Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4v2k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N VAL 128.A O no hydrogen 2.862 N/A LEU 12.A N ALA 9.A O no hydrogen 2.818 N/A LEU 13.A N ALA 10.A O no hydrogen 3.195 N/A GLY 19.A N ASP 15.A O no hydrogen 3.098 N/A GLU 20.A N GLY 16.A O no hydrogen 3.128 N/A SER 21.A N ALA 17.A O no hydrogen 2.978 N/A SER 21.A OG ASP 111.A OD1 no hydrogen 2.620 N/A ILE 22.A N LEU 18.A O no hydrogen 2.904 N/A VAL 23.A N GLY 19.A O no hydrogen 3.123 N/A ARG 24.A N GLU 20.A O no hydrogen 3.038 N/A ARG 24.A NE ASP 111.A OD2 no hydrogen 2.752 N/A ARG 24.A NH2 ASP 111.A OD1 no hydrogen 3.071 N/A GLY 25.A N SER 21.A O no hydrogen 2.805 N/A ARG 26.A N ILE 22.A O no hydrogen 2.967 N/A ARG 26.A NE GLU 56.A OE1 no hydrogen 2.963 N/A ARG 26.A NH2 GLU 56.A OE1 no hydrogen 3.491 N/A ARG 26.A NH2 GLU 56.A OE2 no hydrogen 3.129 N/A ARG 27.A N VAL 23.A O no hydrogen 3.275 N/A TYR 28.A N ARG 24.A O no hydrogen 2.904 N/A LEU 29.A N GLY 25.A O no hydrogen 3.044 N/A SER 30.A N.A ARG 26.A O no hydrogen 2.934 N/A SER 30.A N.A ARG 27.A O no hydrogen 3.258 N/A SER 30.A N.B ARG 26.A O no hydrogen 2.889 N/A SER 30.A OG.B ARG 26.A O no hydrogen 3.081 N/A SER 30.A OG.B ARG 27.A O no hydrogen 3.429 N/A ASP 31.A N ARG 27.A O no hydrogen 2.935 N/A THR 32.A OG1 TYR 28.A O no hydrogen 2.739 N/A GLN 35.A N ASP 31.A O no hydrogen 3.037 N/A GLN 35.A NE2 ASP 31.A OD2 no hydrogen 2.891 N/A LEU 36.A N THR 32.A O no hydrogen 2.876 N/A PHE 39.A N LEU 36.A O no hydrogen 2.916 N/A GLY 41.A N LEU 97.A O no hydrogen 2.834 N/A ASN 42.A ND2 SER 96.A O no hydrogen 2.895 N/A ASN 42.A ND2 SER 184.A O no hydrogen 2.887 N/A GLY 43.A N ARG 183.A O no hydrogen 2.951 N/A LEU 44.A N ASN 42.A OD1 no hydrogen 3.001 N/A ALA 45.A N HIS 48.A ND1 no hydrogen 2.973 N/A CYS 46.A N THR 32.A OG1 no hydrogen 3.174 N/A CYS 46.A SG THR 32.A OG1 no hydrogen 3.566 N/A ARG 47.A N LEU 29.A O no hydrogen 3.192 N/A ARG 47.A NE SER 30.A O.A no hydrogen 3.043 N/A ARG 47.A NE SER 30.A O.B no hydrogen 3.087 N/A ARG 47.A NH2 TYR 174.A O no hydrogen 3.123 N/A HIS 48.A N ALA 45.A O no hydrogen 2.936 N/A HIS 48.A NE2 TYR 174.A O no hydrogen 3.041 N/A CYS 49.A N CYS 46.A O no hydrogen 3.250 N/A HIS 50.A N CYS 46.A O no hydrogen 3.022 N/A HIS 50.A ND1 ALA 64.A O no hydrogen 2.771 N/A GLU 56.A N ARG 53.A O no hydrogen 2.990 N/A VAL 57.A N TYR 115.A OH no hydrogen 2.935 N/A GLY 58.A N HIS 50.A O no hydrogen 2.850 N/A THR 59.A