/A SER 143.A OG PHE 140.A O no hydrogen 2.984 N/A LYS 144.A N PHE 140.A O no hydrogen 2.998 N/A LYS 145.A N GLU 141.A O no hydrogen 2.980 N/A GLU 146.A N ILE 142.A O no hydrogen 2.666 N/A THR 150.A OG1 THR 192.A OG1 no hydrogen 2.716 N/A HIS 151.A N GLN 148.A O no hydrogen 3.236 N/A ILE 153.A N HIS 151.A ND1 no hydrogen 2.950 N/A LEU 155.A N HIS 151.A O no hydrogen 2.861 N/A GLY 156.A N PRO 152.A O no hydrogen 2.839 N/A LEU 157.A N ILE 153.A O no hydrogen 2.995 N/A ALA 158.A N ARG 154.A O no hydrogen 2.882 N/A LEU 159.A N LEU 155.A O no hydrogen 2.825 N/A ASN 160.A N GLY 156.A O no hydrogen 2.977 N/A ASN 160.A ND2 ASP 114.A OD1 no hydrogen 2.851 N/A ASN 160.A ND2 ASP 114.A OD2 no hydrogen 3.404 N/A PHE 161.A N LEU 157.A O no hydrogen 2.881 N/A SER 162.A N ALA 158.A O no hydrogen 2.842 N/A SER 162.A OG ALA 158.A O no hydrogen 3.233 N/A SER 162.A OG LEU 159.A O no hydrogen 2.724 N/A VAL 163.A N LEU 159.A O no hydrogen 3.107 N/A PHE 164.A N ASN 160.A O no hydrogen 2.826 N/A TYR 165.A N PHE 161.A O no hydrogen 2.900 N/A TYR 166.A N SER 162.A O no hydrogen 2.862 N/A GLU 167.A N VAL 163.A O no hydrogen 2.709 N/A ILE 168.A N PHE 164.A O no hydrogen 2.798 N/A LEU 169.A N PHE 164.A O no hydrogen 2.997 N/A SER 171.A N TYR 165.A O no hydrogen 2.725 N/A LYS 174.A N SER 171.A OG no hydrogen 3.362 N/A ALA 175.A N SER 171.A O no hydrogen 2.920 N/A CYS 176.A N PRO 172.A O no hydrogen 2.758 N/A CYS 176.A SG PRO 172.A O no hydrogen 3.317 N/A SER 177.A N GLU 173.A O no hydrogen 2.788 N/A SER 177.A OG GLU 173.A O no hydrogen 3.152 N/A SER 177.A OG LYS 174.A O no hydrogen 3.085 N/A LEU 178.A N LYS 174.A O no hydrogen 2.921 N/A ALA 179.A N ALA 175.A O no hydrogen 2.941 N/A LYS 180.A N CYS 176.A O no hydrogen 2.905 N/A LYS 180.A NZ ASP 184.A OD2 no hydrogen 2.847 N/A THR 181.A N SER 177.A O no hydrogen 2.926 N/A THR 181.A OG1 SER 177.A O no hydrogen 2.904 N/A ALA 182.A N LEU 178.A O no hydrogen 2.996 N/A PHE 183.A N ALA 179.A O no hydrogen 2.864 N/A ASP 184.A N LYS 180.A O no hydrogen 2.837 N/A GLU 185.A N THR 181.A O no hydrogen 2.916 N/A ALA 186.A N ALA 182.A O no hydrogen 3.185 N/A ILE 187.A N PHE 183.A O no hydrogen 2.940 N/A ALA 188.A N ASP 184.A O no hydrogen 3.082 N/A GLU 189.A N ALA 186.A O no hydrogen 2.861 N/A THR 192.A N GLU 189.A O no hydrogen 2.635 N/A THR 192.A OG1 THR 150.A OG1 no hydrogen 2.716 N/A THR 192.A OG1 GLU 189.A O no hydrogen 2.779 N/A LEU 193.A N LEU 190.A O no hydrogen 3.099 N/A SER 197.A N SER 194.A OG no hydrogen 3.129 N/A TYR 198.A N SER 194.A O no hydrogen 3.026 N/A SER 201.A N SER 197.A O no hydrogen 2.743 N/A SER 201.A OG THR 150.A O no hydrogen 2.423 N/A SER 201.A OG SER 197.A O no hydrogen 3.412 N/A THR 202.A N TYR 198.A O no hydrogen 2.883 N/A THR 202.A OG1 TYR 198.A O no hydrogen 2.755 N/A THR 202.A OG1 LYS 199.A O no hydrogen 3.281 N/A LEU 203.A N LYS 199.A O no hydrogen 2.954 N/A ILE 204.A N ASP 200.A O no hydrogen 3.029 N/A MET 205.A N SER 201.A O no hydrogen 2.859 N/A GLN 206.A N THR 202.A O no hydrogen 2.923 N/A GLN 206.A NE2 ASP 210.A OD1 no hydrogen 2.814 N/A LEU 207.A N LEU 203.A O no hydrogen 3.062 N/A LEU 208.A N ILE 204.A O no hydrogen 2.993 N/A ARG 209.A N MET 205.A O no hydrogen 2.998 N/A ASP 210.A N GLN 206.A O no hydrogen 2.705 N/A ASN 211.A N LEU 207.A O no hydrogen 2.873 N/A LEU 212.A N LEU 208.A O no hydrogen 2.880 N/A THR 213.A N ARG 209.A O no hydrogen 2.833 N/A THR 213.A OG1 ARG 209.A O no hydrogen 2.934 N/A LEU 214.A N ASP 210.A O no hydrogen 3.012 N/A TRP 215.A N ASN 211.A O no hydrogen 2.803 N/A THR 216.A N LEU 212.A O no hydrogen 2.825 N/A THR 216.A OG1 LEU 212.A O no hydrogen 2.746 N/A THR 216.A OG1 THR 213.A O no hydrogen 3.410 N/A