Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ith_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 1.A ND2 VAL 2.A O no hydrogen 3.410 N/A MET 5.A N VAL 53.A O no hydrogen 2.877 N/A LYS 6.A N ASP 9.A OD1 no hydrogen 3.207 N/A ASP 9.A N LYS 6.A O no hydrogen 3.367 N/A PHE 10.A N SER 7.A O no hydrogen 3.305 N/A LEU 11.A N PHE 16.A O no hydrogen 3.035 N/A SER 13.A N MET 25.A O no hydrogen 2.856 N/A ALA 15.A N MET 23.A O no hydrogen 2.875 N/A HIS 17.A N GLY 21.A O no hydrogen 2.891 N/A ARG 18.A N ASP 9.A O no hydrogen 2.809 N/A THR 19.A N HIS 17.A ND1 no hydrogen 3.051 N/A GLN 20.A N HIS 17.A ND1 no hydrogen 3.056 N/A MET 23.A N ALA 15.A O no hydrogen 2.921 N/A ILE 24.A N MET 64.A O no hydrogen 2.902 N/A MET 25.A N SER 13.A O no hydrogen 2.871 N/A LYS 26.A N LEU 62.A O no hydrogen 2.880 N/A LYS 26.A NZ LEU 129.A O no hydrogen 3.003 N/A THR 27.A OG1 SER 61.A OG no hydrogen 3.050 N/A VAL 28.A N TYR 60.A O no hydrogen 2.386 N/A ASN 29.A ND2 TYR 60.A OH no hydrogen 2.951 N/A LEU 33.A N ASN 29.A O no hydrogen 3.122 N/A GLU 34.A N GLU 30.A O no hydrogen 2.907 N/A GLU 35.A N ALA 31.A O no hydrogen 2.915 N/A ALA 36.A N LEU 32.A O no hydrogen 2.906 N/A LYS 37.A N LEU 33.A O no hydrogen 2.890 N/A MET 38.A N GLU 34.A O no hydrogen 2.943 N/A MET 39.A N GLU 35.A O no hydrogen 2.935 N/A ASN 40.A N ALA 36.A O no hydrogen 2.900 N/A ASN 40.A N LYS 37.A O no hydrogen 3.177 N/A ARG 41.A N MET 38.A O no hydrogen 3.374 N/A LEU 42.A N MET 39.A O no hydrogen 3.168 N/A ARG 43.A N TYR 100.A OH no hydrogen 2.807 N/A ARG 46.A N HIS 44.A ND1 no hydrogen 3.288 N/A VAL 47.A N HIS 44.A O no hydrogen 3.001 N/A VAL 48.A N ILE 126.A O no hydrogen 2.849 N/A LYS 49.A N GLU 65.A OE2 no hydrogen 2.831 N/A LYS 49.A NZ ASN 40.A O no hydrogen 3.175 N/A LYS 49.A NZ LEU 50.A O no hydrogen 3.296 N/A LEU 51.A N VAL 63.A O no hydrogen 2.570 N/A GLY 52.A N VAL 63.A O no hydrogen 2.991 N/A VAL 53.A N ILE 3.A O no hydrogen 3.129 N/A ILE 54.A N SER 61.A O no hydrogen 2.902 N/A GLU 56.A N LYS 59.A O no hydrogen 3.081 N/A LYS 59.A N GLU 56.A O no hydrogen 2.708 N/A SER 61.A N ILE 54.A O no hydrogen 2.832 N/A SER 61.A OG THR 27.A OG1 no hydrogen 3.050 N/A LEU 62.A N LYS 26.A O no hydrogen 2.935 N/A VAL 63.A N GLY 52.A O no hydrogen 2.849 N/A MET 64.A N ILE 24.A O no hydrogen 2.852 N/A GLU 65.A N LYS 49.A O no hydrogen 3.273 N/A LYS 69.A N VAL 118.A O no hydrogen 2.876 N/A GLY 70.A N MET 67.A O no hydrogen 3.441 N/A LEU 72.A N PRO 113.A O no hydrogen 3.243 N/A HIS 74.A N ASN 71.A OD1 no