Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4gk2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 2.A NE2 GLU 7.A OE1 no hydrogen 2.454 N/A ALA 5.A N VAL 1.A O no hydrogen 3.080 N/A LYS 6.A NZ GLU 7.A O no hydrogen 3.391 N/A LEU 8.A N VAL 80.A O no hydrogen 2.700 N/A ASN 12.A N ASP 9.A O no hydrogen 3.015 N/A ILE 13.A N ALA 10.A O no hydrogen 2.978 N/A SER 14.A N ARG 31.A O no hydrogen 2.958 N/A ASP 16.A N SER 29.A O no hydrogen 2.906 N/A LYS 17.A N SER 29.A O no hydrogen 3.281 N/A VAL 19.A N VAL 27.A O no hydrogen 2.821 N/A GLY 22.A N GLY 25.A O no hydrogen 2.957 N/A VAL 27.A N GLY 20.A O no hydrogen 2.838 N/A CYS 28.A N ILE 44.A O no hydrogen 2.707 N/A SER 29.A N LYS 17.A O no hydrogen 2.957 N/A GLY 30.A N VAL 42.A O no hydrogen 2.938 N/A ARG 31.A N SER 14.A O no hydrogen 2.891 N/A ARG 31.A NH2 GLU 39.A OE1 no hydrogen 3.144 N/A LEU 32.A N ILE 40.A O no hydrogen 2.899 N/A LYS 33.A N ASN 12.A O no hydrogen 2.875 N/A LYS 33.A NZ LYS 37.A O no hydrogen 2.797 N/A LYS 33.A NZ GLU 39.A OE2 no hydrogen 2.860 N/A LEU 34.A N LYS 38.A O no hydrogen 2.806 N/A LYS 37.A N LEU 34.A O no hydrogen 2.692 N/A ILE 40.A N LEU 32.A O no hydrogen 2.925 N/A VAL 42.A N GLY 30.A O no hydrogen 2.958 N/A ALA 43.A N THR 91.A O no hydrogen 2.959 N/A ILE 44.A N CYS 28.A O no hydrogen 2.652 N/A LYS 45.A N ILE 89.A O no hydrogen 2.841 N/A LYS 45.A NZ GLU 62.A OE1 no hydrogen 2.511 N/A THR 46.A N GLU 26.A O no hydrogen 3.059 N/A THR 46.A OG1 GLU 26.A O no hydrogen 2.909 N/A LEU 47.A N VAL 87.A O no hydrogen 2.947 N/A LYS 48.A N PHE 24.A O no hydrogen 2.675 N/A THR 52.A N GLN 55.A OE1 no hydrogen 2.590 N/A THR 52.A OG1 GLN 55.A OE1 no hydrogen 3.144 N/A GLN 55.A N THR 52.A OG1 no hydrogen 3.321 N/A ARG 56.A N THR 52.A O no hydrogen 2.995 N/A ARG 57.A N GLU 53.A O no hydrogen 3.025 N/A ASP 58.A N LYS 54.A O no hydrogen 2.951 N/A PHE 59.A N GLN 55.A O no hydrogen 2.648 N/A LEU 60.A N ARG 56.A O no hydrogen 2.934 N/A GLY 61.A N ARG 57.A O no hydrogen 2.931 N/A GLU 62.A N PHE 59.A O no hydrogen 3.350 N/A ALA 63.A N LEU 60.A O no hydrogen 2.980 N/A SER 64.A N LEU 60.A O no hydrogen 3.342 N/A SER 64.A N GLY 61.A O no hydrogen 3.208 N/A SER 64.A OG LEU 60.A O no hydrogen 3.565 N/A ILE 65.A N GLY 61.A O no hydrogen 3.372 N/A MET 66.A N GLU 62.A O no hydrogen 2.899 N/A GLY 67.A N ALA 63.A O no hydrogen 2.765 N/A GLN 68.A N ILE 65.A O