N PRO 51.A O no hydrogen 3.211 N/A ASN 62.A N GLY 131.A O no hydrogen 2.825 N/A ALA 63.A N GLU 60.A O no hydrogen 3.086 N/A ALA 64.A N GLY 133.A O no hydrogen 2.890 N/A PHE 66.A N GLY 58.A O no hydrogen 2.772 N/A GLY 68.A N SER 120.A OG no hydrogen 2.879 N/A VAL 69.A N PHE 66.A O no hydrogen 2.988 N/A GLY 71.A N GLY 68.A O no hydrogen 3.266 N/A ARG 72.A N VAL 69.A O no hydrogen 3.012 N/A ARG 72.A NH1 GLY 126.A O no hydrogen 3.035 N/A GLN 75.A N ILE 84.A O no hydrogen 3.085 N/A SER 77.A N ARG 82.A O no hydrogen 3.015 N/A HIS 80.A N SER 77.A OG no hydrogen 3.183 N/A HIS 80.A NE2 ASP 92.A OD2 no hydrogen 2.728 N/A GLY 81.A N SER 77.A O no hydrogen 2.787 N/A ARG 82.A N SER 77.A O no hydrogen 3.316 N/A ILE 84.A N GLN 75.A O no hydrogen 2.881 N/A THR 85.A N GLN 88.A OE1 no hydrogen 2.899 N/A THR 85.A OG1 GLU 87.A OE1 no hydrogen 3.479 N/A THR 85.A OG1 GLN 88.A OE1 no hydrogen 3.366 N/A GLU 87.A N GLU 87.A OE1 no hydrogen 2.799 N/A GLN 88.A N THR 85.A OG1 no hydrogen 3.208 N/A ARG 89.A N THR 85.A O no hydrogen 3.012 N/A ARG 89.A NH1.A ARG 89.A O no hydrogen 3.276 N/A ILE 90.A N LEU 86.A O no hydrogen 2.943 N/A GLY 91.A N GLU 87.A O no hydrogen 3.076 N/A ASP 92.A N GLN 88.A O no hydrogen 3.017 N/A GLU 94.A N GLY 91.A O no hydrogen 3.025 N/A ARG 95.A N ASP 92.A O no hydrogen 2.963 N/A ARG 95.A NH1 GLY 188.A O no hydrogen 2.895 N/A ASN 98.A N ARG 95.A O no hydrogen 3.196 N/A ASN 98.A ND2 GLY 41.A O no hydrogen 3.247 N/A GLY 99.A N PHE 93.A O no hydrogen 2.783 N/A ARG 100.A N PHE 39.A O no hydrogen 2.965 N/A ARG 100.A NH1 ASP 38.A O no hydrogen 3.015 N/A HIS 106.A N ALA 103.A O no hydrogen 2.959 N/A ALA 108.A N HIS 106.A ND1 no hydrogen 3.040 N/A ILE 110.A N HIS 106.A O no hydrogen 3.023 N/A ASP 111.A N PRO 107.A O no hydrogen 2.883 N/A MET 112.A N ALA 108.A O no hydrogen 2.983 N/A LEU 113.A N LEU 109.A O no hydrogen 2.910 N/A ALA 114.A N ILE 110.A O no hydrogen 2.835 N/A TYR 115.A N ASP 111.A O no hydrogen 3.025 N/A TYR 115.A OH GLU 56.A OE1 no hydrogen 2.679 N/A TYR 115.A OH VAL 57.A O no hydrogen 3.371 N/A MET 116.A N MET 112.A O no hydrogen 2.940 N/A SER 117.A N LEU 113.A O no hydrogen 2.889 N/A SER 117.A OG LEU 113.A O no hydrogen 2.921 N/A TRP 118.A N ALA 114.A O no hydrogen 2.924 N/A LEU 119.A N TYR 115.A O no hydrogen 2.971 N/A SER 120.A N MET 116.A O no hydrogen 3.031 N/A SER 120.A N SER 117.A O no hydrogen 3.120 N/A SER 120.A OG PHE 66.A O no hydrogen 3.402 N/A SER 120.A OG MET 116.A O