Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3jan_6.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 1.A N ARG 104.A O no hydrogen 2.829 N/A SER 2.A OG ASP 106.A OD2 no hydrogen 3.233 N/A LEU 3.A N THR 109.A OG1 no hydrogen 3.108 N/A LEU 6.A N GLU 112.A OE1 no hydrogen 2.914 N/A GLN 7.A NE2 GLN 7.A O no hydrogen 2.810 N/A ILE 8.A N GLU 4.A O no hydrogen 3.112 N/A ILE 9.A N ILE 5.A O no hydrogen 2.988 N/A LYS 10.A N LEU 6.A O no hydrogen 3.036 N/A LYS 10.A NZ GLU 166.A OE1 no hydrogen 3.006 N/A GLU 11.A N GLN 7.A O no hydrogen 3.137 N/A GLU 11.A N ILE 8.A O no hydrogen 3.146 N/A SER 12.A N ILE 8.A O no hydrogen 2.845 N/A SER 12.A OG ILE 8.A O no hydrogen 3.014 N/A GLN 13.A N ILE 9.A O no hydrogen 2.815 N/A GLN 13.A NE2 GLU 59.A OE1 no hydrogen 3.324 N/A GLN 15.A N GLU 11.A O no hydrogen 3.303 N/A GLN 15.A N SER 12.A O no hydrogen 3.156 N/A HIS 16.A N SER 12.A O no hydrogen 3.250 N/A LEU 18.A N GLN 13.A O no hydrogen 3.078 N/A HIS 20.A N GLY 17.A O no hydrogen 2.635 N/A GLY 21.A N GLY 17.A O no hydrogen 2.983 N/A ASP 22.A N GLY 17.A O no hydrogen 3.330 N/A PHE 23.A N GLY 21.A O no hydrogen 2.873 N/A ARG 25.A N ASP 22.A OD1 no hydrogen 3.398 N/A TYR 26.A N ASP 22.A O no hydrogen 3.332 N/A TYR 26.A OH GLU 59.A OE1 no hydrogen 2.320 N/A ARG 27.A N PHE 23.A O no hydrogen 2.970 N/A ARG 27.A NH2 GLN 67.A OE1 no hydrogen 2.558 N/A GLY 28.A N GLN 24.A O no hydrogen 2.895 N/A TYR 29.A N ARG 25.A O no hydrogen 2.743 N/A CYS 30.A N TYR 26.A O no hydrogen 2.863 N/A CYS 30.A SG TYR 26.A O no hydrogen 3.490 N/A SER 31.A N ARG 27.A O no hydrogen 2.881 N/A SER 31.A OG ARG 27.A O no hydrogen 3.345 N/A ARG 32.A N GLY 28.A O no hydrogen 2.898 N/A ARG 33.A N TYR 29.A O no hydrogen 2.996 N/A GLN 34.A N CYS 30.A O no hydrogen 2.960 N/A GLN 34.A NE2 LEU 53.A O no hydrogen 3.557 N/A GLN 34.A NE2 ASP 57.A OD1 no hydrogen 2.548 N/A ARG 35.A N SER 31.A O no hydrogen 3.008 N/A ARG 36.A N ARG 32.A O no hydrogen 2.969 N/A LEU 37.A N ARG 33.A O no hydrogen 2.889 N/A ARG 38.A N GLN 34.A O no hydrogen 3.090 N/A ARG 38.A NE ASN 42.A OD1 no hydrogen 2.933 N/A ARG 38.A NH2 ASN 42.A OD1 no hydrogen 3.454 N/A LYS 39.A N ARG 35.A O no hydrogen 2.858 N/A THR 40.A N ARG 36.A O no hydrogen 2.845 N/A THR 40.A OG1 ARG 36.A O no hydrogen 3.161 N/A LEU 41.A N LEU 37.A O no hydrogen 2.912 N/A ASN 42.A N ARG 38.A O no hydrogen 2.658 N/A ASN 48.A ND2 SER 2.A O no hydrogen 3.138 N/A ARG 49.A N ASP 47.A OD2 no hydrogen 2.622 N/A LEU 52.A N ASN 48.A O no hydrogen 3.360 N/A LEU 53.A N ARG 49.A O no hydrogen 2.740 N/A VAL 54.A N TYR 50.A O no hydrogen 3.086 N/A LEU 55.A N LEU 51.A O no hydrogen 3.303 N/A MET 56.A N LEU 52.A O no hydrogen 3.073 N/A ASP 57.A N LEU 53.A O no hydrogen 3.027 N/A ALA 58.A N VAL 54.A O no hydrogen 2.953 N/A GLU 59.A N LEU 55.A O no hydrogen 2.632 N/A ARG 60.A N MET 56.A O no hydrogen 2.863 N/A ARG 60.A NE SER 31.A OG no hydrogen 2.786 N/A ARG 60.A NH1 ASP 57.A