Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4crg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N TYR 131.A O no hydrogen 2.842 N/A ILE 1.A N ASP 184.A OD2 no hydrogen 2.718 N/A VAL 2.A N ASP 179.A O no hydrogen 2.838 N/A THR 5.A N LYS 144.A O no hydrogen 2.912 N/A SER 7.A N LEU 142.A O no hydrogen 2.888 N/A SER 7.A OG LEU 142.A O no hydrogen 3.076 N/A VAL 8.A N GLU 11.A OE2 no hydrogen 2.826 N/A ARG 9.A NH1.B GLU 66.A OE1 no hydrogen 3.151 N/A ARG 9.A NH1.B GLU 66.A OE2 no hydrogen 3.004 N/A ARG 9.A NH2.B GLU 66.A OE2 no hydrogen 2.661 N/A GLU 11.A N VAL 8.A O no hydrogen 3.026 N/A TRP 12.A NE1 SER 7.A OG no hydrogen 3.027 N/A TRP 14.A NE1 SER 190B.A OG no hydrogen 3.025 N/A GLN 15.A N TRP 12.A O no hydrogen 2.934 N/A GLN 15.A NE2 VAL 16.A O no hydrogen 3.065 N/A VAL 16.A N GLY 31.A O no hydrogen 2.932 N/A THR 17.A N TYR 58.A O no hydrogen 3.111 N/A THR 17.A OG1 HIS 27.A ND1 no hydrogen 2.730 N/A THR 17.A OG1 GLN 64.A OE1 no hydrogen 3.202 N/A LEU 18.A N CYS 29.A O no hydrogen 2.831 N/A HIS 19.A N ARG 56.A O no hydrogen 2.810 N/A HIS 19.A ND1 GLN 25C.A OE1 no hydrogen 2.917 N/A THR 20.A N ARG 26D.A O no hydrogen 2.992 N/A THR 21.A N ILE 54.A O no hydrogen 2.835 N/A THR 21.A OG1 ILE 54.A O no hydrogen 3.311 N/A SER 22.A N THR 20.A OG1 no hydrogen 3.200 N/A HIS 27.A ND1 THR 17.A OG1 no hydrogen 2.730 N/A HIS 27.A NE2 GLY 183.A O no hydrogen 2.835 N/A LEU 28.A N LEU 18.A O no hydrogen 2.771 N/A CYS 29.A N LEU 18.A O no hydrogen 3.168 N/A CYS 29.A SG LEU 28.A O no hydrogen 3.093 N/A GLY 30.A N SER 185.A O no hydrogen 2.821 N/A GLY 31.A N VAL 16.A O no hydrogen 3.297 N/A SER 32.A N LEU 40.A O no hydrogen 2.931 N/A ILE 33.A N TRP 14.A O no hydrogen 2.825 N/A ILE 34.A N TRP 38.A O no hydrogen 2.989 N/A ASN 36.A ND2.A VAL 103.A O no hydrogen 2.874 N/A GLN 37.A NE2.A LEU 99.A O no hydrogen 2.827 N/A TRP 38.A N GLY 35.A O no hydrogen 3.185 N/A ILE 39.A N LEU 97.A O no hydrogen 3.021 N/A LEU 40.A N SER 32.A O no hydrogen 2.842 N/A THR 41.A N ALA 95.A O no hydrogen 2.919 N/A THR 41.A OG1 GLY 30.A O no hydrogen 2.778 N/A ALA 42.A N THR 41.A OG1 no hydrogen 2.792 N/A HIS 44.A N ASP 93.A OD1 no hydrogen 2.895 N/A HIS 44.A ND1 ASP 93.A OD2 no hydrogen 2.699 N/A HIS 44.A NE2 SER 185.A OG no hydrogen 2.632 N/A CYS 45.A N ALA 42.A O no hydrogen 3.314 N/A CYS 45.A SG SER 185.A O no hydrogen 3.886 N/A PHE 46.A N ALA 