Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4nig_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N ALA 7.A O no hydrogen 3.453 N/A ALA 7.A N ALA 4.A O no hydrogen 2.956 N/A VAL 8.A N.A VAL 165.A O no hydrogen 2.903 N/A VAL 8.A N.B VAL 165.A O no hydrogen 2.868 N/A LEU 10.A N VAL 163.A O no hydrogen 2.689 N/A ARG 12.A N ASP 162.A OD1 no hydrogen 2.774 N/A ARG 12.A NH1 HIS 160.A O no hydrogen 2.749 N/A PHE 13.A N LEU 10.A O no hydrogen 3.294 N/A ALA 14.A N GLY 161.A O no hydrogen 2.830 N/A PHE 15.A N ARG 12.A O no hydrogen 3.060 N/A ALA 18.A N PHE 15.A O no hydrogen 3.332 N/A GLN 20.A NE2 ASP 24.A OD2 no hydrogen 3.053 N/A LEU 21.A N ALA 17.A O no hydrogen 3.028 N/A ILE 22.A N ALA 18.A O no hydrogen 2.979 N/A ARG 23.A N GLU 19.A O no hydrogen 3.066 N/A ARG 23.A NE GLN 20.A OE1 no hydrogen 3.091 N/A ARG 23.A NH2 GLN 20.A OE1 no hydrogen 2.679 N/A ASP 24.A N GLN 20.A O no hydrogen 2.929 N/A ILE 25.A N LEU 21.A O no hydrogen 2.812 N/A ASN 26.A N ILE 22.A O no hydrogen 3.023 N/A ASP 27.A N ARG 23.A O no hydrogen 3.080 N/A VAL 28.A N ASP 24.A O no hydrogen 2.902 N/A ALA 29.A N ILE 25.A O no hydrogen 2.946 N/A SER 30.A N ASN 26.A O no hydrogen 3.030 N/A SER 30.A N ASP 27.A O no hydrogen 3.207 N/A SER 30.A OG ASP 27.A O no hydrogen 2.754 N/A GLN 31.A N VAL 28.A O no hydrogen 2.957 N/A SER 32.A N VAL 28.A O no hydrogen 2.945 N/A SER 32.A OG ASP 70.A OD2 no hydrogen 2.594 N/A ARG 35.A N MET 49.A O no hydrogen 2.906 N/A ARG 35.A NE PRO 33.A O no hydrogen 2.953 N/A ARG 35.A NH1 ASP 70.A OD1 no hydrogen 2.833 N/A ARG 35.A NH2 PRO 33.A O no hydrogen 2.820 N/A ARG 35.A NH2 ASP 70.A OD1 no hydrogen 3.405 N/A ARG 35.A NH2 ASP 70.A OD2 no hydrogen 2.884 N/A GLN 36.A NE2 MET 45.A O no hydrogen 2.819 N/A THR 39.A N TYR 43.A O no hydrogen 2.803 N/A THR 39.A OG1 TYR 43.A O no hydrogen 3.286 N/A GLY 42.A N THR 39.A O no hydrogen 2.902 N/A TYR 43.A N THR 39.A OG1 no hydrogen 2.987 N/A MET 45.A N MET 37.A O.A no hydrogen 2.838 N/A MET 45.A N MET 37.A O.B no hydrogen 2.847 N/A ALA 48.A N ARG 109.A O no hydrogen 3.061 N/A MET 49.A N ARG 35.A O no hydrogen 2.834 N/A THR 50.A N ILE 107.A O no hydrogen 2.990 N/A THR 50.A OG1 SER 32.A O no hydrogen 2.563 N/A ASN 51.A N THR 50.A OG1 no hydrogen 2.858 N/A ASN 51.A ND2 TRP 57.A O no hydrogen 3.063 N/A CYS 52.A N CYS 105.A O no hydrogen 2.849 N/A GLY 53.A N PRO 78.A O no hydrogen 2.837 N/A LEU 55.A N ASP 103.A O no hydrogen 3.047 N/A GLY 56.A N SER 67.A O no hydrogen 2.886 N/A TRP 57.A N ASN 51.A OD1 no hydrogen 2.993 N/A THR 58.A N LEU 65.A O no hydrogen 2.836 N/A THR 58.A OG1 LEU 65.A O no hydrogen 3.090 N/A THR 59.A OG1 VAL 38.A O no hydrogen 2.743 N/A HIS 60.A N.A GLY 63.A O no