OD1 no hydrogen 3.212 N/A ALA 61.A N ASP 57.A O no hydrogen 3.454 N/A TRP 62.A N ALA 58.A O no hydrogen 3.081 N/A SER 63.A N GLU 59.A O no hydrogen 2.804 N/A SER 63.A OG PHE 23.A O no hydrogen 2.762 N/A TYR 64.A N ARG 60.A O no hydrogen 2.955 N/A ALA 65.A N ALA 61.A O no hydrogen 2.932 N/A MET 66.A N TRP 62.A O no hydrogen 3.120 N/A GLN 67.A N SER 63.A O no hydrogen 2.850 N/A GLN 67.A NE2 GLN 24.A OE1 no hydrogen 3.072 N/A GLN 67.A NE2 GLU 71.A OE2 no hydrogen 3.269 N/A LEU 68.A N TYR 64.A O no hydrogen 2.699 N/A LYS 69.A N ALA 65.A O no hydrogen 2.974 N/A LYS 69.A NZ GLU 127.A OE1 no hydrogen 2.695 N/A LYS 69.A NZ GLU 127.A OE2 no hydrogen 2.867 N/A GLN 70.A N MET 66.A O no hydrogen 3.409 N/A GLN 70.A NE2 GLY 21.A O no hydrogen 3.624 N/A GLU 71.A N GLN 67.A O no hydrogen 3.184 N/A GLU 71.A N LEU 68.A O no hydrogen 2.875 N/A ALA 72.A N LEU 68.A O no hydrogen 2.621 N/A THR 74.A N GLU 71.A O no hydrogen 3.056 N/A THR 74.A OG1 GLU 71.A O no hydrogen 3.282 N/A GLU 75.A N GLU 71.A O no hydrogen 3.199 N/A LYS 78.A N GLU 75.A O no hydrogen 2.616 N/A LYS 78.A NZ GLU 71.A OE1 no hydrogen 3.246 N/A ARG 79.A N PRO 76.A O no hydrogen 3.072 N/A ARG 79.A NH2 GLU 127.A O no hydrogen 3.270 N/A LEU 82.A N LYS 78.A O no hydrogen 2.853 N/A LEU 83.A N ARG 79.A O no hydrogen 3.247 N/A SER 84.A N HIS 81.A O no hydrogen 2.823 N/A ARG 85.A N HIS 81.A O no hydrogen 2.834 N/A LEU 86.A N LEU 82.A O no hydrogen 2.902 N/A ARG 87.A N LEU 83.A O no hydrogen 3.061 N/A LYS 88.A N SER 84.A O no hydrogen 2.797 N/A ALA 89.A N ARG 85.A O no hydrogen 2.640 N/A VAL 90.A N LEU 86.A O no hydrogen 3.103 N/A LYS 91.A N ARG 87.A O no hydrogen 3.248 N/A HIS 92.A N LYS 88.A O no hydrogen 3.050 N/A HIS 92.A ND1 GLU 95.A OE1 no hydrogen 3.237 N/A ALA 93.A N ALA 89.A O no hydrogen 3.045 N/A GLU 94.A N VAL 90.A O no hydrogen 2.664 N/A GLU 95.A N LYS 91.A O no hydrogen 2.969 N/A LEU 96.A N HIS 92.A O no hydrogen 2.913 N/A GLU 97.A N ALA 93.A O no hydrogen 2.840 N/A LEU 99.A N GLU 95.A O no hydrogen 3.216 N/A CYS 100.A N LEU 96.A O no hydrogen 3.076 N/A SER 102.A N LEU 99.A O no hydrogen 3.228 N/A ARG 104.A NH1 LEU 45.A O no hydrogen 2.884 N/A ARG 104.A NH2 LEU 45.A O no hydrogen 2.575 N/A VAL 105.A N SER 102.A O no hydrogen 3.227 N/A ASP 106.A N LEU 1.A O no hydrogen 3.393 N/A THR 109.A N ASP 106.A OD1 no hydrogen 2.935 N/A THR 109.A OG1 LEU 3.A O no hydrogen 3.183 N/A THR 109.A OG1 ASP 106.A OD1 no hydrogen 2.760 N/A LYS 110.A N ASP 106.A O no hydrogen 3.331 N/A LYS 110.A NZ VAL 105.A O no hydrogen 3.456 N/A LEU 111.A N ALA 107.A O no hydrogen 2.970 N/A GLU 112.A N LYS 108.A O no hydrogen 3.165 N/A ALA 113.A N THR 109.A O no hydrogen 3.100 N/A GLN 114.A N LYS 110.A O no hydrogen 3.199 N/A ALA 115.A N LEU 111.A O no hydrogen 2.915 N/A ALA 115.A N GLU 112.A O no hydrogen 3.082 N/A TYR 116.A N GLU 112.A O no hydrogen 2.704 N/A TYR 116.A OH GLU 59.A OE2 no hydrogen 2.348 N/A THR 117.A N ALA 113.A O no