Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4rot_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 9.A N TYR 30.A O no hydrogen 2.911 N/A SER 10.A OG.A GLU 69.A OE2 no hydrogen 3.158 N/A SER 10.A OG.B GLU 69.A OE1 no hydrogen 2.521 N/A SER 10.A OG.B GLU 69.A OE2 no hydrogen 2.856 N/A ILE 11.A N VAL 28.A O no hydrogen 2.708 N/A ILE 13.A N VAL 26.A O no hydrogen 2.862 N/A TYR 15.A N ARG 24.A O no hydrogen 2.882 N/A SER 17.A N MET 22.A O no hydrogen 2.799 N/A SER 17.A OG GLU 105.A OE1 no hydrogen 2.559 N/A VAL 19.A N GLU 105.A OE2 no hydrogen 3.036 N/A LEU 20.A N SER 17.A OG no hydrogen 2.987 N/A GLY 21.A N SER 17.A O no hydrogen 2.752 N/A MET 22.A N SER 17.A O no hydrogen 3.257 N/A ARG 24.A N TYR 15.A O no hydrogen 2.796 N/A ARG 24.A NH1 ASP 85.A OD2 no hydrogen 2.847 N/A ARG 24.A NH2 SER 83.A O no hydrogen 3.271 N/A ARG 24.A NH2 ASP 85.A OD1 no hydrogen 3.473 N/A ARG 24.A NH2 ASP 85.A OD2 no hydrogen 3.287 N/A VAL 26.A N ILE 13.A O no hydrogen 2.940 N/A ASN 27.A N MET 81.A O no hydrogen 3.121 N/A ASN 27.A ND2 GLU 59.A O no hydrogen 3.098 N/A ASN 27.A ND2 ASN 60.A OD1 no hydrogen 2.908 N/A ASN 27.A ND2 GLN 63.A OE1 no hydrogen 2.912 N/A VAL 28.A N ILE 11.A O no hydrogen 2.841 N/A ILE 29.A N VAL 79.A O no hydrogen 2.964 N/A TYR 30.A N ALA 9.A O no hydrogen 2.900 N/A SER 34.A N ASP 32.A OD1 no hydrogen 3.119 N/A SER 34.A OG ASP 32.A OD1 no hydrogen 2.822 N/A SER 34.A OG ASP 32.A OD2 no hydrogen 3.278 N/A SER 34.A OG GLU 35.A OE2 no hydrogen 3.530 N/A GLU 35.A N ASP 32.A O no hydrogen 3.052 N/A ILE 36.A N ASP 32.A O no hydrogen 3.296 N/A ASP 40.A N PRO 37.A O no hydrogen 2.989 N/A GLN 41.A N LYS 38.A O no hydrogen 3.174 N/A ASP 43.A N ASP 40.A O no hydrogen 3.187 N/A ASP 45.A N ASP 43.A OD1 no hydrogen 2.702 N/A ILE 46.A N ASN 116.A O no hydrogen 3.052 N/A VAL 48.A N LYS 123.A O no hydrogen 2.889 N/A LEU 49.A N ILE 78.A O no hydrogen 2.902 N/A TYR 50.A N PHE 125.A O no hydrogen 2.879 N/A LEU 51.A N VAL 80.A O no hydrogen 2.815 N/A LEU 52.A N ALA 127.A O no hydrogen 2.911 N/A HIS 53.A ND1 GLY 54.A O no hydrogen 2.787 N/A GLY 57.A N GLY 54.A O no hydrogen 2.917 N/A ASN 58.A N SER 61.A OG no hydrogen 3.013 N/A GLU 59.A N GLU 59.A OE1 no hydrogen 2.802 N/A ASN 60.A N ASN 58.A OD1 no hydrogen 2.966 N/A SER 61.A N ASN 58.A O no hydrogen 3.136 N/A SER 61.A OG ASN 58.A O no hydrogen 3.223 N/A TRP 62.A NE1 LEU 52.A O no hydrogen 3.039 N/A GLN 63.A NE2 GLU 69.A OE2 no hydrogen 2.784 N/A LYS 64.A N ASN 60.A O no hydrogen 3.084 N/A ARG 65.A N SER 61.A O no hydrogen 3.050 N/A THR 66.A N TRP 62.A O no hydrogen 3.193 N/A THR 66.A OG1 TRP 62.A O no hydrogen 2.669 N/A ILE 68.A N THR 66.A OG1 no hydrogen 3.177 N/A ARG 70.A N ALA 67.A O no hydrogen 2.806 N/A ARG 70.A NE GLU 264.A OE1 no hydrogen 2.919 N/A ARG 70.A NH2 GLU 264.A OE2 no hydrogen 