Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4u4l_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 2.A N ASP 5.A OD2 no hydrogen 3.165 N/A ASP 5.A N GLU 2.A O no hydrogen 3.192 N/A GLN 6.A N PHE 13.A O no hydrogen 2.834 N/A ARG 7.A NE GLY 9.A O no hydrogen 3.050 N/A PHE 8.A N LEU 11.A O no hydrogen 2.833 N/A ASP 10.A N GLN 59.A OE1 no hydrogen 2.803 N/A LEU 11.A N PHE 8.A O no hydrogen 2.877 N/A VAL 12.A N THR 24.A O no hydrogen 3.067 N/A PHE 13.A N GLN 6.A O no hydrogen 2.705 N/A ARG 14.A N GLN 22.A O no hydrogen 2.999 N/A GLN 15.A NE2 ALA 17.A O no hydrogen 3.113 N/A GLN 15.A NE2 PRO 18.A O no hydrogen 3.261 N/A LEU 16.A N VAL 20.A O no hydrogen 2.716 N/A ALA 17.A N VAL 20.A O no hydrogen 3.120 N/A VAL 20.A N ALA 17.A O no hydrogen 3.199 N/A TRP 21.A N ILE 38.A O no hydrogen 2.931 N/A GLN 22.A N ARG 14.A O no hydrogen 2.789 N/A HIS 23.A N GLY 36.A O no hydrogen 2.959 N/A HIS 23.A NE2 VAL 48.A O no hydrogen 3.208 N/A THR 24.A N VAL 12.A O no hydrogen 2.854 N/A THR 24.A OG1 ASN 35.A OD1 no hydrogen 2.671 N/A SER 25.A N SER 34.A O no hydrogen 2.941 N/A LEU 27.A N VAL 32.A O no hydrogen 3.057 N/A MET 29.A N GLY 30.A O no hydrogen 2.975 N/A VAL 32.A N LEU 27.A O no hydrogen 2.945 N/A SER 34.A N SER 25.A O no hydrogen 2.753 N/A SER 34.A OG ASP 83.A OD2 no hydrogen 3.490 N/A ASN 35.A N SER 208.A O no hydrogen 2.719 N/A ASN 35.A ND2 MET 207.A O no hydrogen 3.086 N/A GLY 36.A N HIS 23.A O no hydrogen 2.775 N/A LEU 37.A N VAL 48.A O no hydrogen 3.019 N/A ILE 38.A N TRP 21.A O no hydrogen 2.750 N/A VAL 39.A N LEU 46.A O no hydrogen 2.779 N/A ARG 40.A N ASN 19.A O no hydrogen 2.849 N/A ARG 40.A NE ASN 19.A OD1 no hydrogen 2.871 N/A ARG 40.A NH2 PRO 18.A O no hydrogen 2.791 N/A ARG 40.A NH2 ASN 19.A OD1 no hydrogen 3.425 N/A ASP 41.A N ARG 44.A O no hydrogen 2.816 N/A ARG 44.A N ASP 41.A O no hydrogen 3.297 N/A ARG 44.A NE ASP 41.A OD2 no hydrogen 3.149 N/A ARG 44.A NH1 ASN 135.A O no hydrogen 3.126 N/A ARG 44.A NH2 ASP 41.A OD2 no hydrogen 3.112 N/A ARG 44.A NH2 ASN 135.A O no hydrogen 2.744 N/A VAL 45.A N PRO 71.A O no hydrogen 2.779 N/A LEU 46.A N VAL 39.A O no hydrogen 2.766 N/A VAL 47.A N LEU 74.A O no hydrogen 3.048 N/A VAL 48.A N LEU 37.A O no hydrogen 2.901 N/A ASP 49.A N VAL 76.A O no hydrogen 2.773 N/A THR 50.A N LYS 84.A O no hydrogen 3.015 N/A THR 50.A OG1 ALA 51.A O no hydrogen 2.777 N/A THR 50.A OG1 LYS 84.A O no hydrogen 3.071 N/A ALA 51.A N THR 57.A OG1 no hydrogen 3.022 N/A TRP 52.A NE1 SER 25.A O no hydrogen 3.127 N/A GLN 56.A N THR 53.A OG1 no hydrogen 3.123 N/A GLN 56.A NE2 TYR 26.A O no