Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5clb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 3.A N GLU 66.A OE1 no hydrogen 3.236 N/A MET 3.A N GLU 66.A OE2 no hydrogen 3.360 N/A HIS 4.A N GLU 66.A OE1 no hydrogen 2.953 N/A HIS 4.A NE2 ASP 59.A OD1 no hydrogen 2.654 N/A PHE 6.A N HIS 4.A ND1 no hydrogen 3.140 N/A LYS 8.A N HIS 4.A O no hydrogen 2.963 N/A LYS 8.A NZ PRO 2.A O no hydrogen 2.898 N/A LYS 8.A NZ MET 3.A O no hydrogen 3.325 N/A ALA 9.A N PRO 5.A O no hydrogen 2.888 N/A LEU 10.A N PHE 6.A O no hydrogen 2.934 N/A GLN 11.A N VAL 7.A O no hydrogen 2.777 N/A GLU 12.A N LYS 8.A O no hydrogen 2.992 N/A HIS 13.A N ALA 9.A O no hydrogen 2.880 N/A HIS 13.A NE2 ASP 50.A OD1 no hydrogen 2.798 N/A PHE 14.A N LEU 10.A O no hydrogen 2.825 N/A THR 15.A N GLN 11.A O no hydrogen 3.021 N/A THR 15.A OG1 GLN 11.A O no hydrogen 2.575 N/A ALA 16.A N GLU 12.A O no hydrogen 2.914 N/A HIS 17.A N PHE 14.A O no hydrogen 2.922 N/A GLN 18.A N THR 15.A O no hydrogen 3.345 N/A ASN 19.A N LEU 37.A O no hydrogen 2.889 N/A GLU 21.A N ASN 19.A OD1 no hydrogen 3.198 N/A GLU 21.A N GLU 21.A OE1 no hydrogen 2.961 N/A LYS 22.A NZ GLN 40.A OE1 no hydrogen 3.288 N/A ALA 23.A N ASN 19.A O no hydrogen 2.955 N/A MET 26.A N LYS 22.A O no hydrogen 3.235 N/A ALA 27.A N ALA 23.A O no hydrogen 2.924 N/A ARG 28.A N GLU 24.A O no hydrogen 3.100 N/A ARG 28.A NH2 GLU 24.A OE2 no hydrogen 3.341 N/A TYR 29.A N PRO 25.A O no hydrogen 3.007 N/A MET 30.A N ALA 27.A O no hydrogen 3.076 N/A LYS 31.A N ARG 28.A O no hydrogen 2.868 N/A ASN 32.A N ALA 27.A O no hydrogen 2.788 N/A HIS 33.A N MET 30.A O no hydrogen 3.117 N/A LEU 37.A N GLU 74.A OE1 no hydrogen 2.846 N/A GLY 38.A N GLU 74.A OE2 no hydrogen 2.675 N/A ILE 39.A N GLU 74.A OE2 no hydrogen 2.928 N/A ARG 44.A N GLN 40.A O no hydrogen 2.876 N/A ARG 44.A NH1 THR 41.A OG1 no hydrogen 3.066 N/A ARG 44.A NH2 ASP 81.A OD2 no hydrogen 2.716 N/A ARG 45.A N THR 41.A O no hydrogen 2.811 N/A ARG 45.A NE ASP 81.A OD1 no hydrogen 3.362 N/A ARG 45.A NE ASP 81.A OD2 no hydrogen 3.174 N/A ARG 45.A NH1 ASP 81.A OD1 no hydrogen 3.078 N/A GLN 46.A N PRO 42.A O no hydrogen 3.147 N/A GLN 46.A NE2 ASP 50.A OD2 no hydrogen 3.155 N/A LEU 47.A N GLU 43.A O no hydrogen 2.828 N/A LEU 48.A N ARG 44.A O no hydrogen 3.042 N/A LYS 49.A N ARG 45.A O no hydrogen 2.975 N/A ASP 50.A N GLN 46.A O no hydrogen 2.966 N/A ILE 51.A N LEU 48.A O no hydrogen 3.058 N/A ILE 52.A N LEU 48.A O no hydrogen 3.100 N/A GLN 53.A N LYS 49.A O no hydrogen 3.176 N/A LYS 58.A N ASP 56.A OD1 no hydrogen 3.023 N/A ASP 59.A N ASP 56.A O no hydrogen 2.920 N/A PHE 60.A N GLN 57.A O no