Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5a4w_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A N GLU 58.A O no hydrogen 2.955 N/A VAL 5.A N GLU 29.A O no hydrogen 2.968 N/A PHE 6.A N ALA 56.A O no hydrogen 2.869 N/A GLY 7.A N VAL 31.A O no hydrogen 3.114 N/A ALA 10.A N HIS 8.A ND1 no hydrogen 3.261 N/A SER 11.A N HIS 8.A O no hydrogen 3.036 N/A SER 11.A OG THR 14.A OG1 no hydrogen 2.885 N/A THR 14.A N SER 11.A OG no hydrogen 2.974 N/A THR 14.A OG1 SER 11.A OG no hydrogen 2.885 N/A ARG 15.A N SER 11.A O no hydrogen 2.894 N/A ARG 15.A NE PRO 9.A O no hydrogen 2.745 N/A ARG 15.A NH2 PRO 9.A O no hydrogen 3.446 N/A ARG 16.A N ILE 12.A O no hydrogen 3.068 N/A ARG 16.A NE SER 67.A OG no hydrogen 3.236 N/A ARG 16.A NH1 HIS 171.A O no hydrogen 2.683 N/A LEU 18.A N THR 14.A O no hydrogen 3.042 N/A ILE 19.A N ARG 15.A O no hydrogen 2.858 N/A ALA 20.A N ARG 16.A O no hydrogen 3.306 N/A LEU 21.A N VAL 17.A O no hydrogen 3.004 N/A HIS 22.A N LEU 18.A O no hydrogen 2.891 N/A GLU 23.A N ILE 19.A O no hydrogen 2.862 N/A LYS 24.A N ALA 20.A O no hydrogen 3.193 N/A LYS 24.A N LEU 21.A O no hydrogen 3.091 N/A LYS 24.A NZ TYR 78.A O no hydrogen 3.030 N/A LYS 24.A NZ GLU 79.A O no hydrogen 3.130 N/A LYS 24.A NZ GLN 81.A O no hydrogen 3.103 N/A LYS 24.A NZ THR 83.A O no hydrogen 2.720 N/A ASN 25.A N HIS 22.A O no hydrogen 2.871 N/A LEU 26.A N LEU 21.A O no hydrogen 3.153 N/A GLU 29.A N ILE 3.A O no hydrogen 3.006 N/A VAL 31.A N VAL 5.A O no hydrogen 2.822 N/A VAL 33.A N GLY 7.A O no hydrogen 2.877 N/A GLU 34.A N GLU 39.A OE1 no hydrogen 2.974 N/A ASP 37.A N GLU 34.A O no hydrogen 3.234 N/A GLY 38.A N LEU 35.A O no hydrogen 2.783 N/A GLU 39.A N GLU 34.A O no hydrogen 3.072 N/A LYS 41.A N GLY 38.A O no hydrogen 2.991 N/A LYS 42.A N GLU 39.A O no hydrogen 3.222 N/A LEU 46.A N LYS 42.A O no hydrogen 3.072 N/A SER 47.A N PRO 44.A O no hydrogen 3.054 N/A SER 47.A OG GLU 43.A OE1 no hydrogen 2.505 N/A SER 47.A OG GLU 43.A OE2 no hydrogen 3.382 N/A ARG 48.A N PHE 45.A O no hydrogen 2.870 N/A ARG 48.A NH1 GLU 58.A OE2 no hydrogen 2.609 N/A ARG 48.A NH2 GLU 58.A OE2 no hydrogen 3.119 N/A ASN 49.A N PHE 45.A O no hydrogen 3.078 N/A ASN 49.A ND2 GLN 53.A O no hydrogen 2.811 N/A PHE 51.A N ASN 49.A OD1 no hydrogen 2.834 N/A GLY 52.A N ASN 49.A O no hydrogen 2.987 N/A ALA 56.A N PHE 6.A O no hydrogen 2.921 N/A PHE 57.A N LEU 64.A O no hydrogen 2.827 N/A GLU 58.A N LYS 4.A O no hydrogen 2.877 N/A ASP 59.A N LEU 62.A O no hydrogen 2.946 N/A GLY 60.A N GLY 2.A O no hydrogen 3.231 N/A LEU 62.A N ASP 59.A O