Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5t3j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 8.A N GLN 4.A O no hydrogen 2.915 N/A SER 9.A N LEU 5.A O no hydrogen 2.800 N/A SER 9.A OG LEU 5.A O no hydrogen 3.114 N/A ASP 10.A N ASN 6.A O no hydrogen 3.083 N/A VAL 11.A N HIS 7.A O no hydrogen 3.322 N/A ALA 12.A N PHE 8.A O no hydrogen 2.778 N/A ASN 13.A N SER 9.A O no hydrogen 2.816 N/A ASN 13.A ND2 SER 9.A O no hydrogen 3.026 N/A LYS 14.A N ASP 10.A O no hydrogen 2.943 N/A ALA 15.A N VAL 11.A O no hydrogen 2.728 N/A ALA 16.A N ALA 12.A O no hydrogen 2.927 N/A ASN 17.A N ASN 13.A O no hydrogen 2.765 N/A ALA 18.A N LYS 14.A O no hydrogen 2.915 N/A ALA 19.A N ALA 15.A O no hydrogen 2.933 N/A GLY 20.A N ALA 16.A O no hydrogen 2.962 N/A ASP 21.A N ASN 17.A O no hydrogen 3.260 N/A VAL 22.A N ALA 18.A O no hydrogen 3.431 N/A ILE 23.A N ALA 19.A O no hydrogen 2.952 N/A ARG 24.A N GLY 20.A O no hydrogen 2.917 N/A ARG 24.A NH1 ASP 21.A OD1 no hydrogen 3.223 N/A ARG 24.A NH2 PRO 112.A O no hydrogen 2.858 N/A LYS 25.A N ASP 21.A O no hydrogen 3.487 N/A TYR 26.A N VAL 22.A O no hydrogen 3.345 N/A PHE 27.A N ILE 23.A O no hydrogen 2.991 N/A ARG 28.A NE GLY 88.A O no hydrogen 3.133 N/A ARG 28.A NH2 GLY 88.A O no hydrogen 2.911 N/A SER 30.A OG THR 33.A OG1 no hydrogen 2.898 N/A THR 33.A OG1 SER 30.A O no hydrogen 3.184 N/A THR 33.A OG1 SER 30.A OG no hydrogen 2.898 N/A ALA 35.A N PRO 31.A O no hydrogen 2.822 N/A ASP 36.A N VAL 32.A O no hydrogen 2.924 N/A GLN 37.A N THR 33.A O no hydrogen 2.993 N/A SER 38.A N ILE 34.A O no hydrogen 2.872 N/A SER 38.A OG ILE 34.A O no hydrogen 2.625 N/A ALA 39.A N ALA 35.A O no hydrogen 2.901 N/A GLU 40.A N ASP 36.A O no hydrogen 3.193 N/A GLU 41.A N GLN 37.A O no hydrogen 2.872 N/A ALA 42.A N SER 38.A O no hydrogen 2.750 N/A MET 43.A N ALA 39.A O no hydrogen 3.044 N/A VAL 44.A N GLU 40.A O no hydrogen 2.922 N/A SER 45.A N GLU 41.A O no hydrogen 2.884 N/A SER 45.A OG GLU 41.A O no hydrogen 3.194 N/A VAL 46.A N ALA 42.A O no hydrogen 3.358 N/A ILE 47.A N MET 43.A O no hydrogen 2.911 N/A LEU 48.A N VAL 44.A O no hydrogen 2.820 N/A ASP 49.A N SER 45.A O no hydrogen 3.002 N/A ASN 50.A N VAL 46.A O no hydrogen 3.206 N/A ASN 50.A ND2 VAL 46.A O no hydrogen 3.051 N/A PHE 51.A N ILE 47.A O no hydrogen 2.732 N/A ALA 55.A N TYR 72.A O no hydrogen 3.025 N/A VAL 56.A N ARG 64.A O no hydrogen 3.277 N/A TYR 57.A N TRP 74.A O no hydrogen 2.689 N/A GLY 58.A N GLY 62.A O no hydrogen 3.026 N/A GLU 59.A N LEU 76.A O no hydrogen 3.104 N/A GLU 60.A N GLU 40.A OE1 no hydrogen 2.681 N/A LYS 61.A N GLU 40.A OE2 no hydrogen 3.170 N/A ARG 64.A N VAL 56.A O no hydrogen 2.969 N/A ARG 64.A NH1 GLU 41.A OE1 no hydrogen 2.786 N/A CYS 