Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3shj_1.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A N MET 107B.A O no hydrogen 2.432 N/A THR 1.A OG1 MET 107B.A O no hydrogen 3.361 N/A ILE 5.A N ASP 56.A OD1 no hydrogen 2.943 N/A THR 7.A N SER 29.A O no hydrogen 2.706 N/A GLY 8.A N GLY 55.A O no hydrogen 2.988 N/A THR 9.A OG1 ASP 188.A OD1 no hydrogen 2.541 N/A SER 10.A N THR 9.A OG1 no hydrogen 2.587 N/A ILE 12.A N ALA 23.A O no hydrogen 3.118 N/A SER 13.A OG LEU 142.A O no hydrogen 2.970 N/A MET 14.A N ILE 21.A O no hydrogen 3.254 N/A LYS 15.A N PRO 140.A O no hydrogen 2.983 N/A TYR 16.A N GLY 19.A O no hydrogen 2.879 N/A TYR 16.A OH ASP 201.A OD2 no hydrogen 3.163 N/A ASP 17.A N THR 168.A O no hydrogen 2.850 N/A GLY 19.A N TYR 16.A O no hydrogen 3.259 N/A VAL 20.A N ILE 200.A O no hydrogen 3.115 N/A ILE 21.A N MET 14.A O no hydrogen 3.033 N/A ILE 22.A N ALA 198.A O no hydrogen 3.006 N/A ALA 23.A N ILE 12.A O no hydrogen 2.859 N/A ALA 24.A N SER 196.A O no hydrogen 3.137 N/A ASN 26.A N ASN 194.A O no hydrogen 2.872 N/A LEU 27.A N ASP 25.A OD2 no hydrogen 3.289 N/A GLY 28.A N PHE 36.A O no hydrogen 2.639 N/A SER 29.A N THR 7.A O no hydrogen 2.837 N/A TYR 30.A N LEU 33.A O no hydrogen 2.847 N/A LEU 33.A N TYR 30.A O no hydrogen 3.173 N/A ARG 35.A N LEU 33.A O no hydrogen 2.679 N/A PHE 36.A N GLY 28.A O no hydrogen 2.935 N/A VAL 39.A N ASN 26.A O no hydrogen 3.222 N/A ARG 41.A NE ASP 25.A O no hydrogen 3.157 N/A ARG 41.A NE ASP 25.A OD2 no hydrogen 3.430 N/A ARG 41.A NH1 THR 9.A O no hydrogen 2.836 N/A ARG 41.A NH1 SER 10.A O no hydrogen 3.443 N/A ARG 41.A NH1 ILE 53.A O no hydrogen 2.995 N/A ARG 41.A NH2 SER 10.A O no hydrogen 2.655 N/A ARG 41.A NH2 ASP 25.A OD2 no hydrogen 2.949 N/A LEU 42.A N GLU 40.A OE1 no hydrogen 3.033 N/A ILE 43.A N VAL 51.A O no hydrogen 2.712 N/A VAL 45.A N THR 49.A O no hydrogen 2.816 N/A VAL 50.A N ALA 117.A O no hydrogen 2.808 N/A VAL 51.A N ILE 43.A O no hydrogen 2.508 N/A GLY 52.A N ILE 115.A O no hydrogen 2.815 N/A ILE 53.A N ARG 41.A O no hydrogen 3.063 N/A SER 54.A N ALA 113.A O no hydrogen 2.988 N/A SER 54.A OG ALA 113.A O no hydrogen 3.330 N/A SER 54.A OG THR 144.A OG1 no hydrogen 3.251 N/A GLY 55.A N GLY 8.A O no hydrogen 3.148 N/A ASP 56.A N TRP 111.A O no hydrogen 2.686 N/A ILE 57.A N VAL 6.A O no hydrogen 2.600 N/A SER 58.A OG ASP 56.A OD2 no hydrogen 2.494 N/A ASP 59.A N ASP 56.A OD2 no hydrogen 2.960 N/A MET 60.A N ASP 56.A O no hydrogen 2.828 N/A GLN 61.A N ILE 57.A O no hydrogen 2.834 N/A HIS 62.A N SER 58.A O no hydrogen 3.195 N/A ILE 63.A N