Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ya1_F.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N GLY 2.A O no hydrogen 3.293 N/A ASN 7.A ND2 HIS 118.A O no hydrogen 2.775 N/A ASN 7.A ND2 VAL 124.A O no hydrogen 2.977 N/A SER 8.A OG ASN 7.A O no hydrogen 2.498 N/A SER 11.A N ARG 15.A O no hydrogen 2.863 N/A SER 11.A OG ASP 13.A OD2 no hydrogen 3.235 N/A SER 11.A OG ARG 15.A O no hydrogen 3.437 N/A ASP 13.A N SER 11.A OG no hydrogen 3.209 N/A GLY 14.A N SER 11.A O no hydrogen 2.824 N/A ARG 15.A N SER 11.A OG no hydrogen 3.153 N/A ARG 15.A NE GLU 20.A OE2 no hydrogen 2.801 N/A ARG 15.A NH2 GLU 20.A OE1 no hydrogen 2.841 N/A ASN 16.A ND2 ASN 7.A OD1 no hydrogen 3.402 N/A VAL 19.A N ASN 16.A O no hydrogen 3.068 N/A GLU 20.A N ASN 16.A O no hydrogen 3.272 N/A TYR 21.A N PHE 17.A O no hydrogen 2.828 N/A TYR 21.A OH ASP 4.A OD2 no hydrogen 2.645 N/A ALA 22.A N GLN 18.A O no hydrogen 3.110 N/A VAL 23.A N VAL 19.A O no hydrogen 3.167 N/A LYS 24.A N TYR 21.A O no hydrogen 3.170 N/A VAL 26.A N ALA 22.A O no hydrogen 3.218 N/A GLU 27.A N VAL 23.A O no hydrogen 2.855 N/A ASN 28.A N LYS 24.A O no hydrogen 3.095 N/A GLY 29.A N VAL 26.A O no hydrogen 3.014 N/A THR 30.A OG1 GLU 46.A O no hydrogen 2.940 N/A THR 31.A N GLU 46.A OE2 no hydrogen 3.033 N/A THR 31.A OG1 GLU 46.A OE2 no hydrogen 3.220 N/A SER 32.A N THR 160.A O no hydrogen 2.966 N/A SER 32.A OG SER 74.A OG no hydrogen 2.654 N/A ILE 33.A N ALA 44.A O no hydrogen 2.862 N/A GLY 34.A N ALA 158.A O no hydrogen 2.814 N/A ILE 35.A N VAL 42.A O no hydrogen 2.786 N/A LYS 36.A N LYS 156.A O no hydrogen 2.978 N/A CYS 37.A N GLY 40.A O no hydrogen 2.923 N/A ASN 38.A N LEU 182.A O no hydrogen 2.704 N/A VAL 41.A N CYS 214.A O no hydrogen 2.824 N/A VAL 42.A N ILE 35.A O no hydrogen 2.784 N/A PHE 43.A N SER 212.A O no hydrogen 2.962 N/A ALA 44.A N ILE 33.A O no hydrogen 3.182 N/A VAL 45.A N GLU 210.A O no hydrogen 2.996 N/A GLU 46.A N THR 31.A O no hydrogen 2.803 N/A LYS 47.A N GLU 208.A O no hydrogen 3.055 N/A LYS 47.A NZ ASN 59.A O no hydrogen 3.042 N/A LYS 47.A NZ GLU 208.A OE2 no hydrogen 3.144 N/A LYS 47.A NZ GLU 210.A OE2 no hydrogen 3.220 N/A ILE 49.A N ASP 206.A O no hydrogen 2.884 N/A LEU 53.A N SER 51.A OG no hydrogen 3.229 N/A GLN 57.A N GLU 208.A OE1 no hydrogen 3.001 N/A GLN 57.A N GLU 208.A OE2 no hydrogen 3.200 N/A LYS 58.A N VAL 55.A O no hydrogen 3.450 N/A VAL 60.A N LYS 58.A O no hydrogen 2.906 N/A LYS 61.A N GLU 210.A OE1 no hydrogen 3.152 N/A LYS 61.A N GLU 210.A