Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7b3s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N.A GLU 148.A OE2 no hydrogen 2.904 N/A MET 1.A N.B GLU 148.A OE2 no hydrogen 2.883 N/A GLY 2.A N SER 30.A O no hydrogen 3.346 N/A SER 3.A N LYS 31.A O no hydrogen 3.047 N/A THR 5.A N CYS 33.A O no hydrogen 2.853 N/A ASN 7.A N THR 35.A O no hydrogen 2.701 N/A SER 9.A N ASN 7.A OD1 no hydrogen 3.059 N/A SER 9.A OG ASN 7.A OD1 no hydrogen 2.863 N/A TRP 10.A NE1 GLU 241.A OE2 no hydrogen 3.021 N/A ASN 11.A N THR 8.A O no hydrogen 3.133 N/A GLU 13.A N TRP 10.A O no hydrogen 2.841 N/A PHE 14.A N ASN 11.A O no hydrogen 2.902 N/A SER 15.A N ASN 11.A O no hydrogen 2.928 N/A SER 15.A OG ASN 11.A O no hydrogen 3.223 N/A SER 15.A OG LYS 12.A O no hydrogen 3.334 N/A ALA 16.A N LYS 12.A O no hydrogen 3.125 N/A GLU 17.A N PHE 14.A O no hydrogen 3.048 N/A ALA 18.A N SER 15.A O no hydrogen 3.059 N/A VAL 19.A N PHE 14.A O no hydrogen 3.045 N/A VAL 22.A N ASN 218.A O no hydrogen 2.856 N/A PHE 23.A N ASN 36.A OD1 no hydrogen 2.801 N/A VAL 24.A N ALA 216.A O no hydrogen 2.819 N/A LEU 25.A N ALA 34.A O no hydrogen 2.932 N/A CYS 26.A N PHE 214.A O no hydrogen 2.892 N/A SER 28.A N VAL 212.A O no hydrogen 2.749 N/A SER 28.A OG GLU 211.A OE1 no hydrogen 2.763 N/A SER 28.A OG GLU 211.A OE2 no hydrogen 3.224 N/A SER 30.A N GLU 151.A OE1 no hydrogen 3.360 N/A SER 30.A N GLU 151.A OE2 no hydrogen 2.892 N/A SER 30.A OG GLU 151.A OE1 no hydrogen 2.683 N/A LYS 31.A N SER 29.A OG no hydrogen 3.190 N/A CYS 33.A N SER 3.A O no hydrogen 3.226 N/A CYS 33.A SG SER 30.A O no hydrogen 3.824 N/A ALA 34.A N LEU 25.A O no hydrogen 2.859 N/A THR 35.A N THR 5.A O no hydrogen 2.839 N/A THR 35.A OG1 PHE 23.A O no hydrogen 2.860 N/A THR 35.A OG1 ASP 37.A O no hydrogen 3.479 N/A ASN 36.A ND2 GLY 21.A O no hydrogen 3.255 N/A ASP 37.A N THR 35.A OG1 no hydrogen 3.229 N/A ARG 40.A N ASP 37.A OD1 no hydrogen 2.879 N/A ARG 40.A NE ASN 218.A OD1 no hydrogen 2.903 N/A ARG 40.A NH1 ASN 218.A OD1 no hydrogen 2.966 N/A ARG 40.A NH1 ASP 220.A OD1 no hydrogen 2.947 N/A ARG 40.A NH2 ASP 220.A OD1 no hydrogen 2.976 N/A ARG 40.A NH2 ASP 220.A OD2 no hydrogen 3.478 N/A ALA 41.A N ASP 37.A O no hydrogen 2.959 N/A SER 42.A N ALA 39.A O no hydrogen 3.338 N/A LYS 43.A N ARG 40.A O no hydrogen 3.056 N/A TYR 45.A N ILE 141.A O no hydrogen 2.948 N/A ALA 48.A N TRP 134.A O no hydrogen 3.112 N/A THR 49.A OG1 PRO 47.A O no hydrogen 2.821 