hydrogen 3.170 N/A ILE 63.A N ASP 59.A O no hydrogen 2.926 N/A ILE 64.A N PHE 60.A O no hydrogen 2.948 N/A ARG 65.A N GLN 61.A O no hydrogen 2.824 N/A ARG 65.A NE GLU 100.A OE2 no hydrogen 3.001 N/A ARG 65.A NH2 GLU 100.A OE1 no hydrogen 2.909 N/A GLU 66.A N ILE 62.A O no hydrogen 2.905 N/A LEU 67.A N ILE 63.A O no hydrogen 2.993 N/A TRP 68.A N ILE 64.A O no hydrogen 2.851 N/A TRP 68.A NE1 THR 104.A O no hydrogen 2.851 N/A ASP 69.A N ARG 65.A O no hydrogen 3.098 N/A ASP 69.A N GLU 66.A O no hydrogen 3.173 N/A LEU 70.A N LEU 67.A O no hydrogen 3.230 N/A ARG 73.A N LEU 35.A O no hydrogen 2.889 N/A ARG 73.A NE ASP 109.A OD2 no hydrogen 2.893 N/A ARG 73.A NH1 GLN 76.A OE1 no hydrogen 3.113 N/A ARG 73.A NH1 LYS 105.A O no hydrogen 2.895 N/A ARG 73.A NH2 LYS 105.A O no hydrogen 3.137 N/A ARG 73.A NH2 ASP 109.A OD1 no hydrogen 2.778 N/A GLU 74.A N GLU 74.A OE1 no hydrogen 2.793 N/A PHE 75.A N GLU 72.A O no hydrogen 3.105 N/A GLN 76.A N ARG 73.A O no hydrogen 2.903 N/A GLN 76.A NE2 LEU 67.A O no hydrogen 3.169 N/A GLN 76.A NE2 LEU 70.A O no hydrogen 2.928 N/A GLN 76.A NE2 GLU 72.A O no hydrogen 3.535 N/A ALA 77.A N ARG 73.A O no hydrogen 3.122 N/A ALA 78.A N GLU 74.A O no hydrogen 2.802 N/A ALA 79.A N PHE 75.A O no hydrogen 2.953 N/A LEU 80.A N GLN 76.A O no hydrogen 3.100 N/A ASP 81.A N ALA 77.A O no hydrogen 3.141 N/A ILE 82.A N ALA 78.A O no hydrogen 2.846 N/A MET 83.A N ALA 79.A O no hydrogen 2.832 N/A GLN 84.A N LEU 80.A O no hydrogen 3.126 N/A LYS 85.A N ILE 82.A O no hydrogen 2.847 N/A TYR 86.A N MET 83.A O no hydrogen 2.945 N/A TYR 86.A OH PRO 55.A O no hydrogen 2.743 N/A LYS 87.A N GLN 84.A O no hydrogen 3.265 N/A LYS 87.A NZ THR 117.A O no hydrogen 3.474 N/A LYS 87.A NZ ASP 121.A OD1 no hydrogen 2.787 N/A HIS 89.A N TYR 86.A O no hydrogen 2.853 N/A ILE 90.A N LYS 87.A O no hydrogen 3.288 N/A ASN 91.A N HIS 94.A ND1 no hydrogen 2.950 N/A GLU 92.A N GLU 92.A OE1 no hydrogen 2.683 N/A THR 93.A N ASN 91.A OD1 no hydrogen 2.887 N/A THR 93.A OG1 ASN 91.A OD1 no hydrogen 2.680 N/A HIS 94.A N ASN 91.A O no hydrogen 2.939 N/A ILE 95.A N GLU 92.A O no hydrogen 3.210 N/A LEU 98.A N HIS 94.A O no hydrogen 2.973 N/A GLU 99.A N ILE 95.A O no hydrogen 2.803 N/A GLU 100.A N PRO 96.A O no hydrogen 3.001 N/A LEU 101.A N PHE 97.A O no hydrogen 3.103 N/A ILE 102.A N LEU 98.A O no hydrogen 2.958 N/A VAL 103.A N GLU 99.A O no hydrogen 3.052 N/A THR 104.A OG1 GLU 100.A O no hydrogen 2.701 N/A LYS 105.A NZ TRP 68.A O no hydrogen 2.721 N/A SER 106.A OG ILE 102.A O no hydrogen 2.553 N/A SER 110.A OG TRP 107.A O no hydrogen 3.169 N/A VAL 111.A N TRP 107.A O no hydrogen 3.076 