Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3axj_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 3.A N SER 6.A OG no hydrogen 2.911 N/A ASP 5.A N ASP 3.A OD2 no hydrogen 2.762 N/A SER 6.A N ASP 3.A O no hydrogen 3.012 N/A SER 6.A OG ASP 3.A O no hydrogen 3.084 N/A GLN 10.A N SER 6.A O no hydrogen 2.974 N/A GLN 10.A NE2 ASP 5.A O no hydrogen 3.208 N/A GLN 11.A N PRO 7.A O no hydrogen 2.893 N/A PHE 12.A N ILE 8.A O no hydrogen 3.032 N/A ARG 13.A N VAL 9.A O no hydrogen 2.947 N/A ARG 13.A NE GLU 4.A OE1 no hydrogen 2.747 N/A ARG 13.A NH2 GLU 4.A OE2 no hydrogen 2.824 N/A ILE 14.A N GLN 10.A O no hydrogen 3.165 N/A TYR 15.A N GLN 11.A O no hydrogen 2.998 N/A SER 16.A N PHE 12.A O no hydrogen 2.873 N/A ASN 17.A N ARG 13.A O no hydrogen 3.122 N/A GLU 18.A N ILE 14.A O no hydrogen 3.315 N/A LEU 19.A N TYR 15.A O no hydrogen 3.037 N/A ILE 20.A N SER 16.A O no hydrogen 2.850 N/A HIS 22.A N LEU 19.A O no hydrogen 2.867 N/A ASP 23.A N ILE 20.A O no hydrogen 2.816 N/A ARG 24.A NE GLU 81.A O no hydrogen 3.361 N/A HIS 25.A N LYS 21.A O no hydrogen 2.990 N/A GLU 26.A N HIS 22.A O no hydrogen 2.917 N/A ARG 27.A N ASP 23.A O no hydrogen 2.995 N/A ARG 27.A NE GLU 81.A OE1 no hydrogen 2.848 N/A ARG 27.A NE GLU 81.A OE2 no hydrogen 3.200 N/A ARG 27.A NH2 GLU 81.A OE2 no hydrogen 2.473 N/A ILE 28.A N ARG 24.A O no hydrogen 3.051 N/A VAL 29.A N HIS 25.A O no hydrogen 2.800 N/A LYS 30.A N GLU 26.A O no hydrogen 3.115 N/A LEU 31.A N ARG 27.A O no hydrogen 3.138 N/A SER 32.A N ILE 28.A O no hydrogen 2.858 N/A ARG 33.A N VAL 29.A O no hydrogen 2.880 N/A ASP 34.A N LYS 30.A O no hydrogen 3.239 N/A ILE 35.A N LEU 31.A O no hydrogen 3.000 N/A THR 36.A N SER 32.A O no hydrogen 2.895 N/A THR 36.A OG1 SER 32.A O no hydrogen 2.871 N/A ILE 37.A N ARG 33.A O no hydrogen 2.964 N/A GLU 38.A N ASP 34.A O no hydrogen 3.052 N/A SER 39.A N ILE 35.A O no hydrogen 2.891 N/A SER 39.A OG ILE 35.A O no hydrogen 2.874 N/A LYS 40.A N THR 36.A O no hydrogen 3.026 N/A ARG 41.A N ILE 37.A O no hydrogen 3.089 N/A ILE 42.A N GLU 38.A O no hydrogen 2.873 N/A ILE 43.A N SER 39.A O no hydrogen 2.965 N/A PHE 44.A N LYS 40.A O no hydrogen 2.946 N/A LEU 45.A N ARG 41.A O no hydrogen 2.976 N/A LEU 46.A N ILE 42.A O no hydrogen 2.880 N/A HIS 47.A N ILE 43.A O no hydrogen 3.000 N/A HIS 47.A NE2 GLU 163.A OE1 no hydrogen 2.360 N/A SER 48.A N LEU 45.A O no hydrogen 3.048 N/A SER 48.A OG LEU 45.A O no hydrogen 2.563 N/A ILE 49.A N LEU 46.A O no hydrogen 3.297 N/A SER 51.A N ASP 50.A OD1 no hydrogen 2.220 N/A SER 51.A OG ASP 50.A OD1 no hydrogen 3.263 N/A ASN 55.A ND2 SER 48.A O no hydrogen 2.965 N/A LYS 56.A N LYS 53.A O no hydrogen 2.966 N/A VAL 59.A N ASN 55.A O no hydrogen 2.766 N/A LEU 60.A N LYS 56.A O no hydrogen 3.031 N/A GLU 61.A N GLU 