Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3it7_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A OG.A HIS 71.A NE2 no hydrogen 2.564 N/A ASN 5.A N.A PRO 2.A O.A no hydrogen 2.764 N/A ASN 5.A ND2.A ASN 5.A O.A no hydrogen 2.031 N/A LEU 6.A N.A PRO 2.A O.A no hydrogen 3.114 N/A LEU 6.A N.A PRO 3.A O.A no hydrogen 3.055 N/A LEU 6.A N.B PRO 3.A O.B no hydrogen 3.192 N/A GLN 8.A N ALA 54.A O no hydrogen 2.810 N/A GLN 8.A NE2 LEU 9.A O no hydrogen 3.074 N/A GLN 8.A NE2 ASP 96.A OD1 no hydrogen 2.908 N/A TRP 11.A NE1 TYR 15.A O no hydrogen 3.021 N/A GLN 13.A N ASP 96.A OD1 no hydrogen 2.898 N/A GLY 14.A N ASN 177.A O no hydrogen 2.750 N/A TYR 15.A N ARG 12.A O no hydrogen 3.051 N/A GLN 18.A N SER 38.A O no hydrogen 2.747 N/A ASN 20.A N ASP 36.A O no hydrogen 2.896 N/A ASN 20.A ND2 ASP 36.A OD2 no hydrogen 2.902 N/A HIS 23.A N SER 34.A O no hydrogen 2.753 N/A HIS 23.A ND1 GLY 21.A O no hydrogen 2.765 N/A SER 24.A N ASN 150.A OD1 no hydrogen 2.786 N/A SER 24.A OG THR 26.A OG1 no hydrogen 3.153 N/A SER 24.A OG ASN 150.A OD1 no hydrogen 3.536 N/A THR 26.A OG1 SER 24.A OG no hydrogen 3.153 N/A GLY 27.A N SER 24.A O no hydrogen 3.027 N/A GLY 27.A N SER 24.A OG no hydrogen 3.083 N/A SER 28.A N THR 26.A OG1 no hydrogen 3.335 N/A GLY 29.A N SER 24.A OG no hydrogen 2.824 N/A SER 33.A OG SER 34.A OG no hydrogen 3.113 N/A SER 34.A N HIS 23.A O no hydrogen 2.743 N/A SER 34.A OG SER 33.A OG no hydrogen 3.113 N/A SER 34.A OG SER 124.A OG no hydrogen 2.495 N/A PHE 35.A N PHE 123.A O no hydrogen 2.886 N/A ASP 36.A N ASN 20.A OD1 no hydrogen 2.851 N/A ALA 37.A N LEU 121.A O no hydrogen 2.946 N/A SER 38.A N GLN 18.A O no hydrogen 3.110 N/A SER 38.A OG PRO 119.A O no hydrogen 3.118 N/A TYR 39.A N TYR 102.A OH no hydrogen 3.064 N/A TRP 41.A N SER 38.A OG no hydrogen 3.045 N/A TRP 41.A NE1 GLN 18.A O no hydrogen 2.881 N/A GLY 45.A N GLY 104.A O no hydrogen 2.762 N/A SER 46.A N ARG 43.A O no hydrogen 3.354 N/A SER 46.A OG ARG 43.A O no hydrogen 2.862 N/A THR 48.A OG1 TYR 102.A O no hydrogen 2.797 N/A VAL 51.A N GLY 100.A O no hydrogen 2.768 N/A VAL 52.A N PRO 10.A O no hydrogen 3.020 N/A ALA 53.A N THR 97.A O no hydrogen 2.877 N/A ALA 54.A N TYR 79.A OH no hydrogen 2.871 N/A HIS 55.A ND1 ALA 56.A O no hydrogen 2.824 N/A ALA 56.A N SER 4.A O.A no hydrogen 2.993 N/A GLY 57.A N VAL 93.A O no hydrogen 2.989 N/A THR 58.A N THR 70.A O no hydrogen 2.904 N/A THR 58.A OG1 GLN 92.A OE1.A no hydrogen 3.459 N/A VAL 59.A N GLN 91.A O no hydrogen 2.872 N/A ARG 60.A N ARG 68.A O no hydrogen 2.837 N/A VAL 61.A N ASN 89.A OD1 no hydrogen 2.630 N/A LEU 62.A N GLN 66.A O no hydrogen 2.881 N/A SER 63.A N GLN 66.A O no hydrogen 3.390 N/A SER 63.A