Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4r9t_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PRO 1.A N ASP 29.A OD2 no hydrogen 2.842 N/A CYS 2.A SG THR 4.A OG1 no hydrogen 2.936 N/A ARG 7.A N ASP 11.A OD2 no hydrogen 3.091 N/A CYS 9.A SG TRP 46.A O no hydrogen 3.743 N/A CYS 9.A SG THR 47.A OG1 no hydrogen 3.131 N/A ASP 11.A N THR 8.A OG1 no hydrogen 3.050 N/A LEU 12.A N THR 8.A O no hydrogen 3.213 N/A LEU 13.A N CYS 9.A O no hydrogen 2.918 N/A ASP 14.A N LYS 10.A O no hydrogen 2.927 N/A ARG 15.A N ASP 11.A O no hydrogen 3.010 N/A ARG 15.A N LEU 12.A O no hydrogen 3.196 N/A GLY 16.A N LEU 13.A O no hydrogen 3.070 N/A HIS 17.A N LEU 12.A O no hydrogen 3.070 N/A HIS 17.A ND1 LEU 12.A O no hydrogen 3.256 N/A GLY 21.A N CYS 37.A O no hydrogen 3.081 N/A TRP 22.A NE1 ARG 73.A O no hydrogen 2.854 N/A HIS 23.A N VAL 35.A O no hydrogen 2.781 N/A HIS 23.A ND1 GLY 21.A O no hydrogen 3.123 N/A THR 24.A OG1 THR 34.A OG1 no hydrogen 3.132 N/A ILE 25.A N LEU 33.A O no hydrogen 2.832 N/A TYR 26.A N PRO 6.A O no hydrogen 2.762 N/A LEU 27.A N ARG 31.A O no hydrogen 2.808 N/A ARG 31.A NH1 ASN 83.A OD1 no hydrogen 3.145 N/A ARG 31.A NH2 ASN 83.A OD1 no hydrogen 3.436 N/A LEU 33.A N ILE 25.A O no hydrogen 2.878 N/A THR 34.A OG1 THR 24.A OG1 no hydrogen 3.132 N/A VAL 35.A N HIS 23.A O no hydrogen 2.779 N/A CYS 37.A N GLY 21.A O no hydrogen 2.904 N/A CYS 37.A SG HIS 23.A ND1 no hydrogen 3.823 N/A ASP 38.A N TRP 46.A O no hydrogen 2.778 N/A MET 39.A N SER 20.A OG no hydrogen 2.805 N/A ASP 40.A N ASP 38.A OD1 no hydrogen 3.036 N/A THR 41.A N ASP 38.A OD1 no hydrogen 3.060 N/A THR 41.A OG1 ASP 38.A OD1 no hydrogen 3.357 N/A THR 41.A OG1 ASP 38.A OD2 no hydrogen 2.820 N/A GLY 44.A N THR 41.A O no hydrogen 2.890 N/A TRP 46.A N ASP 38.A O no hydrogen 3.111 N/A TRP 46.A NE1 THR 41.A O no hydrogen 2.919 N/A THR 47.A N VAL 214.A O no hydrogen 2.765 N/A VAL 48.A N LEU 36.A O no hydrogen 2.782 N/A PHE 49.A N MET 212.A O no hydrogen 2.797 N/A GLN 50.A N.A MET 212.A O no hydrogen 3.295 N/A GLN 50.A N.B MET 212.A O no hydrogen 3.296 N/A GLN 50.A NE2.A LEU 179.A O no hydrogen 3.324 N/A GLN 50.A NE2.A SER 210.A OG no hydrogen 2.984 N/A GLN 50.A NE2.B LEU 179.A O no hydrogen 2.973 N/A GLN 50.A NE2.B ASN 180.A OD1 no hydrogen 2.997 N/A ARG 51.A N PHE 77.A O no hydrogen 3.036 N/A ARG 51.A NE GLU 211.A OE2 no hydrogen 2.989 N/A ARG 51.A NH1 GLY 75.A O no hydrogen 3.242 N/A ARG 52.A N SER 210.A O no hydrogen 2.861 N/A ARG 52.A NH1 LEU 179.A O no hydrogen 2.919 N/A ARG 52.A NH1 GLY 181.A O no hydrogen 2.760 N/A ARG 52.A NH2 GLY 181.A O no hydrogen 2.910 N/A VAL 53.A N