Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4g9b_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N ALA 167.A O no hydrogen 2.842 N/A GLY 6.A N ALA 167.A O no hydrogen 3.419 N/A VAL 7.A N SER 112.A O.A no hydrogen 3.014 N/A VAL 7.A N SER 112.A O.B no hydrogen 3.032 N/A ILE 8.A N ILE 169.A O no hydrogen 2.791 N/A PHE 9.A N GLY 114.A O no hydrogen 2.911 N/A ASP 10.A N ILE 171.A O no hydrogen 3.079 N/A GLY 13.A N THR 16.A O no hydrogen 2.864 N/A VAL 14.A N LEU 11.A O.A no hydrogen 3.126 N/A VAL 14.A N LEU 11.A O.B no hydrogen 3.057 N/A ILE 15.A N.A LEU 11.A O.A no hydrogen 2.823 N/A ILE 15.A N.A LEU 11.A O.B no hydrogen 2.803 N/A ILE 15.A N.B LEU 11.A O.A no hydrogen 2.828 N/A ILE 15.A N.B LEU 11.A O.B no hydrogen 2.808 N/A THR 16.A N LEU 11.A O.A no hydrogen 3.393 N/A THR 16.A N LEU 11.A O.B no hydrogen 3.436 N/A THR 16.A OG1 ALA 94.A O no hydrogen 2.673 N/A THR 18.A N ASP 12.A OD1 no hydrogen 2.892 N/A THR 18.A OG1 ASP 12.A OD1 no hydrogen 2.981 N/A HIS 22.A N THR 18.A O no hydrogen 3.051 N/A PHE 23.A N ALA 19.A O no hydrogen 3.116 N/A GLN 24.A N HIS 20.A O no hydrogen 2.863 N/A ALA 25.A N LEU 21.A O no hydrogen 3.055 N/A TRP 26.A N HIS 22.A O no hydrogen 3.105 N/A GLN 27.A N PHE 23.A O no hydrogen 2.802 N/A GLN 27.A NE2 ILE 37.A O no hydrogen 3.207 N/A GLN 28.A N GLN 24.A O no hydrogen 3.027 N/A GLN 28.A NE2 GLU 32.A OE1 no hydrogen 3.004 N/A ILE 29.A N ALA 25.A O no hydrogen 3.005 N/A ALA 30.A N TRP 26.A O no hydrogen 2.923 N/A ALA 31.A N GLN 27.A O no hydrogen 2.996 N/A GLU 32.A N GLN 28.A O no hydrogen 2.973 N/A ILE 33.A N ALA 30.A O no hydrogen 3.019 N/A GLY 34.A N ALA 31.A O no hydrogen 3.047 N/A ILE 35.A N ALA 30.A O no hydrogen 2.885 N/A PHE 41.A N ASP 38.A OD1 no hydrogen 2.779 N/A ASN 42.A N ASP 38.A O no hydrogen 3.112 N/A ASN 42.A N ALA 39.A O no hydrogen 3.110 N/A SER 44.A N PHE 41.A O no hydrogen 2.843 N/A LEU 45.A N ASN 42.A O no hydrogen 3.035 N/A LYS 46.A N GLU 43.A O no hydrogen 3.240 N/A GLU 52.A N SER 49.A OG no hydrogen 3.118 N/A SER 53.A N SER 49.A O no hydrogen 2.871 N/A SER 53.A OG ILE 48.A O no hydrogen 3.561 N/A SER 53.A OG SER 49.A O no hydrogen 2.800 N/A LEU 54.A N ARG 50.A O no hydrogen 3.125 N/A ARG 55.A N ASP 51.A O no hydrogen 3.008 N/A ARG 55.A NE GLU 52.A OE1 no hydrogen 2.883 N/A ARG 55.A NE GLU 52.A OE2 no hydrogen 3.456 N/A ARG 55.A NH1 GLN 59.A OE1 no hydrogen 2.929 N/A ARG 55.A NH1 GLU 64.A OE2 no hydrogen 2.796 N/A ARG 55.A NH2 GLU 52.A OE2 no hydrogen 2.960 N/A ARG 55.A NH2 GLN 59.A OE1 no hydrogen 3.277 N/A ARG 56.A N GLU 52.A O no hydrogen 2.871 N/A ARG 56.A NE GLU 52.A OE2 