hydrogen 2.836 N/A THR 117.A OG1 ALA 93.A O no hydrogen 3.091 N/A THR 117.A OG1 GLU 97.A OE1 no hydrogen 3.194 N/A THR 117.A OG1 ALA 113.A O no hydrogen 2.715 N/A ALA 118.A N GLN 114.A O no hydrogen 3.219 N/A TYR 119.A N ALA 115.A O no hydrogen 3.005 N/A LEU 120.A N TYR 116.A O no hydrogen 2.993 N/A SER 121.A N THR 117.A O no hydrogen 2.952 N/A GLY 122.A N ALA 118.A O no hydrogen 2.705 N/A MET 123.A N TYR 119.A O no hydrogen 2.910 N/A LEU 124.A N LEU 120.A O no hydrogen 2.815 N/A ARG 125.A N SER 121.A O no hydrogen 3.210 N/A ARG 125.A NH1 ALA 133.A O no hydrogen 3.379 N/A PHE 126.A N GLY 122.A O no hydrogen 2.953 N/A GLU 127.A N MET 123.A O no hydrogen 2.967 N/A GLU 127.A N LEU 124.A O no hydrogen 2.891 N/A HIS 128.A N LEU 124.A O no hydrogen 2.891 N/A GLU 130.A N ARG 125.A O no hydrogen 2.763 N/A ALA 134.A N GLU 130.A O no hydrogen 2.772 N/A ILE 135.A N TRP 131.A O no hydrogen 3.096 N/A GLU 136.A N LYS 132.A O no hydrogen 2.944 N/A ALA 137.A N ALA 133.A O no hydrogen 3.179 N/A PHE 138.A N ALA 134.A O no hydrogen 2.878 N/A ASN 139.A N ILE 135.A O no hydrogen 2.915 N/A LYS 140.A N GLU 136.A O no hydrogen 2.857 N/A CYS 141.A N ALA 137.A O no hydrogen 2.894 N/A CYS 141.A SG ALA 115.A O no hydrogen 3.696 N/A LYS 142.A N PHE 138.A O no hydrogen 2.899 N/A THR 143.A N ASN 139.A O no hydrogen 2.604 N/A THR 143.A OG1 ASN 139.A O no hydrogen 3.129 N/A ILE 144.A N LYS 140.A O no hydrogen 3.057 N/A TYR 145.A N CYS 141.A O no hydrogen 3.068 N/A GLU 146.A N LYS 142.A O no hydrogen 3.007 N/A LYS 147.A N THR 143.A O no hydrogen 3.033 N/A LEU 148.A N ILE 144.A O no hydrogen 2.962 N/A ALA 149.A N TYR 145.A O no hydrogen 3.117 N/A SER 150.A N GLU 146.A O no hydrogen 3.246 N/A SER 150.A OG LYS 147.A O no hydrogen 3.124 N/A THR 153.A OG1 GLN 156.A OE1 no hydrogen 2.239 N/A GLN 156.A N THR 153.A OG1 no hydrogen 3.377 N/A ALA 157.A N THR 153.A O no hydrogen 2.945 N/A VAL 158.A N GLU 155.A O no hydrogen 3.327 N/A TYR 160.A OH GLU 112.A OE2 no hydrogen 3.032 N/A ASN 161.A N ALA 157.A O no hydrogen 2.898 N/A GLN 162.A N VAL 158.A O no hydrogen 2.965 N/A ARG 163.A N LEU 159.A O no hydrogen 3.195 N/A ARG 163.A N TYR 160.A O no hydrogen 3.218 N/A ARG 163.A NH1 GLU 166.A OE1 no hydrogen 2.955 N/A VAL 164.A N TYR 160.A O no hydrogen 3.142 N/A GLU 165.A N ASN 161.A O no hydrogen 2.903 N/A GLU 166.A N GLN 162.A O no hydrogen 2.805 N/A ILE 167.A N ARG 163.A O no hydrogen 2.965 N/A SER 168.A OG VAL 164.A O no hydrogen 2.506 N/A ILE 171.A N ILE 167.A O no hydrogen 3.014 N/A ARG 172.A N SER 168.A O no hydrogen 3.027 N/A TYR 173.A N PRO 169.A O no hydrogen 3.084 N/A CYS 174.A N ASN 170.A O no hydrogen 3.351 N/A CYS 174.A SG ASN 170.A O no hydrogen 3.475 N/A ALA 175.A N ILE 171.A O no hydrogen 3.385 N/A TYR 176.A N ARG 172.A O no hydrogen 3.455 N/A ASN 177.A N CYS 174.A O no hydrogen 3.142 N/A ASN 177.A ND2 TYR 173.A O no hydrogen 3.027 N/A ILE 178.A N ALA 175.A O no hydrogen 2.953 N/A