Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3iee_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A N ASP 5.A OD2 no hydrogen 3.111 N/A SER 2.A OG ASP 5.A OD2 no hydrogen 2.772 N/A ASP 5.A N SER 2.A OG no hydrogen 3.170 N/A ILE 6.A N SER 2.A O no hydrogen 3.186 N/A GLU 7.A N.A THR 3.A O no hydrogen 3.026 N/A GLU 7.A N.B THR 3.A O no hydrogen 3.059 N/A ASN 8.A N ALA 4.A O no hydrogen 3.018 N/A ALA 9.A N ASP 5.A O no hydrogen 2.863 N/A ALA 10.A N ILE 6.A O no hydrogen 2.882 N/A GLU 11.A N GLU 7.A O.A no hydrogen 2.898 N/A GLU 11.A N GLU 7.A O.B no hydrogen 3.002 N/A VAL 12.A N ASN 8.A O no hydrogen 3.082 N/A ILE 13.A N ALA 9.A O no hydrogen 3.098 N/A LYS 14.A N.A ALA 10.A O no hydrogen 2.839 N/A LYS 14.A N.B ALA 10.A O no hydrogen 2.861 N/A LYS 14.A NZ.A GLU 11.A OE2 no hydrogen 2.875 N/A TYR 15.A N GLU 11.A O no hydrogen 2.987 N/A TYR 15.A OH VAL 62.A O no hydrogen 2.678 N/A TYR 16.A N VAL 12.A O no hydrogen 3.080 N/A ASN 17.A N ILE 13.A O no hydrogen 2.808 N/A THR 18.A N LYS 14.A O.A no hydrogen 2.920 N/A THR 18.A N LYS 14.A O.B no hydrogen 3.029 N/A THR 18.A OG1 LYS 14.A O.A no hydrogen 3.358 N/A THR 18.A OG1 LYS 14.A O.B no hydrogen 3.170 N/A SER 19.A N TYR 15.A O no hydrogen 2.876 N/A SER 19.A OG TYR 15.A O no hydrogen 2.856 N/A SER 19.A OG TYR 81.A OH no hydrogen 2.804 N/A LEU 20.A N TYR 16.A O no hydrogen 2.819 N/A GLY 21.A N ASN 17.A O no hydrogen 3.277 N/A VAL 22.A N THR 18.A O no hydrogen 2.936 N/A LEU 23.A N SER 19.A O no hydrogen 2.803 N/A LYS 24.A N LEU 20.A O no hydrogen 3.094 N/A ASP 25.A N GLY 21.A O no hydrogen 3.073 N/A LYS 29.A NZ ASP 237.A OD1 no hydrogen 2.715 N/A VAL 31.A N LYS 27.A O no hydrogen 2.959 N/A ASN 32.A N GLU 28.A O no hydrogen 2.949 N/A ASN 32.A ND2 ALA 170.A O no hydrogen 2.808 N/A ALA 33.A N LYS 29.A O no hydrogen 2.913 N/A VAL 34.A N ASP 30.A O no hydrogen 2.917 N/A LEU 35.A N VAL 31.A O no hydrogen 3.044 N/A ASP 36.A N ASN 32.A O no hydrogen 2.774 N/A TYR 37.A N ALA 33.A O no hydrogen 2.975 N/A GLN 39.A N ASP 36.A O no hydrogen 2.889 N/A LYS 40.A N TYR 37.A O no hydrogen 2.783 N/A LYS 40.A NZ PRO 44.A O no hydrogen 2.764 N/A GLY 41.A N GLU 38.A O no hydrogen 3.315 N/A LYS 42.A N GLN 39.A O no hydrogen 2.759 N/A THR 43.A N.A GLN 39.A O no hydrogen 2.879 N/A THR 43.A N.B GLN 39.A O no hydrogen 2.900 N/A THR 43.A OG1.A GLN 39.A O no hydrogen 3.372 N/A THR 43.A OG1.A GLN 39.A OE1 no hydrogen 2.204 N/A ALA 48.A N ALA 45.A O no hydrogen 3.163 N/A ILE 61.A N ASP 58.A O no hydrogen 3.005 N/A VAL 62.A N ASP 58.A O no hydrogen 3.092 N/A LEU 63.A N SER 59.A O no hydrogen 2.975 N/A ASN 64.A N ILE 61.A O no hydrogen 3.032 N/A ASN 64.A ND2 ALA 60.A O no hydrogen 2.735 N/A PHE 69.A N GLY 66.A O no hydrogen 3.155 N/A