N/A PHE 50.A N ALA 48.A O no hydrogen 2.894 N/A ASN 53.A N PHE 50.A O no hydrogen 2.952 N/A ASN 53.A ND2 PHE 100.A O no hydrogen 3.303 N/A ILE 55.A N ILE 51.A O no hydrogen 3.222 N/A ILE 56.A N PRO 52.A O no hydrogen 2.899 N/A GLY 57.A N ASN 53.A O no hydrogen 2.854 N/A LEU 58.A N ALA 54.A O no hydrogen 2.997 N/A GLU 59.A N ILE 55.A O no hydrogen 2.809 N/A THR 60.A N ILE 56.A O no hydrogen 2.978 N/A THR 60.A OG1 ILE 56.A O no hydrogen 2.736 N/A THR 60.A OG1 GLY 57.A O no hydrogen 3.137 N/A GLY 61.A N LEU 58.A O no hydrogen 3.070 N/A ILE 63.A N GLY 57.A O no hydrogen 2.911 N/A LYS 64.A N GLN 68.A OE1 no hydrogen 2.752 N/A GLU 66.A N GLU 66.A OE1 no hydrogen 2.368 N/A HIS 67.A N ASN 65.A OD1 no hydrogen 2.913 N/A GLN 68.A N ASN 65.A O no hydrogen 3.146 N/A PHE 70.A N LEU 86.A O no hydrogen 2.665 N/A TRP 72.A N ASP 85.A OD1 no hydrogen 2.865 N/A TRP 72.A NE1 LYS 75.A O.A no hydrogen 2.720 N/A TRP 72.A NE1 LYS 75.A O.B no hydrogen 2.785 N/A LYS 75.A N.A ASP 73.A OD1 no hydrogen 2.854 N/A LYS 75.A N.B ASP 73.A OD1 no hydrogen 2.873 N/A ARG 77.A N GLU 83.A OE2 no hydrogen 2.939 N/A ARG 77.A NH1 TRP 82.A O no hydrogen 2.923 N/A TRP 82.A N MET 79.A O no hydrogen 2.981 N/A TRP 82.A NE1 VAL 94.A O no hydrogen 3.001 N/A GLU 83.A N LYS 80.A O no hydrogen 3.038 N/A ARG 84.A N TRP 82.A O no hydrogen 2.903 N/A LEU 86.A N PHE 70.A O no hydrogen 2.988 N/A ARG 89.A NH1 VAL 173.A O no hydrogen 3.098 N/A ARG 89.A NH2 GLU 170.A O no hydrogen 3.431 N/A ARG 89.A NH2 VAL 173.A O no hydrogen 2.752 N/A GLY 90.A N THR 87.A OG1 no hydrogen 2.985 N/A ALA 91.A N THR 87.A O no hydrogen 2.826 N/A ILE 92.A N LEU 88.A O no hydrogen 2.995 N/A GLN 93.A N ARG 89.A O no hydrogen 2.795 N/A GLN 93.A NE2 ALA 171.A O no hydrogen 3.047 N/A GLN 93.A NE2 VAL 173.A O no hydrogen 3.640 N/A VAL 94.A N GLY 90.A O no hydrogen 3.082 N/A SER 95.A N.A ILE 92.A O no hydrogen 3.002 N/A SER 95.A N.B ILE 92.A O no hydrogen 3.008 N/A ALA 96.A N ALA 91.A O no hydrogen 2.847 N/A VAL 99.A N ALA 96.A O no hydrogen 3.012 N/A PHE 100.A N ALA 96.A O no hydrogen 3.471 N/A GLN 101.A N VAL 97.A O no hydrogen 2.817 N/A GLN 101.A NE2 ASP 131.A O no hydrogen 3.070 N/A GLN 102.A N PRO 98.A O no hydrogen 3.183 N/A GLN 102.A NE2 GLU 106.A OE2 no hydrogen 3.100 N/A ILE 103.A N VAL 99.A O no hydrogen 3.132 N/A ALA 104.A N PHE 100.A O no hydrogen 2.920 N/A ARG 105.A N GLN 101.A O no hydrogen 2.954 N/A ARG 105.A NE ASP 131.A OD2 no hydrogen 3.162 