hydrogen 2.807 N/A THR 57.A N THR 53.A O no hydrogen 2.991 N/A THR 57.A OG1 THR 53.A O no hydrogen 2.794 N/A ALA 58.A N ASP 54.A O no hydrogen 2.858 N/A GLN 59.A N ASP 55.A O no hydrogen 3.103 N/A GLN 59.A NE2 ASP 55.A OD2 no hydrogen 3.135 N/A ILE 60.A N GLN 56.A O no hydrogen 3.066 N/A LEU 61.A N THR 57.A O no hydrogen 3.079 N/A ASN 62.A N ALA 58.A O no hydrogen 2.855 N/A TRP 63.A N GLN 59.A O no hydrogen 2.909 N/A TRP 63.A NE1 GLN 6.A OE1 no hydrogen 3.155 N/A ILE 64.A N ILE 60.A O no hydrogen 2.923 N/A LYS 65.A N LEU 61.A O no hydrogen 3.006 N/A LYS 65.A NZ ASN 69.A OD1 no hydrogen 2.827 N/A GLN 66.A N ASN 62.A O no hydrogen 2.938 N/A GLN 66.A NE2 GLU 67.A OE2 no hydrogen 2.942 N/A GLU 67.A N TRP 63.A O no hydrogen 2.791 N/A ILE 68.A N ILE 64.A O no hydrogen 2.812 N/A ASN 69.A N ILE 64.A O no hydrogen 2.838 N/A ALA 73.A N VAL 45.A O no hydrogen 2.904 N/A ALA 75.A N ALA 97.A O no hydrogen 2.961 N/A VAL 76.A N VAL 47.A O no hydrogen 2.879 N/A VAL 77.A N TYR 99.A O no hydrogen 2.975 N/A THR 78.A N ASP 49.A OD1 no hydrogen 2.709 N/A THR 78.A OG1 ASP 49.A OD1 no hydrogen 3.038 N/A THR 78.A OG1 ASP 49.A OD2 no hydrogen 2.863 N/A HIS 79.A NE2 HIS 81.A ND1 no hydrogen 3.100 N/A ALA 80.A N ASP 151.A OD2 no hydrogen 2.902 N/A HIS 81.A N HIS 79.A O no hydrogen 2.998 N/A HIS 81.A NE2 ASP 182.A OD2 no hydrogen 3.073 N/A GLN 82.A NE2 TRP 52.A O no hydrogen 3.249 N/A LYS 84.A N HIS 81.A O no hydrogen 3.070 N/A LYS 84.A NZ ASP 49.A OD2 no hydrogen 2.820 N/A LYS 84.A NZ SER 208.A OG no hydrogen 3.099 N/A MET 85.A N HIS 81.A O no hydrogen 3.074 N/A GLY 86.A N GLN 82.A O no hydrogen 2.906 N/A GLY 87.A N THR 50.A OG1 no hydrogen 2.971 N/A MET 88.A N MET 85.A O no hydrogen 3.356 N/A ALA 90.A N ASP 54.A OD1 no hydrogen 3.372 N/A ALA 90.A N GLY 87.A O no hydrogen 3.059 N/A LEU 91.A N GLY 87.A O no hydrogen 3.432 N/A HIS 92.A N MET 88.A O no hydrogen 3.075 N/A HIS 92.A NE2 THR 98.A OG1 no hydrogen 2.744 N/A ALA 93.A N ASP 89.A O no hydrogen 2.854 N/A ALA 94.A N ALA 90.A O no hydrogen 3.328 N/A ALA 94.A N LEU 91.A O no hydrogen 3.030 N/A GLY 95.A N HIS 92.A O no hydrogen 2.966 N/A ILE 96.A N LEU 91.A O no hydrogen 3.147 N/A THR 98.A N GLN 117.A OE1 no hydrogen 3.420 N/A THR 98.A OG1 HIS 92.A NE2 no hydrogen 2.744 N/A TYR 99.A N ALA 75.A O no hydrogen 2.870 N/A ALA 100.A N HIS 118.A O no hydrogen 3.095 N/A ASN 101.A ND2 ASP 151.A O no hydrogen 3.078 N/A ALA 102.A N LEU 120.A O no hydrogen 3.028 N/A LEU 103.A N ASN 101.A OD1 no hydrogen 3.353 N/A SER 104.A OG ASP 151.A OD2 no hydrogen 2.611 N/A ASN 105.A N ASN 101.A O no hydrogen 3.136 