hydrogen 3.013 N/A VAL 75.A N ASN 71.A O no hydrogen 3.350 N/A LEU 76.A N LEU 72.A O no hydrogen 2.913 N/A LYS 77.A N MET 73.A O no hydrogen 3.066 N/A ALA 78.A N VAL 75.A O no hydrogen 3.331 N/A LYS 87.A N PRO 83.A O no hydrogen 3.020 N/A LYS 87.A NZ ILE 174.A O no hydrogen 3.123 N/A LYS 87.A NZ ASN 177.A OD1 no hydrogen 2.883 N/A LYS 87.A NZ GLU 207.A OE1 no hydrogen 3.026 N/A LYS 87.A NZ GLU 207.A OE2 no hydrogen 3.555 N/A GLY 88.A N LEU 84.A O no hydrogen 2.969 N/A ARG 89.A N SER 85.A O no hydrogen 2.993 N/A ARG 89.A NH1 ASP 121.A O no hydrogen 3.370 N/A ILE 90.A N VAL 86.A O no hydrogen 2.916 N/A ILE 91.A N LYS 87.A O no hydrogen 2.947 N/A LEU 92.A N GLY 88.A O no hydrogen 2.960 N/A GLU 93.A N ARG 89.A O no hydrogen 2.919 N/A ILE 94.A N ILE 90.A O no hydrogen 2.915 N/A ILE 95.A N ILE 91.A O no hydrogen 2.926 N/A GLU 96.A N LEU 92.A O no hydrogen 2.926 N/A GLY 97.A N GLU 93.A O no hydrogen 2.919 N/A MET 98.A N ILE 94.A O no hydrogen 2.916 N/A ALA 99.A N ILE 95.A O no hydrogen 2.911 N/A TYR 100.A N GLU 96.A O no hydrogen 2.929 N/A LEU 101.A N GLY 97.A O no hydrogen 2.953 N/A HIS 102.A N MET 98.A O no hydrogen 2.916 N/A HIS 102.A NE2 ASP 163.A OD2 no hydrogen 2.810 N/A GLY 103.A N ALA 99.A O no hydrogen 2.889 N/A LYS 104.A N TYR 100.A O no hydrogen 2.985 N/A LYS 104.A N LEU 101.A O no hydrogen 2.941 N/A GLY 105.A N HIS 102.A O no hydrogen 2.883 N/A VAL 106.A N LEU 101.A O no hydrogen 2.897 N/A HIS 108.A N ASP 163.A OD2 no hydrogen 2.724 N/A HIS 108.A NE2 ALA 127.A O no hydrogen 2.680 N/A LYS 109.A N ASP 163.A OD1 no hydrogen 2.931 N/A ASP 110.A N HIS 108.A ND1 no hydrogen 2.922 N/A LYS 112.A NZ ASP 110.A OD1 no hydrogen 3.185 N/A ASN 115.A N LYS 112.A O no hydrogen 2.846 N/A ASN 115.A ND2 ASP 110.A O no hydrogen 2.924 N/A ILE 116.A N PRO 113.A O no hydrogen 3.072 N/A LEU 117.A N LYS 125.A O no hydrogen 2.877 N/A VAL 118.A N GLY 70.A O no hydrogen 2.971 N/A ASP 119.A N HIS 123.A O no hydrogen 2.803 N/A ASN 120.A ND2 ASN 120.A O no hydrogen 3.162 N/A ASP 121.A N ASP 119.A OD2 no hydrogen 2.964 N/A PHE 122.A N ASP 119.A O no hydrogen 2.953 N/A HIS 123.A N ASP 119.A OD2 no hydrogen 3.024 N/A HIS 123.A ND1 GLU 93.A OE2 no hydrogen 2.635 N/A ILE 124.A N GLU 93.A OE1 no hydrogen 2.951 N/A LYS 125.A N LEU 117.A O no hydrogen 2.877 N/A LYS 125.A NZ SER 45.A O no hydrogen 2.929 N/A ILE 126.A N ARG 46.A O no hydrogen 2.809 N/A ALA 127.A N ASN 115.A O no hydrogen 2.765 N/A LEU 129.A N ASN 115.A OD1 no hydrogen 2.959 N/A LEU 131.A N ASP 128.A O no hydrogen 