THR 73.A N ASN 70.A OD1 no hydrogen 2.920 N/A THR 73.A OG1 ASN 70.A OD1 no hydrogen 2.769 N/A ARG 74.A N ASN 70.A O no hydrogen 2.931 N/A ARG 74.A NE PRO 65.A O no hydrogen 2.833 N/A ARG 74.A NH1 GLU 71.A OE2 no hydrogen 2.911 N/A ARG 74.A NH2 PRO 65.A O no hydrogen 3.082 N/A ARG 75.A N GLU 71.A O no hydrogen 2.924 N/A ASN 76.A N GLU 72.A O no hydrogen 2.881 N/A LEU 77.A N THR 73.A O no hydrogen 2.799 N/A LYS 78.A N ARG 74.A O no hydrogen 3.040 N/A GLN 79.A N ARG 75.A O no hydrogen 2.928 N/A ASN 80.A N ASN 76.A O no hydrogen 3.057 N/A ASN 80.A ND2 ASN 76.A O no hydrogen 2.918 N/A TYR 81.A N LEU 77.A O no hydrogen 2.949 N/A TYR 81.A OH SER 19.A OG no hydrogen 2.804 N/A THR 82.A N LYS 78.A O no hydrogen 2.835 N/A THR 82.A OG1 LYS 78.A O no hydrogen 2.775 N/A GLY 83.A N GLN 79.A O no hydrogen 2.939 N/A LEU 84.A N ASN 80.A O no hydrogen 2.856 N/A PHE 85.A N TYR 81.A O no hydrogen 2.894 N/A GLN 86.A N THR 82.A O no hydrogen 2.989 N/A ALA 87.A N GLY 83.A O no hydrogen 2.905 N/A ARG 88.A N LEU 84.A O no hydrogen 2.905 N/A ARG 88.A NH2 VAL 54.A O no hydrogen 2.798 N/A THR 89.A N PHE 85.A O no hydrogen 2.986 N/A THR 89.A OG1 PHE 85.A O no hydrogen 2.793 N/A GLU 90.A N GLN 86.A O no hydrogen 3.050 N/A PHE 91.A N ALA 87.A O no hydrogen 2.872 N/A TYR 92.A N ARG 88.A O no hydrogen 3.048 N/A ALA 93.A N THR 89.A O no hydrogen 2.860 N/A ASN 94.A N GLU 90.A O no hydrogen 2.733 N/A ASN 94.A ND2 ASN 117.A OD1 no hydrogen 3.018 N/A PHE 95.A N PHE 91.A O no hydrogen 3.175 N/A THR 97.A N ALA 93.A O no hydrogen 3.187 N/A THR 97.A OG1 ALA 93.A O no hydrogen 3.145 N/A TYR 98.A N ASN 94.A O no hydrogen 2.863 N/A LEU 99.A N PHE 95.A O no hydrogen 3.197 N/A SER 100.A N.A ASP 96.A O no hydrogen 3.163 N/A SER 100.A N.A THR 97.A O no hydrogen 3.140 N/A SER 100.A N.B ASP 96.A O no hydrogen 3.129 N/A SER 100.A OG.A ASP 96.A O no hydrogen 3.223 N/A TYR 101.A N THR 97.A O no hydrogen 2.940 N/A LEU 102.A N TYR 98.A O no hydrogen 3.042 N/A LYS 103.A N LEU 99.A O no hydrogen 2.948 N/A LYS 104.A N SER 100.A O.A no hydrogen 3.144 N/A LYS 104.A N SER 100.A O.B no hydrogen 3.098 N/A LYS 104.A N TYR 101.A O no hydrogen 3.016 N/A LYS 105.A N LEU 102.A O no hydrogen 2.938 N/A LYS 105.A NZ LYS 103.A O no hydrogen 2.964 N/A ASP 106.A N TYR 101.A O no hydrogen 2.848 N/A ASN 109.A N ASP 106.A OD1 no hydrogen 3.007 N/A ASN 109.A ND2 ASP 106.A OD2 no hydrogen 2.721 N/A ALA 110.A N ASP 106.A O no hydrogen 2.912 N/A LYS 111.A N VAL 107.A O no hydrogen 2.890 N/A LYS 112.A N THR 108.A O no hydrogen 3.385 N/A LYS 112.A NZ ASN 109.A OD1 no hydrogen 3.421 N/A LEU 113.A N ASN 109.A O no hydrogen 3.090 N/A LEU 114.A N ALA 110.A O no hydrogen 2.907 N/A ASP 115.A N LYS 111.A O no hydrogen 2.949 N/A VAL 116.A N