Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1krr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 4.A N GLU 19.A OE2 no hydrogen 3.015 N/A THR 5.A N GLU 19.A OE1 no hydrogen 3.042 N/A THR 5.A OG1 GLU 19.A OE1 no hydrogen 2.931 N/A ARG 7.A N PRO 3.A O no hydrogen 3.089 N/A ARG 7.A NH1 LEU 13.A O no hydrogen 2.830 N/A ILE 8.A N MET 4.A O no hydrogen 3.060 N/A ALA 10.A N GLU 6.A O no hydrogen 2.899 N/A GLY 11.A N ILE 8.A O no hydrogen 3.181 N/A LYS 12.A N ARG 7.A O no hydrogen 2.903 N/A PHE 14.A N MET 126.A O no hydrogen 2.866 N/A LEU 21.A N CYS 18.A O no hydrogen 3.296 N/A LYS 24.A N GLY 20.A O no hydrogen 2.804 N/A ARG 25.A N LEU 21.A O no hydrogen 2.826 N/A ARG 25.A NE TYR 71.A OH no hydrogen 3.564 N/A LEU 26.A N PRO 22.A O no hydrogen 3.060 N/A ARG 27.A N GLU 23.A O no hydrogen 3.294 N/A GLY 28.A N LYS 24.A O no hydrogen 3.303 N/A LYS 29.A N ARG 25.A O no hydrogen 2.965 N/A LYS 29.A NZ SER 70.A O no hydrogen 3.113 N/A THR 30.A N LEU 26.A O no hydrogen 2.957 N/A THR 30.A N ARG 27.A O no hydrogen 3.312 N/A THR 30.A OG1 LEU 26.A O no hydrogen 2.723 N/A LEU 31.A N ARG 27.A O no hydrogen 3.424 N/A MET 32.A N GLY 28.A O no hydrogen 2.886 N/A TYR 33.A N LYS 29.A O no hydrogen 2.893 N/A GLU 34.A N THR 30.A O no hydrogen 3.128 N/A PHE 35.A N LEU 31.A O no hydrogen 2.855 N/A ASN 36.A N MET 32.A O no hydrogen 2.787 N/A ASN 36.A ND2 VAL 67.A O no hydrogen 2.789 N/A HIS 37.A N TYR 33.A O no hydrogen 2.976 N/A SER 38.A N PHE 35.A O no hydrogen 3.246 N/A SER 38.A OG PHE 35.A O no hydrogen 2.929 N/A HIS 39.A N GLU 42.A OE2 no hydrogen 3.212 N/A HIS 39.A ND1 SER 41.A OG no hydrogen 2.950 N/A SER 41.A N HIS 39.A ND1 no hydrogen 3.452 N/A SER 41.A OG HIS 39.A ND1 no hydrogen 2.950 N/A GLU 42.A N HIS 39.A O no hydrogen 2.735 N/A VAL 43.A N SER 41.A O no hydrogen 2.564 N/A ARG 46.A N GLU 42.A O no hydrogen 2.999 N/A ARG 46.A NE SER 38.A OG no hydrogen 2.618 N/A ARG 46.A NH2 SER 38.A O no hydrogen 2.789 N/A ARG 46.A NH2 SER 38.A OG no hydrogen 3.355 N/A GLU 47.A N VAL 43.A O no hydrogen 3.085 N/A SER 48.A N GLU 44.A O no hydrogen 3.006 N/A SER 48.A OG LYS 45.A O no hydrogen 2.757 N/A LEU 49.A N LYS 45.A O no hydrogen 2.844 N/A ILE 50.A N ARG 46.A O no hydrogen 3.306 N/A LYS 51.A N GLU 47.A O no hydrogen 3.466 N/A GLU 52.A N SER 48.A O no hydrogen 3.233 N/A GLU 52.A N LEU 49.A O no hydrogen 3.161 N/A MET 53.A N LEU 49.A O no hydrogen 2.667 N/A PHE 54.A N ILE 50.A O no hydrogen 3.297 N/A ALA 55.A N ILE 75.A O no hydrogen 2.946 N/A THR 56.A N ILE 75.A