65.A SG SER 53.A O no hydrogen 3.927 N/A CYS 65.A SG HIS 54.A O no hydrogen 4.043 N/A CYS 65.A SG GLN 67.A O no hydrogen 3.521 N/A VAL 73.A N LEU 99.A O no hydrogen 2.941 N/A TRP 74.A N ALA 55.A O no hydrogen 2.784 N/A TRP 74.A NE1 HIS 54.A ND1 no hydrogen 2.753 N/A VAL 75.A N ALA 97.A O no hydrogen 2.813 N/A LEU 76.A N TYR 57.A O no hydrogen 2.966 N/A ASP 77.A N LEU 95.A O no hydrogen 2.959 N/A ILE 79.A N ASP 77.A OD1 no hydrogen 3.137 N/A ASP 80.A N GLY 93.A O no hydrogen 2.856 N/A SER 84.A OG ASP 177.A OD1 no hydrogen 3.371 N/A SER 84.A OG ASP 177.A OD2 no hydrogen 3.150 N/A PHE 85.A N GLY 81.A O no hydrogen 2.975 N/A ILE 86.A N THR 82.A O no hydrogen 2.854 N/A THR 87.A N LYS 83.A O no hydrogen 3.090 N/A THR 87.A OG1 LYS 83.A O no hydrogen 2.569 N/A THR 87.A OG1 SER 84.A O no hydrogen 3.381 N/A GLY 88.A N PHE 85.A O no hydrogen 3.181 N/A LYS 89.A N SER 84.A O no hydrogen 2.879 N/A LYS 89.A NZ GLY 175.A O no hydrogen 2.726 N/A LEU 91.A N LYS 89.A O no hydrogen 2.858 N/A GLY 93.A N ASP 80.A O no hydrogen 3.052 N/A THR 94.A N ASP 110.A O no hydrogen 2.972 N/A THR 94.A OG1 PRO 78.A O no hydrogen 2.804 N/A LEU 95.A N ASP 77.A O no hydrogen 2.806 N/A ILE 96.A N ILE 108.A O no hydrogen 3.130 N/A ALA 97.A N VAL 75.A O no hydrogen 2.905 N/A LEU 98.A N LEU 106.A O no hydrogen 3.039 N/A LEU 99.A N VAL 73.A O no hydrogen 2.771 N/A GLN 100.A N THR 103.A O no hydrogen 2.814 N/A ASN 101.A N ASP 71.A O no hydrogen 2.787 N/A THR 103.A N GLN 100.A O no hydrogen 3.186 N/A ILE 105.A N LEU 98.A O no hydrogen 2.869 N/A GLY 107.A N GLY 120.A O no hydrogen 2.992 N/A ILE 108.A N ILE 96.A O no hydrogen 2.802 N/A ILE 109.A N TRP 118.A O no hydrogen 2.944 N/A ASP 110.A N THR 94.A O no hydrogen 2.989 N/A GLN 111.A N GLU 116.A O no hydrogen 2.685 N/A GLN 111.A NE2 PHE 92.A O no hydrogen 2.725 N/A VAL 113.A N GLN 111.A OE1 no hydrogen 2.855 N/A LEU 114.A N GLN 111.A OE1 no hydrogen 2.759 N/A GLU 116.A N GLN 111.A O no hydrogen 3.139 N/A ARG 117.A N ASN 129.A OD1 no hydrogen 3.029 N/A ARG 117.A NE ASP 110.A OD1 no hydrogen 2.895 N/A ARG 117.A NH1 ASN 13.A O no hydrogen 3.306 N/A ARG 117.A NH1 ASN 13.A OD1 no hydrogen 3.030 N/A ARG 117.A NH1 ASN 17.A OD1 no hydrogen 2.848 N/A ARG 117.A NH2 ASN 17.A OD1 no hydrogen 2.833 N/A ARG 117.A NH2 ASP 110.A OD1 no hydrogen 3.299 N/A TRP 118.A N ILE 109.A O no hydrogen 2.865 N/A TRP 118.A NE1 SER 186.A OG no hydrogen 3.000 N/A ILE 119.A N THR 127.A O no hydrogen 2.952 N/A GLY 120.A N GLY 107.A O no hydrogen 2.839 N/A THR 122.A N ILE 105.A O no hydrogen 2.917 N/A THR 122.A OG1 ILE 105.A O no hydrogen 3.195 N/A LYS 124.A N ILE 121.A O no hydrogen 3.135 N/A LYS 124.A NZ ASN 6.A OD1 no hydrogen 3.286 N/A ARG 125.A NH1 VAL 133.A O