Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qqu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 2.A NE1 LEU 75.A O no hydrogen 3.061 N/A VAL 4.A N VAL 78.A O no hydrogen 2.768 N/A ARG 6.A NE GLN 81.A O no hydrogen 2.708 N/A ARG 6.A NH1 PRO 84.A O no hydrogen 2.733 N/A ARG 6.A NH2 GLN 81.A O no hydrogen 3.085 N/A ARG 6.A NH2 PRO 84.A O no hydrogen 2.437 N/A LYS 8.A N ALA 5.A O no hydrogen 2.712 N/A ILE 9.A N ARG 6.A O no hydrogen 2.916 N/A THR 10.A N VAL 27.A O no hydrogen 3.126 N/A SER 12.A N GLU 25.A O no hydrogen 2.724 N/A LEU 15.A N VAL 23.A O no hydrogen 2.847 N/A GLY 16.A N VAL 23.A O no hydrogen 3.334 N/A GLY 18.A N GLY 21.A O no hydrogen 2.616 N/A GLY 21.A N GLY 18.A O no hydrogen 2.834 N/A VAL 23.A N GLY 16.A O no hydrogen 2.750 N/A TYR 24.A N ILE 42.A O no hydrogen 2.456 N/A GLU 25.A N ARG 13.A O no hydrogen 2.861 N/A GLY 26.A N VAL 40.A O no hydrogen 2.701 N/A ALA 28.A N THR 38.A O no hydrogen 3.081 N/A LYS 29.A N LYS 8.A O no hydrogen 2.923 N/A THR 38.A OG1 GLU 35.A OE2 no hydrogen 3.043 N/A VAL 40.A N GLY 26.A O no hydrogen 2.859 N/A ALA 41.A N MET 89.A O no hydrogen 2.704 N/A ILE 42.A N TYR 24.A O no hydrogen 2.583 N/A LYS 43.A N VAL 87.A O no hydrogen 2.940 N/A LYS 43.A NZ ASP 153.A OD1 no hydrogen 2.632 N/A LYS 43.A NZ ASP 153.A OD2 no hydrogen 3.337 N/A THR 44.A N MET 22.A O no hydrogen 3.131 N/A THR 44.A OG1 MET 22.A O no hydrogen 2.605 N/A ASN 46.A N PHE 20.A O no hydrogen 2.904 N/A ASN 46.A ND2 GLN 17.A OE1 no hydrogen 3.466 N/A ALA 49.A N ASN 46.A O no hydrogen 3.305 N/A SER 50.A N GLU 53.A OE1 no hydrogen 3.236 N/A ARG 52.A N SER 50.A OG no hydrogen 3.286 N/A GLU 53.A N SER 50.A O no hydrogen 2.804 N/A GLU 53.A N SER 50.A OG no hydrogen 3.061 N/A ARG 54.A N SER 50.A O no hydrogen 3.260 N/A ILE 55.A N ARG 52.A O no hydrogen 3.425 N/A GLU 56.A N GLU 53.A O no hydrogen 3.279 N/A PHE 57.A N GLU 53.A O no hydrogen 2.950 N/A ASN 59.A N GLU 56.A O no hydrogen 3.168 N/A GLU 60.A N GLU 56.A O no hydrogen 2.888 N/A GLU 60.A N PHE 57.A O no hydrogen 3.006 N/A ALA 61.A N PHE 57.A O no hydrogen 3.247 N/A MET 64.A N ALA 61.A O no hydrogen 3.278 N/A GLU 66.A N VAL 63.A O no hydrogen 3.475 N/A PHE 67.A N MET 64.A O no hydrogen 3.046 N/A HIS 71.A ND1 ASP 121.A OD2 no hydrogen 2.910 N/A VAL 72.A N CYS 69.A O no hydrogen 3.331 N/A VAL 73.A N ILE 151.A O no hydrogen 3.175 N/A ARG 74.A N GLU 90.A OE2 no hydrogen 2.610 N/A GLY 77.A N ILE 88.A O no hydrogen 2.844 N/A VAL 78.A N TRP 2.A O no hydrogen 2.642 N/A VAL 79.A N LEU 86.A O no hydrogen 2.636 N/A SER 80.A N GLU 3.A OE1 no hydrogen 3.272 N/A SER 80.A N GLU 3.A OE2 no hydrogen 2.467 N/A SER 80.A OG GLU 3.A OE1 no hydrogen 2.393 N/A THR 85.A OG1 GLN 83.A OE1 no hydrogen 2.970 N/A LEU 86.A N VAL 79.A O no hydrogen 3.275 N/A VAL 87.A N LYS 43.A O no hydrogen 