Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5a5k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N GLU 57.A O no hydrogen 2.938 N/A VAL 4.A N GLU 28.A O no hydrogen 2.961 N/A PHE 5.A N ALA 55.A O no hydrogen 2.851 N/A GLY 6.A N VAL 30.A O no hydrogen 3.129 N/A ALA 9.A N HIS 7.A ND1 no hydrogen 3.238 N/A SER 10.A N HIS 7.A O no hydrogen 2.993 N/A SER 10.A OG THR 13.A OG1 no hydrogen 3.154 N/A THR 13.A N SER 10.A OG no hydrogen 3.290 N/A ARG 14.A N SER 10.A O no hydrogen 2.797 N/A ARG 14.A NE PRO 8.A O no hydrogen 2.681 N/A ARG 14.A NH2 PRO 8.A O no hydrogen 3.379 N/A ARG 15.A N ILE 11.A O no hydrogen 2.941 N/A ARG 15.A NE SER 66.A OG no hydrogen 3.276 N/A ARG 15.A NH1 HIS 170.A O no hydrogen 2.714 N/A VAL 16.A N ALA 12.A O no hydrogen 3.382 N/A LEU 17.A N THR 13.A O no hydrogen 2.936 N/A ILE 18.A N ARG 14.A O no hydrogen 2.858 N/A ALA 19.A N ARG 15.A O no hydrogen 3.445 N/A LEU 20.A N VAL 16.A O no hydrogen 3.054 N/A HIS 21.A N LEU 17.A O no hydrogen 2.974 N/A GLU 22.A N ILE 18.A O no hydrogen 2.791 N/A LYS 23.A N ALA 19.A O no hydrogen 3.099 N/A LYS 23.A NZ TYR 77.A O no hydrogen 2.880 N/A LYS 23.A NZ GLU 78.A O no hydrogen 3.074 N/A LYS 23.A NZ GLN 80.A O no hydrogen 2.819 N/A LYS 23.A NZ THR 82.A O no hydrogen 2.665 N/A ASN 24.A N HIS 21.A O no hydrogen 2.876 N/A LEU 25.A N LEU 20.A O no hydrogen 3.066 N/A GLU 28.A N ILE 2.A O no hydrogen 2.945 N/A VAL 30.A N VAL 4.A O no hydrogen 2.830 N/A VAL 32.A N GLY 6.A O no hydrogen 2.833 N/A GLU 33.A N GLU 38.A OE1 no hydrogen 2.818 N/A LEU 34.A N VAL 32.A O no hydrogen 3.010 N/A GLY 37.A N LEU 34.A O no hydrogen 2.712 N/A GLU 38.A N GLU 33.A O no hydrogen 3.024 N/A LYS 40.A N GLY 37.A O no hydrogen 3.328 N/A LYS 40.A NZ PHE 50.A O no hydrogen 3.083 N/A LYS 41.A N GLU 38.A O no hydrogen 3.240 N/A LEU 45.A N LYS 41.A O no hydrogen 3.386 N/A SER 46.A N PRO 43.A O no hydrogen 3.121 N/A ARG 47.A N PHE 44.A O no hydrogen 2.791 N/A ASN 48.A N PHE 44.A O no hydrogen 2.945 N/A ASN 48.A ND2 GLN 52.A O no hydrogen 2.817 N/A PHE 50.A N ASN 48.A OD1 no hydrogen 3.073 N/A GLY 51.A N ASN 48.A O no hydrogen 2.886 N/A ALA 55.A N PHE 5.A O no hydrogen 2.849 N/A PHE 56.A N LEU 63.A O no hydrogen 2.855 N/A GLU 57.A N LYS 3.A O no hydrogen 2.797 N/A ASP 58.A N LEU 61.A O no hydrogen 2.947 N/A GLY 59.A N GLY 1.A O no hydrogen 3.114 N/A LEU 61.A N ASP 58.A O no