no hydrogen 2.947 N/A ARG 56.A NH1 SER 44.A O no hydrogen 2.853 N/A ILE 57.A N SER 53.A O no hydrogen 3.118 N/A LEU 58.A N LEU 54.A O no hydrogen 2.916 N/A GLN 59.A N ARG 55.A O no hydrogen 2.826 N/A HIS 60.A N ARG 56.A O no hydrogen 2.977 N/A GLY 61.A N ILE 57.A O no hydrogen 3.220 N/A GLY 61.A N LEU 58.A O no hydrogen 3.147 N/A GLY 62.A N GLN 59.A O no hydrogen 3.030 N/A LYS 63.A N LEU 58.A O no hydrogen 2.768 N/A LYS 63.A NZ ILE 33.A O no hydrogen 2.526 N/A ASP 66.A N LYS 63.A O no hydrogen 3.084 N/A ASN 68.A N GLU 71.A OE1 no hydrogen 2.770 N/A GLU 71.A N ASN 68.A OD1 no hydrogen 2.801 N/A ARG 72.A N ASN 68.A O no hydrogen 2.860 N/A ARG 72.A NE PHE 67.A O no hydrogen 2.885 N/A ARG 72.A NH2 GLU 64.A O no hydrogen 2.823 N/A ARG 72.A NH2 PHE 67.A O no hydrogen 3.475 N/A ALA 73.A N SER 69.A O no hydrogen 3.008 N/A GLN 74.A N GLN 70.A O no hydrogen 3.125 N/A LEU 75.A N GLU 71.A O no hydrogen 3.069 N/A ALA 76.A N ARG 72.A O no hydrogen 2.881 N/A TYR 77.A N ALA 73.A O no hydrogen 2.938 N/A ARG 78.A N GLN 74.A O no hydrogen 3.135 N/A ARG 78.A NE GLU 32.A OE2 no hydrogen 2.825 N/A ARG 78.A NH2 GLU 32.A OE1 no hydrogen 2.839 N/A ARG 78.A NH2 GLU 32.A OE2 no hydrogen 3.476 N/A LYS 79.A N LEU 75.A O no hydrogen 2.912 N/A LYS 79.A NZ HIS 22.A ND1 no hydrogen 2.841 N/A ASN 80.A N ALA 76.A O no hydrogen 2.938 N/A LEU 81.A N TYR 77.A O no hydrogen 2.916 N/A LEU 82.A N ARG 78.A O no hydrogen 2.911 N/A TYR 83.A N LYS 79.A O no hydrogen 2.984 N/A VAL 84.A N ASN 80.A O no hydrogen 2.865 N/A HIS 85.A N LEU 81.A O no hydrogen 3.041 N/A SER 86.A N LEU 82.A O no hydrogen 3.065 N/A SER 86.A OG TYR 83.A O no hydrogen 2.550 N/A LEU 87.A N TYR 83.A O no hydrogen 3.091 N/A ARG 88.A N VAL 84.A O no hydrogen 3.113 N/A GLU 89.A N HIS 85.A O no hydrogen 3.166 N/A GLU 89.A N SER 86.A O no hydrogen 3.173 N/A LEU 90.A N LEU 87.A O no hydrogen 3.194 N/A ASN 93.A N THR 91.A OG1 no hydrogen 3.160 N/A ALA 94.A N THR 91.A O no hydrogen 3.035 N/A VAL 95.A N VAL 92.A O no hydrogen 3.384 N/A LEU 96.A N ILE 15.A O.A no hydrogen 2.833 N/A LEU 96.A N ILE 15.A O.B no hydrogen 2.893 N/A ILE 99.A N LEU 96.A O no hydrogen 3.225 N/A ARG 100.A NH1.A LEU 129.A O no hydrogen 3.240 N/A ARG 100.A NH2.A VAL 92.A O no hydrogen 2.557 N/A ARG 100.A NH2.B GLU 130.A O no hydrogen 3.081 N/A SER 101.A OG.B GLY 98.A O no hydrogen 3.000 N/A LEU 102.A N GLY 98.A O no hydrogen 3.073 N/A LEU 103.A N ILE 99.A O no hydrogen 2.921 N/A ALA 104.A N ARG 100.A O.A no hydrogen 2.970 N/A ALA 104.A N ARG 100.A O.B no hydrogen 2.965 N/A ASP 105.A N SER 101.A O.A no hydrogen 2.965 N/A ASP 105.A N SER 101.A