3.042 N/A ILE 88.A N GLY 77.A O no hydrogen 2.409 N/A MET 89.A N ALA 41.A O no hydrogen 3.156 N/A GLU 90.A N ARG 74.A O no hydrogen 2.943 N/A ARG 94.A NE GLU 145.A O no hydrogen 2.604 N/A ARG 94.A NH2 GLU 145.A O no hydrogen 2.823 N/A GLY 95.A N MET 92.A O no hydrogen 3.060 N/A LEU 97.A N CYS 141.A O no hydrogen 2.433 N/A LYS 98.A NZ ASP 164.A OD1 no hydrogen 3.157 N/A LYS 98.A NZ GLN 211.A OE1 no hydrogen 3.429 N/A SER 99.A N ASP 96.A OD2 no hydrogen 3.142 N/A SER 99.A OG ASP 96.A OD1 no hydrogen 2.264 N/A SER 99.A OG ASP 96.A OD2 no hydrogen 2.553 N/A SER 99.A OG TYR 161.A OH no hydrogen 2.697 N/A TYR 100.A N ASP 96.A O no hydrogen 3.036 N/A LEU 101.A N LEU 97.A O no hydrogen 3.062 N/A ARG 102.A N LYS 98.A O no hydrogen 2.991 N/A ARG 102.A NE ALA 209.A O no hydrogen 2.883 N/A SER 103.A N TYR 100.A O no hydrogen 2.759 N/A LEU 104.A N TYR 100.A O no hydrogen 3.160 N/A ILE 113.A N LEU 109.A O no hydrogen 2.463 N/A GLN 114.A N SER 110.A O no hydrogen 3.040 N/A GLN 114.A NE2 GLU 118.A OE2 no hydrogen 2.981 N/A MET 115.A N LYS 111.A O no hydrogen 3.241 N/A ALA 116.A N MET 112.A O no hydrogen 3.120 N/A GLY 117.A N ILE 113.A O no hydrogen 2.984 N/A GLU 118.A N GLN 114.A O no hydrogen 3.230 N/A GLU 118.A N MET 115.A O no hydrogen 2.884 N/A ILE 119.A N MET 115.A O no hydrogen 3.034 N/A ALA 120.A N ALA 116.A O no hydrogen 2.941 N/A ASP 121.A N GLY 117.A O no hydrogen 3.138 N/A GLY 122.A N GLU 118.A O no hydrogen 2.849 N/A MET 123.A N ILE 119.A O no hydrogen 2.898 N/A ALA 124.A N ALA 120.A O no hydrogen 2.841 N/A TYR 125.A N ASP 121.A O no hydrogen 3.031 N/A LEU 126.A N GLY 122.A O no hydrogen 2.894 N/A ASN 127.A N MET 123.A O no hydrogen 2.646 N/A ALA 128.A N ALA 124.A O no hydrogen 2.970 N/A ASN 129.A N TYR 125.A O no hydrogen 3.044 N/A ASN 129.A N LEU 126.A O no hydrogen 2.483 N/A LYS 130.A N ASN 127.A O no hydrogen 2.811 N/A PHE 131.A N LEU 126.A O no hydrogen 3.204 N/A ALA 138.A N GLU 204.A OE1 no hydrogen 2.678 N/A ARG 139.A NE TYR 165.A OH no hydrogen 2.821 N/A ARG 139.A NH2 ASP 135.A OD1 no hydrogen 3.039 N/A ARG 139.A NH2 TYR 165.A OH no hydrogen 3.109 N/A ASN 140.A N ALA 137.A O no hydrogen 2.967 N/A ASN 140.A ND2 ASP 135.A O no hydrogen 2.770 N/A ASN 140.A ND2 ASP 135.A OD2 no hydrogen 3.103 N/A CYS 141.A N ALA 138.A O no hydrogen 2.771 N/A CYS 141.A SG ALA 137.A O no hydrogen 3.679 N/A MET 142.A N LYS 150.A O no hydrogen 2.886 N/A VAL 143.A N GLY 95.A O no hydrogen 2.525 N/A ALA 144.A N THR 148.A O no hydrogen 2.845 N/A PHE 147.A N ALA 144.A O no hydrogen 2.814 N/A THR 148.A N ASP 146.A OD1 no hydrogen 2.728 N/A THR 148.A OG1 ASP 146.A OD1 no hydrogen 3.057 N/A THR 148.A OG1 ASP 146.A OD2 no hydrogen 3.528 N/A VAL 149.A N GLU 118.A OE1 no hydrogen 2.870 N/A LYS 150.A N MET 142.A O no hydrogen 2.863 N/A LYS 150.A