3.010 N/A ALA 132.A N ASP 128.A OD1 no hydrogen 2.883 N/A SER 133.A N ASP 128.A OD2 no hydrogen 2.796 N/A SER 133.A OG ASP 128.A OD2 no hydrogen 2.791 N/A PHE 134.A N LEU 131.A O no hydrogen 3.063 N/A LYS 135.A N GLU 35.A OE2 no hydrogen 2.699 N/A MET 136.A N GLU 35.A OE2 no hydrogen 3.294 N/A TRP 137.A N GLU 35.A OE1 no hydrogen 2.662 N/A TRP 137.A NE1 LEU 32.A O no hydrogen 2.829 N/A SER 138.A OG PHE 134.A O no hydrogen 3.116 N/A SER 138.A OG LYS 135.A O no hydrogen 3.217 N/A TYR 145.A OH GLU 179.A OE1 no hydrogen 2.294 N/A MET 146.A N LEU 143.A O no hydrogen 3.165 N/A GLU 149.A N GLU 149.A OE2 no hydrogen 2.639 N/A HIS 150.A N ALA 147.A O no hydrogen 2.948 N/A HIS 150.A NE2 SER 162.A OG no hydrogen 2.631 N/A LEU 151.A N ALA 147.A O no hydrogen 3.352 N/A ASP 153.A N HIS 150.A O no hydrogen 2.991 N/A ASN 155.A N ASP 153.A OD2 no hydrogen 3.207 N/A ALA 156.A N ASP 153.A OD2 no hydrogen 3.213 N/A THR 159.A N SER 162.A OG no hydrogen 2.972 N/A LYS 161.A N THR 159.A OG1 no hydrogen 3.111 N/A LYS 161.A NZ PRO 225.A O no hydrogen 3.388 N/A LYS 161.A NZ ARG 228.A O no hydrogen 2.404 N/A SER 162.A N THR 159.A O no hydrogen 3.103 N/A SER 162.A OG HIS 150.A NE2 no hydrogen 2.631 N/A SER 162.A OG THR 159.A O no hydrogen 3.216 N/A VAL 164.A N GLU 160.A O no hydrogen 2.993 N/A TYR 165.A N LYS 161.A O no hydrogen 2.957 N/A SER 166.A N SER 162.A O no hydrogen 3.083 N/A SER 166.A OG TYR 145.A O no hydrogen 2.656 N/A SER 166.A OG SER 162.A O no hydrogen 3.254 N/A PHE 167.A N ASP 163.A O no hydrogen 2.931 N/A ALA 168.A N VAL 164.A O no hydrogen 2.956 N/A VAL 169.A N TYR 165.A O no hydrogen 3.077 N/A VAL 170.A N SER 166.A O no hydrogen 2.928 N/A LEU 171.A N PHE 167.A O no hydrogen 2.923 N/A TRP 172.A N ALA 168.A O no hydrogen 3.068 N/A TRP 172.A NE1 ASP 201.A O no hydrogen 2.953 N/A ALA 173.A N VAL 169.A O no hydrogen 2.910 N/A ILE 174.A N VAL 170.A O no hydrogen 2.921 N/A PHE 175.A N LEU 171.A O no hydrogen 3.048 N/A ALA 176.A N TRP 172.A O no hydrogen 2.913 N/A ASN 177.A N ALA 173.A O no hydrogen 2.910 N/A ASN 177.A ND2 GLU 207.A OE2 no hydrogen 3.162 N/A LYS 178.A NZ GLU 182.A OE1 no hydrogen 2.287 N/A LYS 178.A NZ ASP 204.A OD1 no hydrogen 2.327 N/A ALA 184.A N TYR 181.A O no hydrogen 3.211 N/A LEU 190.A N ALA 186.A O no hydrogen 3.000 N/A ILE 191.A N GLU 187.A O no hydrogen 2.872 N/A MET 192.A N GLN 188.A O no hydrogen 2.988 N/A ALA 193.A N GLN 189.A O no hydrogen 2.906 N/A ILE 194.A N LEU 190.A O no hydrogen 2.892 N/A LYS 195.A N ILE 191.A O no hydrogen 2.913 