Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1xcj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N GLU 7.A OE2 no hydrogen 2.891 N/A GLU 7.A N ALA 4.A O no hydrogen 2.914 N/A CYS 9.A N LEU 132.A O no hydrogen 2.573 N/A CYS 9.A SG GLU 7.A OE1 no hydrogen 3.363 N/A GLY 10.A N ASP 8.A OD1 no hydrogen 2.994 N/A TRP 13.A N GLY 10.A O no hydrogen 3.077 N/A ARG 14.A NE ASP 86.A OD1 no hydrogen 2.665 N/A ARG 14.A NE ASP 86.A OD2 no hydrogen 3.051 N/A ALA 16.A N TRP 13.A O no hydrogen 3.113 N/A ALA 19.A N GLN 28.A O no hydrogen 2.979 N/A TYR 20.A OH GLY 63.A O no hydrogen 2.754 N/A ASP 21.A N HIS 26.A O no hydrogen 3.004 N/A ASP 24.A N ASP 21.A O no hydrogen 2.581 N/A THR 25.A N ASP 21.A OD2 no hydrogen 2.659 N/A HIS 26.A N ASP 21.A OD2 no hydrogen 2.921 N/A HIS 26.A ND1 ASP 21.A OD1 no hydrogen 2.868 N/A LEU 27.A N MET 35.A O no hydrogen 2.923 N/A GLN 28.A N ALA 19.A O no hydrogen 2.815 N/A ILE 29.A N LYS 32.A O no hydrogen 3.093 N/A LYS 32.A N ILE 29.A O no hydrogen 3.004 N/A LYS 32.A NZ GLU 7.A OE1 no hydrogen 2.804 N/A LYS 32.A NZ LEU 30.A O no hydrogen 3.400 N/A VAL 34.A N LEU 27.A O no hydrogen 3.017 N/A MET 35.A N LEU 27.A O no hydrogen 3.372 N/A ARG 37.A N THR 25.A O no hydrogen 3.001 N/A ARG 37.A NE ASP 24.A O no hydrogen 2.869 N/A ARG 37.A NH2 ASP 24.A O no hydrogen 3.542 N/A ARG 37.A NH2 ASP 24.A OD2 no hydrogen 3.141 N/A TRP 38.A NE1 GLU 36.A OE2 no hydrogen 2.840 N/A GLU 39.A N GLU 36.A O no hydrogen 3.106 N/A THR 40.A N ARG 37.A O no hydrogen 2.920 N/A THR 40.A OG1 ARG 37.A O no hydrogen 2.546 N/A TYR 42.A N GLU 39.A O no hydrogen 2.752 N/A TYR 42.A OH ILE 222.A O no hydrogen 2.729 N/A MET 43.A N GLU 39.A O no hydrogen 2.900 N/A HIS 44.A N THR 40.A O no hydrogen 2.854 N/A SER 45.A N PRO 41.A O no hydrogen 3.160 N/A SER 45.A OG THR 223.A OG1 no hydrogen 2.646 N/A LEU 46.A N TYR 42.A O no hydrogen 2.955 N/A ALA 47.A N MET 43.A O no hydrogen 2.840 N/A ALA 48.A N HIS 44.A O no hydrogen 2.948 N/A ALA 49.A N SER 45.A O no hydrogen 3.226 N/A ALA 50.A N LEU 46.A O no hydrogen 2.850 N/A ALA 51.A N ALA 47.A O no hydrogen 2.997 N/A SER 52.A N ALA 49.A O no hydrogen 3.148 N/A SER 52.A OG ALA 49.A O no hydrogen 2.675 N/A ARG 53.A NE SER 52.A OG no hydrogen 2.902 N/A ARG 53.A NH2 SER 52.A OG no hydrogen 2.815 N/A GLY 54.A N ALA 51.A O no hydrogen 2.666 N/A ARG 56.A N ASP 123.A OD2 no hydrogen 3.074 N/A ARG 56.A NE HIS 121.A O no hydrogen 2.876 