Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5u1p_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N ASP 72.A OD2 no hydrogen 2.965 N/A THR 3.A OG1 ASN 27.A OD1 no hydrogen 3.072 N/A VAL 4.A N ASN 27.A O no hydrogen 2.977 N/A LEU 5.A N VAL 73.A O no hydrogen 2.921 N/A ILE 6.A N ILE 29.A O no hydrogen 2.815 N/A VAL 7.A N VAL 75.A O no hydrogen 2.930 N/A GLY 8.A N THR 31.A OG1 no hydrogen 2.917 N/A ALA 9.A N THR 31.A O no hydrogen 2.929 N/A ARG 11.A NH2 ASP 180.A OD2 no hydrogen 2.841 N/A ARG 15.A N ARG 11.A O no hydrogen 3.213 N/A ARG 15.A NH2 SER 10.A O no hydrogen 2.906 N/A GLU 16.A N GLY 12.A O no hydrogen 3.208 N/A PHE 17.A N LEU 13.A O no hydrogen 2.829 N/A VAL 18.A N GLY 14.A O no hydrogen 3.144 N/A ARG 19.A N ARG 15.A O no hydrogen 2.863 N/A ARG 19.A NE GLU 16.A OE2 no hydrogen 2.876 N/A ARG 19.A NH2 GLU 16.A OE1 no hydrogen 2.722 N/A GLN 20.A N GLU 16.A O no hydrogen 2.973 N/A GLN 20.A NE2 GLU 16.A OE1 no hydrogen 2.771 N/A GLN 20.A NE2 ALA 191.A O no hydrogen 3.281 N/A GLN 20.A NE2 THR 195.A OG1 no hydrogen 3.207 N/A TYR 21.A N PHE 17.A O no hydrogen 2.963 N/A GLN 22.A N VAL 18.A O no hydrogen 2.860 N/A ARG 23.A N ARG 19.A O no hydrogen 3.028 N/A ARG 23.A NE ASP 24.A OD1 no hydrogen 2.859 N/A ARG 23.A NH2 ASP 24.A OD1 no hydrogen 3.515 N/A ARG 23.A NH2 ASP 24.A OD2 no hydrogen 3.335 N/A ASP 24.A N GLN 20.A O no hydrogen 2.986 N/A ASP 24.A N TYR 21.A O no hydrogen 3.230 N/A GLY 25.A N GLN 22.A O no hydrogen 3.203 N/A TRP 26.A N TYR 21.A O no hydrogen 3.116 N/A ASN 27.A N LYS 2.A O no hydrogen 2.787 N/A ILE 29.A N VAL 4.A O no hydrogen 2.796 N/A ALA 30.A N HIS 47.A O no hydrogen 2.702 N/A THR 31.A N ILE 6.A O no hydrogen 3.110 N/A ALA 32.A N HIS 49.A O no hydrogen 3.258 N/A ARG 33.A NH1 ASP 52.A OD2 no hydrogen 3.437 N/A SER 37.A N ASP 34.A OD2 no hydrogen 2.865 N/A SER 37.A OG ASP 34.A OD1 no hydrogen 2.790 N/A SER 37.A OG ASP 34.A OD2 no hydrogen 3.098 N/A LEU 38.A N ASP 34.A O no hydrogen 2.977 N/A ALA 39.A N ASP 35.A O no hydrogen 2.878 N/A ALA 40.A N ALA 36.A O no hydrogen 3.072 N/A LEU 41.A N SER 37.A O no hydrogen 3.099 N/A ARG 42.A N LEU 38.A O no hydrogen 2.994 N/A ARG 42.A NE ALA 48.A O no hydrogen 3.419 N/A ARG 42.A NH2 ALA 48.A O no hydrogen 2.954 N/A ALA 43.A N ALA 39.A O no hydrogen 2.987 N/A LEU 44.A N ALA 40.A O no hydrogen 3.141 N/A GLY 45.A N ARG 42.A O no hydrogen 2.956 N/A ALA 46.A N LEU 41.A O no hydrogen 3.201 N/A HIS 47.A N VAL 28.A O no hydrogen 2.974 N/A HIS 49.A N ALA 30.A O no hydrogen 2.860 N/A LEU 51.A N ALA 32.A O no hydrogen 2.900 N/A ASP 52.A N GLN 58.A OE1 no hydrogen 2.731 N/A THR 54.A N ASP 52.A OD1 no hydrogen 2.955 N/A THR 54.A OG1 ASP 52.A OD1 no hydrogen 2.662 N/A THR 54.A OG1 GLN 55.A OE1 no hydrogen 3.382 N/A GLN 55.A N ASP 52.A O no