hydrogen 3.116 N/A LEU 63.A N PHE 56.A O no hydrogen 2.936 N/A ARG 67.A NH2 GLU 105.A OE2 no hydrogen 2.662 N/A ARG 67.A NH2 ASP 110.A OD2 no hydrogen 3.353 N/A ILE 69.A N GLU 65.A O no hydrogen 3.110 N/A THR 70.A N SER 66.A O no hydrogen 2.903 N/A THR 70.A OG1 SER 66.A O no hydrogen 3.343 N/A THR 70.A OG1 ARG 67.A O no hydrogen 2.922 N/A THR 70.A OG1 HIS 170.A NE2 no hydrogen 2.689 N/A GLN 71.A N ARG 67.A O no hydrogen 3.251 N/A GLN 71.A NE2 TYR 95.A OH no hydrogen 3.035 N/A TYR 72.A N ALA 68.A O no hydrogen 3.009 N/A TYR 72.A OH ASP 58.A OD2 no hydrogen 2.739 N/A ILE 73.A N ILE 69.A O no hydrogen 2.970 N/A ALA 74.A N THR 70.A O no hydrogen 2.905 N/A HIS 75.A N GLN 71.A O no hydrogen 3.077 N/A HIS 75.A N TYR 72.A O no hydrogen 3.264 N/A HIS 75.A NE2 TYR 95.A OH no hydrogen 2.743 N/A ARG 76.A N TYR 72.A O no hydrogen 2.796 N/A ARG 76.A NH1 ARG 76.A O no hydrogen 3.099 N/A TYR 77.A N ILE 73.A O no hydrogen 3.076 N/A TYR 77.A OH ASP 58.A OD2 no hydrogen 2.534 N/A GLU 78.A N HIS 75.A O no hydrogen 3.316 N/A GLN 80.A N TYR 77.A O no hydrogen 3.411 N/A THR 82.A N GLU 22.A O no hydrogen 3.011 N/A THR 82.A OG1 GLU 22.A O no hydrogen 3.082 N/A THR 82.A OG1 GLU 22.A OE2 no hydrogen 3.262 N/A ASN 83.A ND2 GLN 86.A O no hydrogen 3.093 N/A GLN 86.A NE2 GLN 94.A O no hydrogen 2.915 N/A GLN 86.A NE2 ALA 160.A O no hydrogen 2.763 N/A SER 89.A OG GLU 78.A OE2 no hydrogen 2.551 N/A ASN 91.A N ASP 88.A O no hydrogen 3.094 N/A GLN 94.A N ASN 91.A OD1 no hydrogen 2.768 N/A TYR 95.A N ASN 91.A O no hydrogen 2.979 N/A TYR 95.A OH HIS 75.A NE2 no hydrogen 2.743 N/A ALA 96.A N ILE 92.A O no hydrogen 3.074 N/A ILE 97.A N SER 93.A O no hydrogen 3.126 N/A MET 98.A N GLN 94.A O no hydrogen 3.230 N/A ALA 99.A N TYR 95.A O no hydrogen 2.747 N/A ILE 100.A N ALA 96.A O no hydrogen 2.906 N/A GLY 101.A N ILE 97.A O no hydrogen 3.473 N/A MET 102.A N MET 98.A O no hydrogen 3.040 N/A GLN 103.A N ALA 99.A O no hydrogen 2.924 N/A VAL 104.A N ILE 100.A O no hydrogen 2.727 N/A GLU 105.A N GLY 101.A O no hydrogen 2.876 N/A ASP 106.A N MET 102.A O no hydrogen 3.245 N/A HIS 107.A N GLN 103.A O no hydrogen 3.083 N/A GLN 108.A N VAL 104.A O no hydrogen 2.793 N/A PHE 109.A N VAL 104.A O no hydrogen 3.420 N/A ASP 110.A N GLU 105.A O no hydrogen 2.790 N/A ALA 113.A N PHE 109.A O no hydrogen 2.952 N/A SER 114.A N ASP 110.A O no hydrogen 2.812 N/A