N/A ASN 105.A ND2 HIS 118.A O no hydrogen 3.145 N/A ASN 105.A ND2 SER 119.A OG no hydrogen 2.907 N/A GLN 106.A N ALA 102.A O no hydrogen 2.839 N/A LEU 107.A N LEU 103.A O no hydrogen 2.808 N/A ALA 108.A N SER 104.A O no hydrogen 2.892 N/A GLU 111.A N LEU 107.A O no hydrogen 3.171 N/A GLU 111.A N ALA 108.A O no hydrogen 2.965 N/A GLY 112.A N PRO 109.A O no hydrogen 2.919 N/A MET 113.A N ALA 108.A O no hydrogen 2.805 N/A ALA 116.A N ASN 105.A OD1 no hydrogen 2.803 N/A GLN 117.A N THR 98.A OG1 no hydrogen 2.898 N/A HIS 118.A N THR 98.A O no hydrogen 2.930 N/A LEU 120.A N ALA 100.A O no hydrogen 2.691 N/A THR 121.A N THR 132.A OG1 no hydrogen 3.343 N/A ALA 123.A N TRP 127.A O no hydrogen 2.894 N/A GLY 126.A N ALA 123.A O no hydrogen 2.956 N/A TRP 127.A N ASN 125.A OD1 no hydrogen 3.133 N/A VAL 128.A N VAL 141.A O no hydrogen 3.114 N/A GLU 129.A N THR 121.A O no hydrogen 2.834 N/A THR 132.A N GLU 129.A O no hydrogen 2.878 N/A THR 132.A OG1 GLU 129.A O no hydrogen 2.769 N/A ALA 133.A N PRO 130.A O no hydrogen 2.987 N/A LEU 139.A N PHE 136.A O no hydrogen 3.017 N/A LYS 140.A N GLY 156.A O no hydrogen 2.885 N/A PHE 142.A N THR 154.A O no hydrogen 2.899 N/A TYR 143.A N GLY 126.A O no hydrogen 2.749 N/A TYR 143.A OH SER 150.A O no hydrogen 2.671 N/A GLY 147.A N THR 149.A O no hydrogen 3.089 N/A THR 149.A N ASN 152.A OD1 no hydrogen 3.068 N/A THR 149.A OG1 ASP 151.A OD1 no hydrogen 2.665 N/A ASN 152.A ND2 GLY 145.A O no hydrogen 3.076 N/A ASN 152.A ND2 ASN 152.A O no hydrogen 2.658 N/A ILE 153.A N THR 78.A O no hydrogen 2.978 N/A THR 154.A N PHE 142.A O no hydrogen 2.856 N/A THR 154.A OG1 PHE 142.A O no hydrogen 2.744 N/A VAL 155.A N PHE 164.A O no hydrogen 3.070 N/A GLY 156.A N LYS 140.A O no hydrogen 2.961 N/A ILE 157.A N ILE 162.A O no hydrogen 3.104 N/A ASP 158.A N PRO 138.A O no hydrogen 2.801 N/A THR 160.A N ILE 157.A O no hydrogen 3.239 N/A THR 160.A OG1 ILE 157.A O no hydrogen 2.713 N/A ILE 162.A N THR 160.A OG1 no hydrogen 3.098 N/A ALA 163.A N MET 204.A O no hydrogen 3.086 N/A PHE 164.A N VAL 155.A O no hydrogen 2.629 N/A GLY 165.A N VAL 206.A O no hydrogen 2.806 N/A CYS 167.A SG ASP 83.A OD2 no hydrogen 3.601 N/A CYS 167.A SG SER 208.A OG no hydrogen 2.993 N/A CYS 167.A SG HIS 209.A NE2 no hydrogen 3.460 N/A LEU 168.A N GLY 165.A O no hydrogen 3.199 N/A LYS 170.A N THR 221.A OG1 no hydrogen 2.894 N/A LYS 170.A NZ CYS 167.A O no hydrogen 2.774 N/A SER 172.A N ASP 213.A OD2 no hydrogen 2.919 N/A SER 172.A OG ASP 213.A OD2 no hydrogen 2.646 N/A LYS 173.A N ASP 171.A OD2 no hydrogen 3.088 N/A ALA 174.A N ASP 171.A