Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1qrg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG ILE 4.A O no hydrogen 3.005 N/A ILE 4.A N SER 2.A OG no hydrogen 3.379 N/A ARG 5.A N VAL 33.A O no hydrogen 2.942 N/A ASN 7.A N SER 17.A O no hydrogen 3.281 N/A ASN 7.A ND2 SER 53.A O no hydrogen 2.997 N/A THR 10.A N ASN 13.A O no hydrogen 3.316 N/A TRP 12.A N THR 10.A OG1 no hydrogen 3.267 N/A TRP 12.A NE1 ASP 54.A O no hydrogen 2.778 N/A ASN 13.A N THR 10.A O no hydrogen 3.009 N/A ASN 13.A ND2 ASN 7.A OD1 no hydrogen 2.930 N/A ASN 13.A ND2 PRO 8.A O no hydrogen 2.933 N/A SER 17.A N ASN 7.A OD1 no hydrogen 2.858 N/A VAL 20.A N VAL 37.A O no hydrogen 2.797 N/A ASP 22.A N ILE 39.A O no hydrogen 2.957 N/A THR 24.A N ASP 22.A OD1 no hydrogen 2.855 N/A THR 24.A OG1 ASP 22.A OD1 no hydrogen 2.839 N/A ALA 25.A N ASP 22.A O no hydrogen 2.900 N/A TYR 26.A N VAL 43.A O no hydrogen 2.885 N/A ASP 28.A N VAL 45.A O no hydrogen 2.935 N/A GLN 30.A N ASP 28.A OD2 no hydrogen 2.813 N/A ALA 31.A N ASP 28.A O no hydrogen 2.901 N/A SER 32.A N ALA 49.A O no hydrogen 2.866 N/A VAL 33.A N ASN 3.A O no hydrogen 2.797 N/A ILE 34.A N ILE 51.A O no hydrogen 2.898 N/A GLY 35.A N ARG 5.A O no hydrogen 2.825 N/A GLU 36.A N SER 53.A O no hydrogen 3.332 N/A VAL 37.A N GLY 35.A O no hydrogen 2.861 N/A THR 38.A N ILE 59.A O no hydrogen 2.971 N/A ILE 39.A N VAL 20.A O no hydrogen 2.904 N/A GLY 40.A N VAL 61.A O no hydrogen 2.834 N/A ALA 41.A N ASP 63.A OD1 no hydrogen 2.864 N/A ASN 42.A N THR 24.A OG1 no hydrogen 2.781 N/A MET 44.A N SER 65.A O no hydrogen 3.413 N/A VAL 45.A N TYR 26.A O no hydrogen 2.898 N/A SER 46.A N VAL 67.A O no hydrogen 2.867 N/A MET 48.A N GLN 30.A O no hydrogen 2.834 N/A ALA 49.A N SER 46.A O no hydrogen 3.267 N/A SER 50.A N VAL 71.A O no hydrogen 2.816 N/A ILE 51.A N SER 32.A O no hydrogen 2.806 N/A ARG 52.A N LEU 73.A O no hydrogen 2.941 N/A ARG 52.A NH1 ASP 54.A OD1 no hydrogen 2.769 N/A SER 53.A N ILE 34.A O no hydrogen 2.782 N/A SER 53.A OG GLU 36.A O no hydrogen 2.762 N/A SER 53.A OG GLY 56.A O no hydrogen 3.511 N/A GLY 56.A N ALA 75.A O no hydrogen 3.135 N/A MET 57.A N THR 78.A OG1 no hydrogen 3.099 N/A ILE 59.A N GLU 36.A O no hydrogen 2.969 N/A PHE 60.A N VAL 100.A O no hydrogen 2.855 N/A VAL 61.A N THR 38.A O no hydrogen 2.781 N/A GLY 62.A N ILE 102.A O no hydrogen 2.865 N/A ASP 63.A N ASN 104.A OD1 no hydrogen 3.027 N/A ARG 64.A N ALA 41.A O no hydrogen 2.770 N/A SER 65.A OG GLY 62.A O no hydrogen 3.483 N/A SER 65.A OG GLY 103.A O no hydrogen 2.667 N/A ASN 66.A N VAL 106.A O no hydrogen 2.872 N/A ASN 66.A ND2 SER 107.A OG no hydrogen 3.019 N/A VAL 67.A N MET 44.A O no hydrogen 2.939 N/A GLN 68.A N LEU 108.A O no hydrogen 2.944 N/A GLN 68.A NE2 ASN 66.A OD1 no hydrogen 2.871 N/A GLY 70.A N PRO 47.A O no hydrogen 3.284 N/A VAL 71.A N GLN 68.A O no hydrogen 3.088 N/A VAL 72.A N SER 112.A O no hydrogen 3.282 N/A LEU 73.A N SER 50.A O no hydrogen 2.939 N/A HIS 74.A NE2 ASP 54.A OD2 no hydrogen 2.775 N/A LEU 76.A N GLY 116.A