Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8vq3_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A N ALA 2.A O no hydrogen 3.038 N/A ARG 5.A NE SER 212.A O no hydrogen 3.050 N/A ARG 5.A NH2 SER 212.A O no hydrogen 3.139 N/A GLY 6.A N GLY 213.A O no hydrogen 2.894 N/A ARG 17.A NH2 LEU 9.A O no hydrogen 3.027 N/A GLU 18.A N ASN 16.A OD1 no hydrogen 3.079 N/A VAL 20.A N ASN 16.A O no hydrogen 2.910 N/A TRP 21.A N ARG 17.A O no hydrogen 2.914 N/A LYS 22.A N GLU 18.A O no hydrogen 2.968 N/A ILE 23.A N GLU 19.A O no hydrogen 2.992 N/A MET 24.A N VAL 20.A O no hydrogen 3.174 N/A LEU 25.A N TRP 21.A O no hydrogen 2.852 N/A ASN 26.A N LYS 22.A O no hydrogen 2.836 N/A LYS 27.A N MET 24.A O no hydrogen 3.247 N/A LYS 27.A NZ SER 146.A O no hydrogen 2.592 N/A LYS 29.A N ASN 26.A O no hydrogen 2.990 N/A THR 30.A N LYS 27.A O no hydrogen 2.859 N/A TYR 31.A N LYS 27.A O no hydrogen 2.938 N/A ARG 33.A NE LEU 187.A O no hydrogen 3.405 N/A ARG 33.A NH2 LEU 187.A O no hydrogen 3.540 N/A ARG 33.A NH2 GLU 188.A O no hydrogen 3.472 N/A HIS 36.A N ASP 34.A OD1 no hydrogen 3.168 N/A PHE 37.A N ASP 34.A O no hydrogen 2.994 N/A GLU 39.A N HIS 36.A O no hydrogen 2.859 N/A GLN 40.A N PHE 37.A O no hydrogen 2.949 N/A GLN 40.A NE2 ALA 82.A O no hydrogen 3.618 N/A HIS 41.A N LEU 38.A O no hydrogen 2.922 N/A HIS 41.A NE2 MET 81.A O no hydrogen 3.064 N/A LEU 44.A N HIS 41.A O no hydrogen 2.884 N/A LYS 47.A NZ ASP 266.A OD1 no hydrogen 3.184 N/A MET 48.A N GLN 45.A O no hydrogen 2.848 N/A ARG 49.A N PRO 46.A O no hydrogen 2.971 N/A ARG 49.A NE ASP 78.A OD1 no hydrogen 2.824 N/A ARG 49.A NH1 VAL 181.A O no hydrogen 2.913 N/A ARG 49.A NH2 ASP 78.A OD2 no hydrogen 2.852 N/A ARG 49.A NH2 VAL 181.A O no hydrogen 3.092 N/A ALA 50.A N PRO 46.A O no hydrogen 3.269 N/A ILE 51.A N LYS 47.A O no hydrogen 2.896 N/A LEU 52.A N MET 48.A O no hydrogen 2.918 N/A LEU 53.A N ARG 49.A O no hydrogen 2.785 N/A ASP 54.A N ALA 50.A O no hydrogen 2.819 N/A TRP 55.A N ILE 51.A O no hydrogen 3.050 N/A LEU 56.A N LEU 52.A O no hydrogen 2.993 N/A MET 57.A N LEU 53.A O no hydrogen 3.019 N/A GLU 58.A N ASP 54.A O no hydrogen 3.035 N/A VAL 59.A N TRP 55.A O no hydrogen 2.874 N/A CYS 60.A N LEU 56.A O no hydrogen 2.876 N/A CYS 60.A SG LEU 56.A O no hydrogen 3.510 N/A GLU 61.A N MET 57.A O no hydrogen 3.086 N/A VAL 62.A N GLU 58.A O no hydrogen 3.143 N/A TYR 63.A N VAL 59.A O no hydrogen 3.152 N/A TYR 63.A OH GLN 116.A OE1 no hydrogen 2.926 N/A LYS 64.A N GLU 61.A O no hydrogen 2.671 N/A LEU 65.A N CYS 60.A O no hydrogen 2.651 N/A HIS 66.A N GLU 108.A OE2 no hydrogen 2.869 N/A HIS 66.A ND1 GLU 108.A OE1 no hydrogen 2.996 N/A HIS 66.A NE2 ASP 251.A OD2 no hydrogen 2.845 N/A ARG 67.A N ASN 254.A O no hydrogen 2.753 N/A ARG 67.A NE HIS 253.A O no hydrogen 2.829 N/A THR 69.A OG1 GLU 108.A OE2 no hydrogen 2.598 N/A PHE 70.A N HIS 66.A O no hydrogen 3.292 N/A TYR 71.A N