N/A ARG 56.A NH1 GLU 78.A OE1 no hydrogen 3.143 N/A ARG 56.A NH2 HIS 121.A O no hydrogen 3.208 N/A VAL 57.A N GLU 78.A O no hydrogen 2.730 N/A LEU 58.A N GLY 124.A O no hydrogen 2.788 N/A GLU 59.A N TRP 80.A O no hydrogen 2.744 N/A VAL 60.A N LEU 126.A O no hydrogen 2.778 N/A GLY 61.A N ILE 82.A O no hydrogen 2.839 N/A PHE 62.A N GLU 83.A OE2 no hydrogen 3.028 N/A ALA 65.A N PHE 62.A O no hydrogen 2.888 N/A SER 69.A N ALA 65.A O no hydrogen 3.045 N/A SER 69.A OG ALA 65.A O no hydrogen 2.794 N/A ARG 70.A NH1 ARG 70.A O no hydrogen 2.673 N/A VAL 71.A N ALA 67.A O no hydrogen 2.898 N/A GLN 72.A N ALA 68.A O no hydrogen 3.116 N/A GLN 72.A NE2 HIS 101.A O no hydrogen 3.591 N/A GLN 73.A N ARG 70.A O no hydrogen 3.095 N/A ALA 74.A N VAL 71.A O no hydrogen 3.053 N/A ILE 76.A N ALA 74.A O no hydrogen 2.757 N/A LYS 77.A N GLY 55.A O no hydrogen 2.815 N/A GLU 78.A N GLY 55.A O no hydrogen 3.192 N/A HIS 79.A N LYS 102.A O no hydrogen 2.699 N/A HIS 79.A NE2 GLU 59.A OE1 no hydrogen 2.707 N/A TRP 80.A N VAL 57.A O no hydrogen 2.740 N/A TRP 80.A NE1 GLU 78.A OE1 no hydrogen 2.975 N/A ILE 81.A N VAL 104.A O no hydrogen 2.994 N/A ILE 82.A N GLU 59.A O no hydrogen 2.959 N/A GLU 83.A N LEU 106.A O no hydrogen 3.058 N/A ASN 85.A N GLU 83.A OE1 no hydrogen 2.828 N/A ASN 85.A ND2 TRP 13.A O no hydrogen 2.764 N/A ASN 85.A ND2 ALA 16.A O no hydrogen 2.836 N/A ASP 86.A N ARG 14.A O no hydrogen 2.874 N/A VAL 88.A N ASN 85.A OD1 no hydrogen 3.058 N/A PHE 89.A N ASN 85.A O no hydrogen 2.949 N/A GLN 90.A N ASP 86.A O no hydrogen 3.230 N/A GLN 90.A N GLY 87.A O no hydrogen 3.153 N/A GLN 90.A NE2 GLN 90.A O no hydrogen 3.240 N/A GLN 90.A NE2 ASN 94.A OD1 no hydrogen 3.137 N/A ARG 91.A N GLY 87.A O no hydrogen 3.309 N/A ARG 91.A NH2 ASP 24.A OD1 no hydrogen 3.349 N/A LEU 92.A N VAL 88.A O no hydrogen 2.796 N/A GLN 93.A N PHE 89.A O no hydrogen 2.920 N/A ASN 94.A N GLN 90.A O no hydrogen 2.983 N/A TRP 95.A N ARG 91.A O no hydrogen 2.761 N/A TRP 95.A NE1 SER 69.A OG no hydrogen 3.224 N/A ALA 96.A N LEU 92.A O no hydrogen 2.746 N/A LYS 98.A NZ GLN 99.A OE1 no hydrogen 2.855 N/A GLN 99.A N ALA 96.A O no hydrogen 3.309 N/A VAL 104.A N HIS 79.A O no hydrogen 2.970 N/A LEU 106.A N ILE 81.A O no hydrogen 2.758 N/A LYS 107.A NZ ASP 86.A OD1 no hydrogen 2.543 N/A GLY 108.A N GLU 83.A O no hydrogen 2.909 N/A GLU 111.A N GLU 111.A OE2 no hydrogen 2.731 N/A GLU 112.A N LEU 109.A O no hydrogen 