GLU 76.A OE2 no hydrogen 2.752 N/A ASP 54.A N GLU 76.A OE2 no hydrogen 2.853 N/A GLY 55.A N GLU 76.A OE2 no hydrogen 2.762 N/A SER 56.A N ASP 54.A OD1 no hydrogen 2.944 N/A SER 56.A OG ASP 54.A OD1 no hydrogen 2.653 N/A VAL 57.A N GLU 76.A OE1 no hydrogen 3.060 N/A TYR 60.A N ASP 58.A OD1 no hydrogen 3.012 N/A ARG 61.A N PHE 59.A O no hydrogen 2.931 N/A ARG 61.A NE ASP 58.A O no hydrogen 2.710 N/A TRP 63.A N ASP 151.A OD1 no hydrogen 2.879 N/A TRP 63.A N ASP 151.A OD2 no hydrogen 3.506 N/A TRP 63.A NE1 GLU 119.A OE2 no hydrogen 2.854 N/A THR 65.A N ASP 62.A OD1 no hydrogen 2.936 N/A THR 65.A OG1 ASP 62.A OD1 no hydrogen 2.531 N/A TYR 66.A N ASP 62.A O no hydrogen 3.102 N/A TYR 66.A OH PHE 59.A O no hydrogen 2.654 N/A LYS 67.A N TRP 63.A O no hydrogen 2.928 N/A LYS 67.A NZ ASP 82.A OD2 no hydrogen 2.914 N/A LYS 67.A NZ GLU 119.A OE1 no hydrogen 3.075 N/A GLN 68.A N ALA 64.A O no hydrogen 3.184 N/A GLY 69.A N THR 65.A O no hydrogen 2.959 N/A PHE 70.A N TRP 78.A O no hydrogen 2.887 N/A SER 72.A N GLU 76.A O no hydrogen 2.842 N/A LEU 74.A N SER 72.A OG no hydrogen 3.092 N/A GLY 75.A N SER 72.A O no hydrogen 3.110 N/A PHE 77.A N ARG 51.A O no hydrogen 3.099 N/A TRP 78.A N PHE 70.A O no hydrogen 2.931 N/A TRP 78.A NE1 ASN 81.A OD1 no hydrogen 2.897 N/A LEU 79.A N PHE 49.A O no hydrogen 2.987 N/A ASN 81.A N TYR 66.A O no hydrogen 2.812 N/A ASP 82.A N LYS 67.A O no hydrogen 3.274 N/A ASN 83.A ND2 LEU 79.A O no hydrogen 2.944 N/A ILE 84.A N GLY 80.A O no hydrogen 2.840 N/A HIS 85.A N ASN 81.A O no hydrogen 2.911 N/A ALA 86.A N ASP 82.A O no hydrogen 2.996 N/A LEU 87.A N ASN 83.A O no hydrogen 2.884 N/A THR 88.A N ILE 84.A O no hydrogen 3.020 N/A THR 88.A N HIS 85.A O no hydrogen 3.135 N/A THR 88.A OG1 ILE 84.A O no hydrogen 2.882 N/A THR 88.A OG1 HIS 85.A O no hydrogen 3.543 N/A ALA 89.A N HIS 85.A O no hydrogen 2.715 N/A GLN 90.A NE2 GLY 91.A O no hydrogen 3.303 N/A GLU 94.A N ARG 215.A O no hydrogen 2.793 N/A LEU 95.A N TYR 111.A O no hydrogen 3.170 N/A ARG 96.A N LYS 213.A O no hydrogen 2.868 N/A ARG 96.A NE ASP 98.A OD1 no hydrogen 3.042 N/A ARG 96.A NE ASP 98.A OD2 no hydrogen 3.126 N/A ARG 96.A NH2 ASP 98.A OD1 no hydrogen 3.056 N/A VAL 97.A N ALA 109.A O no hydrogen 2.758 N/A ASP 98.A N GLU 211.A O no hydrogen 2.851 N/A LEU 99.A N GLN 107.A O no hydrogen 2.829 N/A VAL 100.A N VAL 209.A O no hydrogen 2.991 N/A ASP 101.A N ASN 105.A O no hydrogen 2.995 N/A PHE 102.A N TYR 205.A OH no hydrogen 2.847 N/A GLU 103.A N ASP 101.A OD1 no hydrogen 2.838 N/A ASP 104.A N ASP 101.A O no hydrogen 3.045 N/A ASN 105.A N ASP 101.A OD1 no hydrogen 2.853 N/A ASN 