N/A ARG 105.A NH1 GLN 102.A OE1 no hydrogen 2.857 N/A ARG 105.A NH2 ASP 131.A OD2 no hydrogen 2.825 N/A GLU 106.A N GLN 102.A O no hydrogen 3.096 N/A VAL 107.A N ILE 103.A O no hydrogen 2.924 N/A GLY 108.A N ALA 104.A O no hydrogen 2.992 N/A ARG 111.A NE VAL 107.A O no hydrogen 2.972 N/A ARG 111.A NH2 GLU 106.A O no hydrogen 2.860 N/A ARG 111.A NH2 VAL 107.A O no hydrogen 3.376 N/A MET 112.A N GLY 108.A O no hydrogen 2.926 N/A GLN 113.A N GLU 109.A O no hydrogen 2.898 N/A GLN 113.A NE2 GLN 113.A O no hydrogen 3.415 N/A GLN 113.A NE2 GLN 124.A O no hydrogen 2.916 N/A LYS 114.A N VAL 110.A O no hydrogen 3.081 N/A TYR 115.A N ARG 111.A O no hydrogen 3.097 N/A LEU 116.A N MET 112.A O no hydrogen 3.095 N/A LYS 117.A N GLN 113.A O no hydrogen 3.118 N/A LYS 118.A N LYS 114.A O no hydrogen 2.994 N/A PHE 119.A N TYR 115.A O no hydrogen 2.827 N/A SER 120.A N LYS 117.A O no hydrogen 3.114 N/A TYR 121.A N LEU 116.A O no hydrogen 3.000 N/A GLY 122.A N ASN 145.A OD1 no hydrogen 2.800 N/A ASN 123.A N ARG 140.A O no hydrogen 2.879 N/A ASN 123.A ND2 GLN 138.A O no hydrogen 2.970 N/A GLN 124.A N TYR 121.A O no hydrogen 3.192 N/A ASN 125.A N ASN 123.A OD1 no hydrogen 3.070 N/A ASN 125.A ND2 GLN 138.A OE1 no hydrogen 3.077 N/A SER 127.A N ASN 125.A OD1 no hydrogen 2.990 N/A SER 127.A OG.A ASN 125.A OD1 no hydrogen 2.749 N/A SER 127.A OG.B ASN 125.A OD1 no hydrogen 2.749 N/A LYS 132.A N GLY 129.A O no hydrogen 3.149 N/A LEU 135.A N LYS 132.A O no hydrogen 2.968 N/A GLU 136.A N LYS 132.A O no hydrogen 2.918 N/A GLY 137.A N PHE 133.A O no hydrogen 3.212 N/A ARG 140.A N ASN 123.A OD1 no hydrogen 3.036 N/A ARG 140.A NH1 GLY 137.A O no hydrogen 3.537 N/A ARG 140.A NH2 GLY 137.A O no hydrogen 2.867 N/A ARG 140.A NH2 LEU 139.A O no hydrogen 2.875 N/A ILE 141.A N TYR 45.A O no hydrogen 2.796 N/A VAL 144.A N ALA 41.A O no hydrogen 3.097 N/A ASN 145.A N SER 142.A OG no hydrogen 3.055 N/A ASN 145.A ND2 SER 120.A O no hydrogen 3.089 N/A ASN 145.A ND2 ASN 145.A O no hydrogen 2.788 N/A GLN 146.A N SER 142.A O no hydrogen 2.951 N/A GLN 146.A NE2 THR 49.A OG1 no hydrogen 2.976 N/A VAL 147.A N.A ALA 143.A O no hydrogen 3.121 N/A VAL 147.A N.B ALA 143.A O no hydrogen 3.112 N/A GLU 148.A N VAL 144.A O no hydrogen 3.121 N/A PHE 149.A N ASN 145.A O no hydrogen 2.967 N/A LEU 150.A N GLN 146.A O no hydrogen 2.884 N/A GLU 151.A N VAL 147.A O.A no hydrogen 2.836 N/A GLU 151.A N VAL 147.A O.B no hydrogen 2.815 N/A