LYS 112.A O no hydrogen 2.951 N/A ASN 117.A N LEU 113.A O no hydrogen 2.990 N/A ASN 117.A ND2 PHE 91.A O no hydrogen 2.989 N/A TYR 118.A N LEU 114.A O no hydrogen 2.975 N/A TYR 118.A OH GLU 38.A OE2 no hydrogen 2.330 N/A GLN 119.A N.A ASP 115.A O no hydrogen 3.269 N/A GLN 119.A N.B ASP 115.A O no hydrogen 3.252 N/A LEU 120.A N VAL 116.A O no hydrogen 2.934 N/A SER 121.A N ASN 117.A O no hydrogen 2.952 N/A THR 122.A N TYR 118.A O no hydrogen 3.198 N/A GLN 123.A N GLN 119.A O.A no hydrogen 3.025 N/A GLN 123.A N GLN 119.A O.B no hydrogen 2.997 N/A SER 124.A OG SER 121.A O no hydrogen 3.438 N/A GLU 125.A N THR 122.A O no hydrogen 2.893 N/A TYR 126.A N GLN 123.A O no hydrogen 2.867 N/A LYS 127.A NZ LEU 23.A O no hydrogen 3.075 N/A LYS 127.A NZ VAL 26.A O no hydrogen 3.053 N/A LYS 127.A NZ GLU 28.A OE2 no hydrogen 2.712 N/A GLN 128.A N SER 124.A O no hydrogen 3.010 N/A GLN 128.A NE2 ASP 132.A OD1 no hydrogen 2.829 N/A ASN 129.A N GLU 125.A O no hydrogen 2.780 N/A ASN 129.A ND2 ASN 80.A OD1 no hydrogen 2.870 N/A ILE 130.A N TYR 126.A O no hydrogen 2.998 N/A PHE 131.A N LYS 127.A O no hydrogen 3.300 N/A ASP 132.A N GLN 128.A O no hydrogen 2.870 N/A ILE 133.A N ASN 129.A O no hydrogen 2.914 N/A LEU 134.A N ILE 130.A O no hydrogen 3.027 N/A SER 135.A N PHE 131.A O no hydrogen 2.958 N/A THR 138.A N LEU 134.A O no hydrogen 2.840 N/A THR 138.A OG1 LEU 134.A O no hydrogen 3.395 N/A THR 138.A OG1 SER 135.A O no hydrogen 3.015 N/A GLU 139.A N SER 135.A O no hydrogen 3.109 N/A GLN 140.A N PRO 136.A O no hydrogen 3.209 N/A ALA 141.A N PHE 137.A O no hydrogen 2.943 N/A GLU 142.A N THR 138.A O no hydrogen 2.825 N/A LEU 143.A N GLU 139.A O no hydrogen 3.211 N/A VAL 144.A N GLN 140.A O no hydrogen 3.281 N/A LEU 145.A N ALA 141.A O no hydrogen 3.015 N/A LEU 146.A N GLU 142.A O no hydrogen 2.894 N/A VAL 147.A N VAL 144.A O no hydrogen 3.447 N/A ASN 149.A N LEU 146.A O no hydrogen 2.836 N/A LEU 151.A N ASN 149.A OD1 no hydrogen 2.849 N/A LYS 152.A N ASN 149.A O no hydrogen 2.999 N/A GLN 154.A N GLN 154.A OE1 no hydrogen 2.765 N/A GLN 154.A NE2 PRO 197.A O no hydrogen 3.385 N/A ILE 155.A N LEU 151.A O no hydrogen 2.843 N/A SER 156.A OG ALA 153.A O no hydrogen 3.503 N/A SER 156.A OG GLN 154.A O no hydrogen 2.530 N/A SER 156.A OG TYR 208.A OH no hydrogen 2.735 N/A VAL 157.A N GLN 154.A O no hydrogen 3.004 N/A ARG 158.A N ILE 155.A O no hydrogen 3.036 N/A ARG 158.A NE GLU 142.A OE2 no hydrogen 2.950 N/A SER 160.A OG.A VAL 157.A O no hydrogen 2.758 N/A SER 160.A OG.B GLN 163.A OE1.B no hydrogen 3.305 N/A SER 161.A N ARG 158.A O no hydrogen 3.192 N/A SER 161.A OG TYR 16.A OH no hydrogen 3.327 N/A SER 161.A OG ARG 158.A O no hydrogen 3.275 N/A THR 162.A N LYS 159.A O no hydrogen 