Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3s6i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A N GLU 4.A OE1 no hydrogen 3.147 N/A THR 1.A OG1 GLU 4.A OE1 no hydrogen 3.158 N/A GLU 4.A N THR 1.A OG1 no hydrogen 3.417 N/A ILE 5.A N THR 1.A O no hydrogen 3.421 N/A HIS 6.A N LYS 2.A O no hydrogen 2.832 N/A HIS 6.A NE2 ILE 183.A O no hydrogen 2.998 N/A LEU 7.A N ALA 3.A O no hydrogen 2.885 N/A SER 8.A N GLU 4.A O no hydrogen 2.774 N/A SER 8.A OG GLU 4.A O no hydrogen 3.064 N/A GLY 9.A N ILE 5.A O no hydrogen 3.338 N/A GLY 9.A N HIS 6.A O no hydrogen 3.251 N/A LEU 10.A N LEU 7.A O no hydrogen 3.339 N/A ASN 13.A ND2 ASP 11.A OD1 no hydrogen 3.095 N/A LYS 15.A N ASP 11.A O no hydrogen 3.156 N/A ARG 16.A N GLU 12.A O no hydrogen 3.053 N/A ARG 16.A NH1 TYR 164.A OH no hydrogen 2.936 N/A ARG 16.A NH2 ASP 203.A OD1 no hydrogen 2.620 N/A LEU 17.A N ASN 13.A O no hydrogen 2.842 N/A VAL 18.A N TRP 14.A O no hydrogen 2.774 N/A LYS 19.A N LYS 15.A O no hydrogen 3.232 N/A LEU 20.A N ARG 16.A O no hydrogen 2.933 N/A VAL 21.A N LEU 17.A O no hydrogen 2.923 N/A GLY 22.A N VAL 18.A O no hydrogen 2.879 N/A ASN 27.A ND2 SER 29.A OG no hydrogen 2.882 N/A ARG 28.A NH2 GLU 31.A OE2 no hydrogen 2.607 N/A GLU 31.A N ARG 28.A O no hydrogen 3.232 N/A LYS 33.A N MET 30.A O no hydrogen 3.144 N/A LYS 33.A NZ GLU 37.A OE1 no hydrogen 3.398 N/A TYR 36.A OH PRO 70.A O no hydrogen 2.819 N/A GLU 37.A N GLU 34.A O no hydrogen 2.952 N/A GLU 38.A N GLU 34.A O no hydrogen 3.371 N/A LEU 39.A N PRO 35.A O no hydrogen 2.775 N/A ILE 40.A N TYR 36.A O no hydrogen 2.922 N/A ARG 41.A N GLU 37.A O no hydrogen 3.078 N/A ALA 42.A N GLU 38.A O no hydrogen 2.848 N/A VAL 43.A N LEU 39.A O no hydrogen 2.915 N/A ALA 44.A N ILE 40.A O no hydrogen 2.825 N/A SER 45.A N ARG 41.A O no hydrogen 2.913 N/A SER 45.A N ALA 42.A O no hydrogen 2.978 N/A SER 45.A OG ARG 41.A O no hydrogen 2.746 N/A GLN 46.A N VAL 43.A O no hydrogen 3.180 N/A GLN 46.A NE2 GLY 131.A O no hydrogen 3.110 N/A GLN 46.A NE2 THR 136.A OG1 no hydrogen 2.634 N/A LEU 48.A N GLN 46.A O no hydrogen 2.834 N/A ALA 52.A N HIS 49.A ND1 no hydrogen 3.389 N/A ALA 53.A N HIS 49.A O no hydrogen 3.066 N/A ASN 54.A N SER 50.A O no hydrogen 2.897 N/A ALA 55.A N LYS 51.A O no hydrogen 3.076 N/A ILE 56.A N ALA 52.A O no hydrogen 3.067 N/A PHE 57.A N ALA 53.A O no hydrogen 3.041 N/A ASN 58.A N ASN 54.A O no hydrogen 2.761 N/A ARG 59.A N ALA 55.A O no hydrogen 3.147 N/A ARG 59.A NE CYS 86.A O no hydrogen 2.904 N/A ARG 59.A NH2 CYS 86.A O no hydrogen 2.889 N/A PHE 60.A N ILE 56.A O no hydrogen 3.235 N/A LYS 61.A N PHE 57.A O no hydrogen 2.925 N/A SER 62.A N ARG 59.A O no hydrogen 3.320 N/A SER 62.A OG ASN 58.A O no hydrogen 2.694 N/A ILE 63.A N PHE 60.A O no hydrogen 3.095 N/A SER 64.A OG GLN 68.A O no hydrogen 3.128 N/A SER 64.A OG GLU 74.A OE2 no hydrogen 2.890 N/A GLN 68.A N ASN 65.A O no hydrogen 2.815 N/A THR 71.A N GLU 74.A OE2 no hydrogen 3.121 N/A GLU 73.A N GLU 73.A OE1 no hydrogen 2.671 N/A GLU 74.A N THR 71.A OG1 no hydrogen 3.165 N/A ILE 