Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4io1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A NE2 ASP 118.A OD1 no hydrogen 3.521 N/A GLN 3.A NE2 ASP 118.A OD2 no hydrogen 3.045 N/A GLU 5.A N ASN 1.A O no hydrogen 3.164 N/A LEU 6.A N ASN 2.A O no hydrogen 2.910 N/A LYS 7.A N GLN 3.A O no hydrogen 2.838 N/A LYS 7.A NZ SER 30.A OG no hydrogen 2.781 N/A LYS 8.A N ASP 4.A O no hydrogen 2.935 N/A LEU 9.A N GLU 5.A O no hydrogen 3.009 N/A ALA 10.A N LEU 6.A O no hydrogen 3.014 N/A ALA 11.A N LYS 7.A O no hydrogen 3.061 N/A THR 12.A N.A LYS 8.A O no hydrogen 2.930 N/A THR 12.A N.C LYS 8.A O no hydrogen 2.966 N/A THR 12.A OG1.A LYS 8.A O no hydrogen 2.766 N/A THR 12.A OG1.C LYS 8.A O no hydrogen 3.159 N/A THR 12.A OG1.C LEU 9.A O no hydrogen 3.293 N/A GLU 13.A N LEU 9.A O no hydrogen 3.077 N/A ALA 14.A N ALA 10.A O no hydrogen 3.017 N/A ALA 15.A N ALA 11.A O no hydrogen 3.124 N/A LYS 16.A N GLU 13.A O no hydrogen 3.102 N/A LYS 16.A NZ GLU 13.A OE1 no hydrogen 3.353 N/A SER 17.A N ALA 14.A O no hydrogen 2.944 N/A ILE 18.A N ALA 15.A O no hydrogen 2.924 N/A ILE 22.A N LYS 45.A O no hydrogen 2.853 N/A THR 23.A N ASP 77.A OD2 no hydrogen 2.932 N/A LEU 24.A N THR 48.A O no hydrogen 2.885 N/A GLY 25.A N LEU 78.A O no hydrogen 2.771 N/A VAL 26.A N VAL 50.A O no hydrogen 2.894 N/A GLY 27.A N ILE 80.A O no hydrogen 2.833 N/A THR 28.A N ASP 81.A OD1 no hydrogen 2.924 N/A THR 28.A OG1 SER 52.A OG no hydrogen 2.843 N/A THR 28.A OG1 SER 53.A OG no hydrogen 2.686 N/A THR 28.A OG1 SER 56.A OG no hydrogen 3.368 N/A GLY 33.A N GLY 29.A O no hydrogen 2.987 N/A PHE 34.A N THR 31.A O no hydrogen 3.110 N/A LEU 35.A N THR 31.A O no hydrogen 3.314 N/A ILE 36.A N VAL 32.A O no hydrogen 2.804 N/A GLU 37.A N GLY 33.A O no hydrogen 3.246 N/A GLU 38.A N PHE 34.A O no hydrogen 3.224 N/A LEU 39.A N LEU 35.A O no hydrogen 3.086 N/A LEU 39.A N ILE 36.A O no hydrogen 3.129 N/A ASN 41.A N GLU 38.A O no hydrogen 3.078 N/A ASN 41.A ND2 GLU 38.A OE2 no hydrogen 3.505 N/A TYR 42.A N LEU 39.A O no hydrogen 2.910 N/A ARG 43.A NH1.A LEU 63.A O no hydrogen 2.877 N/A ARG 43.A NH1.B GLY 64.A O no hydrogen 3.380 N/A ARG 43.A NH2.A LEU 63.A O no hydrogen 3.022 N/A ARG 43.A NH2.B LEU 63.A O no hydrogen 3.154 N/A LYS 45.A N TYR 42.A O no hydrogen 2.886 N/A LYS 45.A NZ THR 19.A O no hydrogen 3.001 N/A ILE 46.A N ARG 43.A O.A no hydrogen 3.401 N/A ILE 46.A N ARG 43.A O.B no hydrogen 3.117 N/A LYS 47.A N ILE 22.A O no hydrogen 3.018 N/A VAL 50.A N LEU 24.A O no hydrogen 2.863 N/A SER 51.A OG SER 53.A O no hydrogen 2.838 N/A SER 51.A OG THR 57.A OG1 no hydrogen 2.847 N/A SER 52.A N VAL 26.A O no hydrogen 3.038 N/A SER 52.A OG VAL 26.A O no hydrogen 