no hydrogen 3.168 N/A LEU 64.A N PHE 57.A O no hydrogen 2.871 N/A ARG 68.A NE GLU 106.A OE1 no hydrogen 2.834 N/A ARG 68.A NH2 GLU 106.A OE1 no hydrogen 3.115 N/A ARG 68.A NH2 GLU 106.A OE2 no hydrogen 3.204 N/A ILE 70.A N GLU 66.A O no hydrogen 3.032 N/A THR 71.A N SER 67.A O no hydrogen 2.856 N/A THR 71.A OG1 SER 67.A O no hydrogen 3.459 N/A THR 71.A OG1 ARG 68.A O no hydrogen 3.196 N/A THR 71.A OG1 HIS 171.A NE2 no hydrogen 2.766 N/A GLN 72.A N ARG 68.A O no hydrogen 3.400 N/A GLN 72.A NE2 TYR 96.A OH no hydrogen 3.144 N/A TYR 73.A N ALA 69.A O no hydrogen 3.022 N/A TYR 73.A OH ASP 59.A OD2 no hydrogen 2.650 N/A ILE 74.A N ILE 70.A O no hydrogen 2.959 N/A ALA 75.A N THR 71.A O no hydrogen 2.852 N/A HIS 76.A N GLN 72.A O no hydrogen 3.003 N/A HIS 76.A N TYR 73.A O no hydrogen 3.143 N/A HIS 76.A ND1 GLN 72.A O no hydrogen 3.167 N/A ARG 77.A N TYR 73.A O no hydrogen 2.737 N/A ARG 77.A NH1 ARG 77.A O no hydrogen 3.150 N/A TYR 78.A N ILE 74.A O no hydrogen 3.069 N/A TYR 78.A OH ASP 59.A OD2 no hydrogen 2.551 N/A GLU 79.A N HIS 76.A O no hydrogen 3.187 N/A GLN 81.A N TYR 78.A O no hydrogen 3.202 N/A THR 83.A N GLU 23.A O no hydrogen 2.897 N/A THR 83.A OG1 GLU 23.A O no hydrogen 3.295 N/A THR 83.A OG1 GLU 23.A OE1 no hydrogen 2.632 N/A ASN 84.A ND2 GLN 87.A O no hydrogen 3.037 N/A LEU 86.A N ASN 84.A OD1 no hydrogen 3.221 N/A GLN 87.A NE2 ALA 161.A O no hydrogen 3.646 N/A SER 90.A OG GLU 79.A OE2 no hydrogen 2.513 N/A LYS 91.A N ASP 89.A OD1 no hydrogen 3.270 N/A ASN 92.A N ASP 89.A O no hydrogen 3.084 N/A SER 94.A OG ASN 92.A OD1 no hydrogen 2.740 N/A GLN 95.A N ASN 92.A OD1 no hydrogen 3.008 N/A TYR 96.A N ASN 92.A O no hydrogen 3.008 N/A ALA 97.A N ILE 93.A O no hydrogen 3.007 N/A ILE 98.A N SER 94.A O no hydrogen 3.114 N/A MET 99.A N GLN 95.A O no hydrogen 3.168 N/A ALA 100.A N TYR 96.A O no hydrogen 2.815 N/A ILE 101.A N ALA 97.A O no hydrogen 2.912 N/A GLY 102.A N ILE 98.A O no hydrogen 3.346 N/A MET 103.A N MET 99.A O no hydrogen 2.931 N/A GLN 104.A N ALA 100.A O no hydrogen 2.934 N/A VAL 105.A N ILE 101.A O no hydrogen 2.857 N/A GLU 106.A N GLY 102.A O no hydrogen 2.860 N/A ASP 107.A N MET 103.A O no hydrogen 3.081 N/A HIS 108.A N GLN 104.A O no hydrogen 2.820 N/A GLN 109.A N VAL 105.A O no hydrogen 2.818 N/A PHE 110.A N VAL 105.A O no hydrogen 3.180 N/A ASP 111.A N GLU 106.A O no hydrogen 2.725 N/A ALA 114.A N PHE 110.A O no hydrogen 2.890 N/A SER 115.A N ASP 111.A O no hydrogen 2.840 N/A LYS 116.A N PRO 112.A O no hydrogen 3.151 N/A LEU 117.A N VAL 113.A O no hydrogen 2.995 N/A