N/A ASP 112.A N TRP 108.A O no hydrogen 2.986 N/A SER 113.A N SER 110.A O no hydrogen 3.034 N/A SER 113.A OG ASP 109.A O no hydrogen 3.121 N/A ILE 114.A N SER 110.A O no hydrogen 3.034 N/A ILE 114.A N VAL 111.A O no hydrogen 3.132 N/A VAL 115.A N VAL 111.A O no hydrogen 2.972 N/A THR 117.A OG1 SER 113.A O no hydrogen 3.042 N/A PHE 118.A N ILE 114.A O no hydrogen 3.209 N/A LEU 119.A N ILE 114.A O no hydrogen 3.393 N/A GLY 120.A N VAL 115.A O no hydrogen 3.014 N/A ASP 121.A N THR 117.A O no hydrogen 3.047 N/A ILE 122.A N PHE 118.A O no hydrogen 3.223 N/A PHE 123.A N LEU 119.A O no hydrogen 2.977 N/A LEU 124.A N GLY 120.A O no hydrogen 3.118 N/A LYS 125.A N ASP 121.A O no hydrogen 3.323 N/A HIS 126.A N ILE 122.A O no hydrogen 2.860 N/A GLU 128.A N GLU 128.A OE1 no hydrogen 2.659 N/A LEU 129.A N HIS 126.A O no hydrogen 2.990 N/A ILE 130.A N PRO 127.A O no hydrogen 3.176 N/A ALA 132.A N LEU 129.A O no hydrogen 3.083 N/A TYR 133.A N ILE 130.A O no hydrogen 2.993 N/A ILE 134.A N ILE 130.A O no hydrogen 2.867 N/A LYS 136.A NZ GLU 99.A OE2 no hydrogen 2.836 N/A TRP 137.A N TYR 133.A O no hydrogen 2.846 N/A TRP 137.A NE1 GLU 99.A OE2 no hydrogen 2.692 N/A ILE 138.A N ILE 134.A O no hydrogen 2.966 N/A ALA 139.A N PRO 135.A O no hydrogen 2.977 N/A SER 140.A N TRP 137.A O no hydrogen 3.246 N/A SER 140.A OG TRP 137.A O no hydrogen 2.675 N/A ASN 142.A N SER 140.A OG no hydrogen 3.058 N/A TRP 144.A N ASN 142.A OD1 no hydrogen 2.845 N/A LEU 145.A N ASN 142.A OD1 no hydrogen 3.018 N/A GLN 146.A N ASN 142.A O no hydrogen 2.979 N/A GLN 146.A NE2 ILE 138.A O no hydrogen 2.978 N/A ARG 147.A N ILE 143.A O no hydrogen 2.834 N/A ARG 147.A NE ASP 112.A OD1 no hydrogen 3.004 N/A ARG 147.A NH1 PHE 179.A O no hydrogen 2.843 N/A ARG 147.A NH2 ASP 112.A OD1 no hydrogen 3.285 N/A ARG 147.A NH2 ASP 112.A OD2 no hydrogen 2.819 N/A ALA 148.A N TRP 144.A O no hydrogen 2.918 N/A ALA 149.A N LEU 145.A O no hydrogen 2.983 N/A ILE 150.A N GLN 146.A O no hydrogen 3.199 N/A LEU 151.A N ARG 147.A O no hydrogen 2.875 N/A PHE 152.A N ALA 148.A O no hydrogen 3.030 N/A GLN 153.A NE2 ASP 161.A O no hydrogen 3.687 N/A LEU 154.A N LEU 151.A O no hydrogen 2.969 N/A TYR 156.A N GLN 153.A O no hydrogen 3.021 N/A TYR 156.A OH GLY 120.A O no hydrogen 2.619 N/A GLN 158.A N GLN 158.A OE1 no hydrogen 2.729 N/A LYS 159.A N TYR 156.A O no hydrogen 2.930 N/A MET 160.A N LYS 157.A O no hydrogen 3.067 N/A ASP 161.A N GLN 153.A OE1 no hydrogen 3.129 N/A LEU 164.A N ASP 161.A OD1 no hydrogen 3.057 N/A LEU 165.A N ASP 161.A O no hydrogen 2.864 N/A PHE 166.A N GLU 162.A O no hydrogen 2.908 N/A TRP 167.A N GLU 