hydrogen 2.926 N/A HIS 60.A N.B GLY 63.A O no hydrogen 3.015 N/A HIS 60.A ND1.B GLY 63.A O no hydrogen 3.183 N/A GLY 63.A N HIS 60.A O.A no hydrogen 3.412 N/A GLY 63.A N HIS 60.A O.B no hydrogen 3.208 N/A LEU 65.A N THR 58.A O no hydrogen 2.816 N/A SER 67.A N GLY 56.A O no hydrogen 2.876 N/A SER 67.A OG ILE 69.A O no hydrogen 3.134 N/A ILE 69.A N SER 67.A OG no hydrogen 3.242 N/A ASP 70.A N LYS 75.A O no hydrogen 2.885 N/A GLN 72.A N ASP 70.A OD1 no hydrogen 2.858 N/A ASN 74.A N ASP 70.A O no hydrogen 2.760 N/A LYS 75.A N THR 73.A OG1 no hydrogen 3.115 N/A TRP 77.A NE1 SER 67.A O no hydrogen 2.951 N/A SER 83.A OG ASP 24.A OD2 no hydrogen 2.571 N/A HIS 85.A N PRO 81.A O no hydrogen 2.959 N/A ASN 86.A N GLN 82.A O no hydrogen 2.853 N/A LEU 87.A N SER 83.A O no hydrogen 3.063 N/A CYS 88.A N PHE 84.A O no hydrogen 2.931 N/A GLN 89.A N HIS 85.A O no hydrogen 3.026 N/A GLN 89.A NE2 ASN 86.A OD1 no hydrogen 2.950 N/A ARG 90.A N ASN 86.A O no hydrogen 3.037 N/A ALA 91.A N LEU 87.A O no hydrogen 2.929 N/A ALA 92.A N CYS 88.A O no hydrogen 2.848 N/A THR 93.A N GLN 89.A O no hydrogen 2.981 N/A THR 93.A OG1 GLN 89.A O no hydrogen 2.777 N/A ALA 94.A N ARG 90.A O no hydrogen 2.989 N/A ALA 95.A N ALA 91.A O no hydrogen 2.984 N/A ALA 95.A N ALA 92.A O no hydrogen 3.165 N/A GLY 96.A N THR 93.A O no hydrogen 3.105 N/A TYR 97.A N ALA 92.A O no hydrogen 2.748 N/A TYR 97.A OH GLY 6.A O no hydrogen 2.661 N/A PHE 100.A N TYR 97.A O no hydrogen 3.492 N/A ASP 103.A N ARG 198.A O no hydrogen 2.932 N/A CYS 105.A N CYS 52.A O no hydrogen 2.971 N/A CYS 105.A SG LEU 106.A O no hydrogen 4.046 N/A CYS 105.A SG THR 196.A O no hydrogen 3.991 N/A LEU 106.A N THR 196.A O no hydrogen 2.888 N/A ILE 107.A N THR 50.A O no hydrogen 2.860 N/A ASN 108.A N ASN 194.A O no hydrogen 2.903 N/A ARG 109.A N ALA 48.A O no hydrogen 2.739 N/A TYR 110.A N ARG 192.A O no hydrogen 2.721 N/A TYR 110.A OH ASN 108.A OD1 no hydrogen 3.363 N/A GLY 113.A N LEU 180.A O no hydrogen 2.803 N/A ALA 114.A N ALA 111.A O no hydrogen 2.999 N/A LYS 115.A N SER 46.A OG no hydrogen 2.997 N/A LEU 116.A N ILE 177.A O no hydrogen 3.046 N/A HIS 119.A N HIS 175.A O no hydrogen 2.914 N/A HIS 119.A ND1 CYS 117.A O no hydrogen 2.997 N/A GLN 120.A NE2 LEU 172.A O no hydrogen 2.814 N/A HIS 124.A NE2 ASP 121.A O no hydrogen 2.690 N/A ARG 128.A N ASP 126.A OD1 no hydrogen 3.116 N/A ALA 129.A N ASP 126.A O no hydrogen 3.074 N/A ILE 131.A N TRP 166.A O no hydrogen 2.822 N/A VAL 132.A N PHE 197.A O no hydrogen 3.286 N/A SER 133.A N VAL 164.A O no hydrogen 2.790 N/A SER 133.A OG ASN 194.A OD1 no hydrogen 3.166 N/A VAL 134.A N LEU 195.A O no hydrogen 2.789 N/A SER 135.A N ASP 162.A O no hydrogen 2.866 