ALA 118.A N ALA 114.A O no hydrogen 2.970 N/A PHE 119.A N SER 115.A O no hydrogen 2.958 N/A GLU 120.A N LYS 116.A O no hydrogen 2.908 N/A GLN 121.A N LEU 117.A O no hydrogen 3.109 N/A ILE 122.A N ALA 118.A O no hydrogen 2.878 N/A PHE 123.A N ALA 118.A O no hydrogen 3.226 N/A LYS 124.A N PHE 119.A O no hydrogen 2.951 N/A LYS 124.A NZ GLU 120.A OE1 no hydrogen 3.005 N/A LYS 124.A NZ THR 130.A O no hydrogen 3.468 N/A SER 125.A OG GLN 121.A O no hydrogen 3.274 N/A ILE 126.A N ILE 122.A O no hydrogen 3.225 N/A GLY 128.A N SER 125.A O no hydrogen 3.149 N/A LEU 129.A N LYS 124.A O no hydrogen 2.981 N/A ASP 132.A N GLU 120.A OE1 no hydrogen 3.092 N/A ALA 134.A N ASP 132.A OD1 no hydrogen 3.088 N/A VAL 135.A N ASP 132.A OD1 no hydrogen 3.433 N/A VAL 136.A N ASP 132.A O no hydrogen 3.187 N/A ALA 137.A N GLU 133.A O no hydrogen 3.073 N/A GLU 138.A N ALA 134.A O no hydrogen 2.964 N/A GLU 139.A N VAL 135.A O no hydrogen 2.847 N/A GLU 140.A N VAL 136.A O no hydrogen 2.832 N/A ALA 141.A N ALA 137.A O no hydrogen 3.132 N/A LYS 142.A N GLU 138.A O no hydrogen 3.215 N/A LYS 142.A NZ GLU 139.A OE2 no hydrogen 2.857 N/A LEU 143.A N GLU 139.A O no hydrogen 2.876 N/A ALA 144.A N GLU 140.A O no hydrogen 2.810 N/A LYS 145.A N ALA 141.A O no hydrogen 3.334 N/A VAL 146.A N LYS 142.A O no hydrogen 3.198 N/A LEU 147.A N LEU 143.A O no hydrogen 2.788 N/A ASP 148.A N ALA 144.A O no hydrogen 2.771 N/A VAL 149.A N LYS 145.A O no hydrogen 3.199 N/A TYR 150.A N VAL 146.A O no hydrogen 2.987 N/A TYR 150.A OH HIS 172.A NE2 no hydrogen 2.686 N/A GLU 151.A N LEU 147.A O no hydrogen 2.780 N/A ALA 152.A N ASP 148.A O no hydrogen 3.132 N/A ARG 153.A N VAL 149.A O no hydrogen 3.014 N/A ARG 153.A NE LEU 160.A O no hydrogen 3.083 N/A ARG 153.A NH2 LEU 160.A O no hydrogen 3.150 N/A LEU 154.A N TYR 150.A O no hydrogen 2.824 N/A LYS 155.A N GLU 151.A O no hydrogen 3.079 N/A GLU 156.A N ARG 153.A O no hydrogen 3.176 N/A PHE 157.A N ARG 153.A O no hydrogen 3.247 N/A LYS 158.A N GLU 163.A OE2 no hydrogen 3.070 N/A TYR 159.A N GLY 162.A O no hydrogen 2.897 N/A LEU 160.A N ASP 169.A OD1 no hydrogen 3.105 N/A GLY 162.A N TYR 159.A O no hydrogen 3.451 N/A THR 166.A N ASP 169.A OD2 no hydrogen 2.880 N/A LEU 167.A N LEU 85.A O no hydrogen 2.976 N/A THR 168.A N THR 166.A OG1 no hydrogen 3.290 N/A THR 168.A OG1 MET 99.A O no hydrogen 2.952 N/A LEU 170.A N THR 166.A O no hydrogen 3.006 N/A HIS 171.A N LEU 167.A O no hydrogen 2.938 N/A HIS 171.A NE2 THR 71.A OG1 no hydrogen 2.766 N/A HIS 172.A N ASP 169.A O no hydrogen 3.074 N/A HIS 172.A ND1 