3.053 N/A THR 162.A OG1 LYS 159.A O no hydrogen 3.068 N/A THR 162.A OG1 GLN 189.A OE1 no hydrogen 2.640 N/A GLN 163.A NE2.A GLN 163.A O.A no hydrogen 3.397 N/A GLN 163.A NE2.A ASN 167.A OD1 no hydrogen 3.008 N/A SER 164.A N SER 161.A O no hydrogen 2.930 N/A SER 164.A OG GLN 128.A OE1 no hydrogen 2.679 N/A ILE 165.A N THR 162.A O no hydrogen 2.981 N/A ASN 167.A N GLN 163.A O.A no hydrogen 2.938 N/A ASN 167.A N GLN 163.A O.B no hydrogen 2.972 N/A LEU 168.A N.A SER 164.A O no hydrogen 3.052 N/A LEU 168.A N.B SER 164.A O no hydrogen 3.042 N/A TYR 169.A N ILE 165.A O no hydrogen 2.829 N/A ALA 170.A N LEU 166.A O no hydrogen 2.924 N/A ARG 171.A N.A LEU 168.A O.A no hydrogen 3.042 N/A ARG 171.A N.A LEU 168.A O.B no hydrogen 3.198 N/A ARG 171.A N.B LEU 168.A O.A no hydrogen 3.037 N/A ARG 171.A N.B LEU 168.A O.B no hydrogen 3.194 N/A ARG 171.A NH1.B ASN 167.A O no hydrogen 2.816 N/A ARG 171.A NH2.B ASN 167.A O no hydrogen 3.159 N/A LYS 172.A N ALA 170.A O no hydrogen 2.829 N/A LYS 172.A NZ ASP 36.A OD1 no hydrogen 3.302 N/A LYS 172.A NZ ASP 36.A OD2 no hydrogen 2.819 N/A HIS 173.A NE2 ASP 36.A OD1 no hydrogen 2.804 N/A ARG 174.A N.A ARG 171.A O.A no hydrogen 3.161 N/A ARG 174.A N.A ARG 171.A O.B no hydrogen 3.193 N/A ARG 174.A N.B ARG 171.A O.A no hydrogen 3.049 N/A ARG 174.A N.B ARG 171.A O.B no hydrogen 3.077 N/A ARG 174.A NH1.A GLN 119.A OE1.A no hydrogen 2.616 N/A ARG 174.A NH2.A GLN 119.A OE1.A no hydrogen 3.326 N/A ARG 174.A NH2.B HIS 173.A O no hydrogen 3.471 N/A ARG 178.A N.A ASP 175.A OD1 no hydrogen 3.089 N/A ARG 178.A N.B ASP 175.A OD1 no hydrogen 3.114 N/A ILE 179.A N ASP 175.A O no hydrogen 3.013 N/A ASP 180.A N GLY 176.A O no hydrogen 2.934 N/A LEU 181.A N PRO 177.A O no hydrogen 2.935 N/A LYS 182.A N ARG 178.A O.A no hydrogen 2.996 N/A LYS 182.A N ARG 178.A O.B no hydrogen 3.005 N/A LYS 182.A NZ GLU 185.A OE1 no hydrogen 3.017 N/A VAL 183.A N ILE 179.A O no hydrogen 2.888 N/A ALA 184.A N ASP 180.A O no hydrogen 2.932 N/A GLU 185.A N LEU 181.A O no hydrogen 2.954 N/A LEU 186.A N LYS 182.A O no hydrogen 2.856 N/A THR 187.A N VAL 183.A O no hydrogen 2.790 N/A THR 187.A OG1 VAL 183.A O no hydrogen 2.872 N/A LYS 188.A N ALA 184.A O no hydrogen 3.031 N/A GLN 189.A N GLU 185.A O no hydrogen 2.887 N/A LEU 190.A N LEU 186.A O no hydrogen 2.827 N/A ASP 191.A N THR 187.A O no hydrogen 2.858 N/A ALA 192.A N LYS 188.A O no hydrogen 2.955 N/A ALA 193.A N GLN 189.A O no hydrogen 2.893 N/A LYS 194.A N LEU 190.A O no hydrogen 2.897 N/A LYS 194.A NZ GLU 216.A OE1 no hydrogen 2.812 N/A LYS 195.A N ALA 192.A O no hydrogen 3.132 N/A LEU 196.A N ALA 193.A O no hydrogen 3.020 N/A HIS 202.A ND1 ASN 200.A O.A no hydrogen 2.900 N/A HIS 202.A ND1 ASN 200.A O.B no hydrogen 