2.919 N/A LEU 71.A N ALA 67.A O no hydrogen 2.987 N/A LEU 72.A N ILE 68.A O no hydrogen 2.997 N/A ARG 73.A N ARG 70.A O no hydrogen 3.265 N/A THR 75.A N LEU 72.A O no hydrogen 2.885 N/A ASN 76.A ND2 ASP 43.A OD2 no hydrogen 3.054 N/A ILE 78.A N PRO 47.A O no hydrogen 2.951 N/A VAL 79.A N ILE 29.A O no hydrogen 3.092 N/A VAL 80.A N LEU 49.A O no hydrogen 2.870 N/A MET 81.A N ASN 27.A O no hydrogen 2.858 N/A SER 83.A OG LYS 25.A O.A no hydrogen 3.144 N/A SER 83.A OG LYS 25.A O.B no hydrogen 3.144 N/A THR 84.A N HIS 53.A NE2 no hydrogen 3.024 N/A GLY 87.A N THR 84.A O no hydrogen 2.910 N/A TYR 89.A N THR 84.A OG1 no hydrogen 3.207 N/A TYR 89.A OH HIS 53.A O no hydrogen 2.759 N/A THR 90.A N GLY 87.A O no hydrogen 3.050 N/A THR 90.A OG1 TRP 88.A O no hydrogen 2.769 N/A THR 92.A N LEU 96.A O no hydrogen 2.930 N/A THR 92.A OG1 LEU 96.A O no hydrogen 3.294 N/A ALA 93.A N GLY 176.A O no hydrogen 2.914 N/A TYR 94.A N THR 92.A OG1 no hydrogen 3.321 N/A GLY 95.A N THR 92.A O no hydrogen 3.468 N/A LEU 96.A N THR 92.A OG1 no hydrogen 3.152 N/A TYR 98.A OH ASP 85.A OD2 no hydrogen 2.498 N/A ARG 100.A N ASP 91.A OD1 no hydrogen 2.919 N/A ARG 100.A NH1 GLN 104.A OE1.B no hydrogen 2.623 N/A ALA 101.A N ASN 97.A O no hydrogen 2.987 N/A LEU 102.A N TYR 98.A O no hydrogen 3.007 N/A SER 103.A N TYR 99.A O no hydrogen 2.863 N/A SER 103.A OG TYR 99.A O no hydrogen 2.757 N/A GLN 104.A N ARG 100.A O no hydrogen 2.899 N/A GLU 105.A N ARG 100.A O no hydrogen 3.329 N/A LEU 106.A N ALA 101.A O no hydrogen 2.882 N/A VAL 109.A N GLU 105.A O no hydrogen 2.909 N/A LEU 110.A N LEU 106.A O no hydrogen 2.916 N/A ALA 111.A N PRO 107.A O no hydrogen 3.026 N/A ALA 112.A N GLN 108.A O no hydrogen 3.025 N/A PHE 113.A N VAL 109.A O no hydrogen 2.879 N/A PHE 114.A N LEU 110.A O no hydrogen 2.607 N/A MET 117.A N PHE 114.A O no hydrogen 3.039 N/A THR 118.A N ILE 46.A O no hydrogen 2.862 N/A THR 118.A OG1 ASP 45.A OD1 no hydrogen 2.603 N/A LYS 120.A N THR 118.A OG1 no hydrogen 3.000 N/A LYS 120.A NZ ASP 45.A OD2 no hydrogen 3.200 N/A ARG 121.A NE PHE 146.A O no hydrogen 2.944 N/A ARG 121.A NH1 ASP 199.A OD2 no hydrogen 2.796 N/A ARG 121.A NH2 ASP 199.A OD1 no hydrogen 2.919 N/A ARG 121.A NH2 ASP 199.A OD2 no hydrogen 3.516 N/A ARG 121.A NH2 THR 202.A OG1 no hydrogen 2.948 N/A LYS 123.A N LYS 120.A O no hydrogen 3.049 N/A LYS 123.A NZ ASP 45.A O no hydrogen 3.459 N/A LYS 123.A NZ ASP 45.A OD2 no hydrogen 2.574 N/A THR 124.A N ARG 121.A O no hydrogen 3.165 N/A THR 124.A OG1 LYS 120.A O no hydrogen 2.705 N/A PHE 125.A N VAL 48.A O no hydrogen 2.976 N/A VAL 126.A N TYR 148.A O no hydrogen 3.140 N/A ALA 127.A N TYR 50.A O no hydrogen 2.937 N/A GLY 128.A N ALA 150.A O no hydrogen 3.014 N/A LEU 129.A N LEU 52.A O no hydrogen 3.467 N/A SER 130.A N PHE 152.A O no hydrogen 2.883 N/A SER 