NZ HIS 70.A O no hydrogen 2.501 N/A LYS 150.A NZ GLU 90.A OE1 no hydrogen 2.710 N/A ILE 151.A N HIS 71.A O no hydrogen 2.987 N/A MET 156.A N PHE 154.A O no hydrogen 2.676 N/A TYR 161.A OH ASP 96.A OD2 no hydrogen 2.986 N/A TYR 161.A OH SER 99.A OG no hydrogen 2.697 N/A THR 163.A OG1 ASP 164.A OD2 no hydrogen 3.364 N/A TYR 165.A N GLU 162.A O no hydrogen 3.023 N/A TYR 165.A OH ASP 135.A OD1 no hydrogen 3.059 N/A TYR 165.A OH ASP 135.A OD2 no hydrogen 2.321 N/A TYR 166.A N LEU 174.A O no hydrogen 2.806 N/A TYR 166.A OH GLU 219.A OE1 no hydrogen 2.470 N/A GLY 170.A N ARG 167.A O no hydrogen 2.903 N/A LEU 174.A N TYR 166.A O no hydrogen 2.640 N/A ARG 177.A NE ASN 218.A OD1 no hydrogen 3.318 N/A ARG 177.A NH1 PRO 212.A O no hydrogen 2.685 N/A ARG 177.A NH1 TYR 213.A O no hydrogen 2.749 N/A ARG 177.A NH1 LEU 216.A O no hydrogen 3.441 N/A ARG 177.A NH2 LEU 216.A O no hydrogen 2.704 N/A ARG 177.A NH2 ASN 218.A OD1 no hydrogen 3.503 N/A TRP 178.A N PRO 175.A O no hydrogen 3.192 N/A TRP 178.A NE1 GLU 204.A OE1 no hydrogen 3.212 N/A MET 179.A N VAL 176.A O no hydrogen 3.102 N/A SER 180.A OG SER 183.A OG no hydrogen 2.983 N/A GLU 182.A N GLU 182.A OE1 no hydrogen 3.160 N/A SER 183.A N SER 180.A OG no hydrogen 3.167 N/A SER 183.A OG SER 180.A OG no hydrogen 2.983 N/A SER 183.A OG VAL 188.A O no hydrogen 2.771 N/A LEU 184.A N SER 180.A O no hydrogen 2.897 N/A LYS 185.A N PRO 181.A O no hydrogen 3.017 N/A GLY 187.A N SER 183.A O no hydrogen 2.604 N/A THR 190.A N SER 193.A OG no hydrogen 2.638 N/A SER 193.A N THR 190.A OG1 no hydrogen 3.318 N/A SER 193.A OG THR 190.A O no hydrogen 2.523 N/A ASP 194.A N THR 190.A O no hydrogen 2.958 N/A VAL 195.A N THR 191.A O no hydrogen 3.060 N/A TRP 196.A N TYR 192.A O no hydrogen 3.153 N/A SER 197.A N SER 193.A O no hydrogen 3.044 N/A SER 197.A OG TRP 178.A O no hydrogen 2.786 N/A SER 197.A OG SER 193.A O no hydrogen 3.459 N/A PHE 198.A N ASP 194.A O no hydrogen 2.946 N/A GLY 199.A N VAL 195.A O no hydrogen 3.208 N/A VAL 200.A N SER 197.A O no hydrogen 2.859 N/A VAL 201.A N SER 197.A O no hydrogen 2.832 N/A LEU 202.A N PHE 198.A O no hydrogen 2.854 N/A TRP 203.A N GLY 199.A O no hydrogen 2.983 N/A TRP 203.A NE1 ASP 232.A O no hydrogen 2.958 N/A GLU 204.A N VAL 200.A O no hydrogen 2.746 N/A ILE 205.A N VAL 201.A O no hydrogen 2.940 N/A ALA 206.A N LEU 202.A O no hydrogen 3.119 N/A THR 207.A N TRP 203.A O no hydrogen 3.189 N/A THR 207.A N GLU 204.A O no hydrogen 3.176 N/A THR 207.A OG1 TRP 203.A O no hydrogen 2.997 N/A THR 207.A OG1 GLU 204.A O no hydrogen 3.304 N/A ALA 209.A N GLU 204.A O no hydrogen 2.707 N/A GLU 210.A N THR 207.A OG1 no hydrogen 3.162 N/A LEU 216.A N TYR 213.A O no hydrogen 2.757 N/A SER 217.A N GLN 220.A OE1 no hydrogen 3.002 N/A GLN 220.A N SER 217.A OG no hydrogen 2.792 N/A