no hydrogen 2.793 N/A GLN 121.A N TRP 118.A O no hydrogen 3.182 N/A VAL 123.A N SER 120.A O no hydrogen 2.932 N/A GLY 126.A N GLY 71.A O no hydrogen 3.013 N/A ALA 127.A N PRO 124.A O no hydrogen 2.922 N/A VAL 128.A N PRO 1.A O no hydrogen 2.743 N/A ALA 130.A N VAL 3.A O no hydrogen 2.861 N/A HIS 132.A N VAL 129.A O no hydrogen 2.950 N/A LEU 137.A N ALA 195.A O no hydrogen 3.065 N/A ARG 141.A NH1 GLU 142.A O no hydrogen 3.442 N/A ARG 141.A NH1 ASP 220.A OD1 no hydrogen 2.833 N/A ARG 141.A NH2 ASP 220.A OD1 no hydrogen 3.403 N/A ARG 141.A NH2 ASP 220.A OD2 no hydrogen 3.084 N/A ASP 144.A N ASP 220.A OD1 no hydrogen 2.842 N/A VAL 146.A N ASP 144.A OD1 no hydrogen 3.029 N/A HIS 147.A N ASP 144.A OD1 no hydrogen 3.156 N/A HIS 147.A ND1 ASP 220.A OD2 no hydrogen 2.632 N/A GLY 148.A N ASP 144.A O no hydrogen 2.934 N/A GLU 149.A N GLY 145.A O no hydrogen 2.818 N/A ALA 150.A N VAL 146.A O no hydrogen 3.223 N/A LEU 151.A N HIS 147.A O no hydrogen 2.960 N/A TYR 152.A N GLY 148.A O no hydrogen 2.837 N/A TYR 152.A OH GLY 161.A O no hydrogen 2.754 N/A GLN 153.A N GLU 149.A O no hydrogen 3.021 N/A ALA 154.A N ALA 150.A O no hydrogen 3.118 N/A ARG 155.A N LEU 151.A O no hydrogen 2.842 N/A CYS 156.A N TYR 152.A O no hydrogen 2.923 N/A LEU 157.A N TYR 152.A O no hydrogen 2.913 N/A CYS 159.A N CYS 156.A O no hydrogen 3.101 N/A HIS 160.A N CYS 156.A O no hydrogen 2.985 N/A HIS 160.A ND1 PRO 177.A O no hydrogen 2.750 N/A GLY 161.A N LEU 157.A O no hydrogen 2.810 N/A GLY 164.A N GLY 161.A O no hydrogen 3.024 N/A SER 165.A N ASP 163.A OD1 no hydrogen 3.082 N/A SER 165.A OG ASP 163.A OD1 no hydrogen 2.481 N/A SER 165.A OG ASP 163.A OD2 no hydrogen 3.203 N/A GLY 166.A N HIS 160.A O no hydrogen 2.828 N/A THR 167.A N PHE 176.A O no hydrogen 2.840 N/A THR 167.A OG1 CYS 159.A O no hydrogen 2.986 N/A ASP 169.A N ARG 173.A O no hydrogen 2.712 N/A ASP 171.A N ASP 169.A OD1 no hydrogen 2.856 N/A GLY 172.A N ASP 169.A O no hydrogen 3.093 N/A ARG 173.A N ASP 169.A OD1 no hydrogen 2.980 N/A ARG 173.A N ASP 171.A OD1.B no hydrogen 3.036 N/A ARG 173.A NE ASP 31.A OD1 no hydrogen 2.818 N/A ARG 173.A NH1 ASP 171.A O no hydrogen 2.913 N/A ARG 173.A NH2 ASP 31.A OD1 no hydrogen 3.539 N/A ARG 173.A NH2 ASP 31.A OD2 no hydrogen 2.963 N/A LEU 175.A N THR 167.A O no hydrogen 2.890 N/A PHE 176.A N THR 167.A O no hydrogen 3.165 N/A LEU 179.A N GLY 164.A O no hydrogen 2.814 N/A GLY 181.A N PRO 229.A O no hydrogen 2.851 N/A SER 184.A