no hydrogen 2.896 N/A ARG 125.A NH1 SER 212.A O no hydrogen 3.400 N/A THR 126.A N GLY 211.A O no hydrogen 2.948 N/A THR 126.A OG1 VAL 208.A O no hydrogen 2.762 N/A THR 127.A N ILE 119.A O no hydrogen 3.121 N/A LEU 128.A N GLN 131.A O no hydrogen 2.716 N/A ASN 129.A N ARG 117.A O no hydrogen 3.071 N/A ASN 129.A ND2 LYS 115.A O no hydrogen 3.108 N/A GLN 131.A N LEU 128.A O no hydrogen 2.956 N/A VAL 133.A N THR 126.A O no hydrogen 2.908 N/A SER 134.A OG THR 135.A O no hydrogen 3.008 N/A THR 135.A N SER 212.A O no hydrogen 2.831 N/A THR 135.A OG1 SER 212.A O no hydrogen 3.151 N/A THR 135.A OG1 GLY 243.A O no hydrogen 2.900 N/A ARG 136.A NE ASP 190.A OD1 no hydrogen 2.886 N/A ARG 136.A NH2 PHE 188.A O no hydrogen 3.486 N/A ARG 136.A NH2 ASP 190.A OD1 no hydrogen 3.426 N/A ARG 136.A NH2 ASP 190.A OD2 no hydrogen 2.839 N/A CYS 138.A N ASP 244.A OD2 no hydrogen 3.105 N/A CYS 138.A SG ASP 140.A O no hydrogen 3.423 N/A LEU 141.A N GLN 250.A OE1 no hydrogen 3.201 N/A GLN 143.A N ASP 140.A O no hydrogen 2.875 N/A ALA 144.A N LEU 141.A O no hydrogen 3.079 N/A TYR 145.A N ASP 190.A OD2 no hydrogen 3.011 N/A LEU 146.A N ILE 171.A O no hydrogen 3.086 N/A TYR 147.A N LEU 191.A O no hydrogen 2.968 N/A THR 148.A N LEU 173.A O no hydrogen 2.998 N/A THR 148.A OG1 VAL 193.A O no hydrogen 2.812 N/A THR 149.A OG1 CYS 176.A O no hydrogen 2.889 N/A THR 149.A OG1 GLU 194.A OE2 no hydrogen 3.255 N/A ALA 158.A N SER 155.A O no hydrogen 3.095 N/A GLU 160.A N GLY 156.A O no hydrogen 3.449 N/A ALA 161.A N ASP 157.A O no hydrogen 2.950 N/A PHE 162.A N ALA 158.A O no hydrogen 2.833 N/A ILE 163.A N GLU 159.A O no hydrogen 2.949 N/A ARG 164.A N GLU 160.A O no hydrogen 3.040 N/A ARG 164.A NE SER 254.A O no hydrogen 2.864 N/A ARG 164.A NH2 LEU 255.A O no hydrogen 3.097 N/A VAL 165.A N ALA 161.A O no hydrogen 3.410 N/A ARG 166.A N PHE 162.A O no hydrogen 2.789 N/A ARG 166.A NE ASP 167.A OD1 no hydrogen 3.226 N/A ARG 166.A NH2 ASP 167.A OD1 no hydrogen 2.887 N/A ASP 167.A N ILE 163.A O no hydrogen 2.937 N/A LYS 168.A N VAL 165.A O no hydrogen 2.915 N/A LYS 168.A NZ SER 254.A OG no hydrogen 3.256 N/A VAL 169.A N ARG 166.A O no hydrogen 3.437 N/A LYS 170.A N ALA 144.A O no hydrogen 2.859 N/A LEU 173.A N LEU 146.A O no hydrogen 2.779 N/A CYS 178.A SG ASP 80.A O no hydrogen 3.988 N/A TYR 179.A OH GLU 116.A OE1 no hydrogen 2.504 N/A TYR 179.A OH GLU 116.A OE2 no hydrogen 3.421 N/A TYR 181.A OH GLU 194.A OE1 no hydrogen 2.513 N/A ALA 182.A N CYS 178.A O no hydrogen 3.213 N/A LEU 183.A N TYR 179.A O no hydrogen 2.836 N/A LEU 184.A N ALA 180.A O no hydrogen 3.018 N/A SER 185.A N TYR 181.A O no hydrogen 3.150 N/A SER 185.A OG TYR 181.A O no hydrogen 3.071 N/A SER 186.A N ALA 182.A O no