Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1xre_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N ASN 39.A OD1 no hydrogen 3.492 N/A PHE 2.A N ASN 39.A OD1 no hydrogen 3.048 N/A TYR 9.A OH TRP 85.A O no hydrogen 2.810 N/A ASP 10.A N GLU 13.A OE1 no hydrogen 2.804 N/A TYR 11.A OH HIS 27.A ND1 no hydrogen 2.783 N/A GLU 13.A N ASP 10.A O no hydrogen 2.907 N/A GLU 15.A N ASP 12.A O no hydrogen 3.434 N/A TYR 17.A N LEU 14.A O no hydrogen 2.876 N/A ILE 18.A N LEU 14.A O no hydrogen 3.054 N/A SER 20.A N GLU 15.A OE2 no hydrogen 2.805 N/A SER 20.A OG GLU 15.A OE2 no hydrogen 2.468 N/A THR 22.A N ASP 19.A OD2 no hydrogen 3.065 N/A THR 22.A OG1 ASP 19.A OD1 no hydrogen 3.092 N/A THR 22.A OG1 ASP 19.A OD2 no hydrogen 2.648 N/A LEU 23.A N ASP 19.A O no hydrogen 3.051 N/A SER 24.A N SER 20.A O no hydrogen 3.097 N/A SER 24.A OG SER 20.A O no hydrogen 3.118 N/A SER 24.A OG ASN 21.A O no hydrogen 2.640 N/A ILE 25.A N ASN 21.A O no hydrogen 2.945 N/A HIS 26.A N THR 22.A O no hydrogen 2.727 N/A HIS 26.A NE2 HIS 81.A NE2 no hydrogen 3.000 N/A HIS 27.A N LEU 23.A O no hydrogen 2.962 N/A HIS 27.A ND1 TYR 11.A OH no hydrogen 2.783 N/A HIS 27.A NE2 PRO 5.A O no hydrogen 2.767 N/A GLY 28.A N SER 24.A O no hydrogen 2.888 N/A LYS 29.A N ILE 25.A O no hydrogen 2.785 N/A HIS 30.A N ILE 25.A O no hydrogen 3.007 N/A HIS 31.A N HIS 26.A O no hydrogen 3.078 N/A HIS 31.A NE2 HIS 78.A ND1 no hydrogen 2.929 N/A ALA 32.A N HIS 27.A O no hydrogen 3.312 N/A THR 33.A N LYS 29.A O no hydrogen 2.981 N/A THR 33.A OG1 LYS 29.A O no hydrogen 2.857 N/A TYR 34.A N HIS 30.A O no hydrogen 3.168 N/A VAL 35.A N HIS 31.A O no hydrogen 3.098 N/A ASN 36.A N ALA 32.A O no hydrogen 3.008 N/A ASN 37.A N THR 33.A O no hydrogen 2.928 N/A LEU 38.A N TYR 34.A O no hydrogen 2.945 N/A ASN 39.A N VAL 35.A O no hydrogen 3.016 N/A ASN 39.A ND2 PHE 2.A O no hydrogen 2.823 N/A ALA 40.A N ASN 36.A O no hydrogen 2.913 N/A ALA 41.A N ASN 37.A O no hydrogen 2.954 N/A LEU 42.A N LEU 38.A O no hydrogen 3.187 N/A GLU 43.A N ASN 39.A O no hydrogen 2.937 N/A TYR 45.A N LEU 42.A O no hydrogen 3.013 N/A TYR 45.A OH GLU 66.A OE1 no hydrogen 2.437 N/A GLU 47.A N GLU 47.A OE1 no hydrogen 2.966 N/A LEU 48.A N TYR 45.A O no hydrogen 2.955 N/A HIS 49.A N SER 46.A O no hydrogen 3.307 N/A LYS 51.A N LEU 48.A O no hydrogen 3.151 N/A SER 52.A N GLU 55.A OE1 no hydrogen 2.851 N/A SER 52.A OG GLU 55.A OE1 no hydrogen 3.466 N/A GLU 55.A N SER 52.A OG no hydrogen 3.288 N/A LEU 56.A N SER 52.A O no hydrogen 3.111 N/A LEU 57.A N LEU 53.A O no hydrogen 3.068 N/A CYS 58.A N GLU 54.A O no hydrogen 2.864 N/A CYS 58.A SG GLU 54.A O no hydrogen 3.270 N/A CYS 58.A SG LEU 152.A O no hydrogen 4.027 N/A ASN 59.A N LEU 56.A O no hydrogen 3.196 N/A THR 62.A N ASN 59.A O no hydrogen 3.152 N/A THR 62.A OG1 ASN 59.A O no hydrogen 2.844 N/A LEU 63.A N LEU 60.A O no hydrogen 3.341 N/A ILE 67.A N PRO 64.A O no hydrogen 2.959 N/A VAL 68.A N PRO 64.A O no hydrogen 3.140 N/A VAL 71.A N ILE 67.A O no hydrogen 2.884 N/A ARG 72.A N VAL 68.A O no