43.A O no hydrogen 3.103 N/A LYS 53.A N SER 51.A OG no hydrogen 3.033 N/A LEU 55.A N PRO 52.A O no hydrogen 3.081 N/A ARG 56.A N HIS 19.A O no hydrogen 2.895 N/A ARG 56.A NH1 TYR 58.A OH no hydrogen 3.491 N/A VAL 57.A N PHE 74.A O no hydrogen 2.886 N/A TYR 58.A N THR 17.A O no hydrogen 2.977 N/A TYR 58.A OH GLN 25C.A OE1 no hydrogen 2.955 N/A SER 59.A OG GLN 109.A OE1 no hydrogen 2.632 N/A LEU 62.A N GLU 66.A OE2 no hydrogen 2.918 N/A ASN 63.A N GLU 66.A OE2 no hydrogen 2.816 N/A GLN 64.A N ASN 140.A O no hydrogen 2.795 N/A GLN 64.A NE2 HIS 19.A NE2 no hydrogen 2.990 N/A ALA 65.A N ASN 140.A OD1 no hydrogen 2.907 N/A GLU 66.A N ASN 63.A O no hydrogen 2.898 N/A ILE 67.A N GLN 64.A O no hydrogen 2.882 N/A ALA 68.A N THR 71.A OG1 no hydrogen 2.864 N/A THR 71.A N ALA 68.A O no hydrogen 3.043 N/A THR 71.A OG1 GLU 66.A O no hydrogen 2.843 N/A THR 71.A OG1 ALA 68.A O no hydrogen 3.435 N/A PHE 74.A N VAL 57.A O no hydrogen 2.818 N/A GLN 77.A N LYS 98.A O no hydrogen 2.761 N/A GLN 77.A NE2.B LEU 99.A O no hydrogen 3.516 N/A GLU 78.A N LYS 98.A O no hydrogen 3.286 N/A ILE 80.A N LEU 96.A O no hydrogen 2.830 N/A HIS 82.A N ILE 94.A O no hydrogen 3.226 N/A GLN 84.A N HIS 82.A ND1 no hydrogen 2.961 N/A TYR 85.A N HIS 82.A O no hydrogen 3.041 N/A SER 90.A N MET 87.A O no hydrogen 2.963 N/A SER 90.A OG.A MET 87.A O no hydrogen 3.183 N/A GLY 91.A N ALA 88.A O no hydrogen 3.023 N/A ILE 94.A N TYR 92.A O no hydrogen 2.895 N/A ALA 95.A N THR 41.A O no hydrogen 2.941 N/A LEU 96.A N ILE 80.A O no hydrogen 2.812 N/A LEU 97.A N ILE 39.A O no hydrogen 2.860 N/A LYS 98.A N GLU 78.A O no hydrogen 2.908 N/A LEU 99.A N GLN 37.A O no hydrogen 2.839 N/A GLU 100.A N GLY 75.A O no hydrogen 2.874 N/A VAL 103.A N ASN 36.A O no hydrogen 2.743 N/A ALA 106.A N GLN 109.A O no hydrogen 2.869 N/A GLN 109.A N ALA 106.A O no hydrogen 3.079 N/A GLN 109.A NE2 ASN 104.A O no hydrogen 3.050 N/A ARG 110.A N PRO 13.A O no hydrogen 3.185 N/A ARG 110.A NH1.A PRO 111.A O no hydrogen 2.771 N/A ILE 112.A N ILE 33.A O no hydrogen 3.006 N/A LYS 117.A NZ ASP 226.A OD1 no hydrogen 3.386 N/A LYS 117.A NZ ASP 226.A OD2 no hydrogen 2.859 N/A GLY 118.A N SER 116.A OG no hydrogen 3.070 N/A ASP 119.A N SER 116.A O no hydrogen 2.965 N/A ARG 120.A N LYS 117.A O no hydrogen 3.281 N/A TRP 125.A N SER 190B.A O no hydrogen 2.825 N/A TRP 125.A NE1 ASP 123.A OD1 no hydrogen 2.863 N/A