Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1jit_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A N THR 40.A OG1 no hydrogen 2.770 N/A LYS 1.A NZ GLU 7.A OE2 no hydrogen 2.829 N/A PHE 3.A N PHE 38.A O no hydrogen 2.895 N/A GLY 4.A N GLU 7.A OE1 no hydrogen 3.149 N/A ARG 5.A NH1 TRP 123.A O no hydrogen 2.968 N/A ARG 5.A NH1 ARG 125.A O no hydrogen 3.012 N/A ARG 5.A NH2 ARG 125.A O no hydrogen 3.179 N/A LEU 8.A N GLY 4.A O no hydrogen 2.987 N/A ALA 9.A N ARG 5.A O no hydrogen 3.099 N/A ALA 10.A N CYS 6.A O no hydrogen 3.020 N/A ALA 11.A N GLU 7.A O no hydrogen 3.118 N/A MET 12.A N LEU 8.A O no hydrogen 2.809 N/A LYS 13.A N ALA 9.A O no hydrogen 2.917 N/A ARG 14.A N ALA 10.A O no hydrogen 2.978 N/A HIS 15.A N ALA 11.A O no hydrogen 3.173 N/A HIS 15.A N MET 12.A O no hydrogen 3.026 N/A HIS 15.A ND1 ALA 11.A O no hydrogen 2.874 N/A HIS 15.A NE2 THR 89.A OG1 no hydrogen 2.910 N/A GLY 16.A N LYS 13.A O no hydrogen 3.018 N/A LEU 17.A N MET 12.A O no hydrogen 3.139 N/A TYR 20.A N LEU 17.A O no hydrogen 2.989 N/A ARG 21.A NE SER 100.A OG no hydrogen 2.943 N/A ARG 21.A NH2 SER 100.A OG no hydrogen 3.304 N/A GLY 22.A N ASN 19.A O no hydrogen 2.985 N/A TYR 23.A N TYR 20.A O no hydrogen 3.212 N/A LEU 25.A N ASP 18.A OD1 no hydrogen 3.059 N/A ASN 27.A N SER 24.A O no hydrogen 2.886 N/A ASN 27.A ND2 SER 24.A O no hydrogen 3.409 N/A VAL 29.A N LEU 25.A O no hydrogen 3.168 N/A CYS 30.A N GLY 26.A O no hydrogen 3.018 N/A ALA 31.A N ASN 27.A O no hydrogen 3.021 N/A ALA 32.A N TRP 28.A O no hydrogen 3.060 N/A LYS 33.A N VAL 29.A O no hydrogen 2.951 N/A LYS 33.A NZ ASN 37.A OD1 no hydrogen 2.799 N/A PHE 34.A N CYS 30.A O no hydrogen 3.272 N/A GLU 35.A N ALA 31.A O no hydrogen 2.911 N/A SER 36.A N ALA 32.A O no hydrogen 3.024 N/A SER 36.A OG ALA 32.A O no hydrogen 3.163 N/A SER 36.A OG ILE 55.A O no hydrogen 2.765 N/A ASN 37.A N LYS 33.A O no hydrogen 2.674 N/A PHE 38.A N ALA 32.A O no hydrogen 3.476 N/A ASN 39.A N SER 36.A O no hydrogen 3.088 N/A THR 40.A N LYS 1.A O no hydrogen 3.025 N/A THR 40.A OG1 LYS 1.A O no hydrogen 3.353 N/A THR 40.A OG1 LEU 84.A O no hydrogen 3.338 N/A GLN 41.A N ASN 39.A OD1 no hydrogen 3.014 N/A ALA 42.A N ASN 39.A O no hydrogen 3.242 N/A ASN 44.A N ASP 52.A O no hydrogen 3.172 N/A ASN 46.A N SER 50.A O no hydrogen 2.757 N/A ASN 46.A ND2 ASP 52.A OD2 no hydrogen 3.430 N/A GLY 49.A N ASN 46.A O no hydrogen 3.080 N/A SER 50.A N ASP 48.A OD1 no hydrogen 2.881 N/A SER 50.A OG ASN 46.A OD1 no hydrogen 3.071 N/A SER 50.A OG ASP 48.A OD1 no hydrogen 2.532 N/A SER 50.A OG ASP 48.A OD2 no hydrogen 3.388 N/A THR 51.A N SER 60.A OG no hydrogen 2.889 N/A ASP 52.A N ASN 44.A O no hydrogen 2.812 N/A TYR 53.A N ILE 58.A O no hydrogen 2.962 N/A TYR 53.A OH ASP 66.A OD2 no hydrogen 2.685 N/A GLY 54.A N ALA 42.A O no hydrogen 2.912 N/A GLN 57.A N GLY 54.A O no hydrogen 2.998 N/A GLN 57.A NE2 ALA 42.A O no hydrogen 3.043 N/A GLN 57.A NE2 GLY 54.A O no hydrogen 2.880 N/A ILE 58.A N TYR 53.A O no hydrogen 2.979 N/A ASN 59.A ND2 SER 50.A OG no hydrogen 2.918 N/A ASN 59.A ND2 ASP 52.A OD1 no hydrogen 2.863 N/A SER 60.A N THR 51.A O no