ASP 59.A O no hydrogen 2.971 N/A GLU 64.A N MET 60.A O no hydrogen 2.931 N/A ARG 65.A N GLN 61.A O no hydrogen 3.119 N/A LEU 66.A N HIS 62.A O no hydrogen 2.981 N/A LEU 67.A N ILE 63.A O no hydrogen 3.060 N/A LYS 68.A N GLU 64.A O no hydrogen 3.000 N/A ASP 69.A N ARG 65.A O no hydrogen 3.210 N/A LEU 70.A N LEU 66.A O no hydrogen 3.023 N/A VAL 71.A N LEU 67.A O no hydrogen 2.974 N/A THR 72.A N LYS 68.A O no hydrogen 3.086 N/A THR 72.A OG1 LYS 68.A O no hydrogen 3.021 N/A GLU 73.A N ASP 69.A O no hydrogen 2.743 N/A ASN 74.A N LEU 70.A O no hydrogen 2.871 N/A ASN 74.A ND2 GLU 85C.A O no hydrogen 2.912 N/A ALA 75.A N VAL 71.A O no hydrogen 3.167 N/A ALA 75.A N THR 72.A O no hydrogen 3.103 N/A TYR 76.A N GLU 73.A O no hydrogen 3.069 N/A ASN 78.A N ALA 75.A O no hydrogen 3.195 N/A ASN 78.A ND2 ASN 74.A O no hydrogen 2.868 N/A ASN 78.A ND2 GLU 85C.A O no hydrogen 2.882 N/A ALA 83.A N LEU 80C.A O no hydrogen 3.017 N/A SER 90.A N GLN 120.A OE1 no hydrogen 3.166 N/A ILE 92.A N GLU 88.A O no hydrogen 3.144 N/A PHE 93.A N PRO 89.A O no hydrogen 2.928 N/A GLU 94.A N SER 90.A O no hydrogen 2.891 N/A TYR 95.A N TYR 91.A O no hydrogen 3.022 N/A LEU 96.A N ILE 92.A O no hydrogen 3.016 N/A ALA 97.A N PHE 93.A O no hydrogen 2.693 N/A THR 98.A N GLU 94.A O no hydrogen 2.976 N/A THR 98.A OG1 GLU 94.A O no hydrogen 2.758 N/A VAL 99.A N TYR 95.A O no hydrogen 2.939 N/A MET 100.A N LEU 96.A O no hydrogen 2.697 N/A TYR 101.A N ALA 97.A O no hydrogen 3.117 N/A GLN 102.A N THR 98.A O no hydrogen 3.112 N/A ARG 103.A N VAL 99.A O no hydrogen 2.953 N/A ARG 103.A NE ASN 108.A O no hydrogen 2.686 N/A ARG 103.A NH2 ASN 108.A O no hydrogen 3.400 N/A ARG 103.A NH2 ASN 108.A OD1 no hydrogen 3.179 N/A ARG 104.A N MET 100.A O no hydrogen 3.070 N/A ARG 104.A NE SER 105.A OG no hydrogen 3.149 N/A SER 105.A N TYR 101.A O no hydrogen 2.935 N/A SER 105.A OG TYR 101.A O no hydrogen 3.063 N/A ASN 108.A N ARG 103.A O no hydrogen 2.833 N/A TRP 111.A N ASP 59.A OD1 no hydrogen 2.743 N/A ASN 112.A N LEU 110.A O no hydrogen 2.557 N/A ASN 112.A ND2 SER 54.A O no hydrogen 3.022 N/A ASN 112.A ND2 ASP 56.A O no hydrogen 3.032 N/A ALA 113.A N SER 54.A O no hydrogen 3.087 N/A ILE 114.A N VAL 130.A O no hydrogen 2.665 N/A ILE 115.A N GLY 52.A O no hydrogen 2.898 N/A VAL 116.A N ARG 128.A O no hydrogen 3.006 N/A ALA 117.A N VAL 50.A O no hydrogen 2.972 N/A GLY 118.A N PHE 126.A O no hydrogen 2.855 N/A VAL 119.A N ASN 48.A O no hydrogen 2.913 N/A GLN 120.A N ASP 124.A O no hydrogen 2.612 N/A GLN 120.A NE2 SER 90.A OG no hydrogen 2.827 N/A GLY 123.A N GLN 120.A