105.A ND2 ASP 101.A OD1 no hydrogen 3.476 N/A ASN 105.A ND2 ASP 101.A OD2 no hydrogen 3.128 N/A GLN 107.A N LEU 99.A O no hydrogen 2.835 N/A PHE 108.A N SER 134.A OG no hydrogen 3.178 N/A ALA 109.A N VAL 97.A O no hydrogen 2.958 N/A LYS 110.A N GLU 132.A O no hydrogen 2.945 N/A LYS 110.A NZ ASP 42.A OD2 no hydrogen 2.570 N/A TYR 111.A N LEU 95.A O no hydrogen 2.867 N/A TYR 111.A OH ASP 137.A OD1 no hydrogen 2.699 N/A ARG 112.A N ALA 129.A O no hydrogen 2.834 N/A LYS 115.A N VAL 126.A O no hydrogen 2.856 N/A VAL 116.A N THR 88.A OG1 no hydrogen 3.224 N/A ALA 117.A N ASN 124.A O no hydrogen 2.867 N/A LYS 122.A N GLU 119.A O no hydrogen 2.813 N/A TYR 123.A N ASP 118.A O no hydrogen 3.061 N/A TYR 123.A OH ASP 82.A OD1 no hydrogen 2.512 N/A ASN 124.A N GLU 121.A O no hydrogen 3.138 N/A LEU 125.A N GLN 145.A O no hydrogen 3.049 N/A VAL 126.A N LYS 115.A O no hydrogen 2.796 N/A GLY 128.A N SER 113.A O no hydrogen 2.762 N/A VAL 131.A N LYS 110.A O no hydrogen 2.902 N/A ALA 135.A N PHE 108.A O no hydrogen 2.826 N/A GLY 136.A N GLY 133.A O no hydrogen 3.109 N/A SER 138.A OG SER 199.A OG no hydrogen 2.569 N/A LEU 139.A N ASP 137.A OD1 no hydrogen 2.994 N/A THR 140.A N ASP 137.A OD1 no hydrogen 2.993 N/A THR 140.A OG1 ASP 137.A OD1 no hydrogen 3.233 N/A THR 140.A OG1 ASP 137.A OD2 no hydrogen 2.499 N/A HIS 142.A N LEU 139.A O no hydrogen 2.751 N/A HIS 142.A ND1 TRP 170.A O no hydrogen 2.661 N/A ASN 143.A N THR 140.A O no hydrogen 2.897 N/A ASN 143.A ND2 LEU 125.A O no hydrogen 3.213 N/A ASN 144.A N LEU 125.A O no hydrogen 2.762 N/A GLN 145.A NE2 PHE 141.A O no hydrogen 2.535 N/A GLN 145.A NE2 ASN 143.A O no hydrogen 3.596 N/A PHE 147.A N LYS 122.A O no hydrogen 2.919 N/A SER 148.A N TRP 169.A O no hydrogen 2.808 N/A THR 149.A N GLN 152.A O no hydrogen 3.158 N/A THR 149.A OG1 ASP 151.A OD1 no hydrogen 2.692 N/A LYS 150.A NZ TYR 60.A O no hydrogen 2.998 N/A GLN 152.A N THR 149.A O no hydrogen 2.942 N/A ASN 154.A N SER 148.A OG no hydrogen 2.939 N/A ASN 154.A ND2 PHE 147.A O no hydrogen 2.942 N/A ASP 155.A N ASP 153.A OD1 no hydrogen 3.077 N/A LEU 156.A N LYS 172.A O no hydrogen 2.819 N/A ASN 157.A N ASP 155.A OD1 no hydrogen 2.808 N/A ASN 157.A ND2 ASN 173.A OD1 no hydrogen 3.421 N/A GLY 159.A N ASN 157.A OD1 no hydrogen 2.614 N/A ASN 160.A ND2 LYS 150.A O no hydrogen 2.927 N/A CYS 161.A N ASP 155.A OD2 no hydrogen 3.007 N/A CYS 161.A SG ASP 155.A OD2 no hydrogen 3.276 N/A CYS 161.A SG LYS 172.A O no hydrogen 3.892 N/A VAL 163.A N ASN 160.A OD1 no hydrogen 3.189 N/A MET 164.A N ASN 160.A O no hydrogen 2.931 N/A PHE 165.A N CYS 161.A O no hydrogen 2.751 N/A