ARG 67.A O no hydrogen 2.966 N/A TYR 71.A OH ASP 178.A OD1 no hydrogen 2.730 N/A LEU 72.A N GLU 68.A O no hydrogen 2.747 N/A ALA 73.A N THR 69.A O no hydrogen 3.014 N/A GLN 74.A N PHE 70.A O no hydrogen 2.928 N/A GLN 74.A NE2 ASP 78.A OD2 no hydrogen 2.716 N/A GLN 74.A NE2 TYR 191.A OH no hydrogen 3.285 N/A ASP 75.A N TYR 71.A O no hydrogen 2.921 N/A PHE 76.A N LEU 72.A O no hydrogen 2.809 N/A PHE 77.A N ALA 73.A O no hydrogen 2.939 N/A ASP 78.A N GLN 74.A O no hydrogen 3.014 N/A ARG 79.A N ASP 75.A O no hydrogen 2.963 N/A ARG 79.A NH1 ASP 75.A OD2 no hydrogen 2.717 N/A ARG 79.A NH1 ARG 144.A O no hydrogen 3.289 N/A ARG 79.A NH2 ARG 144.A O no hydrogen 2.593 N/A TYR 80.A N PHE 76.A O no hydrogen 2.820 N/A MET 81.A N PHE 77.A O no hydrogen 2.880 N/A ALA 82.A N ASP 78.A O no hydrogen 3.204 N/A THR 83.A N TYR 80.A O no hydrogen 2.896 N/A THR 83.A OG1 TYR 80.A O no hydrogen 2.692 N/A THR 83.A OG1 GLN 84.A OE1 no hydrogen 3.159 N/A GLN 84.A N MET 81.A O no hydrogen 2.911 N/A ASN 86.A N GLN 40.A O no hydrogen 3.062 N/A VAL 87.A N HIS 41.A ND1 no hydrogen 2.886 N/A LEU 91.A N VAL 88.A O no hydrogen 3.071 N/A LEU 92.A N LYS 89.A O no hydrogen 3.212 N/A GLN 93.A NE2 THR 121.A O no hydrogen 3.626 N/A ILE 95.A N LEU 91.A O no hydrogen 3.074 N/A GLY 96.A N LEU 92.A O no hydrogen 2.736 N/A ILE 97.A N GLN 93.A O no hydrogen 2.867 N/A SER 98.A N LEU 94.A O no hydrogen 3.003 N/A SER 98.A OG LEU 94.A O no hydrogen 2.863 N/A SER 99.A N ILE 95.A O no hydrogen 3.025 N/A SER 99.A OG ILE 95.A O no hydrogen 2.837 N/A LEU 100.A N GLY 96.A O no hydrogen 2.987 N/A PHE 101.A N ILE 97.A O no hydrogen 2.885 N/A ILE 102.A N SER 98.A O no hydrogen 2.967 N/A ALA 103.A N SER 99.A O no hydrogen 2.977 N/A ALA 104.A N LEU 100.A O no hydrogen 2.743 N/A LYS 105.A N PHE 101.A O no hydrogen 3.032 N/A LYS 105.A NZ GLU 134.A OE1 no hydrogen 3.279 N/A LYS 105.A NZ GLU 134.A OE2 no hydrogen 2.646 N/A LEU 106.A N ILE 102.A O no hydrogen 3.002 N/A GLU 107.A N ALA 103.A O no hydrogen 2.955 N/A GLU 108.A N ALA 104.A O no hydrogen 2.929 N/A GLN 116.A N LYS 113.A O no hydrogen 2.728 N/A PHE 117.A N LYS 113.A O no hydrogen 3.343 N/A ALA 118.A N LEU 114.A O no hydrogen 2.993 N/A TYR 119.A N HIS 115.A O no hydrogen 2.783 N/A VAL 120.A N GLN 116.A O no hydrogen 3.134 N/A THR 121.A N ALA 118.A O no hydrogen 2.927 N/A THR 121.A OG1 ALA 118.A O no hydrogen 2.570 N/A THR 121.A OG1 CYS 125.A O no hydrogen 3.169 N/A ASP 122.A N TYR 119.A O no hydrogen 2.922 N/A ALA 124.A N THR 121.A O no hydrogen 3.304 N/A CYS 125.A N THR 121.A OG1 no hydrogen 2.958 N/A SER 126.A N GLU 129.A OE1 no hydrogen 3.380 N/A SER 126.A OG GLU 129.A OE1 no hydrogen 3.269 N/A ILE 130.A N SER 126.A O no hydrogen 3.222 N/A LEU 131.A N GLY 127.A O no hydrogen 2.919 N/A THR 132.A N ASP 128.A O no hydrogen 2.980 N/A THR 132.A OG1 ASP 128.A O no hydrogen 3.083 N/A MET 133.A N GLU 129.A O no hydrogen 2.797 