OG GLU 112.A OE2 no hydrogen 2.663 N/A ARG 64.A NH2 ASP 83.A OD1 no hydrogen 2.796 N/A CYS 65.A N SER 63.A OG no hydrogen 3.141 N/A CYS 65.A SG SER 63.A OG no hydrogen 3.454 N/A GLN 66.A N SER 63.A O no hydrogen 3.465 N/A GLN 66.A NE2 GLU 112.A OE2 no hydrogen 2.684 N/A VAL 67.A N TYR 79.A O no hydrogen 2.910 N/A ARG 68.A N ARG 60.A O no hydrogen 2.848 N/A ARG 68.A NE ASN 78.A OD1 no hydrogen 2.874 N/A VAL 69.A N THR 77.A O no hydrogen 2.936 N/A THR 70.A N THR 58.A O no hydrogen 3.003 N/A HIS 71.A N TRP 75.A O no hydrogen 2.831 N/A HIS 71.A ND1 SER 73.A OG no hydrogen 3.013 N/A HIS 71.A NE2 SER 4.A OG.A no hydrogen 2.564 N/A SER 73.A N HIS 71.A ND1 no hydrogen 3.105 N/A SER 73.A OG ASN 5.A OD1.A no hydrogen 2.319 N/A SER 73.A OG HIS 71.A ND1 no hydrogen 3.013 N/A GLY 74.A N HIS 71.A O no hydrogen 2.816 N/A TRP 75.A N SER 73.A OG no hydrogen 3.399 N/A ALA 76.A N LEU 126.A O no hydrogen 2.856 N/A THR 77.A N VAL 69.A O no hydrogen 2.951 N/A THR 77.A OG1 HIS 55.A NE2 no hydrogen 2.792 N/A THR 77.A OG1 TYR 79.A OH no hydrogen 2.607 N/A ASN 78.A N SER 124.A O no hydrogen 2.985 N/A ASN 78.A ND2 GLN 66.A OE1 no hydrogen 2.960 N/A TYR 79.A N VAL 67.A O no hydrogen 2.801 N/A TYR 79.A OH THR 77.A OG1 no hydrogen 2.607 N/A TYR 80.A N HIS 122.A O no hydrogen 2.809 N/A HIS 81.A ND1 ALA 109.A O no hydrogen 2.809 N/A MET 82.A N CYS 65.A O no hydrogen 2.872 N/A ASP 83.A N VAL 101.A O no hydrogen 2.793 N/A GLN 84.A N ASP 83.A OD1 no hydrogen 2.664 N/A GLN 86.A N LEU 99.A O no hydrogen 2.944 N/A SER 88.A N GLN 91.A OE1 no hydrogen 2.980 N/A GLY 90.A N VAL 59.A O no hydrogen 2.738 N/A GLN 91.A N SER 88.A O no hydrogen 2.977 N/A GLN 92.A NE2.A THR 58.A OG1 no hydrogen 3.114 N/A GLN 92.A NE2.A GLY 90.A O no hydrogen 3.140 N/A GLN 92.A NE2.B VAL 93.A O no hydrogen 3.221 N/A VAL 93.A N GLY 57.A O no hydrogen 2.979 N/A SER 94.A N THR 97.A OG1 no hydrogen 3.214 N/A ASP 96.A N ALA 53.A O no hydrogen 2.805 N/A THR 97.A N SER 94.A O no hydrogen 3.047 N/A THR 97.A OG1 SER 94.A O no hydrogen 2.840 N/A LYS 98.A NZ SER 50.A OG no hydrogen 2.874 N/A LEU 99.A N VAL 51.A O no hydrogen 2.851 N/A VAL 101.A N ASP 83.A O no hydrogen 2.982 N/A TYR 102.A N TYR 49.A O no hydrogen 3.383 N/A ALA 103.A N HIS 81.A O no hydrogen 2.771 N/A THR 108.A OG1 ASN 105.A O no hydrogen 3.140 N/A ALA 109.A N ASN 105.A O no hydrogen 2.817 N/A LEU 110.A N ILE 106.A O no hydrogen 2.975 N/A CYS 111.A SG SER 63.A OG no hydrogen 3.092 N/A GLY 113.A N LEU 110.A O no hydrogen 2.963 N/A SER 116.A OG GLY 118.A O no hydrogen 3.456 N/A HIS 120.A ND1 GLY 118.A O no hydrogen 2.814 N/A LEU 121.A N ALA 37.A O no hydrogen 2.828 N/A HIS 122.A N TYR 80.A O no hydrogen 2.982 N/A HIS 122.A