SER 152.A N GLU 148.A O no hydrogen 3.034 N/A SER 152.A OG GLU 148.A O no hydrogen 3.214 N/A LEU 153.A N PHE 149.A O no hydrogen 2.935 N/A TYR 154.A N LEU 150.A O no hydrogen 2.778 N/A LEU 155.A N GLU 151.A O no hydrogen 2.934 N/A ASN 156.A N LEU 153.A O no hydrogen 3.096 N/A LYS 157.A N SER 152.A O no hydrogen 2.833 N/A LEU 158.A N GLN 165.A OE1 no hydrogen 3.058 N/A ALA 160.A N LEU 158.A O no hydrogen 2.847 N/A SER 161.A N GLU 59.A OE1 no hydrogen 2.852 N/A SER 161.A OG GLU 59.A OE1 no hydrogen 3.382 N/A ASN 164.A N SER 161.A OG no hydrogen 2.972 N/A ASN 164.A ND2 GLU 59.A OE1 no hydrogen 2.675 N/A GLN 165.A N SER 161.A O no hydrogen 3.109 N/A GLN 165.A NE2 LEU 158.A O no hydrogen 3.434 N/A GLN 165.A NE2 ALA 160.A O no hydrogen 3.036 N/A GLN 165.A NE2 SER 161.A O no hydrogen 3.376 N/A LEU 166.A N LYS 162.A O no hydrogen 2.829 N/A ILE 167.A N GLU 163.A O no hydrogen 2.967 N/A VAL 168.A N ASN 164.A O no hydrogen 3.164 N/A LYS 169.A N GLN 165.A O no hydrogen 2.919 N/A LYS 169.A NZ LEU 153.A O no hydrogen 3.084 N/A LYS 169.A NZ TYR 154.A O no hydrogen 3.047 N/A LYS 169.A NZ ASN 156.A OD1 no hydrogen 2.682 N/A GLU 170.A N LEU 166.A O no hydrogen 2.980 N/A ALA 171.A N ILE 167.A O no hydrogen 3.265 N/A LEU 172.A N LYS 169.A O no hydrogen 2.962 N/A VAL 173.A N GLU 170.A O no hydrogen 3.491 N/A THR 174.A N VAL 182.A O no hydrogen 2.868 N/A THR 174.A OG1 VAL 182.A O no hydrogen 3.564 N/A THR 174.A OG1 SER 184.A OG no hydrogen 2.691 N/A GLU 175.A N VAL 182.A O no hydrogen 3.319 N/A ALA 177.A N TYR 180.A O no hydrogen 2.830 N/A TYR 180.A N ALA 177.A O no hydrogen 3.256 N/A TYR 180.A OH GLU 175.A OE2 no hydrogen 2.989 N/A LEU 181.A N GLU 207.A O no hydrogen 2.972 N/A VAL 182.A N GLU 175.A O no hydrogen 2.783 N/A HIS 183.A N TRP 205.A O no hydrogen 3.025 N/A SER 184.A N LEU 172.A O no hydrogen 2.939 N/A SER 184.A OG THR 174.A OG1 no hydrogen 2.691 N/A LYS 185.A N VAL 203.A O no hydrogen 2.857 N/A LYS 185.A NZ SER 95.A OG.A no hydrogen 2.489 N/A LYS 185.A NZ SER 95.A OG.B no hydrogen 3.053 N/A LYS 185.A NZ THR 186.A O no hydrogen 2.811 N/A GLY 187.A N TRP 201.A O no hydrogen 3.105 N/A SER 189.A N VAL 199.A O no hydrogen 2.838 N/A SER 189.A OG VAL 199.A O no hydrogen 3.455 N/A THR 193.A N.A ASN 196.A O no hydrogen 2.955 N/A THR 193.A N.B ASN 196.A O no hydrogen 3.204 N/A ASN 196.A N THR 193.A O.A no hydrogen 2.811 N/A ASN 196.A N THR 193.A O.B no hydrogen 3.343 N/A GLY 198.A N ILE 