N GLY 181.A O no hydrogen 3.180 N/A SER 184.A OG PRO 178.A O no hydrogen 2.852 N/A ASN 186.A N ARG 95.A O no hydrogen 3.268 N/A ASN 186.A ND2 GLU 94.A O no hydrogen 3.008 N/A ASN 186.A ND2 ASN 98.A OD1 no hydrogen 2.941 N/A THR 187.A N PRO 231.A O no hydrogen 2.976 N/A GLY 188.A N ASN 186.A OD1 no hydrogen 2.850 N/A ALA 189.A N ASN 186.A O no hydrogen 3.088 N/A ASN 192.A N ALA 189.A O no hydrogen 2.944 N/A ASN 192.A ND2 THR 187.A O no hydrogen 3.162 N/A ARG 193.A N GLY 190.A O no hydrogen 3.022 N/A ARG 193.A NH2 THR 196.A OG1 no hydrogen 2.895 N/A GLN 194.A NE2 TRP 219.A O no hydrogen 3.021 N/A ALA 197.A N ARG 193.A O no hydrogen 2.971 N/A ALA 198.A N GLN 194.A O no hydrogen 2.901 N/A GLY 199.A N ALA 195.A O no hydrogen 3.041 N/A PHE 200.A N THR 196.A O no hydrogen 2.832 N/A ILE 201.A N ALA 197.A O no hydrogen 2.956 N/A LYS 202.A N ALA 198.A O no hydrogen 2.860 N/A LYS 202.A NZ LEU 213.A O no hydrogen 2.727 N/A LYS 202.A NZ ASP 215.A OD1 no hydrogen 2.883 N/A HIS 203.A N GLY 199.A O no hydrogen 3.043 N/A HIS 203.A ND1 GLY 199.A O no hydrogen 2.968 N/A LYS 204.A N PHE 200.A O no hydrogen 2.864 N/A LYS 204.A NZ GLU 60.A OE1 no hydrogen 2.863 N/A LYS 204.A NZ ASP 210.A OD2 no hydrogen 3.133 N/A MET 205.A N ILE 201.A O no hydrogen 2.936 N/A ALA 209.A N PRO 206.A O no hydrogen 2.895 N/A ASP 211.A N LYS 202.A O no hydrogen 3.094 N/A SER 212.A OG ALA 209.A O no hydrogen 2.750 N/A SER 214.A N GLU 217.A OE1 no hydrogen 2.964 N/A GLU 216.A N GLU 216.A OE1 no hydrogen 2.749 N/A GLU 217.A N SER 214.A OG no hydrogen 3.192 N/A ALA 218.A N SER 214.A O no hydrogen 3.048 N/A TRP 219.A N ASP 215.A O no hydrogen 3.062 N/A TRP 219.A NE1 ARG 141.A O no hydrogen 2.882 N/A ASP 220.A N GLU 216.A O no hydrogen 2.958 N/A VAL 221.A N GLU 217.A O no hydrogen 2.943 N/A ALA 222.A N ALA 218.A O no hydrogen 2.915 N/A GLY 223.A N TRP 219.A O no hydrogen 3.055 N/A PHE 224.A N ASP 220.A O no hydrogen 2.980 N/A VAL 225.A N VAL 221.A O no hydrogen 2.916 N/A LEU 226.A N ALA 222.A O no hydrogen 2.926 N/A THR 227.A N PHE 224.A O no hydrogen 3.157 N/A THR 227.A OG1 PHE 224.A O no hydrogen 2.706 N/A HIS 228.A N VAL 225.A O no hydrogen 3.468 N/A HIS 228.A ND1 VAL 225.A O no hydrogen 2.919 N/A ARG 230.A NH1 LEU 179.A O no hydrogen 3.221 N/A ARG 230.A NH1 SER 184.A OG no hydrogen 3.112 N/A ARG 230.A NH1 PHE 185.A O no hydrogen 3.051 N/A ARG 230.A NH2 LEU 179.A O no hydrogen 2.807 N/A PHE 233.A N THR 187.A OG1 no hydrogen 2.906 N/A