Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2wqb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 1.A N PRO 2.A O no hydrogen 2.667 N/A LEU 4.A N ALA 61.A O no hydrogen 2.719 N/A ASP 8.A N ASP 5.A O no hydrogen 3.077 N/A ILE 9.A N TRP 6.A O no hydrogen 3.013 N/A LYS 10.A N ARG 25.A O no hydrogen 3.039 N/A GLN 12.A N LYS 23.A O no hydrogen 2.629 N/A VAL 14.A N ASP 13.A OD2 no hydrogen 2.585 N/A ILE 15.A N VAL 21.A O no hydrogen 3.034 N/A LEU 22.A N ILE 37.A O no hydrogen 3.082 N/A LYS 23.A N ASP 13.A O no hydrogen 2.724 N/A LYS 23.A NZ ALA 24.A O no hydrogen 3.275 N/A LYS 23.A NZ ASP 34.A OD2 no hydrogen 2.936 N/A ALA 24.A N ALA 35.A O no hydrogen 3.127 N/A ARG 25.A N LYS 10.A O no hydrogen 2.948 N/A ARG 25.A NE ASP 34.A OD2 no hydrogen 3.001 N/A ARG 25.A NH2 ASP 34.A OD2 no hydrogen 3.450 N/A ILE 26.A N MET 33.A O no hydrogen 2.883 N/A LYS 28.A N LEU 31.A O no hydrogen 2.840 N/A LEU 31.A N LYS 28.A O no hydrogen 3.211 N/A MET 33.A N ILE 26.A O no hydrogen 2.969 N/A ALA 35.A N ALA 24.A O no hydrogen 3.426 N/A ALA 36.A N ILE 72.A O no hydrogen 3.023 N/A ILE 37.A N LEU 22.A O no hydrogen 2.907 N/A LYS 38.A N LEU 70.A O no hydrogen 3.143 N/A ARG 39.A NH1 GLN 20.A OE1 no hydrogen 3.374 N/A MET 40.A N LEU 68.A O no hydrogen 2.980 N/A CYS 47.A SG LEU 43.A O no hydrogen 3.807 N/A CYS 47.A SG ASP 152.A OD1 no hydrogen 3.792 N/A LYS 48.A N VAL 45.A O no hydrogen 3.041 N/A GLY 50.A N CYS 47.A O no hydrogen 3.482 N/A HIS 52.A N LEU 49.A O no hydrogen 3.092 N/A ASN 54.A N HIS 52.A ND1 no hydrogen 2.990 N/A ASN 54.A ND2 ALA 148.A O no hydrogen 3.313 N/A ILE 55.A N HIS 52.A O no hydrogen 2.990 N/A ILE 56.A N ILE 150.A O no hydrogen 2.783 N/A ASN 57.A N GLU 73.A OE1 no hydrogen 3.126 N/A LEU 59.A N ALA 71.A O no hydrogen 2.821 N/A GLY 60.A N ALA 71.A O no hydrogen 2.997 N/A CYS 62.A N TYR 69.A O no hydrogen 3.030 N/A CYS 62.A SG GLU 63.A O no hydrogen 3.800 N/A HIS 64.A N TYR 67.A O no hydrogen 2.741 N/A TYR 67.A N HIS 64.A O no hydrogen 3.149 N/A LEU 68.A N MET 40.A O no hydrogen 3.477 N/A TYR 69.A N CYS 62.A O no hydrogen 2.778 N/A LEU 70.A N LYS 38.A O no hydrogen 2.830 N/A ALA 71.A N GLY 60.A O no hydrogen 2.705 N/A ILE 72.A N ALA 36.A O no hydrogen 2.906 N/A GLU 73.A N ASN 57.A O no hydrogen 2.574 N/A LEU 80.A N ILE 140.A O no hydrogen 2.568 N/A ASP 82.A N ASN 79.A OD1 no hydrogen 2.846 N/A PHE 83.A N ASN 79.A O no hydrogen 3.255 N/A LEU 84.A N LEU 80.A O no hydrogen 2.865 N/A ARG 85.A N LEU 81.A O no hydrogen 3.036 N/A ARG 85.A NE GLY 204.A O no hydrogen 2.926 N/A ARG 85.A NH1 GLY 204.A O no hydrogen 3.145 N/A LYS 86.A N ASP 82.A O no hydrogen 2.722 N/A SER 87.A N LEU 84.A O no hydrogen 3.006 N/A SER 87.A OG LEU 84.A O no hydrogen 2.738 N/A SER 87.A OG SER 104.A OG no hydrogen 2.238 N/A ARG 88.A N ARG 85.A O no hydrogen 3.002 N/A