OE2 no hydrogen 3.358 N/A LYS 61.A NZ THR 30.A OG1 no hydrogen 3.296 N/A ILE 62.A N GLU 210.A OE1 no hydrogen 2.861 N/A GLN 63.A N CYS 71.A O no hydrogen 2.854 N/A VAL 65.A N ILE 69.A O no hydrogen 2.804 N/A ARG 67.A N ASP 66.A OD1 no hydrogen 2.732 N/A HIS 68.A NE2 ILE 102.A O no hydrogen 2.697 N/A ILE 69.A N VAL 65.A O no hydrogen 3.232 N/A GLY 70.A N GLY 134.A O no hydrogen 2.913 N/A CYS 71.A N GLN 63.A O no hydrogen 2.731 N/A VAL 72.A N ILE 132.A O no hydrogen 2.806 N/A TYR 73.A OH GLN 63.A OE1 no hydrogen 2.593 N/A SER 74.A N SER 130.A O no hydrogen 3.173 N/A SER 74.A OG THR 30.A O no hydrogen 2.592 N/A SER 74.A OG SER 32.A OG no hydrogen 2.654 N/A SER 74.A OG THR 160.A O no hydrogen 3.486 N/A LEU 76.A N GLY 128.A O no hydrogen 2.875 N/A GLY 80.A N LEU 76.A O no hydrogen 3.294 N/A ARG 81.A N ILE 77.A O no hydrogen 3.039 N/A HIS 82.A N PRO 78.A O no hydrogen 2.970 N/A HIS 82.A NE2 TYR 114.A OH no hydrogen 2.816 N/A LEU 83.A N ASP 79.A O no hydrogen 3.091 N/A VAL 84.A N GLY 80.A O no hydrogen 2.996 N/A ASN 85.A N ARG 81.A O no hydrogen 2.946 N/A ARG 86.A N HIS 82.A O no hydrogen 3.152 N/A ARG 86.A NE GLU 90.A OE2 no hydrogen 2.981 N/A ARG 86.A NH2 GLU 90.A OE2 no hydrogen 3.031 N/A GLY 87.A N LEU 83.A O no hydrogen 2.907 N/A ARG 88.A N VAL 84.A O no hydrogen 2.818 N/A ARG 88.A NE VAL 64.A O no hydrogen 2.908 N/A ARG 88.A NH2 VAL 64.A O no hydrogen 2.775 N/A GLU 89.A N ASN 85.A O no hydrogen 3.196 N/A GLU 90.A N ARG 86.A O no hydrogen 2.897 N/A ALA 91.A N GLY 87.A O no hydrogen 2.897 N/A ALA 92.A N ARG 88.A O no hydrogen 3.076 N/A SER 93.A N GLU 89.A O no hydrogen 3.059 N/A SER 93.A OG GLU 90.A O no hydrogen 3.131 N/A PHE 94.A N GLU 90.A O no hydrogen 3.056 N/A LYS 95.A N ALA 91.A O no hydrogen 3.153 N/A LYS 96.A N ALA 92.A O no hydrogen 2.909 N/A LEU 97.A N SER 93.A O no hydrogen 3.201 N/A TYR 98.A N PHE 94.A O no hydrogen 2.889 N/A LYS 99.A N LYS 95.A O no hydrogen 2.814 N/A THR 100.A N TYR 98.A O no hydrogen 2.725 N/A THR 100.A OG1 PRO 101.A O no hydrogen 3.496 N/A ILE 104.A N ASP 137.A OD2 no hydrogen 3.087 N/A PHE 107.A N PRO 103.A O no hydrogen 2.843 N/A ALA 108.A N ILE 104.A O no hydrogen 2.794 N/A ASP 109.A N PRO 105.A O no hydrogen 3.227 N/A ARG 110.A N ALA 106.A O no hydrogen 3.235 N/A ARG 110.A NH1 GLU 90.A OE1 no hydrogen 2.869 N/A LEU 111.A N PHE 107.A O no hydrogen 3.152 N/A GLY 112.A N ALA 108.A O no hydrogen 2.865 N/A GLN 113.A N ASP 109.A O no hydrogen 2.768 N/A GLN 113.A NE2 ASP 109.A OD1 no hydrogen 