2.857 N/A VAL 113.A N LEU 109.A O no hydrogen 2.745 N/A ALA 114.A N TRP 110.A O no hydrogen 2.693 N/A THR 116.A N VAL 113.A O no hydrogen 2.865 N/A THR 116.A OG1 VAL 113.A O no hydrogen 2.577 N/A LEU 117.A N ALA 114.A O no hydrogen 2.825 N/A GLY 120.A N ARG 151.A O no hydrogen 2.648 N/A PHE 122.A N LEU 152.A O no hydrogen 2.908 N/A ASP 123.A N ARG 56.A O no hydrogen 2.886 N/A ILE 125.A N ILE 158.A O no hydrogen 2.896 N/A LEU 126.A N LEU 58.A O no hydrogen 2.747 N/A TYR 127.A N THR 160.A O no hydrogen 3.113 N/A TYR 127.A OH HIS 140.A ND1 no hydrogen 3.018 N/A ASP 128.A N VAL 60.A O no hydrogen 2.983 N/A GLU 134.A N GLU 7.A O no hydrogen 2.976 N/A THR 136.A N SER 133.A O no hydrogen 3.195 N/A THR 136.A OG1 THR 139.A OG1 no hydrogen 3.344 N/A TRP 137.A N GLU 134.A O no hydrogen 3.201 N/A TRP 137.A NE1 THR 165.A O no hydrogen 2.823 N/A HIS 138.A ND1 SER 166.A OG no hydrogen 2.633 N/A THR 139.A N THR 136.A O no hydrogen 3.083 N/A THR 139.A OG1 THR 136.A OG1 no hydrogen 3.344 N/A HIS 140.A N THR 136.A O no hydrogen 3.023 N/A HIS 140.A ND1 TYR 127.A OH no hydrogen 3.018 N/A ASN 143.A N THR 139.A O no hydrogen 3.292 N/A PHE 144.A N HIS 140.A O no hydrogen 3.282 N/A ILE 145.A N GLN 141.A O no hydrogen 2.962 N/A LYS 146.A N PHE 142.A O no hydrogen 2.982 N/A THR 147.A N ASN 143.A O no hydrogen 3.249 N/A THR 147.A OG1 ASN 143.A O no hydrogen 2.688 N/A HIS 148.A N PHE 144.A O no hydrogen 2.796 N/A ALA 149.A N PHE 144.A O no hydrogen 3.150 N/A ARG 151.A NH1 THR 147.A O no hydrogen 3.447 N/A ARG 151.A NH2 ALA 114.A O no hydrogen 2.749 N/A ARG 151.A NH2 LEU 117.A O no hydrogen 3.153 N/A LEU 152.A N HIS 148.A O no hydrogen 2.787 N/A LEU 153.A N ALA 149.A O no hydrogen 3.198 N/A LYS 154.A N PHE 122.A O no hydrogen 2.865 N/A GLY 157.A N LYS 154.A O no hydrogen 2.730 N/A ILE 158.A N ASP 123.A O no hydrogen 2.767 N/A LEU 159.A N VAL 226.A O no hydrogen 2.634 N/A THR 160.A N ILE 125.A O no hydrogen 3.021 N/A THR 160.A OG1 PRO 224.A O no hydrogen 2.744 N/A TYR 161.A OH GLN 186.A OE1 no hydrogen 3.107 N/A CYS 162.A N TYR 127.A O no hydrogen 3.332 N/A ASN 163.A ND2 TRP 137.A O no hydrogen 2.988 N/A SER 166.A N ASN 163.A O no hydrogen 3.254 N/A SER 166.A N ASN 163.A OD1 no hydrogen 2.958 N/A SER 166.A OG HIS 138.A ND1 no hydrogen 2.633 N/A TRP 167.A N ASN 163.A O no hydrogen 2.966 N/A GLY 168.A N LEU 164.A O no hydrogen 2.895 N/A LEU 170.A N SER 166.A O no hydrogen 2.974 