57.A O no hydrogen 2.894 N/A GLU 62.A N LYS 58.A O no hydrogen 3.155 N/A ALA 63.A N VAL 59.A O no hydrogen 2.924 N/A ARG 64.A N LEU 60.A O no hydrogen 2.848 N/A GLN 65.A N GLU 61.A O no hydrogen 3.083 N/A ARG 66.A N GLU 62.A O no hydrogen 3.047 N/A ARG 66.A NE GLU 38.A OE2 no hydrogen 2.993 N/A ARG 66.A NH1 GLU 62.A OE2 no hydrogen 3.011 N/A ARG 66.A NH2 GLU 38.A OE1 no hydrogen 3.063 N/A ARG 66.A NH2 GLU 38.A OE2 no hydrogen 3.461 N/A LEU 67.A N ALA 63.A O no hydrogen 2.892 N/A ASN 68.A N ARG 64.A O no hydrogen 2.886 N/A LYS 69.A N GLN 65.A O no hydrogen 3.012 N/A LEU 70.A N ARG 66.A O no hydrogen 3.220 N/A ILE 71.A N LEU 67.A O no hydrogen 3.079 N/A ALA 72.A N ASN 68.A O no hydrogen 2.951 N/A VAL 73.A N LYS 69.A O no hydrogen 2.826 N/A ASN 74.A ND2 LYS 69.A O no hydrogen 3.624 N/A PHE 75.A N LEU 70.A O no hydrogen 2.863 N/A ARG 76.A NH2 VAL 136.A O no hydrogen 2.833 N/A ALA 77.A N VAL 73.A O no hydrogen 3.052 N/A VAL 78.A N ASN 74.A O no hydrogen 3.112 N/A ALA 79.A N PHE 75.A O no hydrogen 2.880 N/A LEU 80.A N ARG 76.A O no hydrogen 2.884 N/A GLU 81.A N ALA 77.A O no hydrogen 3.046 N/A LEU 82.A N VAL 78.A O no hydrogen 3.132 N/A ARG 83.A N LEU 80.A O no hydrogen 3.295 N/A ARG 83.A NH1 GLU 137.A OE2 no hydrogen 2.491 N/A ARG 83.A NH2 GLU 137.A OE2 no hydrogen 2.799 N/A GLN 85.A N LEU 82.A O no hydrogen 2.896 N/A TYR 88.A N ASP 86.A OD1 no hydrogen 2.882 N/A GLN 89.A N ASP 86.A O no hydrogen 3.207 N/A GLN 89.A N ASP 86.A OD1 no hydrogen 3.233 N/A ARG 91.A N TYR 88.A O no hydrogen 3.357 N/A SER 93.A N PHE 90.A O no hydrogen 2.762 N/A SER 93.A OG HIS 25.A ND1 no hydrogen 2.606 N/A TYR 94.A N ARG 91.A O no hydrogen 3.203 N/A TYR 94.A OH VAL 87.A O no hydrogen 2.669 N/A SER 95.A N ARG 91.A O no hydrogen 2.806 N/A SER 95.A OG GLU 152.A OE1 no hydrogen 2.444 N/A SER 95.A OG GLU 152.A OE2 no hydrogen 3.130 N/A GLY 97.A N SER 32.A OG no hydrogen 3.130 N/A LEU 98.A N TYR 94.A O no hydrogen 2.958 N/A GLN 99.A N SER 95.A O no hydrogen 2.997 N/A GLN 99.A NE2 GLU 152.A OE1 no hydrogen 2.941 N/A GLU 100.A N PRO 96.A O no hydrogen 3.015 N/A PHE 101.A N GLY 97.A O no hydrogen 2.879 N/A ILE 102.A N LEU 98.A O no hydrogen 2.911 N/A GLN 103.A N GLN 99.A O no hydrogen 3.054 N/A ALA 104.A N GLU 100.A O no hydrogen 3.061 N/A TYR 105.A N PHE 101.A O no hydrogen 2.845 N/A THR 106.A N ILE 102.A O no hydrogen 2.909 N/A THR 106.A OG1 ILE 102.A O no hydrogen 2.807 N/A THR 106.A OG1 GLN 103.A O no hydrogen 3.351 N/A TYR 107.A N GLN 103.A O no hydrogen 2.995 N/A TYR 107.A OH HIS 47.A ND1 no hydrogen 3.028 N/A TYR 109.A N THR 106.A O no hydrogen 2.827 N/A TYR 109.A OH GLU 113.A OE2 no hydrogen 2.758 N/A LEU 110.A N TYR 107.A O no hydrogen 2.990 N/A HIS 112.A N GLU 108.A O no hydrogen 3.101 N/A HIS 112.A NE2 GLU 120.A O no