no hydrogen 2.948 N/A GLN 68.A NE2 SER 64.A O no hydrogen 3.048 N/A PHE 69.A N MET 66.A O no hydrogen 3.148 N/A ASN 73.A N HIS 71.A ND1 no hydrogen 2.907 N/A ASN 73.A ND2 CYS 152.A O no hydrogen 2.831 N/A ILE 74.A N HIS 71.A O no hydrogen 3.245 N/A ILE 75.A N VAL 154.A O no hydrogen 2.974 N/A ARG 76.A N GLU 92.A OE2 no hydrogen 2.850 N/A ARG 76.A NE GLU 78.A OE2 no hydrogen 3.096 N/A GLU 78.A N VAL 90.A O no hydrogen 2.713 N/A GLY 79.A N VAL 90.A O no hydrogen 3.296 N/A VAL 80.A N LYS 6.A O no hydrogen 2.925 N/A VAL 81.A N MET 88.A O no hydrogen 3.005 N/A THR 82.A N GLU 7.A OE2 no hydrogen 2.894 N/A THR 82.A OG1 HIS 2.A NE2 no hydrogen 3.392 N/A THR 82.A OG1 GLU 7.A OE1 no hydrogen 2.880 N/A THR 82.A OG1 GLU 7.A OE2 no hydrogen 3.469 N/A LYS 83.A N GLU 7.A OE2 no hydrogen 2.974 N/A LYS 85.A NZ TYR 51.A OH no hydrogen 2.942 N/A MET 88.A N VAL 81.A O no hydrogen 3.051 N/A ILE 89.A N LYS 45.A O no hydrogen 2.881 N/A VAL 90.A N GLY 79.A O no hydrogen 2.930 N/A THR 91.A N ALA 43.A O no hydrogen 2.989 N/A THR 91.A OG1 GLU 92.A O no hydrogen 2.975 N/A GLU 92.A N ARG 76.A O no hydrogen 3.042 N/A ASN 96.A N ILE 146.A O no hydrogen 2.974 N/A ASN 96.A ND2 ASN 147.A O no hydrogen 2.875 N/A GLY 97.A N MET 94.A O no hydrogen 3.345 N/A SER 98.A OG ARG 142.A O no hydrogen 3.507 N/A LEU 99.A N ILE 144.A O no hydrogen 2.786 N/A SER 101.A OG SER 98.A O no hydrogen 3.489 N/A PHE 102.A N SER 98.A O no hydrogen 3.006 N/A LEU 103.A N LEU 99.A O no hydrogen 2.905 N/A ARG 104.A N ASP 100.A O no hydrogen 3.152 N/A ARG 104.A NH1 ASP 100.A OD2 no hydrogen 3.330 N/A ARG 104.A NH1 GLY 194.A O no hydrogen 2.561 N/A ARG 104.A NH2 ASP 100.A OD2 no hydrogen 2.877 N/A LYS 105.A N PHE 102.A O no hydrogen 3.180 N/A HIS 106.A N LEU 103.A O no hydrogen 3.027 N/A HIS 106.A ND1 GLN 109.A OE1 no hydrogen 2.890 N/A GLN 109.A N HIS 106.A O no hydrogen 2.832 N/A PHE 110.A N TYR 193.A OH no hydrogen 3.069 N/A THR 111.A N GLN 114.A OE1 no hydrogen 2.921 N/A GLN 114.A N THR 111.A OG1 no hydrogen 3.072 N/A LEU 115.A N THR 111.A O no hydrogen 3.070 N/A VAL 116.A N VAL 112.A O no hydrogen 2.875 N/A GLY 117.A N ILE 113.A O no hydrogen 2.875 N/A MET 118.A N GLN 114.A O no hydrogen 3.147 N/A LEU 119.A N LEU 115.A O no hydrogen 2.938 N/A ARG 120.A N VAL 116.A O no hydrogen 2.759 N/A ARG 120.A NE ASP 252.A OD1 no hydrogen 2.604 N/A ARG 120.A NE ASP 252.A OD2 no