N/A LEU 136.A N TYR 193.A O no hydrogen 2.833 N/A LEU 138.A N CYS 191.A O no hydrogen 3.183 N/A ALA 140.A N LEU 158.A O no hydrogen 3.055 N/A PHE 142.A N LEU 156.A O no hydrogen 2.898 N/A GLN 143.A N GLY 176.A O no hydrogen 2.805 N/A GLN 143.A NE2 GLN 178.A OE1 no hydrogen 2.907 N/A PHE 144.A N LYS 154.A O no hydrogen 2.915 N/A GLY 145.A N TYR 174.A O no hydrogen 2.839 N/A LYS 148.A N ASP 151.A OD2 no hydrogen 2.965 N/A ASP 151.A N LYS 148.A O no hydrogen 2.962 N/A LYS 154.A N PHE 144.A O no hydrogen 2.774 N/A LYS 154.A NZ GLU 1.A OE2 no hydrogen 3.324 N/A LYS 154.A NZ LEU 3.A O no hydrogen 2.891 N/A ARG 155.A NE GLN 178.A OE1 no hydrogen 2.756 N/A LEU 156.A N PHE 142.A O no hydrogen 2.816 N/A LEU 158.A N ALA 140.A O no hydrogen 2.779 N/A GLU 159.A N ASP 162.A OD2 no hydrogen 2.896 N/A GLY 161.A N SER 135.A O no hydrogen 2.764 N/A ASP 162.A N GLU 159.A O no hydrogen 2.872 N/A VAL 163.A N LEU 10.A O no hydrogen 2.982 N/A VAL 164.A N SER 133.A O no hydrogen 2.814 N/A VAL 165.A N VAL 8.A O.A no hydrogen 2.981 N/A VAL 165.A N VAL 8.A O.B no hydrogen 2.823 N/A TRP 166.A N ILE 131.A O no hydrogen 3.017 N/A GLY 167.A N SER 170.A OG no hydrogen 3.349 N/A SER 170.A N GLY 167.A O no hydrogen 3.066 N/A SER 170.A OG ALA 5.A O no hydrogen 2.789 N/A SER 170.A OG GLY 167.A O no hydrogen 2.976 N/A ARG 171.A N GLY 168.A O no hydrogen 3.193 N/A PHE 173.A N SER 170.A O no hydrogen 3.090 N/A TYR 174.A N GLY 146.A O no hydrogen 2.920 N/A HIS 175.A N HIS 119.A O no hydrogen 2.883 N/A HIS 175.A ND1 PHE 173.A O no hydrogen 3.061 N/A GLY 176.A N GLN 143.A O no hydrogen 3.064 N/A ILE 177.A N LEU 116.A O no hydrogen 2.897 N/A GLN 178.A N ILE 141.A O no hydrogen 2.947 N/A LEU 180.A N ALA 114.A O no hydrogen 2.929 N/A HIS 185.A N ILE 189.A O no hydrogen 3.132 N/A LEU 187.A N HIS 185.A ND1 no hydrogen 3.180 N/A THR 188.A OG1 CYS 191.A O no hydrogen 2.788 N/A ILE 189.A N HIS 185.A O no hydrogen 2.701 N/A ASP 190.A N THR 188.A O no hydrogen 2.784 N/A CYS 191.A SG THR 188.A O no hydrogen 3.847 N/A ARG 192.A N TYR 110.A O no hydrogen 3.019 N/A ARG 192.A NH2 SER 135.A OG no hydrogen 2.849 N/A TYR 193.A N LEU 136.A O no hydrogen 2.819 N/A ASN 194.A N ASN 108.A O no hydrogen 2.883 N/A LEU 195.A N VAL 134.A O no hydrogen 2.887 N/A THR 196.A N LEU 106.A O no hydrogen 2.839 N/A THR 196.A OG1 ASN 194.A OD1 no hydrogen 3.090 N/A PHE 197.A N VAL 132.A O no hydrogen 2.829 N/A ARG 198.A N ALA 104.A O no hydrogen 2.975 N/A ARG 198.A NH1 TYR 66.A OH no hydrogen 2.805 N/A ARG 198.A NH1 LYS 122.A O no hydrogen 2.816 N/A GLN 199.A NE2 ASP 126.A OD2 no hydrogen 3.549 N/A ALA 200.A N ASP 103.A OD1 no hydrogen 2.805 N/A GLY 201.A N ASP 103.A OD2 no hydrogen 2.905 N/A