O no hydrogen 2.806 N/A ASP 124.A N ASN 122B.A OD1 no hydrogen 2.943 N/A GLN 125.A N GLN 125.A OE1 no hydrogen 2.945 N/A GLN 125.A NE2 TYR 16.A O no hydrogen 2.796 N/A PHE 126.A N GLY 118.A O no hydrogen 2.601 N/A ARG 128.A N VAL 116.A O no hydrogen 3.216 N/A ARG 128.A NH1 SER 138.A OG no hydrogen 3.145 N/A TYR 129.A N TYR 137.A O no hydrogen 2.955 N/A VAL 130.A N ILE 114.A O no hydrogen 2.909 N/A ASN 131.A N VAL 135.A O no hydrogen 3.273 N/A ASN 131.A ND2 TYR 129.A OH no hydrogen 3.069 N/A LEU 133.A N ASN 131.A OD1 no hydrogen 2.703 N/A GLY 134.A N ASN 131.A O no hydrogen 2.821 N/A TYR 137.A N TYR 129.A O no hydrogen 3.208 N/A SER 138.A OG LEU 127.A O no hydrogen 2.784 N/A SER 139.A OG THR 141.A O no hydrogen 3.278 N/A THR 141.A OG1 ASN 152.A OD1 no hydrogen 2.812 N/A LEU 142.A N SER 13.A O no hydrogen 2.843 N/A THR 144.A N VAL 11.A O no hydrogen 2.946 N/A THR 144.A OG1 SER 54.A OG no hydrogen 3.251 N/A GLY 147.A N SER 10.A OG no hydrogen 2.859 N/A ALA 148.A N GLY 145.A O no hydrogen 2.945 N/A HIS 149.A N PHE 146.A O no hydrogen 2.768 N/A MET 150.A N PHE 146.A O no hydrogen 3.154 N/A ASN 152.A N GLY 147.A O no hydrogen 2.897 N/A ASN 152.A ND2 ALA 148.A O no hydrogen 3.244 N/A LEU 155.A N ALA 151.A O no hydrogen 3.030 N/A ARG 156.A N ASN 152.A O no hydrogen 2.741 N/A LYS 157.A N LEU 154.A O no hydrogen 2.992 N/A VAL 158.A N LEU 155.A O no hydrogen 3.047 N/A LYS 167.A N ASP 164F.A O no hydrogen 3.067 N/A THR 168.A N ILE 165G.A O no hydrogen 2.910 N/A THR 168.A OG1 ASP 164F.A O no hydrogen 2.866 N/A VAL 172.A N THR 169.A OG1 no hydrogen 3.215 N/A ALA 173.A N THR 169.A O no hydrogen 2.788 N/A GLU 174.A N VAL 170.A O no hydrogen 2.833 N/A GLU 175.A N GLN 171.A O no hydrogen 3.055 N/A ALA 176.A N VAL 172.A O no hydrogen 2.927 N/A ILE 177.A N ALA 173.A O no hydrogen 2.974 N/A VAL 178.A N GLU 174.A O no hydrogen 2.958 N/A ASN 179.A N GLU 175.A O no hydrogen 2.927 N/A ALA 180.A N ALA 176.A O no hydrogen 3.105 N/A MET 181.A N ILE 177.A O no hydrogen 2.936 N/A ARG 182.A N VAL 178.A O no hydrogen 3.234 N/A ARG 182.A NH2 GLU 215.A O no hydrogen 2.883 N/A VAL 183.A N ASN 179.A O no hydrogen 2.866 N/A LEU 184.A N ALA 180.A O no hydrogen 2.901 N/A TYR 185.A N MET 181.A O no hydrogen 3.026 N/A TYR 186.A N ARG 182.A O no hydrogen 3.050 N/A TYR 186.A N VAL 183.A O no hydrogen 2.830 N/A ARG 187.A N VAL 183.A O no hydrogen 3.063 N/A ASP 188.A N LEU 184.A O no hydrogen 2.812 N/A ARG 190.A N ASP 188.A OD2 no hydrogen 2.798 N/A ARG 190.A NE GLY 31.A O no hydrogen 3.224 N/A ARG 190.A NH1 ALA 189.A O no hydrogen 3.400 N/A SER 