hydrogen 3.368 N/A ARG 120.A NH2 ASP 252.A OD2 no hydrogen 2.865 N/A GLY 121.A N GLY 117.A O no hydrogen 3.163 N/A ILE 122.A N MET 118.A O no hydrogen 3.138 N/A ALA 123.A N LEU 119.A O no hydrogen 2.968 N/A SER 124.A N ARG 120.A O no hydrogen 2.817 N/A SER 124.A OG.B ARG 120.A O no hydrogen 3.168 N/A GLY 125.A N GLY 121.A O no hydrogen 2.997 N/A MET 126.A N ILE 122.A O no hydrogen 3.013 N/A LYS 127.A N ALA 123.A O no hydrogen 2.926 N/A LYS 127.A NZ ASP 131.A OD1 no hydrogen 3.480 N/A LYS 127.A NZ ASP 131.A OD2 no hydrogen 2.528 N/A TYR 128.A N SER 124.A O no hydrogen 3.120 N/A LEU 129.A N GLY 125.A O no hydrogen 2.921 N/A SER 130.A N MET 126.A O no hydrogen 2.867 N/A SER 130.A OG MET 126.A O no hydrogen 2.964 N/A SER 130.A OG LYS 127.A O no hydrogen 3.096 N/A ASP 131.A N LYS 127.A O no hydrogen 2.973 N/A MET 132.A N TYR 128.A O no hydrogen 3.086 N/A MET 132.A N LEU 129.A O no hydrogen 3.144 N/A GLY 133.A N SER 130.A O no hydrogen 3.111 N/A TYR 134.A N.A LEU 129.A O no hydrogen 3.238 N/A TYR 134.A N.B LEU 129.A O no hydrogen 3.240 N/A TYR 134.A OH.B GLN 68.A OE1 no hydrogen 2.596 N/A HIS 136.A N ASP 179.A OD2 no hydrogen 2.809 N/A HIS 136.A NE2 SER 155.A O no hydrogen 2.900 N/A ARG 137.A N ASP 179.A OD1 no hydrogen 3.066 N/A ARG 137.A NH1 LEU 159.A O no hydrogen 2.860 N/A ASP 138.A N HIS 136.A ND1 no hydrogen 2.994 N/A ALA 141.A N GLU 189.A OE1 no hydrogen 2.814 N/A ASN 143.A N ALA 140.A O no hydrogen 2.776 N/A ASN 143.A ND2 ASP 138.A O no hydrogen 2.832 N/A ASN 143.A ND2 ASP 138.A OD2 no hydrogen 2.796 N/A ILE 144.A N ALA 141.A O no hydrogen 3.077 N/A LEU 145.A N LYS 153.A O no hydrogen 3.042 N/A ILE 146.A N GLY 97.A O no hydrogen 2.906 N/A ASN 147.A N VAL 151.A O no hydrogen 2.994 N/A ASN 149.A N ASN 147.A OD1 no hydrogen 2.956 N/A LEU 150.A N ASN 147.A O no hydrogen 2.920 N/A VAL 151.A N ASN 147.A OD1 no hydrogen 2.846 N/A CYS 152.A SG LEU 150.A O no hydrogen 3.833 N/A LYS 153.A N LEU 145.A O no hydrogen 2.846 N/A LYS 153.A NZ GLU 92.A OE1 no hydrogen 2.651 N/A LYS 153.A NZ GLU 92.A OE2 no hydrogen 3.125 N/A VAL 154.A N ASN 73.A O no hydrogen 2.782 N/A SER 155.A N ASN 143.A O no hydrogen 2.959 N/A SER 155.A OG ASN 143.A O no hydrogen 2.950 N/A PHE 157.A N GLU 62.A OE2 no hydrogen 2.699 N/A ARG 162.A NE PRO 197.A O no hydrogen 2.814 N/A ARG 162.A NE TRP 199.A O no hydrogen 3.263 N/A ARG 162.A NH1 ASN 203.A