GLY 167.A N ALA 162.A O no hydrogen 3.079 N/A TRP 169.A N SER 148.A O no hydrogen 3.173 N/A TRP 169.A NE1 SER 177.A OG no hydrogen 2.922 N/A TRP 170.A NE1 TYR 123.A O no hydrogen 2.898 N/A TYR 171.A OH ASN 178.A OD1 no hydrogen 2.558 N/A LYS 172.A N CYS 174.A O no hydrogen 2.811 N/A VAL 176.A N HIS 142.A NE2 no hydrogen 3.239 N/A SER 177.A N HIS 142.A NE2 no hydrogen 3.475 N/A SER 177.A OG SER 138.A O no hydrogen 2.837 N/A ASN 178.A N ASN 196.A O no hydrogen 2.855 N/A ASN 178.A ND2 PHE 165.A O no hydrogen 3.065 N/A ASN 178.A ND2 GLY 194.A O no hydrogen 3.153 N/A ASN 180.A ND2 ALA 168.A O no hydrogen 3.126 N/A GLY 181.A N ASN 178.A O no hydrogen 2.930 N/A ARG 182.A N ASN 193.A O no hydrogen 3.094 N/A TYR 183.A OH LYS 208.A O no hydrogen 2.668 N/A LEU 184.A N SER 206.A OG no hydrogen 3.273 N/A GLY 186.A N SER 206.A O no hydrogen 2.989 N/A HIS 188.A N ASN 204.A O no hydrogen 2.961 N/A HIS 188.A ND1 SER 190.A O no hydrogen 2.772 N/A HIS 188.A NE2 ASN 196.A OD1 no hydrogen 3.200 N/A SER 190.A OG HIS 188.A ND1 no hydrogen 3.414 N/A SER 190.A OG ASN 193.A OD1 no hydrogen 2.660 N/A ALA 192.A N TYR 203.A O no hydrogen 2.855 N/A ILE 195.A N SER 206.A OG no hydrogen 3.000 N/A TRP 197.A NE1 GLY 136.A O no hydrogen 2.876 N/A LYS 198.A N VAL 176.A O no hydrogen 2.890 N/A SER 199.A N SER 138.A OG no hydrogen 2.932 N/A SER 199.A OG ALA 135.A O no hydrogen 2.663 N/A SER 199.A OG SER 138.A OG no hydrogen 2.569 N/A GLY 200.A N TRP 197.A O no hydrogen 2.853 N/A LYS 201.A NZ ASP 101.A OD2 no hydrogen 3.077 N/A GLY 202.A N TRP 197.A O no hydrogen 3.161 N/A TYR 203.A OH HIS 175.A O no hydrogen 2.692 N/A SER 206.A N GLY 186.A O no hydrogen 2.890 N/A SER 206.A OG ARG 182.A O no hydrogen 3.337 N/A TYR 207.A N ILE 195.A O no hydrogen 3.118 N/A TYR 207.A OH GLN 107.A OE1 no hydrogen 2.627 N/A LYS 208.A N VAL 100.A O no hydrogen 2.804 N/A LYS 208.A NZ ASP 104.A OD1 no hydrogen 2.386 N/A VAL 209.A N VAL 100.A O no hydrogen 3.110 N/A SER 210.A N ARG 52.A O no hydrogen 3.013 N/A SER 210.A OG GLN 50.A OE1.B no hydrogen 2.995 N/A GLU 211.A N ASP 98.A O no hydrogen 2.882 N/A MET 212.A N GLN 50.A O.A no hydrogen 3.045 N/A MET 212.A N GLN 50.A O.B no hydrogen 3.042 N/A LYS 213.A N ARG 96.A O no hydrogen 3.002 N/A LYS 213.A NZ ASP 38.A OD2 no hydrogen 2.805 N/A LYS 213.A NZ ASP 98.A OD2 no hydrogen 2.823 N/A LYS 213.A NZ GLU 211.A OE1 no hydrogen 2.607 N/A VAL 214.A N THR 47.A O no hydrogen 2.872 N/A ARG 215.A N GLU 94.A O no hydrogen 3.075 N/A ARG 215.A NH1 ASP 42.A O no hydrogen 2.603 N/A ARG 215.A NH1 GLY 44.A O no hydrogen 2.942 N/A ALA 217.A N THR 92.A O no hydrogen 3.181 N/A