O.B no hydrogen 3.002 N/A ASP 105.A N SER 101.A O.C no hydrogen 2.963 N/A LEU 106.A N LEU 102.A O no hydrogen 2.864 N/A ARG 107.A N LEU 103.A O no hydrogen 3.058 N/A ARG 107.A NH2 ILE 111.A O no hydrogen 3.009 N/A ALA 108.A N ALA 104.A O no hydrogen 2.971 N/A GLN 109.A N ASP 105.A O no hydrogen 3.045 N/A GLN 109.A N LEU 106.A O no hydrogen 3.100 N/A GLN 110.A N ARG 107.A O no hydrogen 3.007 N/A ILE 111.A N LEU 106.A O no hydrogen 2.987 N/A SER 112.A OG.B GLN 5.A O no hydrogen 2.590 N/A VAL 113.A N THR 136.A OG1 no hydrogen 3.017 N/A GLY 114.A N VAL 7.A O no hydrogen 2.865 N/A LEU 115.A N PHE 137.A O no hydrogen 2.970 N/A ALA 116.A N PHE 9.A O no hydrogen 2.899 N/A SER 119.A N SER 117.A OG no hydrogen 3.042 N/A ASN 121.A N SER 119.A OG no hydrogen 2.931 N/A ALA 122.A N SER 119.A O no hydrogen 3.316 N/A ILE 125.A N ASN 121.A O no hydrogen 2.980 N/A LEU 126.A N ALA 122.A O no hydrogen 2.879 N/A ALA 127.A N PRO 123.A O no hydrogen 3.013 N/A ALA 128.A N THR 124.A O no hydrogen 3.061 N/A LEU 129.A N ILE 125.A O no hydrogen 3.007 N/A GLU 130.A N ALA 127.A O no hydrogen 3.031 N/A LEU 131.A N LEU 126.A O no hydrogen 2.891 N/A PHE 134.A N LEU 131.A O no hydrogen 2.999 N/A PHE 135.A N ARG 132.A O no hydrogen 3.091 N/A THR 136.A N VAL 113.A O no hydrogen 2.796 N/A PHE 137.A N VAL 113.A O no hydrogen 3.292 N/A ALA 139.A N LEU 115.A O no hydrogen 2.995 N/A SER 142.A N ASP 140.A OD1 no hydrogen 3.000 N/A SER 142.A OG ASP 140.A OD1 no hydrogen 2.560 N/A SER 142.A OG ASP 140.A OD2 no hydrogen 3.283 N/A GLN 143.A N ASP 140.A O no hydrogen 3.087 N/A LEU 144.A N ALA 141.A O no hydrogen 3.198 N/A LYS 145.A N GLU 152.A OE1 no hydrogen 3.259 N/A LYS 145.A N GLU 152.A OE2 no hydrogen 3.176 N/A ASN 146.A N GLU 152.A OE1 no hydrogen 3.034 N/A LYS 148.A NZ ALA 116.A O no hydrogen 3.002 N/A LYS 148.A NZ GLU 172.A OE2 no hydrogen 2.609 N/A ASP 150.A N SER 147.A O no hydrogen 3.001 N/A GLU 152.A N ASP 150.A OD1 no hydrogen 2.908 N/A LEU 155.A N PRO 151.A O no hydrogen 2.964 N/A ALA 156.A N GLU 152.A O no hydrogen 2.819 N/A ALA 157.A N ILE 153.A O no hydrogen 3.121 N/A CYS 158.A N PHE 154.A O no hydrogen 3.000 N/A CYS 158.A SG PHE 154.A O no hydrogen 3.385 N/A ALA 159.A N LEU 155.A O no hydrogen 2.958 N/A GLY 160.A N ALA 156.A O no hydrogen 2.956 N/A LEU 161.A N ALA 157.A O no hydrogen 3.054 N/A GLY 162.A N ALA 159.A O no hydrogen 3.000 N/A VAL 163.A N CYS 158.A O no hydrogen 3.199 N/A GLN 166.A N GLN 166.A OE1 no hydrogen 2.749 N/A ALA 167.A N PRO 164.A O no hydrogen 3.093 N/A CYS 168.A N PRO 165.A O no hydrogen 2.938 N/A CYS 168.A SG PRO 164.A O no hydrogen 