hydrogen 3.123 N/A GLU 113.A N TYR 109.A O no hydrogen 2.841 N/A ASP 114.A N LEU 110.A O no hydrogen 3.402 N/A ALA 115.A N HIS 112.A O no hydrogen 3.288 N/A GLU 118.A N GLU 118.A OE1 no hydrogen 2.791 N/A GLU 120.A N GLY 117.A O no hydrogen 3.215 N/A THR 121.A N GLU 118.A O no hydrogen 3.029 N/A THR 121.A OG1 GLU 118.A O no hydrogen 2.692 N/A LYS 122.A N ASN 119.A O no hydrogen 3.288 N/A SER 123.A OG VAL 124.A O no hydrogen 2.672 N/A SER 125.A N GLU 108.A OE1 no hydrogen 2.846 N/A SER 125.A OG GLU 108.A OE1 no hydrogen 3.437 N/A SER 125.A OG GLU 108.A OE2 no hydrogen 2.588 N/A ALA 129.A N ASP 126.A OD1 no hydrogen 2.850 N/A ILE 130.A N ASP 126.A O no hydrogen 3.050 N/A GLN 131.A N TRP 127.A O no hydrogen 2.905 N/A GLN 131.A NE2 GLN 131.A O no hydrogen 3.449 N/A GLN 131.A NE2 PHE 146.A O no hydrogen 2.444 N/A ALA 132.A N GLN 128.A O no hydrogen 2.974 N/A VAL 133.A N ILE 130.A O no hydrogen 2.974 N/A GLN 134.A NE2 GLN 131.A O no hydrogen 3.113 N/A GLN 134.A NE2 GLN 145.A OE1 no hydrogen 2.818 N/A TYR 135.A N PHE 144.A O no hydrogen 2.737 N/A TYR 135.A OH ILE 71.A O no hydrogen 2.688 N/A GLU 137.A N LYS 142.A O no hydrogen 2.954 N/A SER 140.A OG PRO 141.A O no hydrogen 3.531 N/A PHE 144.A N TYR 135.A O no hydrogen 3.080 N/A VAL 148.A N GLN 131.A OE1 no hydrogen 3.057 N/A GLU 152.A N ASP 149.A OD2 no hydrogen 3.304 N/A TYR 153.A N ASP 149.A O no hydrogen 2.965 N/A TYR 153.A OH SER 125.A O no hydrogen 2.676 N/A ILE 154.A N PRO 150.A O no hydrogen 2.896 N/A LEU 155.A N THR 151.A O no hydrogen 3.016 N/A GLY 156.A N GLU 152.A O no hydrogen 2.912 N/A LEU 157.A N TYR 153.A O no hydrogen 2.827 N/A SER 158.A N ILE 154.A O no hydrogen 3.068 N/A SER 158.A OG LEU 155.A O no hydrogen 2.692 N/A ASP 159.A N GLY 156.A O no hydrogen 3.136 N/A LEU 160.A N LEU 157.A O no hydrogen 3.009 N/A THR 161.A N SER 158.A O no hydrogen 3.104 N/A THR 161.A OG1 SER 158.A O no hydrogen 2.733 N/A GLY 162.A N ASP 159.A O no hydrogen 3.185 N/A LEU 164.A N LEU 160.A O no hydrogen 2.944 N/A ARG 165.A NH1 GLU 163.A OE2 no hydrogen 3.046 N/A ARG 166.A N GLU 163.A O no hydrogen 2.858 N/A ARG 166.A NE GLU 113.A OE1 no hydrogen 3.238 N/A ARG 166.A NE GLU 113.A OE2 no hydrogen 3.227 N/A ARG 166.A NH1 ILE 49.A O no hydrogen 2.956 N/A ARG 166.A NH2 ILE 49.A O no hydrogen 3.491 N/A ARG 166.A NH2 GLU 113.A OE1 no hydrogen 2.774 N/A CYS 167.A N LEU 164.A O no hydrogen 2.933 N/A CYS 167.A SG CYS 179.A O no hydrogen 3.726 N/A ASN 169.A N ARG 165.A O no hydrogen 2.896 N/A SER 170.A N ARG 166.A O no hydrogen 2.920 N/A SER 170.A OG ARG 166.A O no hydrogen 2.805 N/A LEU 171.A N CYS 167.A O no hydrogen 3.227 N/A GLY 172.A N ILE 168.A O no hydrogen 3.167 N/A SER 173.A N ASN 169.A O no hydrogen 3.063 N/A SER 173.A OG ASN 169.A O no hydrogen 3.055 N/A SER 