hydrogen 2.788 N/A ARG 72.A NE ASP 149.A OD1 no hydrogen 2.914 N/A ARG 72.A NH2 ASP 149.A OD2 no hydrogen 2.854 N/A ASN 73.A N THR 69.A O no hydrogen 2.849 N/A ASN 74.A N ALA 70.A O no hydrogen 2.855 N/A ASN 74.A ND2 ALA 70.A O no hydrogen 2.987 N/A GLY 75.A N VAL 71.A O no hydrogen 2.844 N/A GLY 76.A N ARG 72.A O no hydrogen 2.989 N/A GLY 77.A N ASN 73.A O no hydrogen 2.944 N/A HIS 78.A N ASN 74.A O no hydrogen 2.867 N/A HIS 78.A ND1 HIS 31.A NE2 no hydrogen 2.929 N/A TYR 79.A N GLY 75.A O no hydrogen 2.884 N/A CYS 80.A N GLY 76.A O no hydrogen 2.871 N/A CYS 80.A SG GLY 76.A O no hydrogen 3.271 N/A CYS 80.A SG GLN 148.A O no hydrogen 3.933 N/A HIS 81.A N GLY 77.A O no hydrogen 3.206 N/A HIS 81.A ND1 GLY 77.A O no hydrogen 2.917 N/A HIS 81.A NE2 HIS 26.A NE2 no hydrogen 3.000 N/A SER 82.A N HIS 78.A O no hydrogen 3.087 N/A SER 82.A OG HIS 78.A ND1 no hydrogen 3.385 N/A SER 82.A OG HIS 78.A O no hydrogen 2.793 N/A LEU 83.A N TYR 79.A O no hydrogen 3.169 N/A PHE 84.A N CYS 80.A O no hydrogen 3.012 N/A TRP 85.A N HIS 81.A O no hydrogen 2.959 N/A TRP 85.A NE1 HIS 31.A ND1 no hydrogen 2.948 N/A GLU 86.A N SER 82.A O no hydrogen 3.445 N/A VAL 87.A N LEU 83.A O no hydrogen 3.121 N/A SER 89.A N THR 187.A O no hydrogen 2.822 N/A ARG 91.A N SER 89.A OG no hydrogen 3.171 N/A GLY 93.A N VAL 188.A O no hydrogen 2.801 N/A ALA 101.A N GLY 98.A O no hydrogen 3.195 N/A LYS 102.A N ASP 99.A O no hydrogen 3.242 N/A ILE 104.A N VAL 100.A O no hydrogen 2.855 N/A ASP 105.A N ALA 101.A O no hydrogen 3.084 N/A TYR 106.A N LYS 102.A O no hydrogen 2.995 N/A TYR 107.A N VAL 103.A O no hydrogen 3.093 N/A TYR 107.A OH GLU 138.A O no hydrogen 3.236 N/A PHE 108.A N ILE 104.A O no hydrogen 2.855 N/A THR 110.A N PHE 108.A O no hydrogen 2.874 N/A ASN 113.A N THR 110.A OG1 no hydrogen 3.077 N/A ASN 113.A ND2 PHE 108.A O no hydrogen 2.854 N/A LEU 114.A N THR 110.A O no hydrogen 3.274 N/A LYS 115.A N PHE 111.A O no hydrogen 2.909 N/A ASP 116.A N ASP 112.A O no hydrogen 2.936 N/A GLN 117.A N ASN 113.A O no hydrogen 2.992 N/A GLN 117.A NE2 ASN 113.A OD1 no hydrogen 3.328 N/A LEU 118.A N LEU 114.A O no hydrogen 2.927 N/A SER 119.A N LYS 115.A O no hydrogen 2.972 N/A SER 119.A OG LYS 115.A O no hydrogen 2.791 N/A LYS 120.A N ASP 116.A O no hydrogen 3.026 N/A ALA 121.A N GLN 117.A O no hydrogen 3.074 N/A ALA 122.A N LEU 118.A O no hydrogen 2.944 N/A ILE 123.A N SER 119.A O no hydrogen 2.885 N/A SER 124.A N LYS 120.A O no hydrogen 2.800 N/A SER 124.A OG LYS 120.A O no hydrogen 2.612 N/A ARG 125.A N ALA 122.A O no hydrogen 3.388 N/A ARG 125.A NE SER 144.A OG no hydrogen 3.028 N/A ARG 125.A NH2 SER 144.A OG no hydrogen 2.959 N/A TYR 130.A N THR 145.A O no hydrogen 3.007 N/A GLY 131.A N ILE 162.A O no hydrogen 2.897 N/A TRP 132.A N MET 143.A O no hydrogen 2.711 N/A TRP 132.A NE1 THR 145.A OG1 no hydrogen 2.875 N/A LEU 133.A N LEU 160.A O no hydrogen 2.932 N/A VAL 134.A N SER 141.A O no hydrogen 2.888 N/A LEU 135.A N ILE 157.A O no hydrogen 2.834 N/A ASP 136.A N GLU 139.A O no hydrogen 2.826 