191.A N ASP 188.A O no hydrogen 3.200 N/A SER 191.A OG LEU 184.A O no hydrogen 3.164 N/A SER 191.A OG ASP 188.A O no hydrogen 2.677 N/A SER 192.A N ASP 25.A OD1 no hydrogen 2.994 N/A ARG 193.A NE VAL 214.A O no hydrogen 2.874 N/A ARG 193.A NH2 VAL 214.A O no hydrogen 3.270 N/A ARG 193.A NH2 GLU 215.A OE2 no hydrogen 3.303 N/A ASN 194.A N SER 192.A OG no hydrogen 3.232 N/A ASN 194.A ND2 GLN 213.A OE1 no hydrogen 3.616 N/A PHE 195.A N LEU 212.A O no hydrogen 3.364 N/A SER 196.A N ALA 24.A O no hydrogen 3.065 N/A SER 196.A OG ASN 26.A OD1 no hydrogen 2.974 N/A SER 196.A OG GLU 40.A OE1 no hydrogen 3.335 N/A SER 196.A OG GLU 40.A OE2 no hydrogen 2.748 N/A LEU 197.A N LYS 209.A O no hydrogen 2.963 N/A ALA 198.A N ILE 22.A O no hydrogen 2.957 N/A ILE 199.A N THR 207.A O no hydrogen 2.881 N/A ILE 200.A N VAL 20.A O no hydrogen 2.872 N/A ASP 201.A N GLY 205.A O no hydrogen 2.740 N/A LYS 202.A N ASN 18.A O no hydrogen 2.818 N/A ASN 203.A N ASP 201.A OD1 no hydrogen 2.710 N/A ASN 203.A ND2 ASN 18.A OD1 no hydrogen 3.284 N/A GLY 205.A N ASP 201.A O no hydrogen 2.753 N/A THR 207.A N ILE 199.A O no hydrogen 2.897 N/A LYS 209.A N LEU 197.A O no hydrogen 2.743 N/A LYS 209.A NZ GLU 174.A OE1 no hydrogen 2.561 N/A LYS 209.A NZ GLU 174.A OE2 no hydrogen 3.333 N/A LYS 210.A NZ GLU 40.A OE2 no hydrogen 2.531 N/A LEU 212.A N PHE 195.A O no hydrogen 3.096 N/A VAL 214.A N ARG 193.A O no hydrogen 3.113 N/A LYS 218.A N TYR 186.A OH no hydrogen 2.887 N/A ALA 222.A N TRP 219.A O no hydrogen 2.859 N/A LYS 223.A N ASP 220.A O no hydrogen 2.990 N/A LYS 223.A NZ ASP 220.A OD1 no hydrogen 2.572 N/A LYS 223.A NZ ASP 220.A OD2 no hydrogen 3.542 N/A LYS 223.A NZ ASP 224.A OD1 no hydrogen 3.406 N/A ASP 224.A N PHE 221.A O no hydrogen 3.207 N/A ILE 225.A N ALA 222.A O no hydrogen 3.277 N/A LYS 226.A NZ ASP 224.A O no hydrogen 3.027 N/A GLN 231.A NE2 ILE 233.A O no hydrogen 3.063 N/A ALA 81A.A N ASN 78.A O no hydrogen 3.140 N/A LYS 106A.A N ARG 103.A O no hydrogen 3.096 N/A SER 121A.A N GLU 88.A OE2 no hydrogen 2.933 N/A SER 121A.A OG GLU 88.A OE2 no hydrogen 3.254 N/A VAL 159A.A N LEU 155.A O no hydrogen 3.182 N/A THR 204A.A N ASP 201.A OD1 no hydrogen 2.918 N/A GLU 84B.A N GLU 84B.A OE2 no hydrogen 2.937 N/A MET 107B.A N ARG 104.A O no hydrogen 2.852 N/A ASN 122B.A ND2 ASP 124.A OD1 no hydrogen 3.314 N/A ASP 160B.A N ASP 164F.A OD1 no hydrogen 2.803 N/A GLU 85C.A N LEU 80C.A O no hydrogen 2.882 N/A ALA 86D.A N ALA 83.A O no hydrogen 3.167 N/A ASP 164F.A N ARG 161C.A O no hydrogen 3.207 N/A ILE 165G.A N GLU 162D.A O no hydrogen 2.771 N/A