2.998 N/A GLU 205.A N GLU 205.A OE1 no hydrogen 2.890 N/A SER 207.A N.A GLY 204.A O no hydrogen 2.927 N/A SER 207.A N.B GLY 204.A O no hydrogen 2.995 N/A SER 207.A OG.B GLY 204.A O no hydrogen 3.288 N/A TYR 208.A N GLU 205.A O no hydrogen 2.801 N/A TYR 208.A OH SER 156.A OG no hydrogen 2.735 N/A ALA 210.A N LYS 206.A O no hydrogen 2.991 N/A PHE 211.A N SER 207.A O.A no hydrogen 2.964 N/A PHE 211.A N SER 207.A O.B no hydrogen 2.984 N/A LEU 212.A N TYR 208.A O no hydrogen 2.939 N/A SER 213.A N.A GLN 209.A O no hydrogen 3.009 N/A SER 213.A N.B GLN 209.A O no hydrogen 3.000 N/A SER 213.A OG.B GLN 209.A O no hydrogen 3.266 N/A GLN 214.A N ALA 210.A O no hydrogen 3.001 N/A GLN 214.A NE2 ALA 210.A O no hydrogen 3.362 N/A VAL 215.A N PHE 211.A O no hydrogen 2.853 N/A GLU 216.A N LEU 212.A O no hydrogen 3.076 N/A THR 217.A N SER 213.A O.A no hydrogen 3.016 N/A THR 217.A N SER 213.A O.B no hydrogen 3.014 N/A THR 217.A OG1 SER 213.A O.A no hydrogen 3.158 N/A THR 217.A OG1 SER 213.A O.B no hydrogen 3.210 N/A PHE 218.A N GLN 214.A O no hydrogen 2.888 N/A ILE 219.A N VAL 215.A O no hydrogen 2.884 N/A LYS 220.A N GLU 216.A O no hydrogen 3.064 N/A GLN 221.A N THR 217.A O no hydrogen 2.937 N/A VAL 222.A N PHE 218.A O no hydrogen 2.891 N/A LYS 223.A N ILE 219.A O no hydrogen 2.993 N/A LYS 224.A N LYS 220.A O no hydrogen 3.045 N/A VAL 225.A N GLN 221.A O no hydrogen 2.949 N/A ARG 226.A N VAL 222.A O no hydrogen 2.854 N/A ARG 226.A NE ASP 180.A OD1 no hydrogen 2.860 N/A ARG 226.A NH2 ASP 180.A OD2 no hydrogen 2.877 N/A GLU 227.A N LYS 224.A O no hydrogen 3.059 N/A LYS 228.A N VAL 225.A O no hydrogen 2.996 N/A LYS 228.A NZ ASP 235.A OD1 no hydrogen 2.867 N/A LYS 228.A NZ ASP 235.A OD2 no hydrogen 2.897 N/A TYR 231.A OH ASP 233.A OD1 no hydrogen 2.566 N/A SER 232.A N TYR 169.A OH no hydrogen 3.168 N/A ASP 235.A N SER 232.A OG no hydrogen 2.994 N/A TYR 236.A N SER 232.A O no hydrogen 2.976 N/A ASP 237.A N ASP 233.A O no hydrogen 2.844 N/A THR 239.A N TYR 236.A O no hydrogen 2.826 N/A THR 239.A OG1 TYR 236.A O no hydrogen 3.356 N/A THR 239.A OG1 ASP 237.A O no hydrogen 3.149 N/A SER 240.A N ASP 237.A O no hydrogen 2.891 N/A SER 240.A OG ASP 237.A O no hydrogen 2.711 N/A PHE 242.A N LEU 238.A O no hydrogen 2.920 N/A GLU 243.A N THR 239.A O no hydrogen 2.833 N/A THR 244.A N SER 240.A O no hydrogen 2.993 N/A THR 244.A OG1 GLN 214.A OE1 no hydrogen 3.384 N/A THR 244.A OG1 SER 240.A O no hydrogen 3.178 N/A THR 244.A OG1 ALA 241.A O no hydrogen 2.696 N/A SER 245.A N ALA 241.A O no hydrogen 3.184 N/A SER 245.A N PHE 242.A O no hydrogen 2.936 N/A SER 245.A OG PHE 242.A O no hydrogen 2.622 N/A ILE 246.A N PHE 242.A O no hydrogen 3.306 N/A ILE 247.A N THR 244.A O no hydrogen 3.364 N/A