3.793 N/A ILE 169.A N GLY 6.A O no hydrogen 3.021 N/A GLY 170.A N ARG 187.A O no hydrogen 2.875 N/A ILE 171.A N ILE 8.A O no hydrogen 2.962 N/A GLU 172.A N VAL 189.A O no hydrogen 3.050 N/A ASP 173.A N GLU 172.A OE1 no hydrogen 3.177 N/A ALA 174.A N GLU 172.A OE1 no hydrogen 3.261 N/A GLN 175.A NE2 GLN 175.A O no hydrogen 3.458 N/A GLN 175.A NE2 ASP 179.A OD1 no hydrogen 3.144 N/A GLN 175.A NE2 THR 196.A O no hydrogen 2.841 N/A ILE 178.A N ALA 174.A O no hydrogen 2.901 N/A ASP 179.A N GLN 175.A O no hydrogen 2.870 N/A ALA 180.A N ALA 176.A O no hydrogen 2.948 N/A ILE 181.A N GLY 177.A O no hydrogen 2.935 N/A ASN 182.A N ILE 178.A O no hydrogen 2.880 N/A ASN 182.A ND2 GLY 197.A O no hydrogen 2.849 N/A ALA 183.A N ASP 179.A O no hydrogen 2.904 N/A SER 184.A N ALA 180.A O no hydrogen 3.065 N/A SER 184.A N ILE 181.A O no hydrogen 3.217 N/A SER 184.A OG ILE 181.A O no hydrogen 2.676 N/A GLY 185.A N ASN 182.A O no hydrogen 3.104 N/A MET 186.A N SER 184.A OG no hydrogen 3.316 N/A ARG 187.A N CYS 168.A O no hydrogen 3.034 N/A ARG 187.A NE GLN 166.A O no hydrogen 2.919 N/A ARG 187.A NH2 GLN 166.A O no hydrogen 2.934 N/A SER 188.A N GLN 199.A OE1 no hydrogen 3.255 N/A SER 188.A OG ASN 182.A OD1 no hydrogen 2.780 N/A SER 188.A OG GLY 197.A O no hydrogen 3.502 N/A VAL 189.A N GLY 170.A O no hydrogen 2.887 N/A GLY 190.A N LEU 200.A O no hydrogen 2.873 N/A ILE 191.A N GLU 172.A O no hydrogen 2.878 N/A GLY 192.A N LEU 202.A O no hydrogen 2.792 N/A THR 196.A N GLN 175.A OE1 no hydrogen 2.848 N/A THR 196.A OG1 GLN 175.A OE1 no hydrogen 3.428 N/A GLN 199.A N SER 188.A OG no hydrogen 3.096 N/A LEU 200.A N SER 188.A O no hydrogen 3.103 N/A LEU 202.A N GLY 190.A O no hydrogen 2.852 N/A THR 205.A OG1 PRO 97.A O no hydrogen 2.691 N/A GLU 206.A N SER 204.A OG no hydrogen 3.236 N/A SER 207.A N SER 204.A O no hydrogen 3.170 N/A LEU 208.A N THR 205.A O no hydrogen 2.981 N/A ARG 212.A N THR 209.A OG1 no hydrogen 3.174 N/A LEU 213.A N THR 209.A O no hydrogen 2.970 N/A SER 214.A N TRP 210.A O no hydrogen 2.767 N/A ALA 215.A N PRO 211.A O no hydrogen 2.957 N/A PHE 216.A N ARG 212.A O no hydrogen 2.922 N/A TRP 217.A N LEU 213.A O no hydrogen 2.823 N/A TRP 217.A NE1 MET 2.A O no hydrogen 2.807 N/A GLN 218.A N SER 214.A O no hydrogen 2.979 N/A ASN 219.A N ALA 215.A O no hydrogen 3.065 N/A ASN 219.A N PHE 216.A O no hydrogen 3.129 N/A VAL 220.A N PHE 216.A O no hydrogen 3.015 N/A ALA 221.A N TRP 217.A O no hydrogen 2.928 N/A TYR 225.A N ASN 223.A OD1 no hydrogen 2.860 N/A PHE 226.A N ASN 223.A O no hydrogen 2.927 N/A GLN 227.A N LEU 224.A O no hydrogen 3.211 N/A