130.A OG HIS 241.A NE2 no hydrogen 2.655 N/A GLY 132.A N LEU 129.A O no hydrogen 2.770 N/A GLY 133.A N SER 130.A O no hydrogen 2.841 N/A TYR 134.A N SER 130.A O no hydrogen 3.242 N/A TYR 134.A OH HIS 189.A O no hydrogen 2.655 N/A GLY 135.A N MET 131.A O no hydrogen 2.999 N/A ALA 136.A N GLY 132.A O no hydrogen 2.814 N/A PHE 137.A N GLY 133.A O no hydrogen 3.105 N/A LYS 138.A N TYR 134.A O no hydrogen 2.873 N/A LYS 138.A NZ TYR 89.A O no hydrogen 3.176 N/A LYS 138.A NZ THR 90.A OG1 no hydrogen 3.089 N/A TRP 139.A N GLY 135.A O no hydrogen 2.891 N/A ALA 140.A N ALA 136.A O no hydrogen 2.992 N/A LEU 141.A N PHE 137.A O no hydrogen 2.805 N/A LYS 142.A N LYS 138.A O no hydrogen 2.894 N/A SER 143.A N TRP 139.A O no hydrogen 2.892 N/A SER 143.A OG TRP 139.A O no hydrogen 2.647 N/A ASN 144.A N ALA 140.A O no hydrogen 3.327 N/A ARG 145.A N SER 143.A OG no hydrogen 3.001 N/A ARG 145.A NH2 SER 103.A O no hydrogen 3.520 N/A SER 147.A N THR 124.A O no hydrogen 3.020 N/A SER 147.A OG ARG 121.A O no hydrogen 2.751 N/A SER 147.A OG THR 124.A O no hydrogen 3.353 N/A ALA 149.A N LYS 203.A O no hydrogen 2.898 N/A ALA 150.A N VAL 126.A O no hydrogen 2.895 N/A SER 151.A N TYR 205.A O no hydrogen 2.919 N/A PHE 152.A N GLY 128.A O no hydrogen 2.905 N/A SER 153.A N TRP 207.A O no hydrogen 2.825 N/A ALA 155.A N SER 130.A O no hydrogen 3.343 N/A SER 159.A N THR 162.A OG1 no hydrogen 3.172 N/A GLU 161.A N SER 159.A OG no hydrogen 2.961 N/A THR 162.A N SER 159.A OG no hydrogen 3.240 N/A THR 162.A OG1 SER 159.A O no hydrogen 3.153 N/A ASN 163.A N SER 159.A O no hydrogen 2.803 N/A LEU 164.A N PRO 160.A O no hydrogen 3.196 N/A ASN 167.A N GLU 165.A O no hydrogen 2.983 N/A GLU 170.A N GLU 170.A OE1.A no hydrogen 2.343 N/A TYR 173.A N GLU 170.A OE2.A no hydrogen 2.869 N/A TYR 173.A OH LEU 86.A O no hydrogen 2.808 N/A TRP 174.A N GLU 170.A O no hydrogen 3.233 N/A TRP 174.A NE1 LEU 168.A O no hydrogen 2.850 N/A GLN 175.A N LEU 171.A O no hydrogen 2.947 N/A GLY 176.A N ALA 172.A O no hydrogen 2.957 N/A GLY 176.A N TYR 173.A O no hydrogen 2.984 N/A VAL 177.A N TYR 173.A O no hydrogen 3.109 N/A PHE 178.A N TRP 174.A O no hydrogen 2.987 N/A GLY 179.A N GLN 175.A O no hydrogen 2.882 N/A GLN 180.A NE2 GLN 175.A OE1 no hydrogen 3.585 N/A GLU 182.A N GLU 182.A OE1 no hydrogen 2.911 N/A ASP 183.A N GLN 180.A O no hydrogen 3.015 N/A ASP 185.A N ASP 183.A OD1 no hydrogen 2.807 N/A LEU 186.A N ASP 183.A O no hydrogen 3.101 N/A LYS 188.A N ASP 185.A O no hydrogen 3.073 N/A HIS 189.A N LEU 186.A O no hydrogen 2.970 N/A TYR 190.A N ASP 187.A O no hydrogen 3.113 N/A ASN 193.A N TYR 190.A O no hydrogen 2.890 N/A ASN 193.A ND2 ASP 187.A O no hydrogen 2.858 N/A MET 194.A N LEU 191.A O no hydrogen 2.917 N/A SER 198.A N VAL 195.A O no hydrogen 3.008 N/A SER 198.A OG VAL 195.A O no hydrogen 