O no hydrogen 3.374 N/A GLY 58.A N GLY 78.A O no hydrogen 2.720 N/A ASN 60.A ND2 ASN 80.A OD1 no hydrogen 2.943 N/A TRP 62.A N PHE 81.A O no hydrogen 2.669 N/A TRP 62.A NE1 GLU 64.A OE2 no hydrogen 3.241 N/A GLU 64.A N ALA 83.A O no hydrogen 3.001 N/A VAL 67.A N ASN 36.A OD1 no hydrogen 2.643 N/A TYR 68.A N LEU 87.A O no hydrogen 2.903 N/A SER 70.A N ASP 91.A OD1 no hydrogen 2.961 N/A TYR 71.A N ASP 91.A OD1 no hydrogen 2.881 N/A GLY 72.A N ASP 91.A OD1 no hydrogen 3.330 N/A GLY 72.A N ASP 91.A OD2 no hydrogen 2.675 N/A ASN 74.A N ASP 91.A OD2 no hydrogen 3.368 N/A ASN 74.A ND2 ASP 91.A O no hydrogen 2.702 N/A ILE 75.A N GLY 72.A O no hydrogen 3.231 N/A HIS 76.A N VAL 95.A O no hydrogen 2.823 N/A ILE 77.A N THR 56.A O no hydrogen 2.830 N/A ARG 79.A N ASP 99.A OD1 no hydrogen 2.808 N/A ASN 80.A N GLU 59.A O no hydrogen 2.998 N/A ASN 80.A ND2 ASN 100.A OD1 no hydrogen 3.117 N/A TYR 82.A N VAL 101.A O no hydrogen 3.119 N/A ALA 83.A N TRP 62.A O no hydrogen 2.809 N/A ASN 84.A N ILE 103.A O no hydrogen 2.975 N/A PHE 85.A N ASN 84.A OD1 no hydrogen 2.868 N/A ASN 86.A ND2 ASN 106.A OD1 no hydrogen 3.139 N/A THR 88.A N VAL 107.A O no hydrogen 2.838 N/A ILE 89.A N TYR 68.A O no hydrogen 2.641 N/A VAL 90.A N LEU 109.A O no hydrogen 2.862 N/A VAL 95.A N ASN 74.A O no hydrogen 2.816 N/A THR 96.A N ILE 131.A O no hydrogen 3.013 N/A ILE 97.A N HIS 76.A O no hydrogen 2.903 N/A ASP 99.A N ASN 135.A OD1 no hydrogen 2.769 N/A ASN 100.A N ARG 79.A O no hydrogen 2.890 N/A ASN 100.A ND2 ASN 136.A OD1 no hydrogen 2.971 N/A LEU 102.A N VAL 137.A O no hydrogen 2.984 N/A ILE 103.A N TYR 82.A O no hydrogen 2.937 N/A ALA 104.A N ILE 139.A O no hydrogen 2.839 N/A ASN 106.A N PHE 85.A O no hydrogen 2.998 N/A ASN 106.A ND2 HIS 142.A NE2 no hydrogen 3.312 N/A THR 108.A N VAL 143.A O no hydrogen 3.010 N/A LEU 109.A N THR 88.A O no hydrogen 2.553 N/A SER 110.A N ILE 145.A O no hydrogen 2.839 N/A SER 110.A OG THR 112.A O no hydrogen 2.773 N/A VAL 111.A N VAL 90.A O no hydrogen 3.203 N/A THR 112.A OG1 ASP 92.A OD2 no hydrogen 2.619 N/A THR 112.A OG1 SER 128.A OG no hydrogen 2.669 N/A GLY 113.A N TYR 127.A O no hydrogen 3.188 N/A HIS 114.A ND1 GLU 125.A O no hydrogen 3.016 N/A LEU 120.A N HIS 117.A O no hydrogen 2.863 N/A ARG 121.A NE PRO 115.A O no hydrogen 2.923 N/A ARG 121.A NH2 VAL 116.A O no hydrogen 2.829 N/A ASN 123.A N GLU 125.A OE2 no hydrogen 3.177 N/A ASN 123.A ND2 GLU 125.A OE2 no hydrogen 3.063 N/A GLY 124.A N ARG 121.A O no hydrogen 2.873 N/A MET 126.A N PHE 14.A