N/A MET 171.A N TRP 167.A O no hydrogen 2.720 N/A LYS 172.A N GLU 169.A O no hydrogen 3.133 N/A SER 173.A N GLU 169.A O no hydrogen 2.884 N/A SER 173.A OG GLU 169.A O no hydrogen 3.021 N/A LYS 174.A N LEU 170.A O no hydrogen 3.122 N/A TYR 175.A N LEU 170.A O no hydrogen 3.076 N/A TYR 175.A OH GLU 184.A OE1 no hydrogen 2.875 N/A THR 179.A N ASP 177.A OD1 no hydrogen 2.925 N/A THR 179.A OG1 ASP 177.A OD1 no hydrogen 2.655 N/A ALA 180.A N ASP 177.A OD1 no hydrogen 3.098 N/A MET 181.A N ASP 177.A O no hydrogen 2.965 N/A PHE 182.A N ILE 178.A O no hydrogen 3.077 N/A GLU 183.A N THR 179.A O no hydrogen 3.059 N/A GLU 184.A N ALA 180.A O no hydrogen 3.190 N/A THR 185.A N MET 181.A O no hydrogen 2.808 N/A THR 185.A OG1 MET 181.A O no hydrogen 2.702 N/A GLN 186.A N PHE 182.A O no hydrogen 2.753 N/A GLN 186.A NE2 THR 185.A OG1 no hydrogen 2.790 N/A VAL 187.A N PHE 182.A O no hydrogen 2.965 N/A LEU 190.A N GLN 186.A O no hydrogen 3.138 N/A LEU 191.A N VAL 187.A O no hydrogen 2.811 N/A GLU 192.A N PRO 188.A O no hydrogen 2.992 N/A ALA 193.A N ALA 189.A O no hydrogen 2.818 N/A GLY 194.A N LEU 191.A O no hydrogen 3.032 N/A PHE 195.A N LEU 190.A O no hydrogen 3.377 N/A ARG 197.A NE ARG 197.A O no hydrogen 2.696 N/A ARG 197.A NH1 GLU 183.A OE2 no hydrogen 3.164 N/A ARG 197.A NH2 ARG 197.A O no hydrogen 2.949 N/A ASN 199.A N GLN 196.A O no hydrogen 2.811 N/A ILE 200.A N ARG 197.A O no hydrogen 3.242 N/A CYS 201.A N LEU 225.A O no hydrogen 2.722 N/A GLU 203.A N THR 223.A O no hydrogen 3.146 N/A MET 205.A N MET 221.A O no hydrogen 3.124 N/A LEU 207.A N PRO 219.A O no hydrogen 3.048 N/A CYS 213.A N PRO 210.A O no hydrogen 2.812 N/A CYS 213.A SG GLU 36.A OE2 no hydrogen 3.558 N/A CYS 213.A SG TYR 216.A O no hydrogen 3.576 N/A ARG 214.A NH1 GLY 31.A O no hydrogen 3.391 N/A ARG 214.A NH2 GLY 31.A O no hydrogen 3.322 N/A TYR 215.A OH GLU 39.A OE1 no hydrogen 2.686 N/A TYR 216.A OH GLN 220.A O no hydrogen 2.636 N/A MET 221.A N MET 205.A O no hydrogen 2.918 N/A THR 223.A N GLU 203.A O no hydrogen 2.969 N/A THR 223.A OG1 SER 45.A OG no hydrogen 2.646 N/A LEU 225.A N CYS 201.A O no hydrogen 2.671 N/A VAL 226.A N LEU 159.A O no hydrogen 2.953 N/A THR 227.A N ASN 199.A O no hydrogen 2.939 N/A THR 227.A OG1 ASN 199.A O no hydrogen 3.563 N/A THR 227.A OG1 HIS 229.A O no hydrogen 2.615 N/A LYS 228.A NZ PHE 150.A O no hydrogen 2.660 N/A LYS 228.A NZ LEU 153.A O no hydrogen 3.284 N/A