ARG 88.A NE LEU 203.A O no hydrogen 3.107 N/A ARG 88.A NH1 SER 202.A O no hydrogen 3.141 N/A ARG 88.A NH1 ALA 283.A O no hydrogen 2.593 N/A ARG 88.A NH2 ALA 283.A O no hydrogen 3.206 N/A VAL 89.A N ALA 103.A O no hydrogen 2.934 N/A LEU 90.A N TYR 282.A OH no hydrogen 3.171 N/A GLU 91.A N ARG 88.A O no hydrogen 3.282 N/A THR 92.A N ARG 88.A O no hydrogen 3.225 N/A THR 92.A OG1 ARG 88.A O no hydrogen 3.227 N/A ASP 93.A N VAL 89.A O no hydrogen 2.810 N/A ALA 97.A N ASP 93.A O no hydrogen 2.934 N/A ILE 98.A N PRO 94.A O no hydrogen 2.866 N/A ALA 99.A N ALA 95.A O no hydrogen 3.137 N/A ASN 100.A N PHE 96.A O no hydrogen 2.919 N/A ASN 100.A ND2 PHE 96.A O no hydrogen 3.327 N/A SER 101.A N ILE 98.A O no hydrogen 3.136 N/A THR 102.A N ALA 97.A O no hydrogen 2.945 N/A THR 102.A OG1 SER 104.A O no hydrogen 3.066 N/A THR 102.A OG1 THR 274.A O no hydrogen 3.213 N/A ALA 103.A N THR 274.A O no hydrogen 2.668 N/A SER 104.A OG SER 87.A O no hydrogen 3.066 N/A SER 104.A OG SER 87.A OG no hydrogen 2.238 N/A THR 105.A N SER 87.A O no hydrogen 3.021 N/A LEU 106.A N SER 104.A OG no hydrogen 2.970 N/A SER 107.A N GLN 110.A OE1 no hydrogen 3.161 N/A GLN 109.A NE2 LEU 265.A O no hydrogen 2.824 N/A GLN 110.A N SER 107.A OG no hydrogen 3.247 N/A LEU 111.A N SER 107.A O no hydrogen 2.779 N/A LEU 112.A N SER 108.A O no hydrogen 2.972 N/A HIS 113.A N GLN 109.A O no hydrogen 3.013 N/A PHE 114.A N GLN 110.A O no hydrogen 3.307 N/A PHE 114.A N LEU 111.A O no hydrogen 3.262 N/A ALA 115.A N LEU 111.A O no hydrogen 3.279 N/A ALA 116.A N LEU 112.A O no hydrogen 2.641 N/A ASP 117.A N HIS 113.A O no hydrogen 2.653 N/A VAL 118.A N PHE 114.A O no hydrogen 3.031 N/A ALA 119.A N ALA 115.A O no hydrogen 2.864 N/A ARG 120.A N ALA 116.A O no hydrogen 2.684 N/A ARG 120.A NH1 ASN 54.A OD1 no hydrogen 2.851 N/A ARG 120.A NH1 ASP 117.A OD2 no hydrogen 3.013 N/A GLY 121.A N ASP 117.A O no hydrogen 3.156 N/A MET 122.A N VAL 118.A O no hydrogen 2.888 N/A ASP 123.A N ALA 119.A O no hydrogen 2.839 N/A TYR 124.A N ARG 120.A O no hydrogen 3.069 N/A LEU 125.A N GLY 121.A O no hydrogen 2.906 N/A SER 126.A N MET 122.A O no hydrogen 2.581 N/A SER 126.A OG MET 122.A O no hydrogen 3.363 N/A SER 126.A OG ASP 123.A O no hydrogen 3.189 N/A GLN 127.A N ASP 123.A O no hydrogen 3.018 N/A LYS 128.A N LEU 125.A O no hydrogen 2.711 N/A LYS 128.A NZ TYR 124.A OH no hydrogen 3.282 N/A GLN 129.A N SER 126.A O no hydrogen 2.912 N/A GLN 129.A NE2 GLN 127.A O no hydrogen 3.015 N/A PHE 130.A N LEU 125.A O no hydrogen 3.258 N/A ILE 131.A N SER 156.A O no hydrogen 2.769 N/A HIS 132.A N ASP 189.A OD2 no hydrogen 2.644 N/A ARG 133.A N ASP 189.A OD1 no hydrogen 2.765 N/A ASN 134.A N HIS 132.A ND1 no hydrogen 3.008 N/A ALA 137.A N GLU 199.A OE2 no hydrogen 2.867 N/A ASN 139.A N ALA 136.A O no hydrogen 2.741 N/A ASN 