ND1 ASP 36.A OD1 no hydrogen 3.101 N/A HIS 122.A NE2 ASN 25.A OD1 no hydrogen 2.958 N/A PHE 123.A N PHE 35.A O no hydrogen 2.977 N/A SER 124.A N ASN 78.A O no hydrogen 2.980 N/A SER 124.A OG SER 34.A OG no hydrogen 2.495 N/A LEU 125.A N SER 33.A O no hydrogen 2.785 N/A LEU 126.A N ALA 76.A O no hydrogen 2.880 N/A TYR 127.A N ALA 130.A O no hydrogen 2.892 N/A ASN 128.A N GLY 74.A O no hydrogen 2.991 N/A ALA 130.A N TYR 127.A O no hydrogen 3.030 N/A VAL 132.A N LEU 125.A O no hydrogen 3.119 N/A LEU 134.A N TYR 32.A O no hydrogen 2.974 N/A GLN 135.A N SER 133.A OG no hydrogen 3.130 N/A GLN 135.A NE2 ASN 145.A OD1 no hydrogen 2.972 N/A GLY 136.A N ILE 144.A O no hydrogen 2.989 N/A ALA 137.A N LEU 134.A O no hydrogen 2.802 N/A PHE 139.A N TYR 142.A O no hydrogen 2.836 N/A GLY 140.A N MET 7.A O no hydrogen 2.836 N/A TYR 142.A N PHE 139.A O no hydrogen 3.020 N/A TYR 142.A OH TYR 176.A O no hydrogen 2.663 N/A ARG 143.A N TYR 161.A O no hydrogen 2.800 N/A ILE 144.A N ALA 137.A O no hydrogen 2.933 N/A ASN 145.A N TYR 159.A O no hydrogen 2.781 N/A ASN 145.A ND2 ARG 157.A O no hydrogen 3.052 N/A VAL 146.A N GLN 135.A OE1 no hydrogen 2.873 N/A THR 148.A N ASP 152.A OD2 no hydrogen 2.853 N/A THR 148.A OG1 ASP 152.A OD2 no hydrogen 3.292 N/A ASN 150.A ND2 GLY 29.A O no hydrogen 3.035 N/A TYR 151.A N ALA 22.A O no hydrogen 2.875 N/A ASP 152.A N SER 149.A O no hydrogen 2.985 N/A ASP 154.A N ASP 152.A OD1 no hydrogen 3.334 N/A CYS 155.A SG TYR 158.A O no hydrogen 3.855 N/A ARG 156.A N ASP 154.A OD1 no hydrogen 3.090 N/A ARG 156.A NH2 ASP 154.A OD2 no hydrogen 3.381 N/A ARG 157.A N ASP 154.A O no hydrogen 2.913 N/A ARG 157.A NE ASP 152.A OD2 no hydrogen 2.723 N/A ARG 157.A NH2 ASP 152.A OD1 no hydrogen 2.907 N/A ARG 157.A NH2 ASP 152.A OD2 no hydrogen 3.381 N/A TYR 158.A N ASP 154.A O no hydrogen 2.748 N/A TYR 158.A OH ASN 20.A O no hydrogen 2.687 N/A TYR 159.A N ASN 145.A O no hydrogen 3.161 N/A PHE 160.A N HIS 169.A O no hydrogen 2.917 N/A TYR 161.A N ARG 143.A O no hydrogen 2.817 N/A ASN 162.A N THR 167.A O no hydrogen 2.819 N/A GLN 163.A N PRO 141.A O no hydrogen 2.872 N/A GLN 163.A NE2 PRO 141.A O no hydrogen 3.079 N/A SER 164.A N ASN 162.A OD1 no hydrogen 2.913 N/A ALA 165.A N ASN 162.A O no hydrogen 3.167 N/A GLY 166.A N ASN 162.A O no hydrogen 2.789 N/A THR 167.A OG1 HIS 169.A NE2 no hydrogen 2.733 N/A HIS 169.A N PHE 160.A O no hydrogen 2.743 N/A HIS 169.A NE2 THR 167.A OG1 no hydrogen 2.733 N/A PHE 172.A N PRO 19.A O no hydrogen 2.781 N/A LEU 175.A N TRP 17.A O no hydrogen 2.766 N/A ASN 177.A N TYR 15.A O no hydrogen 2.938 N/A ASN 177.A ND2 TRP 11.A O no hydrogen 2.642 N/A GLY 179.A N ASN 177.A OD1 no hydrogen 2.995 N/A