O no hydrogen 3.191 N/A GLU 77.A N GLU 55.A OE2 no hydrogen 3.107 N/A GLU 77.A N GLU 77.A OE1.A no hydrogen 3.146 N/A THR 78.A OG1 MET 57.A O no hydrogen 3.335 N/A ASN 80.A N GLU 84.A O no hydrogen 2.556 N/A GLY 83.A N ASN 80.A O no hydrogen 2.564 N/A GLU 84.A N ASN 80.A O no hydrogen 3.178 N/A ILE 86.A N THR 78.A O no hydrogen 3.078 N/A ASN 89.A N ILE 86.A O no hydrogen 2.929 N/A ASN 89.A ND2 GLU 77.A O no hydrogen 2.957 N/A ILE 90.A N GLU 87.A O no hydrogen 3.240 N/A VAL 91.A N TYR 98.A O no hydrogen 2.884 N/A VAL 93.A N LYS 96.A O no hydrogen 2.875 N/A LYS 96.A N VAL 93.A O no hydrogen 2.924 N/A TYR 98.A N VAL 91.A O no hydrogen 2.847 N/A ALA 99.A N PRO 58.A O no hydrogen 2.813 N/A VAL 100.A N PRO 58.A O no hydrogen 3.237 N/A TYR 101.A N ALA 118.A O no hydrogen 2.926 N/A ILE 102.A N PHE 60.A O no hydrogen 2.783 N/A GLY 103.A N VAL 120.A O no hydrogen 2.828 N/A ASN 104.A N ASP 122.A OD2 no hydrogen 2.750 N/A ASN 104.A ND2 ASP 122.A OD1 no hydrogen 3.156 N/A ASN 105.A N ASP 63.A O no hydrogen 2.942 N/A VAL 106.A N SER 65.A OG no hydrogen 2.881 N/A SER 107.A N THR 124.A O no hydrogen 3.149 N/A SER 107.A OG ASN 188.A OD1 no hydrogen 2.720 N/A LEU 108.A N ASN 66.A O no hydrogen 2.974 N/A ALA 109.A N ILE 126.A O no hydrogen 2.793 N/A HIS 110.A N GLN 68.A OE1 no hydrogen 3.234 N/A HIS 110.A ND1 ASP 69.A OD1 no hydrogen 2.743 N/A GLN 111.A N ASP 69.A O no hydrogen 2.828 N/A SER 112.A N ALA 109.A O no hydrogen 3.042 N/A SER 112.A OG ALA 109.A O no hydrogen 2.768 N/A GLN 113.A N ALA 130.A O no hydrogen 3.067 N/A VAL 114.A N VAL 72.A O no hydrogen 3.167 N/A HIS 115.A N VAL 132.A O no hydrogen 2.792 N/A HIS 115.A ND1 GLY 116.A O no hydrogen 2.833 N/A GLY 116.A N HIS 74.A O no hydrogen 2.770 N/A ALA 118.A N ALA 99.A O no hydrogen 3.197 N/A ALA 119.A N SER 135.A O no hydrogen 3.061 N/A VAL 120.A N TYR 101.A O no hydrogen 2.875 N/A GLY 121.A N VAL 137.A O no hydrogen 2.749 N/A ASP 123.A N ASN 104.A O no hydrogen 3.135 N/A THR 124.A OG1 GLY 121.A O no hydrogen 3.331 N/A THR 124.A OG1 GLY 138.A O no hydrogen 2.798 N/A PHE 125.A N CYS 141.A O no hydrogen 3.055 N/A ILE 126.A N SER 107.A O no hydrogen 2.758 N/A GLY 127.A N LEU 143.A O no hydrogen 2.687 N/A GLN 129.A N HIS 110.A O no hydrogen 3.081 N/A GLN 129.A NE2 GLN 111.A OE1 no hydrogen 2.913 N/A ALA 130.A N GLY 127.A O no hydrogen 2.935 N/A PHE 131.A N SER 147.A O no hydrogen 3.124 N/A VAL 132.A N GLN 113.A O no hydrogen 3.007 N/A PHE 133.A N ALA 149.A O no hydrogen 3.050 N/A SER 135.A OG PHE 133.A O no hydrogen 2.931 N/A LYS 136.A N VAL 152.A O no hydrogen 2.881 N/A VAL 137.A N ALA 119.A O no hydrogen 2.736 N/A GLY 138.A N ILE 154.A O no hydrogen 2.814 N/A ASN 139.A N ASP 156.A OD2 no hydrogen 2.980 N/A ASN 140.A N ASP 122.A O no hydrogen 2.968 N/A CYS 141.A N THR 124.A OG1 no hydrogen 2.910 N/A CYS 141.A SG GLY 138.A O no hydrogen 3.469 N/A CYS 141.A SG ASN 139.A O no hydrogen 3.599 N/A CYS 141.A SG PRO 155.A O no hydrogen 3.179 N/A VAL 142.A N ARG 158.A O no hydrogen 3.135 N/A LEU 143.A