OD1 no hydrogen 3.125 N/A ARG 162.A NH2 TRP 199.A O no hydrogen 2.997 N/A ARG 162.A NH2 MET 201.A O no hydrogen 2.571 N/A TRP 163.A N PRO 160.A O no hydrogen 3.150 N/A TRP 163.A NE1 GLU 189.A OE1 no hydrogen 2.907 N/A THR 164.A N ILE 161.A O no hydrogen 3.172 N/A THR 164.A OG1 PRO 160.A O no hydrogen 2.613 N/A SER 165.A OG GLU 167.A OE2 no hydrogen 2.800 N/A GLU 167.A N GLU 167.A OE1 no hydrogen 2.862 N/A ALA 168.A N SER 165.A OG no hydrogen 3.251 N/A ILE 169.A N SER 165.A O no hydrogen 3.017 N/A ALA 170.A N PRO 166.A O no hydrogen 2.916 N/A TYR 171.A N GLU 167.A O no hydrogen 3.072 N/A ARG 172.A N ALA 168.A O no hydrogen 2.906 N/A LYS 173.A N GLU 167.A O no hydrogen 3.413 N/A PHE 174.A N ARG 172.A O no hydrogen 3.064 N/A THR 175.A N SER 178.A OG no hydrogen 2.946 N/A ALA 177.A N THR 175.A OG1 no hydrogen 3.026 N/A SER 178.A N THR 175.A O no hydrogen 2.966 N/A SER 178.A N THR 175.A OG1 no hydrogen 3.384 N/A SER 178.A OG THR 175.A O no hydrogen 2.645 N/A ASP 179.A N THR 175.A O no hydrogen 3.228 N/A VAL 180.A N SER 176.A O no hydrogen 2.910 N/A TRP 181.A N ALA 177.A O no hydrogen 3.139 N/A SER 182.A N SER 178.A O no hydrogen 3.039 N/A SER 182.A OG TRP 163.A O no hydrogen 2.579 N/A SER 182.A OG SER 178.A O no hydrogen 3.348 N/A TYR 183.A N ASP 179.A O no hydrogen 2.830 N/A TYR 183.A OH LEU 119.A O no hydrogen 2.765 N/A GLY 184.A N VAL 180.A O no hydrogen 3.001 N/A ILE 185.A N TRP 181.A O no hydrogen 3.243 N/A VAL 186.A N SER 182.A O no hydrogen 2.924 N/A LEU 187.A N TYR 183.A O no hydrogen 2.778 N/A TRP 188.A N GLY 184.A O no hydrogen 3.008 N/A TRP 188.A NE1 PRO 217.A O no hydrogen 2.723 N/A GLU 189.A N ILE 185.A O no hydrogen 2.776 N/A VAL 190.A N VAL 186.A O no hydrogen 2.788 N/A MET 191.A N LEU 187.A O no hydrogen 3.027 N/A SER 192.A N TRP 188.A O no hydrogen 2.849 N/A SER 192.A OG TRP 188.A O no hydrogen 2.922 N/A TYR 193.A N VAL 190.A O no hydrogen 2.880 N/A GLY 194.A N GLU 189.A O no hydrogen 2.822 N/A ARG 196.A NE TRP 199.A O no hydrogen 3.005 N/A TRP 199.A N ARG 196.A O no hydrogen 2.890 N/A MET 201.A N TYR 198.A O no hydrogen 3.077 N/A SER 202.A OG ASP 205.A OD2 no hydrogen 3.040 N/A ASP 205.A N SER 202.A O no hydrogen 3.140 N/A VAL 206.A N SER 202.A O no hydrogen 3.139 N/A ILE 207.A N ASN 203.A O no hydrogen 2.903 N/A LYS 208.A N GLN 204.A O no hydrogen 2.915 N/A LYS 208.A NZ GLU 212.A OE2 no