hydrogen 3.130 N/A GLY 187.A N LEU 184.A O no hydrogen 3.039 N/A PHE 188.A N LEU 183.A O no hydrogen 2.912 N/A ASP 190.A N TYR 145.A O no hydrogen 3.024 N/A LEU 191.A N TYR 145.A O no hydrogen 3.114 N/A VAL 192.A N ALA 241.A O no hydrogen 2.796 N/A VAL 193.A N TYR 147.A O no hydrogen 3.120 N/A GLU 194.A N VAL 239.A O no hydrogen 2.863 N/A SER 195.A OG ASN 238.A OD1 no hydrogen 2.559 N/A GLY 196.A N ASN 238.A OD1 no hydrogen 3.409 N/A LEU 197.A N PHE 237.A O no hydrogen 2.718 N/A ASP 201.A N LYS 198.A O no hydrogen 2.786 N/A PHE 202.A N PRO 199.A O no hydrogen 3.254 N/A LEU 203.A N PRO 199.A O no hydrogen 2.995 N/A LEU 205.A N PHE 202.A O no hydrogen 3.095 N/A ILE 206.A N LEU 203.A O no hydrogen 3.283 N/A ILE 209.A N LEU 205.A O no hydrogen 2.771 N/A GLU 210.A N ILE 206.A O no hydrogen 2.879 N/A GLY 211.A N PRO 207.A O no hydrogen 2.990 N/A SER 212.A N ILE 209.A O no hydrogen 3.203 N/A SER 212.A OG VAL 208.A O no hydrogen 2.775 N/A GLY 213.A N GLU 210.A O no hydrogen 3.033 N/A GLY 214.A N ILE 209.A O no hydrogen 2.939 N/A VAL 215.A N ALA 242.A O no hydrogen 2.835 N/A THR 217.A N VAL 240.A O no hydrogen 3.047 N/A THR 217.A OG1 ASP 218.A O no hydrogen 2.891 N/A THR 217.A OG1 HIS 248.A NE2 no hydrogen 2.806 N/A ASP 218.A N HIS 222.A O no hydrogen 2.992 N/A TRP 219.A NE1 VAL 239.A O no hydrogen 3.125 N/A LYS 220.A N ASP 218.A OD1 no hydrogen 3.075 N/A GLY 221.A N ASP 218.A O no hydrogen 2.978 N/A HIS 222.A N ASP 218.A OD1 no hydrogen 2.852 N/A ARG 225.A NH1 THR 103.A OG1 no hydrogen 3.215 N/A TRP 226.A NE1 ILE 233.A O no hydrogen 3.164 N/A SER 229.A N SER 232.A OG no hydrogen 2.969 N/A SER 229.A OG SER 232.A OG no hydrogen 3.170 N/A SER 232.A OG GLU 227.A O no hydrogen 2.671 N/A SER 232.A OG SER 229.A OG no hydrogen 3.170 N/A THR 235.A OG1 ILE 233.A O no hydrogen 3.349 N/A PHE 237.A N LEU 197.A O no hydrogen 2.791 N/A VAL 239.A N GLU 194.A O no hydrogen 2.710 N/A VAL 240.A N THR 217.A O no hydrogen 3.032 N/A ALA 241.A N VAL 192.A O no hydrogen 2.848 N/A ALA 242.A N VAL 215.A O no hydrogen 2.785 N/A GLY 243.A N ASP 190.A O no hydrogen 3.029 N/A GLN 246.A N ASP 244.A OD1 no hydrogen 3.052 N/A HIS 248.A N ASP 244.A O no hydrogen 3.213 N/A HIS 248.A NE2 THR 217.A OG1 no hydrogen 2.806 N/A GLN 249.A N LYS 245.A O no hydrogen 3.005 N/A GLN 250.A N GLN 246.A O no hydrogen 3.034 N/A GLN 250.A NE2 ASP 140.A OD1 no hydrogen 2.796 N/A ALA 251.A N ILE 247.A O no hydrogen 2.831 N/A LEU 252.A N HIS 248.A O no hydrogen 2.805 N/A ASP 253.A N GLN 249.A O no hydrogen 3.157 N/A SER 254.A N GLN 250.A O no hydrogen 3.257 N/A LEU 255.A N ALA 251.A O no hydrogen 2.897 N/A GLN 256.A N LEU 252.A O no hydrogen 3.297 N/A GLN 256.A NE2 ASP 253.A O no hydrogen 2.950 N/A