SER 114.A OG ASP 110.A O no hydrogen 3.058 N/A SER 114.A OG ASP 110.A OD1 no hydrogen 3.031 N/A LYS 115.A N PRO 111.A O no hydrogen 3.301 N/A LEU 116.A N VAL 112.A O no hydrogen 3.034 N/A ALA 117.A N ALA 113.A O no hydrogen 2.925 N/A PHE 118.A N SER 114.A O no hydrogen 2.954 N/A GLU 119.A N LYS 115.A O no hydrogen 2.781 N/A GLN 120.A N LEU 116.A O no hydrogen 3.039 N/A GLN 120.A NE2 THR 183.A OG1 no hydrogen 2.679 N/A ILE 121.A N ALA 117.A O no hydrogen 2.967 N/A LYS 123.A N PHE 118.A O no hydrogen 2.982 N/A LYS 123.A NZ GLU 119.A OE2 no hydrogen 3.042 N/A SER 124.A OG GLN 120.A O no hydrogen 3.243 N/A ILE 125.A N ILE 121.A O no hydrogen 3.079 N/A TYR 126.A N PHE 122.A O no hydrogen 3.343 N/A GLY 127.A N LYS 123.A O no hydrogen 2.947 N/A LEU 128.A N LYS 123.A O no hydrogen 3.105 N/A THR 130.A OG1 GLU 119.A O no hydrogen 2.897 N/A ALA 133.A N ASP 131.A OD1 no hydrogen 3.255 N/A VAL 135.A N ASP 131.A O no hydrogen 3.077 N/A ALA 136.A N GLU 132.A O no hydrogen 3.140 N/A GLU 137.A N ALA 133.A O no hydrogen 2.963 N/A GLU 138.A N VAL 134.A O no hydrogen 2.938 N/A GLU 139.A N VAL 135.A O no hydrogen 2.780 N/A ALA 140.A N ALA 136.A O no hydrogen 3.036 N/A LYS 141.A N GLU 137.A O no hydrogen 3.233 N/A LYS 141.A NZ GLU 138.A OE2 no hydrogen 3.132 N/A LEU 142.A N GLU 138.A O no hydrogen 2.833 N/A ALA 143.A N GLU 139.A O no hydrogen 2.903 N/A LYS 144.A N ALA 140.A O no hydrogen 3.279 N/A VAL 145.A N LYS 141.A O no hydrogen 3.097 N/A LEU 146.A N LEU 142.A O no hydrogen 2.664 N/A ASP 147.A N ALA 143.A O no hydrogen 2.905 N/A VAL 148.A N LYS 144.A O no hydrogen 3.435 N/A TYR 149.A N VAL 145.A O no hydrogen 3.129 N/A TYR 149.A OH HIS 171.A NE2 no hydrogen 2.580 N/A GLU 150.A N LEU 146.A O no hydrogen 2.801 N/A ALA 151.A N ASP 147.A O no hydrogen 3.088 N/A ARG 152.A N VAL 148.A O no hydrogen 3.077 N/A ARG 152.A NE LEU 159.A O no hydrogen 2.968 N/A ARG 152.A NH2 LEU 159.A O no hydrogen 3.101 N/A LEU 153.A N TYR 149.A O no hydrogen 2.759 N/A LYS 154.A N GLU 150.A O no hydrogen 2.856 N/A GLU 155.A N ARG 152.A O no hydrogen 3.077 N/A PHE 156.A N ARG 152.A O no hydrogen 3.238 N/A TYR 158.A N GLY 161.A O no hydrogen 2.964 N/A LEU 159.A N ASP 168.A OD1 no hydrogen 3.145 N/A GLY 161.A N TYR 158.A O no hydrogen 3.408 N/A THR 165.A N ASP 168.A OD2 no hydrogen 2.958 N/A THR 165.A OG1 ASP 168.A OD2 no hydrogen 3.281 N/A LEU 