2.802 N/A SER 52.A OG THR 28.A OG1 no hydrogen 2.843 N/A SER 53.A N SER 51.A OG no hydrogen 3.157 N/A SER 53.A OG THR 28.A OG1 no hydrogen 2.686 N/A SER 53.A OG SER 56.A OG no hydrogen 3.207 N/A GLU 54.A N.A ASP 163.A OD2 no hydrogen 2.966 N/A GLU 54.A N.B ASP 163.A OD2 no hydrogen 2.885 N/A SER 56.A N SER 53.A OG no hydrogen 2.910 N/A SER 56.A OG GLY 27.A O no hydrogen 2.647 N/A SER 56.A OG THR 28.A OG1 no hydrogen 3.368 N/A SER 56.A OG SER 53.A OG no hydrogen 3.207 N/A THR 57.A N SER 53.A O no hydrogen 2.898 N/A THR 57.A OG1 SER 51.A OG no hydrogen 2.847 N/A THR 57.A OG1 SER 53.A O no hydrogen 3.012 N/A ARG 58.A N GLU 54.A O.A no hydrogen 2.907 N/A ARG 58.A N GLU 54.A O.B no hydrogen 3.083 N/A ARG 58.A NH2 ASP 55.A OD1 no hydrogen 3.195 N/A LYS 59.A N ASP 55.A O no hydrogen 3.304 N/A LYS 59.A NZ ASP 55.A OD2 no hydrogen 3.206 N/A LEU 60.A N SER 56.A O no hydrogen 2.862 N/A LYS 61.A N THR 57.A O no hydrogen 2.955 N/A ALA 62.A N ARG 58.A O no hydrogen 3.023 N/A LEU 63.A N LEU 60.A O no hydrogen 3.067 N/A GLY 64.A N LYS 61.A O no hydrogen 2.848 N/A PHE 65.A N LEU 60.A O no hydrogen 3.067 N/A VAL 68.A N VAL 49.A O no hydrogen 2.877 N/A ASN 71.A N ASP 69.A OD2 no hydrogen 2.865 N/A ASN 71.A ND2 ASP 69.A OD2 no hydrogen 2.863 N/A TYR 72.A N ASP 69.A O no hydrogen 2.970 N/A ALA 73.A N ASP 69.A O no hydrogen 3.047 N/A GLY 74.A N LEU 70.A O no hydrogen 2.918 N/A ILE 76.A N ALA 109.A O no hydrogen 2.999 N/A ASP 77.A N THR 23.A O no hydrogen 2.889 N/A LEU 78.A N THR 23.A O no hydrogen 3.417 N/A TYR 79.A N LYS 112.A O no hydrogen 2.879 N/A TYR 79.A OH ASP 81.A OD2 no hydrogen 2.741 N/A ILE 80.A N GLY 25.A O no hydrogen 3.092 N/A ASP 81.A N ILE 114.A O no hydrogen 3.098 N/A GLY 82.A N ASP 81.A OD1 no hydrogen 2.832 N/A ASP 84.A N ILE 93.A O no hydrogen 2.818 N/A GLU 85.A N ILE 93.A O no hydrogen 3.162 N/A CYS 86.A N LYS 121.A O no hydrogen 2.900 N/A CYS 86.A SG ASN 87.A O no hydrogen 3.475 N/A ASN 87.A N GLU 91.A O no hydrogen 3.026 N/A ASN 87.A ND2 GLU 91.A OE1 no hydrogen 2.871 N/A ASN 88.A ND2 ASN 124.A OD1 no hydrogen 3.331 N/A HIS 89.A N ASN 87.A OD1 no hydrogen 2.831 N/A LYS 90.A N ASN 87.A O no hydrogen 3.456 N/A LYS 90.A NZ ASP 204.A O no hydrogen 2.890 N/A LYS 90.A NZ LEU 218.A O no hydrogen 3.316 N/A LYS 90.A NZ LEU 218.A OXT no hydrogen 2.897 N/A GLU 91.A N ASN 87.A OD1 no hydrogen 3.077 N/A LEU 92.A N PHE 198.A O no hydrogen 3.044 N/A ILE 93.A N GLU 85.A O no hydrogen 2.986 N/A LYS 94.A N GLY 196.A O no hydrogen 2.853 N/A LYS 94.A NZ ASP 81.A OD2 no hydrogen 2.743 N/A LYS 94.A NZ GLY 82.A O no hydrogen 2.775 N/A LYS 94.A NZ GLU 103.A OE1 no hydrogen 3.085 N/A GLY 96.A N ASP 84.A OD2 no hydrogen 2.807 N/A