N PHE 125.A O no hydrogen 2.790 N/A GLU 144.A N ILE 160.A O no hydrogen 2.974 N/A ARG 146.A N MET 128.A O no hydrogen 2.950 N/A ARG 146.A NE GLN 129.A OE1 no hydrogen 2.760 N/A ARG 146.A NH2 GLN 129.A OE1 no hydrogen 3.142 N/A SER 147.A N GLU 144.A O no hydrogen 3.052 N/A SER 147.A OG GLU 144.A O no hydrogen 2.646 N/A ALA 148.A N MET 164.A O no hydrogen 2.794 N/A ALA 149.A N PHE 131.A O no hydrogen 2.900 N/A ILE 150.A N VAL 166.A O no hydrogen 2.789 N/A GLY 151.A N PHE 133.A O no hydrogen 3.033 N/A VAL 152.A N SER 135.A OG no hydrogen 3.084 N/A THR 153.A N GLN 169.A OE1 no hydrogen 2.769 N/A ILE 154.A N LYS 136.A O no hydrogen 2.804 N/A GLY 157.A N ASN 139.A O no hydrogen 2.880 N/A ARG 158.A NH1 ASP 173.A O no hydrogen 2.938 N/A ARG 158.A NH1 LEU 175.A O no hydrogen 2.690 N/A TYR 159.A N PRO 176.A O no hydrogen 2.929 N/A ILE 160.A N VAL 142.A O no hydrogen 2.837 N/A ALA 162.A N GLU 144.A OE1 no hydrogen 2.829 N/A GLY 163.A N PRO 145.A O no hydrogen 3.089 N/A MET 164.A N PRO 161.A O no hydrogen 3.095 N/A VAL 166.A N ALA 148.A O no hydrogen 2.856 N/A THR 167.A N GLU 171.A OE2 no hydrogen 2.869 N/A SER 168.A N GLU 171.A OE2 no hydrogen 3.111 N/A GLN 169.A NE2 THR 153.A O no hydrogen 2.930 N/A GLN 169.A NE2 ASP 173.A OD1 no hydrogen 3.202 N/A GLU 171.A N SER 168.A OG no hydrogen 3.148 N/A ALA 172.A N SER 168.A O no hydrogen 2.978 N/A ASP 173.A N GLN 169.A O no hydrogen 2.897 N/A LYS 174.A N GLU 171.A O no hydrogen 3.040 N/A LEU 175.A N ALA 172.A O no hydrogen 3.301 N/A VAL 178.A N GLY 157.A O no hydrogen 2.900 N/A TYR 182.A N THR 179.A O no hydrogen 2.965 N/A TYR 182.A OH GLU 144.A OE2 no hydrogen 2.673 N/A SER 185.A N TYR 182.A O no hydrogen 2.984 N/A SER 185.A OG ASP 180.A O no hydrogen 2.933 N/A SER 185.A OG TYR 182.A O no hydrogen 2.999 N/A THR 187.A N TYR 184.A O no hydrogen 3.221 N/A ASN 188.A ND2 ASN 105.A O no hydrogen 2.811 N/A ASN 188.A ND2 ASP 123.A OD1.A no hydrogen 2.900 N/A ALA 190.A N HIS 186.A O no hydrogen 3.386 N/A VAL 191.A N THR 187.A O no hydrogen 3.032 N/A VAL 192.A N ASN 188.A O no hydrogen 2.864 N/A TYR 193.A N GLU 189.A O no hydrogen 3.097 N/A VAL 194.A N ALA 190.A O no hydrogen 2.912 N/A ASN 195.A N VAL 191.A O no hydrogen 2.813 N/A ASN 195.A ND2 VAL 191.A O no hydrogen 2.854 N/A VAL 196.A N VAL 192.A O no hydrogen 2.859 N/A HIS 197.A N TYR 193.A O no hydrogen 3.208 N/A HIS 197.A ND1 TYR 193.A O no hydrogen 2.791 N/A LEU 198.A N VAL 194.A O no hydrogen 2.856 N/A ALA 199.A N ASN 195.A O no hydrogen 2.926 N/A GLU 200.A N VAL 196.A O no hydrogen 3.169 N/A GLY 201.A N HIS 197.A O no hydrogen 2.900 N/A TYR 202.A N LEU 198.A O no hydrogen 2.740 N/A LYS 203.A N ALA 199.A O no hydrogen 2.838 N/A LYS 203.A NZ ALA 25.A O no hydrogen 3.135 N/A GLU 204.A N GLU 200.A O no hydrogen 3.179 N/A GLU 204.A N GLY 201.A O no hydrogen 3.082 N/A THR 205.A N TYR 202.A O no hydrogen 2.959 N/A THR 205.A OG1 TYR 202.A O no hydrogen 2.653 N/A SER 206.A N LYS 203.A O no hydrogen 3.199 N/A SER 206.A OG LYS 203.A O no hydrogen 2.669 N/A