166.A N LEU 84.A O no hydrogen 2.952 N/A THR 167.A OG1 MET 98.A O no hydrogen 2.892 N/A ASP 168.A N THR 165.A O no hydrogen 2.842 N/A LEU 169.A N THR 165.A O no hydrogen 2.990 N/A HIS 170.A N LEU 166.A O no hydrogen 2.948 N/A HIS 170.A NE2 THR 70.A OG1 no hydrogen 2.689 N/A HIS 171.A N ASP 168.A O no hydrogen 2.980 N/A HIS 171.A ND1 THR 167.A O no hydrogen 2.761 N/A HIS 171.A NE2 TYR 149.A OH no hydrogen 2.580 N/A ILE 172.A N LEU 169.A O no hydrogen 2.990 N/A ILE 175.A N HIS 171.A O no hydrogen 3.195 N/A GLN 176.A N ILE 172.A O no hydrogen 2.786 N/A GLN 176.A NE2 SER 206.A O no hydrogen 2.764 N/A TYR 177.A N PRO 173.A O no hydrogen 3.275 N/A TYR 177.A OH ALA 9.A O no hydrogen 2.595 N/A LEU 178.A N ALA 174.A O no hydrogen 2.983 N/A LEU 179.A N ILE 175.A O no hydrogen 2.864 N/A GLY 180.A N TYR 177.A O no hydrogen 3.270 N/A THR 183.A OG1 GLU 139.A OE2 no hydrogen 2.666 N/A LYS 184.A N THR 181.A O no hydrogen 3.027 N/A LYS 185.A N PRO 182.A O no hydrogen 3.094 N/A LEU 186.A N THR 183.A O no hydrogen 3.025 N/A THR 188.A N LYS 184.A O no hydrogen 2.878 N/A THR 188.A OG1 LYS 184.A O no hydrogen 3.166 N/A GLU 189.A N LYS 185.A O no hydrogen 2.790 N/A ARG 190.A NE ASP 147.A OD1 no hydrogen 2.841 N/A ARG 190.A NH1 LEU 186.A O no hydrogen 2.854 N/A ARG 190.A NH2 ASP 147.A OD1 no hydrogen 3.155 N/A ARG 192.A N GLU 150.A OE2 no hydrogen 2.768 N/A ARG 192.A NE LEU 153.A O no hydrogen 2.857 N/A ARG 192.A NH2 LEU 153.A O no hydrogen 3.103 N/A ARG 192.A NH2 PHE 156.A O no hydrogen 2.984 N/A ARG 192.A NH2 LYS 157.A O no hydrogen 2.725 N/A VAL 193.A N GLU 150.A OE1 no hydrogen 2.980 N/A ASN 194.A N ARG 190.A O no hydrogen 2.789 N/A GLU 195.A N PRO 191.A O no hydrogen 3.044 N/A TRP 196.A N ARG 192.A O no hydrogen 3.019 N/A TRP 196.A NE1 ASP 168.A OD1 no hydrogen 2.880 N/A VAL 197.A N VAL 193.A O no hydrogen 2.748 N/A ALA 198.A N ASN 194.A O no hydrogen 2.980 N/A GLU 199.A N GLU 195.A O no hydrogen 2.880 N/A ILE 200.A N TRP 196.A O no hydrogen 3.073 N/A THR 201.A N VAL 197.A O no hydrogen 2.948 N/A THR 201.A OG1 VAL 197.A O no hydrogen 2.541 N/A THR 201.A OG1 ALA 198.A O no hydrogen 3.486 N/A LYS 202.A N ALA 198.A O no hydrogen 3.171 N/A SER 206.A OG ILE 200.A O no hydrogen 2.664 N/A GLU 207.A N ARG 203.A O no hydrogen 3.120 N/A LYS 208.A N PRO 204.A O no hydrogen 3.015 N/A GLN 210.A N GLU 207.A O no hydrogen 3.176 N/A