3.521 N/A GLN 113.A NE2 ASP 109.A OD2 no hydrogen 3.284 N/A TYR 114.A N ARG 110.A O no hydrogen 3.314 N/A TYR 114.A OH HIS 82.A NE2 no hydrogen 2.816 N/A VAL 115.A N LEU 111.A O no hydrogen 2.960 N/A GLN 116.A N GLY 112.A O no hydrogen 2.892 N/A ALA 117.A N GLN 113.A O no hydrogen 2.933 N/A HIS 118.A N VAL 115.A O no hydrogen 3.186 N/A HIS 118.A ND1 TYR 114.A O no hydrogen 2.697 N/A THR 119.A N GLN 116.A O no hydrogen 2.992 N/A THR 119.A OG1 GLN 116.A O no hydrogen 2.663 N/A LEU 120.A N ALA 117.A O no hydrogen 3.323 N/A ARG 125.A NH1 ASP 79.A OD2 no hydrogen 2.694 N/A ARG 125.A NH2 ASP 79.A OD1 no hydrogen 3.110 N/A ARG 125.A NH2 ASP 79.A OD2 no hydrogen 3.425 N/A GLY 128.A N ASP 79.A OD2 no hydrogen 2.896 N/A SER 130.A N SER 74.A O no hydrogen 3.264 N/A THR 131.A N LEU 146.A O no hydrogen 2.924 N/A ILE 132.A N VAL 72.A O no hydrogen 2.697 N/A PHE 133.A N TYR 144.A O no hydrogen 2.940 N/A GLY 134.A N GLY 70.A O no hydrogen 3.115 N/A GLY 135.A N HIS 142.A O no hydrogen 3.120 N/A ASP 137.A N GLY 140.A O no hydrogen 3.060 N/A ASN 139.A N ASP 137.A OD1 no hydrogen 2.700 N/A GLY 140.A N ASP 137.A O no hydrogen 3.124 N/A HIS 142.A N GLY 135.A O no hydrogen 3.019 N/A TYR 144.A N PHE 133.A O no hydrogen 2.745 N/A MET 145.A N TRP 153.A O no hydrogen 3.427 N/A LEU 146.A N THR 131.A O no hydrogen 2.811 N/A GLU 147.A N SER 151.A O no hydrogen 2.801 N/A GLY 150.A N GLU 147.A O no hydrogen 2.872 N/A SER 151.A N SER 149.A OG no hydrogen 3.188 N/A TYR 152.A OH ASP 109.A OD1 no hydrogen 2.777 N/A TYR 155.A N LEU 143.A O no hydrogen 2.775 N/A ALA 158.A N GLY 34.A O no hydrogen 2.850 N/A THR 160.A N SER 32.A O no hydrogen 2.970 N/A LYS 162.A N GLY 29.A O no hydrogen 2.894 N/A GLY 163.A N THR 31.A OG1 no hydrogen 3.098 N/A ARG 164.A NE GLY 161.A O no hydrogen 2.686 N/A ARG 164.A NH2 GLY 161.A O no hydrogen 3.403 N/A ALA 167.A N GLY 163.A O no hydrogen 3.183 N/A LYS 168.A N ARG 164.A O no hydrogen 2.768 N/A ALA 169.A N GLN 165.A O no hydrogen 3.182 N/A GLU 170.A N SER 166.A O no hydrogen 3.225 N/A LEU 171.A N ALA 167.A O no hydrogen 2.843 N/A GLU 172.A N LYS 168.A O no hydrogen 2.828 N/A LYS 173.A N ALA 169.A O no hydrogen 3.199 N/A LYS 173.A NZ GLU 170.A OE2 no hydrogen 3.293 N/A LEU 174.A N GLU 170.A O no hydrogen 3.325 N/A VAL 175.A N LEU 171.A O no hydrogen 3.091 N/A ASP 176.A N GLU 172.A O no hydrogen 3.161 N/A HIS 177.A N LYS 173.A O no hydrogen 2.860 N/A GLU 186.A N SER 183.A OG no hydrogen 3.089 N/A ALA 187.A N SER 183.A O no hydrogen 2.840 