hydrogen 3.005 N/A SER 60.A OG THR 51.A O no hydrogen 3.421 N/A SER 60.A OG ASP 66.A OD2 no hydrogen 3.388 N/A SER 60.A OG THR 69.A OG1 no hydrogen 2.888 N/A ARG 61.A N ASN 59.A OD1 no hydrogen 2.711 N/A ARG 61.A NE ASP 48.A OD2 no hydrogen 3.226 N/A ARG 61.A NH2 ASP 48.A OD2 no hydrogen 3.070 N/A TRP 63.A N ASN 59.A O no hydrogen 3.151 N/A ASN 65.A N ILE 78.A O no hydrogen 3.071 N/A GLY 67.A N ASN 65.A OD1 no hydrogen 3.344 N/A ARG 68.A N ASP 66.A OD1 no hydrogen 3.015 N/A ARG 68.A NH2 THR 51.A OG1 no hydrogen 3.076 N/A THR 69.A OG1 SER 60.A OG no hydrogen 2.888 N/A THR 69.A OG1 ASP 66.A OD1 no hydrogen 2.903 N/A THR 69.A OG1 ASP 66.A OD2 no hydrogen 3.332 N/A SER 72.A OG THR 69.A O no hydrogen 2.734 N/A ARG 73.A N ARG 61.A O no hydrogen 2.826 N/A LEU 75.A N TRP 62.A O no hydrogen 2.910 N/A CYS 76.A N TRP 63.A O no hydrogen 3.038 N/A CYS 76.A SG CYS 94.A O no hydrogen 3.775 N/A ASN 77.A N ASN 74.A O no hydrogen 2.866 N/A ILE 78.A N ASN 74.A OD1 no hydrogen 3.018 N/A CYS 80.A N ASN 65.A O no hydrogen 2.905 N/A ALA 82.A N PRO 79.A O no hydrogen 2.931 N/A LEU 83.A N CYS 80.A O no hydrogen 2.817 N/A LEU 84.A N SER 81.A O no hydrogen 3.129 N/A SER 85.A OG ASP 87.A O no hydrogen 3.445 N/A ASP 87.A N SER 85.A OG no hydrogen 2.899 N/A THR 89.A N ASP 87.A OD1 no hydrogen 2.975 N/A THR 89.A OG1 HIS 15.A NE2 no hydrogen 2.910 N/A THR 89.A OG1 ASP 87.A OD1 no hydrogen 2.599 N/A THR 89.A OG1 ASP 87.A OD2 no hydrogen 3.533 N/A VAL 92.A N ILE 88.A O no hydrogen 2.853 N/A ASN 93.A N THR 89.A O no hydrogen 2.896 N/A CYS 94.A N ALA 90.A O no hydrogen 3.149 N/A ALA 95.A N SER 91.A O no hydrogen 2.876 N/A LYS 96.A N VAL 92.A O no hydrogen 3.034 N/A LYS 96.A NZ HIS 15.A O no hydrogen 2.674 N/A ILE 98.A N CYS 94.A O no hydrogen 3.020 N/A VAL 99.A N ALA 95.A O no hydrogen 2.873 N/A SER 100.A N LYS 97.A O no hydrogen 3.248 N/A SER 100.A OG LYS 96.A O no hydrogen 2.726 N/A ASP 101.A N ILE 98.A O no hydrogen 3.023 N/A MET 105.A N TYR 23.A OH no hydrogen 3.250 N/A ASN 106.A N ASN 103.A O no hydrogen 3.129 N/A ASN 106.A ND2 ASN 103.A O no hydrogen 2.985 N/A ALA 107.A N GLY 104.A O no hydrogen 3.459 N/A TRP 108.A N MET 105.A O no hydrogen 3.004 N/A TRP 108.A NE1 LEU 56.A O no hydrogen 2.689 N/A ALA 110.A N GLU 35.A OE2 no hydrogen 3.133 N/A TRP 111.A N TRP 108.A O no hydrogen 3.161 N/A TRP 111.A NE1 ASN 27.A OD1 no hydrogen 3.077 N/A ARG 112.A N TRP 108.A O no hydrogen 3.123 N/A ARG 112.A NE ASN 106.A O no hydrogen 3.492 N/A ARG 112.A NH2 ASN 106.A O no hydrogen 3.271 N/A ASN 113.A N VAL 109.A O no hydrogen 2.991 N/A ARG 114.A N ALA 110.A O no hydrogen 2.767 N/A CYS 115.A N TRP 111.A O no hydrogen 2.863 N/A LYS 116.A N TRP 111.A O no hydrogen 2.711 N/A LYS 116.A NZ ASN 106.A OD1 no hydrogen 2.823 N/A THR 118.A N CYS 115.A O no hydrogen 2.937 N/A THR 118.A OG1 CYS 115.A O no hydrogen 2.559 N/A VAL 120.A N THR 118.A O no hydrogen 2.894 N/A ALA 122.A N ASP 119.A O no hydrogen 3.129 N/A TRP 123.A N VAL 120.A O no hydrogen 2.955 N/A ILE 124.A N GLN 121.A O no hydrogen 3.118 N/A CYS 127.A N ILE 124.A O no hydrogen 3.187 N/A CYS 127.A SG ARG 125.A O no hydrogen 3.962 N/A