hydrogen 2.912 N/A GLN 55.A NE2 GLU 57.A OE2 no hydrogen 2.936 N/A GLU 57.A N GLU 57.A OE1 no hydrogen 2.598 N/A GLN 58.A N GLN 55.A O no hydrogen 2.913 N/A ILE 59.A N GLN 55.A O no hydrogen 3.131 N/A ALA 60.A N PRO 56.A O no hydrogen 2.925 N/A ALA 61.A N GLU 57.A O no hydrogen 3.021 N/A LEU 62.A N GLN 58.A O no hydrogen 2.861 N/A GLY 63.A N ILE 59.A O no hydrogen 3.090 N/A TRP 64.A N ALA 60.A O no hydrogen 3.031 N/A LYS 65.A N ALA 61.A O no hydrogen 2.913 N/A LEU 66.A N LEU 62.A O no hydrogen 2.818 N/A ASP 67.A N GLY 63.A O no hydrogen 3.165 N/A GLU 69.A N LEU 66.A O no hydrogen 2.976 N/A LEU 71.A N LEU 117.A O no hydrogen 2.966 N/A VAL 73.A N THR 3.A O no hydrogen 3.281 N/A ALA 74.A N VAL 124.A O no hydrogen 2.978 N/A VAL 75.A N LEU 5.A O no hydrogen 2.880 N/A VAL 76.A N ALA 126.A O no hydrogen 2.846 N/A VAL 77.A N VAL 7.A O no hydrogen 2.872 N/A SER 78.A N VAL 7.A O no hydrogen 3.231 N/A VAL 80.A N ASN 103.A OD1 no hydrogen 2.985 N/A ARG 84.A NH2 MET 181.A O no hydrogen 2.980 N/A GLU 86.A N GLU 89.A OE2 no hydrogen 2.648 N/A GLY 87.A N GLU 89.A OE2 no hydrogen 3.091 N/A PHE 96.A N ALA 92.A O no hydrogen 2.942 N/A ASP 97.A N SER 93.A O no hydrogen 3.036 N/A THR 98.A N ASP 94.A O no hydrogen 2.963 N/A THR 98.A OG1 ASP 94.A O no hydrogen 3.000 N/A VAL 99.A N ASP 95.A O no hydrogen 3.064 N/A MET 100.A N PHE 96.A O no hydrogen 2.938 N/A HIS 101.A N ASP 97.A O no hydrogen 2.716 N/A THR 102.A N THR 98.A O no hydrogen 3.241 N/A THR 102.A OG1 THR 98.A O no hydrogen 2.722 N/A ASN 103.A N VAL 99.A O no hydrogen 2.819 N/A ASN 103.A ND2 VAL 80.A O no hydrogen 2.937 N/A ASN 103.A ND2 SER 149.A OG no hydrogen 2.997 N/A VAL 104.A N MET 100.A O no hydrogen 2.992 N/A ARG 105.A N MET 100.A O no hydrogen 2.938 N/A GLY 106.A N HIS 101.A O no hydrogen 2.912 N/A MET 108.A N VAL 104.A O no hydrogen 2.943 N/A GLN 109.A N ARG 105.A O no hydrogen 2.916 N/A LEU 110.A N GLY 106.A O no hydrogen 2.897 N/A LEU 110.A N PRO 107.A O no hydrogen 3.265 N/A LEU 111.A N PRO 107.A O no hydrogen 2.864 N/A ILE 113.A N LEU 110.A O no hydrogen 2.888 N/A LEU 114.A N LEU 110.A O no hydrogen 3.155 N/A LEU 115.A N LEU 111.A O no hydrogen 2.927 N/A VAL 118.A N LEU 114.A O no hydrogen 2.889 N/A GLU 119.A N LEU 115.A O no hydrogen 2.777 N/A ASP 120.A N PRO 116.A O no hydrogen 3.001 N/A ALA 121.A N VAL 118.A O no hydrogen 3.054 N/A ARG 122.A N GLU 119.A O no hydrogen 3.068 N/A GLY 123.A N VAL 118.A O no hydrogen 3.008 N/A VAL 124.A N ASP 72.A O no hydrogen 2.973 N/A LEU 125.A N ALA 168.A O no hydrogen 2.821 N/A ALA 126.A N ALA 74.A O no hydrogen 2.854 N/A VAL 127.A N ILE 170.A O no hydrogen 3.171 N/A VAL 128.A N VAL 76.A O no hydrogen 2.858 N/A SER 129.A N LEU 172.A O no hydrogen 2.825 N/A SER 129.A OG LYS 150.A O no hydrogen 3.335 N/A SER 129.A