O no hydrogen 3.114 N/A TYR 127.A N GLY 113.A O no hydrogen 3.182 N/A SER 128.A OG THR 112.A OG1 no hydrogen 2.669 N/A PHE 129.A N VAL 111.A O no hydrogen 2.907 N/A ILE 131.A N THR 94.A O no hydrogen 3.365 N/A THR 132.A N VAL 149.A O no hydrogen 2.972 N/A ILE 133.A N THR 96.A O no hydrogen 2.827 N/A GLY 134.A N ILE 151.A O no hydrogen 2.789 N/A ASN 135.A N ASP 153.A OD1 no hydrogen 2.793 N/A ASN 136.A N ASP 99.A O no hydrogen 2.800 N/A ASN 136.A ND2 ASN 154.A OD1 no hydrogen 3.382 N/A TRP 138.A N SER 155.A O no hydrogen 3.230 N/A ILE 139.A N LEU 102.A O no hydrogen 2.794 N/A GLY 140.A N ILE 157.A O no hydrogen 2.740 N/A SER 141.A OG PRO 105.A O no hydrogen 3.342 N/A HIS 142.A N PRO 105.A O no hydrogen 3.412 N/A VAL 144.A N SER 161.A O no hydrogen 2.928 N/A ILE 145.A N THR 108.A O no hydrogen 2.968 N/A ASN 146.A N VAL 163.A O no hydrogen 2.954 N/A GLY 148.A N PHE 129.A O no hydrogen 2.604 N/A THR 150.A N ASP 166.A OD1 no hydrogen 3.210 N/A ILE 151.A N THR 132.A O no hydrogen 2.808 N/A GLY 152.A N ILE 167.A O no hydrogen 2.637 N/A ASN 154.A N ASN 135.A O no hydrogen 2.650 N/A ASN 154.A ND2 ASN 170.A OD1 no hydrogen 2.788 N/A SER 155.A OG GLY 152.A O no hydrogen 3.182 N/A SER 155.A OG PRO 168.A O no hydrogen 2.452 N/A VAL 156.A N VAL 171.A O no hydrogen 2.756 N/A ILE 157.A N TRP 138.A O no hydrogen 2.936 N/A GLY 158.A N ALA 173.A O no hydrogen 2.854 N/A GLY 160.A N SER 141.A O no hydrogen 2.571 N/A SER 161.A N GLY 158.A O no hydrogen 3.239 N/A SER 161.A OG GLY 158.A O no hydrogen 2.897 N/A ILE 162.A N GLY 175.A O no hydrogen 3.260 N/A VAL 163.A N VAL 144.A O no hydrogen 2.876 N/A ILE 167.A N THR 150.A O no hydrogen 2.772 N/A ASN 170.A N ASP 153.A O no hydrogen 2.933 N/A VAL 171.A N SER 155.A OG no hydrogen 3.213 N/A VAL 172.A N ARG 182.A O no hydrogen 3.011 N/A ALA 173.A N VAL 156.A O no hydrogen 2.828 N/A ALA 174.A N ARG 179.A O no hydrogen 3.065 N/A CYS 178.A N ILE 162.A O no hydrogen 2.911 N/A CYS 178.A SG SER 161.A OG no hydrogen 3.660 N/A ARG 179.A N ALA 174.A O no hydrogen 2.839 N/A ILE 181.A N VAL 172.A O no hydrogen 2.729 N/A ARG 182.A N VAL 172.A O no hydrogen 3.336 N/A ARG 182.A NH2 ASP 188.A OD1 no hydrogen 2.310 N/A ILE 184.A N ASN 170.A O no hydrogen 2.975 N/A ARG 187.A N ASN 185.A OD1 no hydrogen 2.934 N/A ASP 188.A N ASN 185.A O no hydrogen 3.151 N/A LYS 189.A N ASP 186.A O no hydrogen 3.014 N/A TYR 191.A N ARG 187.A O no hydrogen 3.239 N/A TYR 192.A N TYR 196.A O no hydrogen 3.173 N/A TYR 196.A N PHE 193.A O no hydrogen 2.826 N/A