N/A VAL 188.A N ALA 184.A O no hydrogen 3.088 N/A LYS 189.A N ARG 185.A O no hydrogen 3.358 N/A GLN 190.A N GLU 186.A O no hydrogen 2.875 N/A ALA 191.A N ALA 187.A O no hydrogen 2.801 N/A ALA 192.A N VAL 188.A O no hydrogen 3.125 N/A LYS 193.A N LYS 189.A O no hydrogen 3.131 N/A ILE 194.A N GLN 190.A O no hydrogen 2.976 N/A ILE 195.A N ALA 191.A O no hydrogen 3.214 N/A TYR 196.A N ALA 192.A O no hydrogen 3.155 N/A LEU 197.A N LYS 193.A O no hydrogen 2.805 N/A ALA 198.A N ILE 194.A O no hydrogen 2.796 N/A HIS 199.A ND1 GLU 46.A OE1 no hydrogen 2.596 N/A GLU 200.A N LEU 197.A O no hydrogen 3.480 N/A ASP 201.A N ALA 198.A O no hydrogen 3.483 N/A ASN 202.A N HIS 199.A O no hydrogen 3.000 N/A GLU 204.A N GLU 204.A OE2 no hydrogen 2.721 N/A GLU 208.A N LYS 47.A O no hydrogen 2.736 N/A GLU 210.A N VAL 45.A O no hydrogen 3.360 N/A SER 212.A N PHE 43.A O no hydrogen 2.836 N/A SER 212.A OG HIS 223.A NE2 no hydrogen 2.983 N/A TRP 213.A N LYS 224.A O no hydrogen 2.884 N/A CYS 214.A N VAL 41.A O no hydrogen 2.999 N/A CYS 214.A SG HIS 68.A O no hydrogen 3.664 N/A SER 215.A N THR 219.A OG1 no hydrogen 2.701 N/A SER 215.A OG ASP 39.A OD1 no hydrogen 2.845 N/A SER 215.A OG ASP 39.A OD2 no hydrogen 3.199 N/A LEU 216.A N ASP 39.A O no hydrogen 2.954 N/A SER 217.A N ASP 39.A OD2 no hydrogen 2.937 N/A SER 217.A OG ASP 39.A OD2 no hydrogen 2.650 N/A GLU 218.A N SER 215.A OG no hydrogen 3.407 N/A THR 219.A N SER 215.A O no hydrogen 2.944 N/A THR 219.A OG1 SER 215.A O no hydrogen 2.849 N/A THR 219.A OG1 LEU 222.A O no hydrogen 2.775 N/A GLY 221.A N SER 215.A O no hydrogen 2.922 N/A LEU 222.A N THR 219.A O no hydrogen 3.196 N/A HIS 223.A N ARG 67.A O no hydrogen 2.961 N/A HIS 223.A NE2 SER 212.A OG no hydrogen 2.983 N/A LYS 224.A N TRP 213.A O no hydrogen 2.996 N/A VAL 226.A N ILE 211.A O no hydrogen 2.890 N/A GLN 232.A N GLY 228.A O no hydrogen 2.976 N/A GLN 232.A NE2 GLN 232.A O no hydrogen 3.489 N/A GLN 232.A NE2 ASP 236.A OD1 no hydrogen 3.168 N/A GLU 233.A N ASP 229.A O no hydrogen 2.885 N/A ALA 234.A N LEU 230.A O no hydrogen 3.226 N/A ILE 235.A N LEU 231.A O no hydrogen 2.943 N/A ASP 236.A N GLN 232.A O no hydrogen 2.879 N/A PHE 237.A N GLU 233.A O no hydrogen 3.078 N/A ALA 238.A N ALA 234.A O no hydrogen 2.969 N/A GLN 239.A N ILE 235.A O no hydrogen 2.879 N/A LYS 240.A N ASP 236.A O no hydrogen 2.967 N/A GLU 241.A N PHE 237.A O no hydrogen 3.315 N/A GLU 241.A N ALA 238.A O no hydrogen 3.194 N/A ILE 242.A N ALA 238.A O no hydrogen 3.304 N/A