N/A GLU 134.A N ILE 130.A O no hydrogen 2.786 N/A LEU 135.A N LEU 131.A O no hydrogen 3.503 N/A MET 136.A N THR 132.A O no hydrogen 3.195 N/A ILE 137.A N MET 133.A O no hydrogen 2.881 N/A MET 138.A N GLU 134.A O no hydrogen 2.921 N/A LYS 139.A N LEU 135.A O no hydrogen 2.926 N/A ALA 140.A N MET 136.A O no hydrogen 2.983 N/A LEU 141.A N ILE 137.A O no hydrogen 2.866 N/A LYS 142.A N LYS 139.A O no hydrogen 2.900 N/A TRP 143.A N MET 138.A O no hydrogen 2.872 N/A ARG 144.A N LEU 141.A O no hydrogen 2.983 N/A SER 146.A N TYR 31.A OH no hydrogen 2.964 N/A THR 149.A OG1 GLU 68.A OE1 no hydrogen 2.604 N/A SER 152.A N THR 149.A OG1 no hydrogen 3.074 N/A SER 152.A OG THR 149.A O no hydrogen 2.965 N/A TRP 153.A N THR 149.A O no hydrogen 3.107 N/A LEU 154.A N ILE 150.A O no hydrogen 3.298 N/A ASN 155.A N VAL 151.A O no hydrogen 3.162 N/A ASN 155.A ND2 ASN 254.A OD1 no hydrogen 2.985 N/A VAL 156.A N SER 152.A O no hydrogen 3.056 N/A TYR 157.A N TRP 153.A O no hydrogen 2.985 N/A TYR 157.A OH GLY 192.A O no hydrogen 2.869 N/A MET 158.A N LEU 154.A O no hydrogen 2.868 N/A GLN 159.A N ASN 155.A O no hydrogen 2.845 N/A GLN 159.A NE2 ASN 155.A OD1 no hydrogen 2.871 N/A VAL 160.A N VAL 156.A O no hydrogen 3.012 N/A ALA 161.A N TYR 157.A O no hydrogen 3.126 N/A TYR 162.A N MET 158.A O no hydrogen 3.003 N/A LEU 163.A N GLN 159.A O no hydrogen 2.979 N/A ASN 164.A N ALA 161.A O no hydrogen 3.154 N/A GLN 167.A NE2 ASP 249.A O no hydrogen 2.882 N/A GLN 167.A NE2 HIS 253.A ND1 no hydrogen 3.193 N/A GLN 168.A N TYR 165.A O no hydrogen 3.071 N/A ILE 169.A N TYR 165.A O no hydrogen 3.291 N/A PHE 170.A N PRO 166.A O no hydrogen 3.036 N/A ILE 171.A N GLN 167.A O no hydrogen 3.144 N/A GLN 172.A N GLN 168.A O no hydrogen 3.040 N/A GLN 172.A NE2 SER 239.A O no hydrogen 3.235 N/A ILE 173.A N ILE 169.A O no hydrogen 2.875 N/A ALA 174.A N PHE 170.A O no hydrogen 2.701 N/A GLU 175.A N ILE 171.A O no hydrogen 2.925 N/A LEU 176.A N GLN 172.A O no hydrogen 3.316 N/A LEU 177.A N ILE 173.A O no hydrogen 3.026 N/A ASP 178.A N ALA 174.A O no hydrogen 2.730 N/A LEU 179.A N GLU 175.A O no hydrogen 3.186 N/A LEU 179.A N LEU 176.A O no hydrogen 3.059 N/A CYS 180.A N LEU 176.A O no hydrogen 3.000 N/A CYS 180.A SG LEU 176.A O no hydrogen 3.459 N/A VAL 181.A N LEU 177.A O no hydrogen 2.910 N/A LEU 182.A N LEU 179.A O no hydrogen 3.188 N/A ASP 183.A N CYS 180.A O no hydrogen 3.061 N/A ASP 185.A N ASP 183.A OD1 no hydrogen 2.699 N/A CYS 186.A N ASP 183.A O no hydrogen 2.926 N/A CYS 186.A SG ASP 183.A O no hydrogen 3.202 N/A LEU 187.A N VAL 184.A O no hydrogen 3.093 N/A GLU 188.A N ASP 185.A O no hydrogen 3.216 N/A PHE 189.A N CYS 186.A O no hydrogen 3.167 N/A TYR 191.A OH ASP 75.A OD1 no hydrogen 2.543 N/A ILE 193.A N PRO 190.A O no hydrogen 2.795 N/A LEU 194.A N PRO 190.A O no hydrogen 3.002 N/A ALA 195.A N TYR 191.A O no hydrogen 3.048 N/A ALA 196.A N GLY 192.A O