N/A GLU 139.A N ASP 136.A O no hydrogen 3.188 N/A SER 141.A N VAL 134.A O no hydrogen 3.065 N/A MET 143.A N TRP 132.A O no hydrogen 3.032 N/A THR 145.A N TYR 130.A O no hydrogen 3.152 N/A THR 145.A OG1 ASP 149.A O no hydrogen 2.674 N/A ASN 147.A N SER 128.A O no hydrogen 2.784 N/A GLN 148.A NE2 TYR 130.A OH no hydrogen 2.633 N/A ASP 149.A N PRO 146.A O no hydrogen 2.975 N/A LEU 152.A N THR 150.A OG1 no hydrogen 3.026 N/A GLU 154.A N PRO 151.A O no hydrogen 2.943 N/A GLY 155.A N LEU 152.A O no hydrogen 2.930 N/A LYS 156.A N PRO 151.A O no hydrogen 3.302 N/A LYS 156.A NZ GLU 154.A OE2 no hydrogen 3.287 N/A ILE 157.A N LEU 135.A O no hydrogen 2.880 N/A LEU 159.A N LEU 133.A O no hydrogen 2.923 N/A LEU 160.A N LEU 133.A O no hydrogen 3.440 N/A ILE 162.A N GLY 131.A O no hydrogen 2.896 N/A VAL 164.A N GLY 129.A O no hydrogen 2.940 N/A TRP 165.A N ASP 163.A OD1 no hydrogen 2.898 N/A TRP 165.A NE1 ASN 147.A O no hydrogen 2.987 N/A ALA 168.A N TRP 165.A O no hydrogen 2.962 N/A TYR 169.A N GLU 166.A O no hydrogen 3.101 N/A TYR 170.A N GLU 166.A O no hydrogen 2.855 N/A TYR 173.A N TYR 169.A O no hydrogen 2.943 N/A TYR 173.A OH TYR 17.A O no hydrogen 2.571 N/A GLN 174.A N TYR 170.A O no hydrogen 2.956 N/A GLN 174.A NE2 TYR 170.A O no hydrogen 3.112 N/A ARG 176.A N TYR 173.A O no hydrogen 2.919 N/A ARG 176.A NE GLU 179.A OE1 no hydrogen 2.923 N/A ARG 176.A NH1 GLN 174.A OE1 no hydrogen 3.535 N/A ARG 176.A NH2 GLN 174.A OE1 no hydrogen 3.198 N/A ARG 177.A NE TYR 169.A OH no hydrogen 3.034 N/A ARG 177.A NH1 ALA 122.A O no hydrogen 2.934 N/A ARG 177.A NH1 ARG 125.A O no hydrogen 2.746 N/A ARG 177.A NH2 ARG 125.A O no hydrogen 3.440 N/A ARG 177.A NH2 GLY 127.A O no hydrogen 3.066 N/A PHE 180.A N ARG 176.A O no hydrogen 3.189 N/A VAL 181.A N ARG 177.A O no hydrogen 2.909 N/A THR 182.A N PRO 178.A O no hydrogen 2.940 N/A THR 182.A OG1 PRO 178.A O no hydrogen 3.071 N/A ASN 183.A N GLU 179.A O no hydrogen 3.032 N/A ASN 183.A ND2 GLU 179.A O no hydrogen 2.936 N/A TRP 184.A N PHE 180.A O no hydrogen 2.850 N/A TRP 185.A NE1 SER 119.A OG no hydrogen 3.081 N/A HIS 186.A N ASN 183.A O no hydrogen 2.996 N/A THR 187.A N TRP 184.A O no hydrogen 2.975 N/A THR 187.A OG1 TRP 184.A O no hydrogen 2.781 N/A VAL 188.A N TRP 185.A O no hydrogen 3.388 N/A ASN 189.A N VAL 87.A O no hydrogen 2.764 N/A ASN 189.A ND2 GLU 86.A O no hydrogen 3.400 N/A TRP 190.A NE1 GLY 94.A O no hydrogen 3.104 N/A ARG 192.A N ASN 189.A OD1 no hydrogen 3.095 N/A ARG 192.A NE GLU 86.A O no hydrogen 2.909 N/A ARG 192.A NH2 SER 8.A OG no hydrogen 3.372 N/A VAL 193.A N ASN 189.A O no hydrogen 3.067 N/A ASN 194.A N TRP 190.A O no hydrogen 2.993 N/A GLU 195.A N ASP 191.A O no hydrogen 3.163 N/A LYS 196.A N ARG 192.A O no hydrogen 2.853 N/A LYS 196.A NZ GLU 86.A OE2 no hydrogen 2.824 N/A TYR 197.A N VAL 193.A O no hydrogen 2.946 N/A LEU 198.A N ASN 194.A O no hydrogen 3.091 N/A GLN 199.A N GLU 195.A O no hydrogen 3.068 N/A ALA 200.A N LYS 196.A O no hydrogen 2.886 N/A ILE 201.A N TYR 197.A O no hydrogen 3.053 N/A