OG ASN 154.A OD1 no hydrogen 2.798 N/A ARG 131.A N HIS 173.A ND1 no hydrogen 3.023 N/A ARG 131.A NE GLU 137.A OE1 no hydrogen 3.294 N/A ARG 131.A NE GLU 137.A OE2 no hydrogen 2.711 N/A ARG 131.A NH1 GLN 217.A OE1 no hydrogen 2.997 N/A ARG 131.A NH2 GLU 137.A OE1 no hydrogen 2.753 N/A ARG 131.A NH2 GLU 137.A OE2 no hydrogen 3.454 N/A MET 132.A N SER 130.A OG no hydrogen 2.986 N/A GLY 133.A N SER 130.A O no hydrogen 2.899 N/A SER 134.A N ARG 131.A O no hydrogen 2.995 N/A SER 134.A OG SER 224.A O no hydrogen 2.738 N/A SER 134.A OG TRP 225.A OXT no hydrogen 3.365 N/A ILE 135.A N TRP 225.A O no hydrogen 2.791 N/A SER 136.A N.A TRP 225.A OXT no hydrogen 3.000 N/A SER 136.A N.B TRP 225.A OXT no hydrogen 2.999 N/A SER 136.A OG.A SER 224.A OG.A no hydrogen 2.720 N/A SER 136.A OG.A TRP 225.A OXT no hydrogen 2.609 N/A SER 136.A OG.B TRP 225.A OXT no hydrogen 3.174 N/A GLU 137.A N SER 134.A OG no hydrogen 3.151 N/A ALA 138.A N SER 134.A O no hydrogen 3.200 N/A THR 141.A OG1 GLU 86.A O no hydrogen 2.810 N/A GLY 143.A N THR 85.A O no hydrogen 2.910 N/A TRP 144.A NE1 GLU 89.A O no hydrogen 3.016 N/A ARG 147.A N GLY 143.A O no hydrogen 2.890 N/A ARG 147.A NE THR 142.A O no hydrogen 2.701 N/A ARG 147.A NH1 MET 132.A O no hydrogen 2.982 N/A ARG 147.A NH1 THR 139.A OG1 no hydrogen 2.841 N/A ARG 147.A NH2 THR 142.A OG1 no hydrogen 3.113 N/A ALA 148.A N TRP 144.A O no hydrogen 2.945 N/A SER 149.A N LEU 145.A O no hydrogen 2.988 N/A SER 149.A OG TYR 146.A O no hydrogen 2.777 N/A LYS 150.A N TYR 146.A O no hydrogen 3.020 N/A LYS 150.A N ARG 147.A O no hydrogen 3.111 N/A LYS 150.A NZ VAL 128.A O no hydrogen 3.039 N/A ALA 151.A N ARG 147.A O no hydrogen 2.919 N/A ALA 152.A N ALA 148.A O no hydrogen 2.954 N/A LEU 153.A N SER 149.A O no hydrogen 2.932 N/A ASN 154.A N LYS 150.A O no hydrogen 2.848 N/A ASP 155.A N ALA 151.A O no hydrogen 2.974 N/A VAL 156.A N ALA 152.A O no hydrogen 2.900 N/A LEU 157.A N LEU 153.A O no hydrogen 2.914 N/A ARG 158.A N ASN 154.A O no hydrogen 2.838 N/A ILE 159.A N ASP 155.A O no hydrogen 2.848 N/A ALA 160.A N VAL 156.A O no hydrogen 3.013 N/A SER 161.A N LEU 157.A O no hydrogen 2.970 N/A SER 161.A OG ARG 158.A O no hydrogen 2.663 N/A LEU 162.A N ARG 158.A O no hydrogen 3.311 N/A LEU 162.A N ILE 159.A O no hydrogen 3.121 N/A GLN 163.A N ALA 160.A O no hydrogen 3.038 N/A GLN 163.A NE2.B ALA 160.A O no hydrogen 3.240 N/A THR 164.A OG1 SER 161.A O no hydrogen 3.403 N/A THR 164.A OG1 ALA 167.A O no hydrogen 3.277 N/A ARG 165.A N GLU 119.A OE2 no hydrogen 2.807 N/A HIS 166.A N GLU 119.A OE1 no hydrogen 2.709 N/A HIS 166.A N GLU 119.A OE2 no hydrogen 3.345 N/A ALA 167.A N GLU 119.A OE2 no hydrogen 3.332 N/A ALA 168.A N GLY 123.A O no hydrogen 2.978 N/A CYS 169.A N ASN 212.A OD1 no hydrogen 2.844 