THR 168.A O no hydrogen 2.698 N/A HIS 172.A NE2 TYR 150.A OH no hydrogen 2.686 N/A ILE 173.A N LEU 170.A O no hydrogen 3.067 N/A ILE 176.A N HIS 172.A O no hydrogen 3.140 N/A GLN 177.A N ILE 173.A O no hydrogen 2.841 N/A GLN 177.A NE2 SER 207.A O no hydrogen 2.992 N/A TYR 178.A N PRO 174.A O no hydrogen 3.220 N/A TYR 178.A OH ALA 10.A O no hydrogen 2.653 N/A LEU 179.A N ALA 175.A O no hydrogen 3.001 N/A LEU 180.A N ILE 176.A O no hydrogen 2.928 N/A GLY 181.A N TYR 178.A O no hydrogen 3.031 N/A THR 182.A N LEU 179.A O no hydrogen 3.066 N/A THR 182.A OG1 GLN 121.A OE1 no hydrogen 3.570 N/A THR 182.A OG1 LEU 179.A O no hydrogen 2.755 N/A THR 184.A N THR 182.A OG1 no hydrogen 3.184 N/A THR 184.A OG1 GLN 121.A OE1 no hydrogen 2.760 N/A THR 184.A OG1 GLU 140.A OE2 no hydrogen 2.908 N/A LYS 185.A N THR 182.A O no hydrogen 3.010 N/A LYS 186.A N PRO 183.A O no hydrogen 3.256 N/A LEU 187.A N THR 184.A O no hydrogen 2.987 N/A PHE 188.A N LYS 185.A O no hydrogen 3.032 N/A THR 189.A N LYS 185.A O no hydrogen 3.115 N/A THR 189.A OG1 LYS 185.A O no hydrogen 3.533 N/A THR 189.A OG1 LYS 186.A O no hydrogen 3.194 N/A GLU 190.A N LYS 186.A O no hydrogen 2.788 N/A ARG 191.A N PHE 188.A O no hydrogen 3.305 N/A ARG 191.A NE ASP 148.A OD1 no hydrogen 2.906 N/A ARG 191.A NH1 LEU 187.A O no hydrogen 2.910 N/A ARG 191.A NH1 GLU 190.A OE2 no hydrogen 3.021 N/A ARG 191.A NH2 ASP 148.A OD1 no hydrogen 2.952 N/A ARG 193.A N GLU 151.A OE2 no hydrogen 2.985 N/A ARG 193.A NE LEU 154.A O no hydrogen 2.782 N/A ARG 193.A NH2 LEU 154.A O no hydrogen 2.945 N/A ARG 193.A NH2 PHE 157.A O no hydrogen 3.131 N/A ARG 193.A NH2 LYS 158.A O no hydrogen 3.152 N/A VAL 194.A N GLU 151.A OE1 no hydrogen 2.913 N/A ASN 195.A N ARG 191.A O no hydrogen 2.755 N/A GLU 196.A N PRO 192.A O no hydrogen 3.106 N/A TRP 197.A N ARG 193.A O no hydrogen 2.946 N/A TRP 197.A NE1 ASP 169.A OD1 no hydrogen 2.963 N/A VAL 198.A N VAL 194.A O no hydrogen 2.876 N/A ALA 199.A N ASN 195.A O no hydrogen 2.965 N/A GLU 200.A N GLU 196.A O no hydrogen 2.911 N/A ILE 201.A N TRP 197.A O no hydrogen 2.989 N/A THR 202.A N VAL 198.A O no hydrogen 3.051 N/A THR 202.A OG1 VAL 198.A O no hydrogen 2.605 N/A THR 202.A OG1 ALA 199.A O no hydrogen 3.450 N/A LYS 203.A N ALA 199.A O no hydrogen 3.205 N/A ARG 204.A NH1 GLU 23.A OE2 no hydrogen 3.117 N/A SER 207.A OG ILE 201.A O no hydrogen 2.698 N/A GLU 208.A N ARG 204.A O no hydrogen 3.063 N/A LYS 209.A N PRO 205.A O no hydrogen 2.979 N/A VAL 210.A N SER 207.A O no hydrogen 3.287 N/A GLN 211.A N GLU 208.A O no hydrogen 3.288 N/A