VAL 126.A N ALA 145.A O no hydrogen 2.889 N/A THR 127.A OG1 GLN 15.A OE1 no hydrogen 2.731 N/A GLY 128.A N GLN 143.A O no hydrogen 3.016 N/A TRP 129.A NE1 LEU 62.A O no hydrogen 2.965 N/A GLY 130.A N ASP 184.A OD1 no hydrogen 2.746 N/A TYR 131.A N LYS 182.A O no hydrogen 2.810 N/A ARG 132.A N ASP 136.A OD2 no hydrogen 2.824 N/A ARG 132.A NE ASP 136.A OD2 no hydrogen 3.357 N/A GLN 139.A N TRP 129.A O no hydrogen 2.844 N/A GLN 139.A NE2 LYS 137.A O no hydrogen 2.902 N/A THR 141.A OG1 ASN 63.A OD1 no hydrogen 2.725 N/A LEU 142.A N LEU 62.A O no hydrogen 2.952 N/A GLN 143.A N GLY 128.A O no hydrogen 2.929 N/A GLN 143.A NE2 THR 141.A O no hydrogen 3.124 N/A LYS 144.A N THR 5.A O no hydrogen 2.855 N/A LYS 144.A NZ GLU 11.A OE1 no hydrogen 3.567 N/A LYS 144.A NZ GLU 11.A OE2 no hydrogen 2.786 N/A ALA 145.A N VAL 126.A O no hydrogen 2.974 N/A ILE 147.A N CYS 124.A O no hydrogen 3.014 N/A VAL 150.A N CYS 170.A O no hydrogen 2.960 N/A ASN 152.A ND2 MET 168.A O no hydrogen 3.075 N/A GLU 154.A N THR 151.A OG1 no hydrogen 3.099 N/A CYS 155.A N THR 151.A O no hydrogen 2.902 N/A GLN 156.A N ASN 152.A O no hydrogen 2.897 N/A GLN 156.A NE2 GLN 156.A O no hydrogen 2.929 N/A GLN 156.A NE2 HIS 162.A O no hydrogen 2.850 N/A LYS 157.A N GLU 153.A O no hydrogen 3.294 N/A LYS 157.A NZ.B GLU 154.A OE1.A no hydrogen 3.468 N/A ARG 158.A N CYS 155.A O no hydrogen 2.940 N/A ARG 158.A NE GLU 154.A OE2.A no hydrogen 2.811 N/A ARG 158.A NE GLU 154.A OE2.B no hydrogen 3.475 N/A ARG 158.A NH2 GLU 154.A OE2.A no hydrogen 2.787 N/A ARG 158.A NH2 GLU 154.A OE2.B no hydrogen 3.275 N/A TYR 159.A N GLN 156.A O no hydrogen 3.180 N/A TYR 159.A OH PRO 215.A O no hydrogen 2.712 N/A ARG 160.A NE.A LYS 157.A O no hydrogen 3.540 N/A HIS 162.A N TYR 159.A O no hydrogen 3.005 N/A HIS 162.A NE2 GLU 89.A OE1 no hydrogen 2.756 N/A ILE 164.A N GLN 156.A OE1 no hydrogen 2.888 N/A LYS 167.A N THR 165.A OG1 no hydrogen 3.020 N/A LYS 167.A NZ GLU 223.A OE1 no hydrogen 2.782 N/A MET 168.A N THR 165.A O no hydrogen 3.006 N/A ILE 169.A N TYR 218.A O no hydrogen 2.855 N/A ALA 171.A N GLY 216.A O no hydrogen 2.988 N/A GLY 172.A N PRO 148.A O no hydrogen 2.957 N/A GLU 175.A N GLU 175.A OE1 no hydrogen 2.811 N/A GLY 176.A N TYR 173A.A O no hydrogen 2.864 N/A GLY 177.A N ALA 210.A O no hydrogen 2.855 N/A ASP 179.A N VAL 2.A O no hydrogen 3.214 N/A ALA 180.A N ASP 179.A OD1 