VAL 221.A N SER 217.A O no hydrogen 2.626 N/A LEU 222.A N ASN 218.A O no hydrogen 3.147 N/A PHE 224.A N GLN 220.A O no hydrogen 2.985 N/A VAL 225.A N VAL 221.A O no hydrogen 2.870 N/A MET 226.A N LEU 222.A O no hydrogen 3.116 N/A MET 226.A N ARG 223.A O no hydrogen 3.252 N/A GLU 227.A N ARG 223.A O no hydrogen 3.054 N/A GLY 229.A N PHE 224.A O no hydrogen 2.924 N/A LYS 233.A NZ ASP 239.A OD1 no hydrogen 2.690 N/A CYS 237.A N PRO 234.A O no hydrogen 3.255 N/A CYS 237.A SG PRO 238.A O no hydrogen 3.921 N/A PHE 242.A N PRO 238.A O no hydrogen 3.457 N/A LEU 244.A N MET 240.A O no hydrogen 2.924 N/A MET 245.A N LEU 241.A O no hydrogen 2.741 N/A ARG 246.A N PHE 242.A O no hydrogen 3.072 N/A MET 247.A N LEU 244.A O no hydrogen 3.225 N/A CYS 248.A N LEU 244.A O no hydrogen 3.281 N/A CYS 248.A N MET 245.A O no hydrogen 2.732 N/A CYS 248.A SG LEU 244.A O no hydrogen 3.161 N/A TRP 249.A N MET 245.A O no hydrogen 3.004 N/A GLN 250.A NE2 ARG 246.A O no hydrogen 3.000 N/A TYR 251.A OH MET 226.A O no hydrogen 2.573 N/A LYS 254.A NZ TYR 192.A OH no hydrogen 3.189 N/A MET 255.A N ASN 252.A O no hydrogen 3.112 N/A ARG 256.A N PRO 253.A O no hydrogen 3.089 N/A ARG 256.A NE GLN 250.A O no hydrogen 2.692 N/A ARG 256.A NH1 GLU 182.A OE1 no hydrogen 3.103 N/A ARG 256.A NH1 GLU 182.A OE2 no hydrogen 2.984 N/A ARG 256.A NH1 TYR 192.A O no hydrogen 3.531 N/A ARG 256.A NH2 GLU 182.A OE1 no hydrogen 3.121 N/A SER 258.A N GLU 261.A OE1 no hydrogen 2.855 N/A GLU 261.A N SER 258.A OG no hydrogen 3.048 N/A ILE 262.A N SER 258.A O no hydrogen 3.055 N/A ILE 263.A N PHE 259.A O no hydrogen 2.911 N/A SER 264.A N LEU 260.A O no hydrogen 2.857 N/A SER 264.A OG LEU 260.A O no hydrogen 2.741 N/A SER 264.A OG TYR 280.A OH no hydrogen 2.517 N/A SER 265.A N GLU 261.A O no hydrogen 3.176 N/A SER 265.A OG GLU 261.A O no hydrogen 3.262 N/A SER 265.A OG ILE 262.A O no hydrogen 2.555 N/A ILE 266.A N ILE 263.A O no hydrogen 2.607 N/A LYS 267.A NZ GLU 268.A OE1 no hydrogen 3.228 N/A GLU 269.A N ILE 266.A O no hydrogen 2.957 N/A GLU 271.A N GLN 114.A OE1 no hydrogen 2.891 N/A PHE 274.A N GLU 271.A O no hydrogen 3.143 N/A ARG 275.A NH1 GLU 268.A OE2 no hydrogen 3.206 N/A GLU 276.A N GLY 273.A O no hydrogen 2.990 N/A VAL 277.A N PHE 274.A O no hydrogen 3.016 N/A SER 278.A N PHE 274.A O no hydrogen 2.776 N/A SER 278.A OG PHE 274.A O no hydrogen 3.287 N/A PHE 279.A N ASP 121.A OD1 no hydrogen 3.026 N/A PHE 279.A N ASP 121.A OD2 no hydrogen 2.611 N/A TYR 280.A N ASP 121.A OD1 no hydrogen 2.738 N/A TYR 280.A OH SER 264.A OG no hydrogen 2.517 N/A TYR 281.A N SER 278.A OG no hydrogen 3.199 N/A SER 282.A N PHE 279.A O no hydrogen 2.930 N/A SER 282.A OG PHE 279.A O no hydrogen 2.692 N/A ASN 285.A N SER 282.A O no hydrogen 2.962 N/A ASN 285.A N SER 282.A OG no hydrogen 3.083 N/A