173.A OG SER 170.A O no hydrogen 3.498 N/A GLY 174.A N LEU 171.A O no hydrogen 3.006 N/A THR 178.A N ASP 175.A O no hydrogen 3.229 N/A THR 178.A OG1 ASP 175.A OD2 no hydrogen 2.683 N/A CYS 179.A SG CYS 167.A O no hydrogen 3.346 N/A ASP 181.A N ASP 177.A O no hydrogen 3.137 N/A THR 182.A N THR 178.A O no hydrogen 2.897 N/A THR 182.A OG1 THR 178.A O no hydrogen 3.047 N/A THR 182.A OG1 CYS 179.A O no hydrogen 3.032 N/A CYS 183.A N CYS 179.A O no hydrogen 3.021 N/A LYS 184.A N LEU 180.A O no hydrogen 2.967 N/A ALA 185.A N ASP 181.A O no hydrogen 3.070 N/A LEU 186.A N THR 182.A O no hydrogen 2.909 N/A GLN 187.A N CYS 183.A O no hydrogen 2.949 N/A GLN 187.A NE2 GLU 218.A OE2 no hydrogen 2.575 N/A HIS 188.A N LYS 184.A O no hydrogen 3.040 N/A HIS 188.A ND1 LYS 184.A O no hydrogen 2.879 N/A PHE 189.A N ALA 185.A O no hydrogen 2.907 N/A TYR 190.A N LEU 186.A O no hydrogen 2.877 N/A SER 191.A N GLN 187.A O no hydrogen 3.038 N/A SER 191.A OG GLN 187.A O no hydrogen 3.117 N/A GLY 192.A N HIS 188.A O no hydrogen 3.122 N/A TYR 193.A N PHE 189.A O no hydrogen 2.810 N/A TYR 193.A OH ILE 154.A O no hydrogen 2.661 N/A ILE 194.A N TYR 190.A O no hydrogen 3.001 N/A SER 195.A N GLY 192.A O no hydrogen 3.178 N/A SER 195.A OG GLY 192.A O no hydrogen 2.589 N/A LEU 196.A N TYR 193.A O no hydrogen 3.069 N/A TRP 205.A N ALA 201.A O no hydrogen 3.033 N/A ARG 206.A N ARG 202.A O no hydrogen 3.194 N/A LYS 207.A N GLU 203.A O no hydrogen 3.126 N/A LYS 207.A NZ ASP 159.A OD1 no hydrogen 2.976 N/A ILE 208.A N LEU 204.A O no hydrogen 3.035 N/A THR 209.A N TRP 205.A O no hydrogen 3.072 N/A THR 209.A OG1 TRP 205.A O no hydrogen 3.092 N/A THR 210.A N ARG 206.A O no hydrogen 3.049 N/A THR 210.A OG1 ARG 206.A O no hydrogen 2.991 N/A SER 213.A N THR 210.A O no hydrogen 3.121 N/A SER 213.A OG THR 210.A O no hydrogen 3.459 N/A LEU 215.A N LYS 211.A O no hydrogen 2.965 N/A LYS 216.A N GLN 212.A O no hydrogen 3.022 N/A ALA 217.A N SER 213.A O no hydrogen 3.032 N/A GLU 218.A N VAL 214.A O no hydrogen 2.906 N/A ASN 219.A N LEU 215.A O no hydrogen 2.947 N/A ASN 219.A ND2 LEU 215.A O no hydrogen 2.419 N/A VAL 220.A N LYS 216.A O no hydrogen 3.037 N/A CYS 221.A N ALA 217.A O no hydrogen 3.153 N/A CYS 221.A SG CYS 179.A O no hydrogen 3.464 N/A CYS 221.A SG ALA 217.A O no hydrogen 3.557 N/A TYR 222.A N GLU 218.A O no hydrogen 3.079 N/A ASN 223.A N ASN 219.A O no hydrogen 2.992 N/A VAL 224.A N VAL 220.A O no hydrogen 2.922 N/A LYS 225.A N CYS 221.A O no hydrogen 2.981 N/A VAL 226.A N TYR 222.A O no hydrogen 2.987 N/A ARG 227.A N ASN 223.A O no hydrogen 2.872 N/A ARG 227.A NH1 ASN 223.A OD1 no hydrogen 2.684 N/A GLY 228.A N VAL 224.A O no hydrogen 3.092 N/A ALA 232.A N GLY 228.A O no hydrogen 3.122 N/A LYS 233.A N GLU 230.A O no hydrogen 3.203 N/A