163.A O no hydrogen 3.001 N/A ILE 168.A N LEU 164.A O no hydrogen 2.898 N/A ILE 169.A N LEU 165.A O no hydrogen 2.931 N/A GLY 170.A N PHE 166.A O no hydrogen 2.895 N/A GLN 171.A N TRP 167.A O no hydrogen 2.976 N/A LEU 172.A N ILE 168.A O no hydrogen 3.125 N/A LEU 172.A N ILE 169.A O no hydrogen 3.086 N/A HIS 173.A ND1 GLY 170.A O no hydrogen 2.899 N/A HIS 173.A NE2 GLU 207.A OE1 no hydrogen 2.727 N/A SER 174.A OG HIS 173.A NE2 no hydrogen 3.164 N/A SER 175.A N LEU 172.A O no hydrogen 3.044 N/A GLU 177.A N SER 175.A OG no hydrogen 3.087 N/A ILE 180.A N GLU 177.A O no hydrogen 3.061 N/A GLN 181.A N GLU 177.A O no hydrogen 2.898 N/A GLN 181.A NE2 SER 175.A O no hydrogen 3.056 N/A LYS 182.A N PHE 178.A O no hydrogen 2.830 N/A ALA 183.A N PHE 179.A O no hydrogen 3.214 N/A ILE 184.A N ILE 180.A O no hydrogen 2.960 N/A GLY 185.A N GLN 181.A O no hydrogen 3.129 N/A TRP 186.A N LYS 182.A O no hydrogen 2.857 N/A VAL 187.A N ALA 183.A O no hydrogen 2.979 N/A LEU 188.A N ILE 184.A O no hydrogen 3.097 N/A ARG 189.A N GLY 185.A O no hydrogen 2.905 N/A ARG 189.A NE GLU 215.A O no hydrogen 2.897 N/A ARG 189.A NH2 GLU 215.A OE1 no hydrogen 2.839 N/A GLU 190.A N TRP 186.A O no hydrogen 2.849 N/A TYR 191.A N VAL 187.A O no hydrogen 2.942 N/A ALA 192.A N LEU 188.A O no hydrogen 2.893 N/A LYS 193.A N GLU 190.A O no hydrogen 3.062 N/A LYS 193.A NZ GLU 190.A OE1 no hydrogen 3.096 N/A THR 194.A N TYR 191.A O no hydrogen 2.762 N/A ASN 195.A N TYR 191.A O no hydrogen 2.837 N/A ASN 195.A ND2 TYR 191.A OH no hydrogen 3.025 N/A VAL 199.A N ASN 195.A O no hydrogen 3.398 N/A TRP 200.A N PRO 196.A O no hydrogen 2.971 N/A GLU 201.A N ASP 197.A O no hydrogen 2.944 N/A TYR 202.A N VAL 198.A O no hydrogen 2.976 N/A VAL 203.A N VAL 199.A O no hydrogen 2.867 N/A GLN 204.A N TRP 200.A O no hydrogen 2.934 N/A ASN 205.A N TYR 202.A O no hydrogen 3.126 N/A ASN 205.A ND2 GLU 201.A O no hydrogen 2.830 N/A ASN 206.A ND2 TYR 202.A O no hydrogen 2.869 N/A SER 212.A OG GLN 181.A O no hydrogen 2.720 N/A LYS 213.A N ALA 209.A O no hydrogen 2.993 N/A ARG 214.A N PRO 210.A O no hydrogen 2.904 N/A ARG 214.A NH2 GLU 215.A OE2 no hydrogen 2.926 N/A GLU 215.A N LEU 211.A O no hydrogen 3.004 N/A ALA 216.A N SER 212.A O no hydrogen 2.958 N/A ILE 217.A N LYS 213.A O no hydrogen 3.209 N/A ILE 220.A N ILE 217.A O no hydrogen 3.197 N/A LYS 221.A N ILE 217.A O no hydrogen 2.977 N/A GLN 222.A N GLN 222.A OE1 no hydrogen 2.747 N/A GLN 222.A NE2 HIS 219.A O no hydrogen 2.701 N/A ASN 223.A N ILE 220.A O no hydrogen 2.861 N/A TYR 224.A N LYS 221.A O no hydrogen 3.368 N/A TYR 224.A OH ASP 197.A OD1 no hydrogen 2.711 N/A