221.A O no hydrogen 2.852 N/A VAL 199.A N SER 189.A OG no hydrogen 2.898 N/A ALA 200.A N MET 219.A O no hydrogen 2.968 N/A TRP 201.A N GLY 187.A O no hydrogen 2.793 N/A TRP 201.A NE1 LEU 46.A O no hydrogen 2.770 N/A TRP 202.A N PHE 217.A O no hydrogen 2.937 N/A TRP 202.A NE1 SER 184.A OG no hydrogen 3.096 N/A VAL 203.A N LYS 185.A O no hydrogen 3.026 N/A GLY 204.A N PHE 215.A O no hydrogen 2.947 N/A TRP 205.A N HIS 183.A O no hydrogen 2.912 N/A TRP 205.A NE1 GLU 207.A OE2 no hydrogen 3.076 N/A VAL 206.A N TYR 213.A O no hydrogen 2.784 N/A GLU 207.A N LEU 181.A O no hydrogen 2.934 N/A LYS 208.A N GLU 211.A O no hydrogen 2.936 N/A LYS 208.A NZ GLY 242.A O no hydrogen 2.481 N/A LYS 208.A NZ ILE 243.A O no hydrogen 3.548 N/A GLU 211.A N LYS 208.A O no hydrogen 2.628 N/A VAL 212.A N GLU 211.A OE1 no hydrogen 2.997 N/A TYR 213.A N VAL 206.A O no hydrogen 2.825 N/A PHE 214.A N CYS 26.A O no hydrogen 2.844 N/A PHE 215.A N GLY 204.A O no hydrogen 2.853 N/A ALA 216.A N VAL 24.A O no hydrogen 2.954 N/A PHE 217.A N TRP 202.A O no hydrogen 2.853 N/A ASN 218.A N VAL 22.A O no hydrogen 3.065 N/A MET 219.A N ALA 200.A O no hydrogen 2.976 N/A ASP 220.A N ASN 20.A O no hydrogen 2.910 N/A ILE 221.A N GLY 198.A O no hydrogen 2.991 N/A SER 225.A N.A ASN 223.A OD1 no hydrogen 2.972 N/A SER 225.A N.B ASN 223.A OD1 no hydrogen 2.986 N/A SER 225.A OG.A ASN 223.A OD1 no hydrogen 3.085 N/A SER 225.A OG.B ASN 223.A OD1 no hydrogen 3.246 N/A LYS 226.A N ASN 223.A O no hydrogen 2.945 N/A LEU 227.A N GLU 224.A O no hydrogen 3.004 N/A LEU 229.A N LYS 226.A O no hydrogen 3.070 N/A ARG 230.A N LEU 227.A O no hydrogen 2.961 N/A ARG 230.A NH2 GLY 187.A O no hydrogen 3.041 N/A LYS 231.A N PRO 228.A O no hydrogen 3.139 N/A SER 232.A N PRO 228.A O no hydrogen 2.994 N/A ILE 233.A N LEU 229.A O no hydrogen 3.066 N/A THR 235.A N LYS 231.A O no hydrogen 2.928 N/A THR 235.A OG1 LYS 231.A O no hydrogen 2.712 N/A LYS 236.A N.A SER 232.A O no hydrogen 2.971 N/A LYS 236.A N.B SER 232.A O no hydrogen 2.969 N/A ILE 237.A N ILE 233.A O no hydrogen 3.090 N/A MET 238.A N PRO 234.A O no hydrogen 2.862 N/A GLU 239.A N THR 235.A O no hydrogen 2.769 N/A SER 240.A N LYS 236.A O.A no hydrogen 2.978 N/A SER 240.A N LYS 236.A O.B no hydrogen 2.928 N/A SER 240.A OG ILE 237.A O no hydrogen 2.973 N/A GLU 241.A N ILE 237.A O no hydrogen 2.894 N/A GLY 242.A N GLU 239.A O no hydrogen 3.043 N/A ILE 243.A N MET 238.A O no hydrogen 2.917 N/A