75.A N THR 71.A O no hydrogen 3.001 N/A ARG 76.A N PRO 72.A O no hydrogen 2.957 N/A ARG 76.A NH2 ASP 77.A OD1 no hydrogen 3.359 N/A ARG 76.A NH2 ASP 77.A OD2 no hydrogen 3.365 N/A ASP 77.A N GLU 73.A O no hydrogen 3.066 N/A ASP 77.A N GLU 74.A O no hydrogen 3.079 N/A MET 78.A N ILE 75.A O no hydrogen 3.108 N/A ILE 82.A N ASP 79.A O no hydrogen 3.353 N/A MET 83.A N PHE 80.A O no hydrogen 3.089 N/A ARG 84.A N PHE 80.A O no hydrogen 3.041 N/A ARG 84.A NH1 ARG 84.A O no hydrogen 2.867 N/A ALA 85.A N GLU 81.A O no hydrogen 3.055 N/A CYS 86.A SG ILE 82.A O no hydrogen 3.175 N/A GLY 87.A N ARG 84.A O no hydrogen 3.201 N/A PHE 88.A N MET 83.A O no hydrogen 3.444 N/A LYS 92.A N SER 89.A OG no hydrogen 3.021 N/A LYS 92.A NZ VAL 43.A O no hydrogen 3.039 N/A LYS 92.A NZ GLN 46.A O no hydrogen 3.154 N/A ILE 93.A N SER 89.A O no hydrogen 2.946 N/A ASP 94.A N ALA 90.A O no hydrogen 3.114 N/A SER 95.A N ARG 91.A O no hydrogen 3.026 N/A SER 95.A OG ARG 91.A O no hydrogen 3.321 N/A SER 95.A OG LYS 130.A O no hydrogen 2.991 N/A LEU 96.A N LYS 92.A O no hydrogen 2.943 N/A LYS 97.A N ILE 93.A O no hydrogen 2.972 N/A SER 98.A N ASP 94.A O no hydrogen 2.822 N/A SER 98.A OG ASP 94.A O no hydrogen 3.132 N/A ILE 99.A N SER 95.A O no hydrogen 2.732 N/A ALA 100.A N LEU 96.A O no hydrogen 2.977 N/A GLU 101.A N LYS 97.A O no hydrogen 2.973 N/A ALA 102.A N SER 98.A O no hydrogen 2.746 N/A THR 103.A N ILE 99.A O no hydrogen 2.851 N/A THR 103.A OG1 ILE 99.A O no hydrogen 2.692 N/A ILE 104.A N ALA 100.A O no hydrogen 3.036 N/A SER 105.A N GLU 101.A O no hydrogen 2.933 N/A SER 105.A OG GLU 101.A O no hydrogen 3.504 N/A SER 105.A OG ALA 102.A O no hydrogen 3.258 N/A GLY 106.A N ALA 102.A O no hydrogen 2.942 N/A LEU 107.A N SER 105.A OG no hydrogen 3.346 N/A ILE 108.A N ALA 102.A O no hydrogen 2.948 N/A THR 110.A N GLU 113.A OE1 no hydrogen 3.018 N/A LYS 111.A N GLU 34.A OE1 no hydrogen 3.231 N/A LYS 111.A N GLU 34.A OE2 no hydrogen 3.417 N/A LYS 111.A NZ GLU 31.A O no hydrogen 2.690 N/A LYS 111.A NZ SER 144.A O no hydrogen 3.381 N/A GLU 113.A N THR 110.A OG1 no hydrogen 3.192 N/A ALA 114.A N THR 110.A O no hydrogen 2.869 N/A GLU 115.A N LYS 111.A O no hydrogen 3.111 N/A ARG 116.A N GLU 113.A O no hydrogen 3.009 N/A LEU 117.A N ALA 114.A O no hydrogen 3.103 N/A GLU 120.A N GLU 120.A OE1 no hydrogen 2.892 N/A GLU 121.A N SER 118.A OG no hydrogen 3.097 N/A LEU 122.A N SER 118.A O no hydrogen 3.067 N/A ILE 123.A N ASN 119.A O no hydrogen 3.030 N/A GLU 124.A N GLU 120.A O no hydrogen 3.060 N/A ARG 125.A N GLU 121.A O no hydrogen 2.943 N/A ARG 125.A NE LEU 107.A O no hydrogen 2.949 N/A ARG 125.A NH1 GLY 106.A O no hydrogen 3.099 N/A ARG 125.A NH1 LEU 107.A O no hydrogen 3.453 N/A LEU 126.A N LEU 122.A O no hydrogen 2.792 N/A THR 127.A N ILE 123.A O no hydrogen 2.979 N/A THR 127.A OG1 ILE 123.A O no hydrogen 2.772 N/A THR 127.A OG1 GLU 124.A O no hydrogen 3.496 N/A GLN 128.A N ARG 125.A O no hydrogen 3.351 N/A ILE 129.A N LEU 126.A O no hydrogen 3.123 N/A ILE 132.A N ILE 129.A O no hydrogen 