N/A LYS 195.A NZ PRO 148.A O no hydrogen 2.973 N/A LYS 195.A NZ LEU 151.A O no hydrogen 2.796 N/A SER 196.A N MET 192.A O no hydrogen 2.928 N/A SER 196.A OG MET 192.A O no hydrogen 3.348 N/A SER 196.A OG ALA 193.A O no hydrogen 2.968 N/A GLY 197.A N ILE 194.A O no hydrogen 2.972 N/A ASN 198.A N ALA 193.A O no hydrogen 2.894 N/A ARG 199.A NE TRP 221.A O no hydrogen 2.788 N/A ARG 199.A NH1 ILE 194.A O no hydrogen 2.966 N/A ARG 199.A NH1 ASN 198.A O no hydrogen 2.834 N/A ARG 199.A NH2 TRP 221.A O no hydrogen 3.051 N/A ASP 204.A N ASP 201.A O no hydrogen 2.933 N/A ILE 205.A N VAL 202.A O no hydrogen 2.874 N/A CYS 209.A SG PRO 210.A O no hydrogen 3.590 N/A ILE 213.A N PRO 210.A O no hydrogen 3.359 N/A ILE 214.A N PRO 210.A O no hydrogen 3.385 N/A SER 215.A N ARG 211.A O no hydrogen 2.979 N/A SER 215.A OG ARG 211.A O no hydrogen 3.304 N/A LEU 216.A N GLU 212.A O no hydrogen 2.919 N/A MET 217.A N ILE 213.A O no hydrogen 2.899 N/A LYS 218.A N ILE 214.A O no hydrogen 2.974 N/A LEU 219.A N SER 215.A O no hydrogen 2.910 N/A CYS 220.A N LEU 216.A O no hydrogen 2.882 N/A CYS 220.A SG LEU 216.A O no hydrogen 3.308 N/A TRP 221.A N MET 217.A O no hydrogen 3.104 N/A GLU 222.A N LEU 219.A O no hydrogen 3.274 N/A GLU 226.A N ASN 224.A OD1 no hydrogen 2.839 N/A ALA 227.A N ASN 224.A O no hydrogen 3.035 N/A ARG 228.A N PRO 225.A O no hydrogen 3.088 N/A ARG 228.A NE GLU 222.A O no hydrogen 2.759 N/A ARG 228.A NH1 GLU 149.A OE1 no hydrogen 2.838 N/A ARG 228.A NH1 LYS 161.A O no hydrogen 2.998 N/A ARG 228.A NH2 GLU 149.A OE1 no hydrogen 3.356 N/A ARG 228.A NH2 GLU 149.A OE2 no hydrogen 2.863 N/A ARG 228.A NH2 GLU 222.A O no hydrogen 3.165 N/A GLY 233.A N THR 230.A OG1 no hydrogen 3.100 N/A ILE 234.A N THR 230.A O no hydrogen 2.960 N/A GLU 235.A N PHE 231.A O no hydrogen 2.884 N/A GLU 236.A N PRO 232.A O no hydrogen 2.892 N/A LYS 237.A N GLY 233.A O no hydrogen 3.008 N/A PHE 238.A N ILE 234.A O no hydrogen 2.808 N/A ARG 239.A N GLU 235.A O no hydrogen 2.873 N/A ARG 239.A NE GLU 235.A OE1 no hydrogen 2.896 N/A ARG 239.A NH2 GLU 96.A OE2 no hydrogen 2.306 N/A ARG 239.A NH2 GLU 235.A OE1 no hydrogen 2.374 N/A TYR 242.A N PHE 238.A O no hydrogen 2.754 N/A LEU 243.A N ARG 239.A O no hydrogen 3.037 N/A SER 244.A N PRO 240.A O no hydrogen 3.142 N/A SER 244.A OG PRO 240.A O no hydrogen 3.178 N/A SER 244.A OG PHE 241.A O no hydrogen 3.497 N/A GLN 245.A N PHE 241.A O no hydrogen 2.997 N/A LEU 246.A N TYR 242.A O no hydrogen 2.766 N/A GLU 247.A N TYR 242.A O no hydrogen 2.753 N/A