O no hydrogen 2.955 N/A ALA 183.A N LEU 180.A O no hydrogen 3.117 N/A ASP 184.A N GLY 147.A O no hydrogen 2.910 N/A GLU 186.A N ASP 184.A OD1 no hydrogen 3.033 N/A HIS 187.A N ASP 184.A OD1 no hydrogen 3.038 N/A HIS 187.A ND1 ASP 184.A OD2 no hydrogen 2.844 N/A TYR 188.A OH LEU 168.A O no hydrogen 2.660 N/A SER 191.A N HIS 187.A O no hydrogen 2.892 N/A SER 191.A OG PRO 144.A O no hydrogen 3.493 N/A SER 191.A OG PRO 146.A O no hydrogen 2.616 N/A SER 191.A OG HIS 187.A O no hydrogen 2.970 N/A ALA 192.A N TYR 188.A O no hydrogen 2.904 N/A ARG 193.A N ALA 189.A O no hydrogen 2.985 N/A ARG 193.A NH1 ASP 226.A OD1 no hydrogen 3.024 N/A ARG 193.A NH1 ASP 226.A OD2 no hydrogen 3.564 N/A ARG 193.A NH2 ASP 226.A OD2 no hydrogen 2.739 N/A ALA 194.A N ALA 190.A O no hydrogen 2.849 N/A PHE 195.A N SER 191.A O no hydrogen 3.044 N/A GLY 196.A N ALA 192.A O no hydrogen 3.202 N/A ALA 197.A N ARG 193.A O no hydrogen 3.059 N/A ALA 198.A N ALA 194.A O no hydrogen 2.935 N/A ALA 198.A N PHE 195.A O no hydrogen 3.224 N/A PHE 199.A N PHE 195.A O no hydrogen 3.256 N/A ALA 202.A N PHE 199.A O no hydrogen 3.185 N/A SER 203.A N ASP 161.A O no hydrogen 2.826 N/A MET 204.A N ASP 161.A O no hydrogen 2.904 N/A ILE 205.A N ASP 213.A O no hydrogen 2.837 N/A VAL 206.A N ALA 163.A O no hydrogen 2.920 N/A SER 208.A N GLY 166.A O no hydrogen 2.944 N/A HIS 209.A ND1 ALA 33.A O no hydrogen 3.000 N/A SER 210.A OG ASP 171.A OD1 no hydrogen 2.865 N/A ASP 213.A N ILE 205.A O no hydrogen 2.941 N/A SER 214.A N ASP 213.A OD1 no hydrogen 2.658 N/A ARG 215.A NH1 PHE 199.A O no hydrogen 2.822 N/A ARG 215.A NH1 ALA 202.A O no hydrogen 2.833 N/A ARG 215.A NH2 GLY 196.A O no hydrogen 2.913 N/A ALA 216.A N SER 214.A OG no hydrogen 3.136 N/A ALA 217.A N SER 214.A O no hydrogen 3.101 N/A ILE 218.A N ARG 215.A O no hydrogen 2.887 N/A THR 219.A N ARG 215.A O no hydrogen 3.402 N/A THR 219.A OG1 ALA 216.A O no hydrogen 3.169 N/A HIS 220.A N ALA 216.A O no hydrogen 2.833 N/A HIS 220.A NE2 ALA 174.A O no hydrogen 2.893 N/A THR 221.A N ALA 217.A O no hydrogen 2.996 N/A THR 221.A OG1 ALA 217.A O no hydrogen 2.672 N/A ALA 222.A N ILE 218.A O no hydrogen 2.955 N/A ARG 223.A N THR 219.A O no hydrogen 2.988 N/A MET 224.A N HIS 220.A O no hydrogen 3.005 N/A ALA 225.A N THR 221.A O no hydrogen 2.975 N/A ASP 226.A N ALA 222.A O no hydrogen 2.854 N/A LYS 227.A N MET 224.A O no hydrogen 3.326 N/A LEU 228.A N ALA 225.A O no hydrogen 3.020 N/A ARG 229.A N ASP 226.A O no hydrogen 3.435 N/A ARG 229.A NE GLU 186.A O no hydrogen 3.105 N/A ARG 229.A NH2 GLU 186.A OE2 no hydrogen 2.772 N/A