3.163 N/A ARG 134.A NE GLU 138.A OE2 no hydrogen 3.062 N/A TRP 135.A NE1 ASP 155.A OD2 no hydrogen 2.904 N/A VAL 137.A N GLY 133.A O no hydrogen 3.299 N/A GLU 138.A N ARG 134.A O no hydrogen 2.859 N/A MET 139.A N TRP 135.A O no hydrogen 2.911 N/A LEU 140.A N THR 136.A O no hydrogen 3.363 N/A LEU 141.A N VAL 137.A O no hydrogen 2.809 N/A ILE 142.A N GLU 138.A O no hydrogen 2.886 N/A PHE 143.A N MET 139.A O no hydrogen 2.726 N/A SER 144.A N LEU 140.A O no hydrogen 2.973 N/A LEU 145.A N LEU 140.A O no hydrogen 3.151 N/A ARG 147.A N LEU 141.A O no hydrogen 3.113 N/A ARG 147.A NH1 LEU 117.A O no hydrogen 2.917 N/A ARG 147.A NH2 LEU 117.A O no hydrogen 2.870 N/A VAL 150.A N THR 189.A OG1 no hydrogen 2.919 N/A ASP 155.A N PRO 152.A O no hydrogen 3.060 N/A ILE 158.A N ASP 155.A OD1 no hydrogen 2.799 N/A ARG 159.A N ASP 155.A O no hydrogen 3.047 N/A ARG 159.A NE PRO 172.A O no hydrogen 2.708 N/A ASN 160.A N LEU 156.A O no hydrogen 3.042 N/A GLY 161.A N SER 157.A O no hydrogen 2.947 N/A TYR 162.A N ILE 158.A O no hydrogen 3.151 N/A ARG 163.A N ARG 159.A O no hydrogen 2.904 N/A ARG 163.A NH2 LYS 206.A O no hydrogen 3.426 N/A TYR 164.A N ASN 160.A O no hydrogen 3.043 N/A TYR 164.A OH ASP 203.A OD1 no hydrogen 2.905 N/A LEU 165.A N GLY 161.A O no hydrogen 2.743 N/A HIS 166.A N TYR 162.A O no hydrogen 2.827 N/A HIS 166.A ND1 TYR 176.A OH no hydrogen 2.816 N/A ARG 167.A N TYR 164.A O no hydrogen 2.898 N/A LEU 168.A N ARG 163.A O no hydrogen 2.830 N/A TYR 176.A N THR 173.A OG1 no hydrogen 2.983 N/A TYR 176.A OH HIS 166.A ND1 no hydrogen 2.816 N/A VAL 177.A N THR 173.A O no hydrogen 3.056 N/A LEU 178.A N LYS 174.A O no hydrogen 2.830 N/A LYS 179.A N MET 175.A O no hydrogen 2.824 N/A HIS 180.A N TYR 176.A O no hydrogen 2.951 N/A HIS 180.A ND1 TYR 176.A O no hydrogen 3.162 N/A SER 181.A N VAL 177.A O no hydrogen 3.082 N/A SER 181.A OG VAL 177.A O no hydrogen 2.607 N/A CYS 184.A N SER 181.A O no hydrogen 2.764 N/A ALA 185.A N GLU 182.A O no hydrogen 3.122 N/A PHE 187.A N CYS 184.A O no hydrogen 2.803 N/A ARG 188.A N ASP 149.A OD1 no hydrogen 3.099 N/A ARG 188.A NE ASP 149.A OD1 no hydrogen 2.879 N/A ARG 188.A NE ASP 149.A OD2 no hydrogen 3.124 N/A ARG 188.A NH1 ASP 149.A OD2 no hydrogen 3.057 N/A THR 189.A N ASP 148.A O no hydrogen 3.115 N/A THR 189.A OG1 ARG 147.A O no hydrogen 2.756 N/A THR 189.A OG1 VAL 150.A O no hydrogen 3.505 N/A ALA 191.A N PHE 187.A O no hydrogen 3.097 N/A ALA 192.A N ARG 188.A O no hydrogen 3.006 N/A TRP 193.A N THR 189.A O no hydrogen 3.164 N/A TYR 194.A N ALA 190.A O no hydrogen 3.042 N/A TYR 194.A OH GLY 22.A O no hydrogen 2.615 N/A LEU 195.A N ALA 191.A O no hydrogen 2.894 N/A TRP 196.A N ALA 192.A O no hydrogen 2.849 N/A TRP 196.A NE1 ASP 155.A OD1 no hydrogen 3.038 N/A LYS 197.A N TYR 194.A O no hydrogen 3.034 N/A THR 198.A N LEU 195.A O no hydrogen 3.132 N/A THR 198.A OG1 LEU 195.A O no hydrogen 2.570 N/A LYS 200.A N LYS 197.A O no hydrogen 3.123 N/A LEU 201.A N THR 198.A O no hydrogen 2.958 N/A TYR 204.A N LEU 201.A O no hydrogen 2.725 N/A