ALA 98.A N GLY 95.A O no hydrogen 2.884 N/A THR 101.A OG1 GLU 134.A OE1 no hydrogen 2.518 N/A THR 101.A OG1 THR 194.A OG1.B no hydrogen 2.705 N/A ARG 102.A NE ASN 164.A OD1 no hydrogen 2.990 N/A ARG 102.A NH1 GLU 54.A OE2.A no hydrogen 3.238 N/A ARG 102.A NH2 ASN 164.A OD1 no hydrogen 3.432 N/A GLU 103.A N ALA 99.A O no hydrogen 3.090 N/A LYS 104.A N LEU 100.A O no hydrogen 2.832 N/A LYS 104.A NZ GLU 183.A OE2 no hydrogen 2.811 N/A LYS 104.A NZ ASN 195.A O no hydrogen 2.843 N/A LYS 104.A NZ ILE 197.A O no hydrogen 2.712 N/A ILE 105.A N THR 101.A O no hydrogen 3.005 N/A CYS 106.A N ARG 102.A O no hydrogen 2.948 N/A CYS 106.A SG ARG 102.A O no hydrogen 3.402 N/A VAL 107.A N GLU 103.A O no hydrogen 2.920 N/A ALA 108.A N LYS 104.A O no hydrogen 2.931 N/A ALA 109.A N ILE 105.A O no hydrogen 2.984 N/A ALA 110.A N VAL 107.A O no hydrogen 3.125 N/A LYS 111.A N ILE 76.A O no hydrogen 2.961 N/A LYS 111.A NZ GLU 75.A OE1 no hydrogen 2.427 N/A PHE 113.A N ASP 204.A OD2 no hydrogen 2.844 N/A ILE 114.A N TYR 79.A O no hydrogen 2.867 N/A CYS 115.A N THR 205.A O no hydrogen 2.893 N/A CYS 115.A SG ASP 81.A O no hydrogen 3.735 N/A ILE 116.A N ASP 81.A O no hydrogen 2.786 N/A ILE 117.A N ILE 207.A O no hydrogen 2.992 N/A GLU 119.A N ALA 209.A O no hydrogen 2.915 N/A SER 120.A N ASP 118.A OD1 no hydrogen 2.864 N/A SER 120.A OG ASP 118.A OD1 no hydrogen 2.556 N/A LYS 121.A N ASP 118.A O no hydrogen 3.057 N/A LYS 121.A NZ ALA 83.A O no hydrogen 2.855 N/A LYS 122.A N GLU 119.A O no hydrogen 3.222 N/A LYS 122.A NZ ASN 88.A OD1 no hydrogen 2.521 N/A LYS 122.A NZ VAL 123.A O no hydrogen 3.042 N/A VAL 123.A N CYS 86.A O no hydrogen 2.886 N/A GLY 127.A N GLU 85.A OE1 no hydrogen 2.826 N/A ASN 128.A N GLU 85.A OE2 no hydrogen 2.797 N/A LEU 131.A N VAL 171.A O no hydrogen 2.904 N/A ILE 133.A N LEU 169.A O no hydrogen 2.897 N/A GLU 134.A N THR 194.A O.A no hydrogen 2.950 N/A GLU 134.A N THR 194.A O.B no hydrogen 2.986 N/A VAL 135.A N VAL 167.A O no hydrogen 2.880 N/A ILE 136.A N GLY 191.A O no hydrogen 2.902 N/A ALA 139.A N ILE 136.A O no hydrogen 2.885 N/A ARG 140.A N PRO 137.A O no hydrogen 3.041 N/A ILE 143.A N ALA 139.A O no hydrogen 2.891 N/A ALA 144.A N ARG 140.A O no hydrogen 3.010 N/A ARG 145.A N SER 141.A O.A no hydrogen 3.014 N/A ARG 145.A N SER 141.A O.B no hydrogen 3.027 N/A GLN 146.A N TYR 142.A O no hydrogen 3.094 N/A ILE 147.A N ILE 143.A O no hydrogen 2.774 N/A VAL 148.A N ALA 144.A O no hydrogen 2.987 N/A LYS 149.A N ARG 145.A O no hydrogen 3.122 N/A LYS 149.A NZ GLN 146.A OE1 no hydrogen 3.286 N/A LEU 150.A N GLN 146.A O no hydrogen 3.126 N/A GLY 151.A N VAL 148.A O no hydrogen 2.920 N/A GLY 152.A N ILE 147.A O no