2.654 N/A LYS 201.A N ASP 199.A OD1 no hydrogen 2.842 N/A THR 202.A OG1 PHE 146.A O no hydrogen 3.114 N/A LYS 203.A N SER 147.A O no hydrogen 2.861 N/A PHE 204.A N ASP 231.A O no hydrogen 2.922 N/A TYR 205.A N ALA 149.A O no hydrogen 2.874 N/A TYR 205.A OH GLN 249.A OE1 no hydrogen 2.579 N/A ALA 206.A N ASP 233.A O no hydrogen 2.974 N/A TRP 207.A N SER 151.A O no hydrogen 2.943 N/A CYS 208.A N HIS 235.A O no hydrogen 3.174 N/A CYS 208.A SG GLY 209.A O no hydrogen 3.672 N/A CYS 208.A SG ASN 218.A OD1 no hydrogen 3.580 N/A TYR 210.A N GLY 237.A O no hydrogen 2.865 N/A GLU 211.A N GLY 239.A O no hydrogen 3.094 N/A ASP 212.A N GLY 209.A O no hydrogen 3.190 N/A LEU 214.A N ASP 212.A OD1 no hydrogen 2.821 N/A PHE 215.A N ASP 212.A O no hydrogen 3.020 N/A ASN 218.A N LEU 214.A O no hydrogen 3.021 N/A GLU 219.A N PHE 215.A O no hydrogen 2.930 N/A LYS 220.A N ALA 216.A O no hydrogen 3.005 N/A ALA 221.A N THR 217.A O no hydrogen 2.903 N/A ILE 222.A N ASN 218.A O no hydrogen 2.911 N/A ALA 223.A N GLU 219.A O no hydrogen 3.177 N/A ASP 224.A N LYS 220.A O no hydrogen 3.092 N/A PHE 225.A N ALA 221.A O no hydrogen 2.919 N/A GLN 226.A N ILE 222.A O no hydrogen 2.744 N/A ALA 227.A N ALA 223.A O no hydrogen 3.021 N/A GLN 228.A N ASP 224.A O no hydrogen 3.317 N/A GLN 228.A N PHE 225.A O no hydrogen 3.193 N/A GLN 228.A NE2 LYS 192.A O no hydrogen 3.000 N/A GLY 229.A N GLN 226.A O no hydrogen 2.989 N/A LEU 230.A N PHE 225.A O no hydrogen 3.061 N/A ASP 233.A N PHE 204.A O no hydrogen 2.939 N/A TYR 234.A OH GLU 219.A OE2 no hydrogen 2.624 N/A HIS 235.A N ALA 206.A O no hydrogen 2.868 N/A LYS 236.A NZ GLU 219.A OE2 no hydrogen 2.995 N/A HIS 238.A ND1 GLU 211.A OE2 no hydrogen 2.782 N/A GLY 239.A N GLU 211.A OE1 no hydrogen 2.804 N/A HIS 241.A ND1 ASP 212.A OD2 no hydrogen 2.823 N/A HIS 241.A NE2 SER 130.A OG no hydrogen 2.655 N/A TYR 245.A N GLU 242.A O no hydrogen 3.045 N/A TRP 246.A N GLU 242.A O no hydrogen 3.391 N/A TRP 246.A NE1 SER 153.A OG no hydrogen 2.799 N/A ASN 247.A N TRP 243.A O no hydrogen 2.893 N/A ASN 247.A ND2.B GLU 251.A OE2 no hydrogen 3.009 N/A GLN 248.A N TYR 244.A O no hydrogen 3.131 N/A GLN 249.A N TYR 245.A O no hydrogen 3.019 N/A LEU 250.A N TRP 246.A O no hydrogen 2.857 N/A GLU 251.A N ASN 247.A O no hydrogen 3.160 N/A VAL 252.A N GLN 248.A O no hydrogen 3.066 N/A LEU 253.A N GLN 249.A O no hydrogen 2.824 N/A LEU 254.A N LEU 250.A O no hydrogen 2.966 N/A TRP 256.A N VAL 252.A O no hydrogen 3.118 N/A LEU 257.A N LEU 253.A O no hydrogen 2.977 N/A ILE 259.A N LEU 257.A O no hydrogen 2.941 N/A GLN 262.A N THR 75.A OG1 no hydrogen 2.934 N/A ARG 266.A NE GLU 264.A OE2 no hydrogen 2.988 N/A ARG 266.A NH1 GLU 251.A OE1 no hydrogen 2.913 N/A ARG 266.A NH2 GLU 251.A OE1 no hydrogen 2.925 N/A ARG 266.A NH2 GLU 264.A OE2 no hydrogen 2.804 N/A