N/A ILE 170.A N LEU 125.A O no hydrogen 2.932 N/A SER 171.A N ARG 214.A O no hydrogen 3.040 N/A SER 171.A OG ASN 154.A OD1 no hydrogen 2.787 N/A LEU 172.A N VAL 127.A O no hydrogen 2.948 N/A HIS 173.A N PHE 216.A O no hydrogen 2.781 N/A TRP 176.A NE1 GLY 182.A O no hydrogen 3.088 N/A ARG 178.A N LEU 188.A O no hydrogen 2.773 N/A ARG 178.A NH1 ALA 186.A O no hydrogen 3.042 N/A ARG 178.A NH1 ALA 187.A O no hydrogen 3.109 N/A THR 179.A N VAL 177.A O no hydrogen 2.837 N/A MET 181.A N THR 179.A OG1 no hydrogen 3.135 N/A GLY 182.A N THR 179.A OG1 no hydrogen 3.013 N/A GLY 183.A N THR 179.A O no hydrogen 2.875 N/A ALA 186.A N GLY 183.A O no hydrogen 3.285 N/A LEU 188.A N TRP 176.A O no hydrogen 2.895 N/A THR 192.A OG1 ASP 189.A OD1 no hydrogen 2.555 N/A SER 193.A N ASP 189.A O no hydrogen 3.256 N/A SER 193.A OG PRO 174.A O no hydrogen 2.653 N/A VAL 194.A N PRO 190.A O no hydrogen 2.841 N/A THR 195.A N ALA 191.A O no hydrogen 2.800 N/A THR 195.A OG1 GLN 20.A OE1 no hydrogen 3.349 N/A THR 195.A OG1 ALA 191.A O no hydrogen 2.899 N/A GLY 196.A N THR 192.A O no hydrogen 3.174 N/A MET 197.A N SER 193.A O no hydrogen 2.939 N/A ARG 198.A N VAL 194.A O no hydrogen 2.830 N/A ARG 198.A NH1 GLN 20.A OE1 no hydrogen 2.922 N/A ARG 198.A NH1 ASP 24.A OD2 no hydrogen 3.282 N/A ARG 198.A NH2 ASP 24.A OD2 no hydrogen 2.774 N/A ARG 199.A N THR 195.A O no hydrogen 3.173 N/A VAL 200.A N GLY 196.A O no hydrogen 2.961 N/A ILE 201.A N MET 197.A O no hydrogen 2.878 N/A ALA 202.A N ARG 198.A O no hydrogen 2.889 N/A GLU 203.A N ARG 199.A O no hydrogen 2.807 N/A ALA 204.A N VAL 200.A O no hydrogen 2.825 N/A GLY 205.A N ILE 201.A O no hydrogen 2.978 N/A ALA 206.A N ALA 202.A O no hydrogen 3.128 N/A ASP 207.A N ALA 204.A O no hydrogen 3.241 N/A GLN 210.A N ASP 207.A O no hydrogen 3.151 N/A GLN 210.A NE2 SER 209.A OG no hydrogen 3.092 N/A SER 211.A N ASP 207.A O no hydrogen 3.014 N/A SER 211.A OG.A ALA 204.A O no hydrogen 2.934 N/A SER 211.A OG.A ASP 207.A O no hydrogen 3.281 N/A SER 211.A OG.A VAL 208.A O no hydrogen 3.525 N/A ASN 212.A N VAL 208.A O no hydrogen 3.016 N/A ASN 212.A ND2 SER 161.A O no hydrogen 2.891 N/A GLY 213.A N CYS 169.A O no hydrogen 2.662 N/A ARG 214.A NE GLU 222.A OE1 no hydrogen 2.926 N/A ARG 214.A NE GLU 222.A OE2 no hydrogen 3.235 N/A ARG 214.A NH1 GLN 210.A O no hydrogen 2.785 N/A ARG 214.A NH2 GLU 222.A OE2 no hydrogen 2.693 N/A PHE 216.A N SER 171.A O no hydrogen 2.762 N/A GLN 217.A N VAL 221.A O no hydrogen 2.798 N/A GLN 217.A NE2 ASP 219.A OD1 no hydrogen 3.054 N/A GLN 217.A NE2 ASP 219.A OD2 no hydrogen 3.388 N/A GLY 220.A N GLN 217.A O no hydrogen 2.930 N/A VAL 221.A N ASP 219.A OD1 no hydrogen 3.329 N/A LEU 223.A N PHE 215.A O no hydrogen 2.878 N/A SER 224.A OG.A SER 136.A OG.A no hydrogen 2.720 N/A