hydrogen 2.976 N/A GLN 153.A N TYR 172.A O no hydrogen 2.933 N/A VAL 155.A N ASP 170.A O no hydrogen 2.859 N/A ARG 157.A N ILE 168.A O.A no hydrogen 2.982 N/A ARG 157.A N ILE 168.A O.B no hydrogen 2.921 N/A ARG 157.A NE ASP 170.A OD2 no hydrogen 2.830 N/A ARG 157.A NH2 GLY 95.A O no hydrogen 3.020 N/A ARG 157.A NH2 ASP 170.A OD1 no hydrogen 2.806 N/A THR 160.A OG1 GLU 158.A O no hydrogen 3.246 N/A THR 162.A N ASN 166.A O no hydrogen 2.882 N/A THR 162.A OG1 GLU 134.A OE2 no hydrogen 2.763 N/A ASN 164.A N THR 162.A OG1 no hydrogen 3.176 N/A ASN 164.A ND2 GLU 134.A OE1 no hydrogen 3.433 N/A ASN 164.A ND2 GLU 134.A OE2 no hydrogen 3.022 N/A GLY 165.A N THR 162.A O no hydrogen 2.901 N/A ASN 166.A N THR 162.A OG1 no hydrogen 3.123 N/A ASN 166.A ND2 GLU 134.A OE2 no hydrogen 2.972 N/A VAL 167.A N VAL 135.A O no hydrogen 3.219 N/A LEU 169.A N ILE 133.A O no hydrogen 2.944 N/A ASP 170.A N VAL 155.A O no hydrogen 2.904 N/A VAL 171.A N LEU 131.A O no hydrogen 2.801 N/A TYR 172.A N GLN 153.A O no hydrogen 2.916 N/A LYS 175.A NZ ASP 177.A OD1 no hydrogen 2.528 N/A LEU 182.A N ASN 178.A O no hydrogen 2.973 N/A GLU 183.A N PRO 179.A O no hydrogen 2.916 N/A THR 184.A N LEU 180.A O no hydrogen 3.121 N/A THR 184.A OG1 LEU 180.A O no hydrogen 2.813 N/A GLU 185.A N LYS 181.A O no hydrogen 2.885 N/A LEU 186.A N LEU 182.A O no hydrogen 2.875 N/A ASN 187.A N GLU 183.A O no hydrogen 3.135 N/A GLN 188.A N GLU 185.A O no hydrogen 3.063 N/A ILE 189.A N LEU 186.A O no hydrogen 3.158 N/A VAL 192.A N ILE 189.A O no hydrogen 3.029 N/A VAL 193.A N GLU 134.A O no hydrogen 2.870 N/A THR 194.A OG1.A ASN 195.A O no hydrogen 3.239 N/A THR 194.A OG1.B THR 101.A OG1 no hydrogen 2.705 N/A ASN 195.A ND2 GLU 183.A O no hydrogen 3.088 N/A GLY 196.A N PRO 132.A O no hydrogen 2.869 N/A ILE 197.A N ASN 195.A OD1 no hydrogen 3.102 N/A PHE 198.A N LEU 92.A O no hydrogen 2.844 N/A ALA 199.A N GLU 183.A OE1 no hydrogen 2.872 N/A LEU 200.A N GLU 183.A OE1 no hydrogen 2.837 N/A LYS 201.A NZ VAL 107.A O no hydrogen 2.779 N/A LYS 201.A NZ ALA 110.A O no hydrogen 3.250 N/A ALA 203.A N LYS 90.A O no hydrogen 2.985 N/A ASP 204.A N PHE 113.A O no hydrogen 2.904 N/A THR 205.A N PHE 113.A O no hydrogen 3.284 N/A VAL 206.A N LEU 218.A O no hydrogen 3.046 N/A ILE 207.A N CYS 115.A O no hydrogen 2.817 N/A MET 208.A N VAL 216.A O no hydrogen 2.813 N/A ALA 209.A N ILE 117.A O no hydrogen 2.940 N/A THR 210.A N ASN 214.A O no hydrogen 2.810 N/A THR 210.A OG1 ASP 212.A OD1 no hydrogen 2.391 N/A THR 210.A OG1 ASN 214.A O no hydrogen 3.253 N/A ASN 214.A N THR 210.A O no hydrogen 3.290 N/A VAL 216.A N MET 208.A O no hydrogen 2.734 N/A LEU 218.A N VAL 206.A O no hydrogen 2.859 N/A