hydrogen 3.495 N/A ALA 209.A N ASP 205.A O no hydrogen 2.834 N/A VAL 210.A N VAL 206.A O no hydrogen 3.142 N/A ASP 211.A N ILE 207.A O no hydrogen 3.065 N/A GLU 212.A N LYS 208.A O no hydrogen 2.867 N/A GLY 213.A N VAL 210.A O no hydrogen 2.894 N/A TYR 214.A N ALA 209.A O no hydrogen 2.953 N/A ARG 215.A N LEU 264.A O no hydrogen 2.724 N/A ARG 215.A NE TRP 234.A O no hydrogen 3.164 N/A ARG 215.A NH1 VAL 210.A O no hydrogen 2.826 N/A ARG 215.A NH1 TYR 214.A O no hydrogen 3.114 N/A ARG 215.A NH2 TRP 234.A O no hydrogen 2.904 N/A CYS 222.A N PRO 219.A O no hydrogen 3.064 N/A CYS 222.A SG PRO 223.A O no hydrogen 3.469 N/A ALA 224.A N ILE 259.A O no hydrogen 2.804 N/A LEU 226.A N PRO 223.A O no hydrogen 3.055 N/A TYR 227.A N PRO 223.A O no hydrogen 3.126 N/A TYR 227.A OH LEU 216.A O no hydrogen 2.693 N/A GLN 228.A N ALA 224.A O no hydrogen 2.856 N/A GLN 228.A NE2 ASP 232.A OD1 no hydrogen 2.940 N/A LEU 229.A N ALA 225.A O no hydrogen 3.170 N/A MET 230.A N LEU 226.A O no hydrogen 3.116 N/A LEU 231.A N TYR 227.A O no hydrogen 3.040 N/A ASP 232.A N GLN 228.A O no hydrogen 2.860 N/A CYS 233.A N LEU 229.A O no hydrogen 2.986 N/A CYS 233.A SG LEU 229.A O no hydrogen 3.369 N/A TRP 234.A N MET 230.A O no hydrogen 2.997 N/A TRP 234.A N LEU 231.A O no hydrogen 3.113 N/A GLN 235.A N ASP 232.A O no hydrogen 3.174 N/A ASN 239.A N ASP 237.A OD1 no hydrogen 3.035 N/A ASN 240.A N ASP 237.A O no hydrogen 2.795 N/A ARG 241.A N ARG 238.A O no hydrogen 3.225 N/A ARG 241.A NE GLN 235.A O no hydrogen 2.935 N/A ARG 241.A NH1 GLU 167.A OE2 no hydrogen 2.887 N/A ARG 241.A NH1 ALA 177.A O no hydrogen 2.956 N/A ARG 241.A NH2 GLU 167.A OE1 no hydrogen 2.906 N/A ARG 241.A NH2 GLN 235.A O no hydrogen 3.093 N/A LYS 243.A N GLN 246.A OE1 no hydrogen 2.754 N/A ILE 247.A N LYS 243.A O no hydrogen 3.027 N/A VAL 248.A N PHE 244.A O no hydrogen 2.816 N/A SER 249.A N GLU 245.A O no hydrogen 2.969 N/A SER 249.A OG GLU 245.A O no hydrogen 3.238 N/A ILE 250.A N GLN 246.A O no hydrogen 2.707 N/A LEU 251.A N ILE 247.A O no hydrogen 2.963 N/A ASP 252.A N VAL 248.A O no hydrogen 2.945 N/A LYS 253.A N SER 249.A O no hydrogen 3.238 N/A LEU 254.A N ILE 250.A O no hydrogen 3.184 N/A ILE 255.A N LEU 251.A O no hydrogen 2.979 N/A ARG 256.A N LYS 253.A O no hydrogen 3.210 N/A THR 261.A N CYS 222.A O no hydrogen 3.081 N/A LEU 264.A N ARG 215.A O no hydrogen 2.915 N/A