no hydrogen 3.047 N/A SER 197.A N ILE 193.A O no hydrogen 2.831 N/A SER 197.A OG ILE 193.A O no hydrogen 2.915 N/A ALA 198.A N LEU 194.A O no hydrogen 3.011 N/A LEU 199.A N ALA 195.A O no hydrogen 3.090 N/A TYR 200.A N ALA 196.A O no hydrogen 2.890 N/A HIS 201.A N SER 197.A O no hydrogen 3.099 N/A PHE 202.A N LEU 199.A O no hydrogen 3.021 N/A SER 203.A N TYR 200.A O no hydrogen 2.947 N/A SER 203.A OG LEU 199.A O no hydrogen 2.579 N/A SER 203.A OG SER 204.A O no hydrogen 3.465 N/A LEU 207.A N SER 204.A OG no hydrogen 2.971 N/A MET 208.A N SER 204.A O no hydrogen 3.002 N/A GLN 209.A N SER 205.A O no hydrogen 2.945 N/A LYS 210.A N GLU 206.A O no hydrogen 3.001 N/A VAL 211.A N LEU 207.A O no hydrogen 2.889 N/A SER 212.A N MET 208.A O no hydrogen 2.817 N/A SER 212.A OG MET 208.A O no hydrogen 2.851 N/A GLY 213.A N GLN 209.A O no hydrogen 2.853 N/A TYR 214.A N SER 212.A OG no hydrogen 2.997 N/A CYS 217.A SG ASP 218.A OD2 no hydrogen 3.101 N/A ASP 218.A N GLN 215.A O no hydrogen 3.086 N/A ILE 219.A N TRP 216.A O no hydrogen 3.016 N/A GLU 220.A N TRP 216.A O no hydrogen 2.987 N/A CYS 222.A SG SER 197.A OG no hydrogen 3.346 N/A VAL 223.A N ILE 219.A O no hydrogen 2.723 N/A LYS 224.A N GLU 220.A O no hydrogen 2.858 N/A TRP 225.A N ASN 221.A O no hydrogen 3.058 N/A MET 226.A N CYS 222.A O no hydrogen 2.789 N/A ALA 230.A N MET 226.A O no hydrogen 2.900 N/A MET 231.A N VAL 227.A O no hydrogen 2.929 N/A VAL 232.A N PRO 228.A O no hydrogen 3.014 N/A ILE 233.A N PHE 229.A O no hydrogen 3.219 N/A ARG 234.A N ALA 230.A O no hydrogen 2.902 N/A ARG 234.A NH2 HIS 201.A O no hydrogen 3.280 N/A GLU 235.A N MET 231.A O no hydrogen 2.904 N/A THR 236.A N ILE 233.A O no hydrogen 3.061 N/A THR 236.A OG1 ILE 233.A O no hydrogen 3.109 N/A THR 236.A OG1 GLY 237.A O no hydrogen 3.141 N/A GLY 237.A N ARG 234.A O no hydrogen 3.278 N/A SER 239.A N GLU 175.A OE1 no hydrogen 3.028 N/A SER 239.A OG GLU 175.A OE2 no hydrogen 2.635 N/A LYS 240.A NZ SER 238.A O no hydrogen 2.821 N/A LEU 241.A N GLN 168.A OE1 no hydrogen 2.685 N/A VAL 247.A N PHE 244.A O no hydrogen 3.002 N/A ASP 251.A N ALA 248.A O no hydrogen 2.911 N/A ALA 252.A N ASP 249.A O no hydrogen 3.323 N/A ASN 254.A N ASP 251.A O no hydrogen 2.930 N/A ASN 254.A ND2 ASP 251.A OD1 no hydrogen 2.908 N/A ILE 255.A N ALA 252.A O no hydrogen 3.163 N/A GLN 256.A N LEU 65.A O no hydrogen 2.888 N/A GLN 256.A NE2 ASP 178.A OD2 no hydrogen 2.859 N/A GLN 256.A NE2 THR 257.A O no hydrogen 2.941 N/A HIS 258.A NE2 ASP 54.A OD1 no hydrogen 2.301 N/A SER 261.A N ARG 259.A O no hydrogen 2.828 N/A SER 261.A OG ARG 259.A O no hydrogen 3.320 N/A LEU 265.A N SER 261.A O no hydrogen 2.893 N/A ASP 266.A N LEU 262.A O no hydrogen 3.269 N/A LYS 267.A N ASP 263.A O no hydrogen 3.208 N/A ALA 268.A N LEU 264.A O no hydrogen 2.943 N/A ARG 269.A N LEU 265.A O no hydrogen 2.956 N/A ALA 270.A N ASP 266.A O no hydrogen 2.869 N/A