no hydrogen 2.814 N/A CYS 181.A N ASP 184.A OD2 no hydrogen 2.881 N/A ASP 184.A N CYS 181.A O no hydrogen 2.899 N/A SER 185.A OG HIS 44.A NE2 no hydrogen 2.632 N/A GLY 186.A N THR 203.A O no hydrogen 2.936 N/A GLY 187.A N ASP 184.A O no hydrogen 2.989 N/A CYS 191.A N HIS 198.A O no hydrogen 2.991 N/A LYS 192.A N ASP 123.A O no hydrogen 2.960 N/A HIS 198.A N CYS 191.A O no hydrogen 2.800 N/A HIS 198.A ND1.B LEU 114.A O no hydrogen 3.124 N/A LEU 199.A N SER 113.A O no hydrogen 2.907 N/A VAL 200.A N LEU 189A.A O no hydrogen 3.014 N/A GLY 201.A N LEU 189A.A O no hydrogen 3.157 N/A ILE 202.A N THR 219.A O no hydrogen 3.204 N/A THR 203.A N GLY 187.A O no hydrogen 2.908 N/A THR 203.A OG1 GLY 187.A O no hydrogen 3.505 N/A SER 204.A N VAL 217.A O no hydrogen 3.151 N/A SER 204.A OG ASP 93.A OD2 no hydrogen 2.652 N/A TRP 205.A N VAL 217.A O no hydrogen 3.068 N/A GLU 207.A N TYR 159.A OH no hydrogen 3.086 N/A ALA 210.A N ASP 179.A OD2 no hydrogen 2.797 N/A GLN 211.A NE2 GLU 207.A O no hydrogen 2.999 N/A GLU 213.A N ARG 174.A O no hydrogen 2.892 N/A ARG 214.A N GLN 211.A O no hydrogen 3.320 N/A GLY 216.A N ALA 171.A O no hydrogen 2.873 N/A VAL 217.A N TRP 205.A O no hydrogen 2.822 N/A TYR 218.A N ILE 169.A O no hydrogen 2.763 N/A THR 219.A N ILE 202.A O no hydrogen 2.901 N/A THR 219.A OG1 ASP 93.A O no hydrogen 2.736 N/A ASN 220.A N LYS 167.A O no hydrogen 2.925 N/A ASN 220.A ND2 HIS 166.A O no hydrogen 2.934 N/A VAL 221.A N VAL 200.A O no hydrogen 3.083 N/A GLU 223.A N ASN 220.A O no hydrogen 3.026 N/A TYR 224.A N VAL 221.A O no hydrogen 2.812 N/A VAL 225.A N VAL 222.A O no hydrogen 3.521 N/A ILE 228.A N TYR 224.A O no hydrogen 2.831 N/A LEU 229.A N VAL 225.A O no hydrogen 3.050 N/A GLU 230.A N ASP 226.A O no hydrogen 2.962 N/A LYS 231.A N TRP 227.A O no hydrogen 2.878 N/A THR 232.A N ILE 228.A O no hydrogen 2.985 N/A THR 232.A OG1 ILE 228.A O no hydrogen 2.756 N/A THR 232.A OG1 LEU 229.A O no hydrogen 3.530 N/A GLN 233.A NE2 LEU 229.A O no hydrogen 2.941 N/A TYR 47A.A N HIS 44.A O no hydrogen 3.407 N/A TYR 173A.A OH LYS 146.A O no hydrogen 2.636 N/A LEU 189A.A N GLY 201.A O no hydrogen 2.890 N/A HIS 193A.A N VAL 196D.A O no hydrogen 2.920 N/A SER 190B.A N TRP 125.A O no hydrogen 2.890 N/A VAL 49C.A N PHE 46.A O no hydrogen 2.923 N/A ARG 26D.A N THR 20.A O no hydrogen 3.010 N/A VAL 196D.A N HIS 193A.A O no hydrogen 3.065 N/A