139.A ND2 ASN 134.A O no hydrogen 2.885 N/A ILE 140.A N ALA 137.A O no hydrogen 3.040 N/A LEU 141.A N LYS 149.A O no hydrogen 2.817 N/A VAL 142.A N GLY 78.A O no hydrogen 3.086 N/A GLY 143.A N VAL 147.A O no hydrogen 2.695 N/A VAL 147.A N GLU 144.A O no hydrogen 3.299 N/A ALA 148.A N ASP 117.A OD1 no hydrogen 2.918 N/A LYS 149.A N LEU 141.A O no hydrogen 2.593 N/A LYS 149.A NZ PRO 53.A O no hydrogen 2.741 N/A LYS 149.A NZ GLU 73.A OE1 no hydrogen 3.094 N/A LYS 149.A NZ GLU 73.A OE2 no hydrogen 2.902 N/A ILE 150.A N ASN 54.A O no hydrogen 2.907 N/A ASP 152.A N ASP 152.A OD2 no hydrogen 2.483 N/A ARG 157.A NE LYS 128.A O no hydrogen 2.971 N/A ARG 157.A NH2 LYS 128.A O no hydrogen 3.080 N/A GLY 158.A N GLN 129.A O no hydrogen 2.856 N/A VAL 161.A N TYR 184.A O no hydrogen 3.053 N/A VAL 163.A N SER 182.A O no hydrogen 2.871 N/A ARG 172.A NH1 MET 211.A O no hydrogen 3.033 N/A TRP 173.A N PRO 170.A O no hydrogen 2.649 N/A TRP 173.A NE1 GLU 199.A OE2 no hydrogen 2.872 N/A MET 174.A N PRO 170.A O no hydrogen 3.177 N/A MET 174.A N VAL 171.A O no hydrogen 2.941 N/A GLU 177.A N GLU 177.A OE1 no hydrogen 2.580 N/A SER 178.A OG VAL 183.A O no hydrogen 2.588 N/A LEU 179.A N ALA 175.A O no hydrogen 2.691 N/A ASN 180.A N ILE 176.A O no hydrogen 2.514 N/A TYR 181.A N GLU 177.A O no hydrogen 2.800 N/A SER 182.A N SER 178.A O no hydrogen 2.939 N/A TYR 184.A N VAL 161.A O no hydrogen 2.900 N/A THR 185.A N SER 188.A OG no hydrogen 3.126 N/A THR 186.A OG1 PHE 130.A O no hydrogen 3.487 N/A SER 188.A N THR 185.A OG1 no hydrogen 3.025 N/A SER 188.A OG THR 185.A O no hydrogen 2.858 N/A ASP 189.A N THR 185.A O no hydrogen 3.141 N/A VAL 190.A N THR 186.A O no hydrogen 3.028 N/A TRP 191.A N ASN 187.A O no hydrogen 3.397 N/A SER 192.A N SER 188.A O no hydrogen 3.261 N/A SER 192.A OG TRP 173.A O no hydrogen 2.811 N/A SER 192.A OG SER 188.A O no hydrogen 3.502 N/A TYR 193.A N ASP 189.A O no hydrogen 2.851 N/A TYR 193.A OH ALA 115.A O no hydrogen 2.878 N/A GLY 194.A N VAL 190.A O no hydrogen 2.978 N/A VAL 195.A N TRP 191.A O no hydrogen 3.367 N/A VAL 195.A N SER 192.A O no hydrogen 2.858 N/A LEU 196.A N SER 192.A O no hydrogen 2.866 N/A LEU 197.A N TYR 193.A O no hydrogen 2.750 N/A TRP 198.A N GLY 194.A O no hydrogen 2.776 N/A TRP 198.A NE1 GLU 227.A O no hydrogen 3.126 N/A GLU 199.A N VAL 195.A O no hydrogen 2.641 N/A ILE 200.A N LEU 196.A O no hydrogen 2.842 N/A VAL 201.A N LEU 197.A O no hydrogen 2.961 N/A SER 202.A N TRP 198.A O no hydrogen 3.151 N/A SER 202.A N GLU 199.A O no hydrogen 3.104 N/A SER 202.A OG TRP 198.A O no hydrogen 2.440 N/A SER 202.A OG GLU 199.A O no hydrogen 3.288 N/A LEU 203.A N ILE 200.A O no hydrogen 2.975 N/A GLY 204.A N GLU 199.A O no hydrogen 3.026 N/A GLY 205.A N SER 202.A O no hydrogen 3.081 N/A THR 206.A N GLY 284.A O no hydrogen 2.980 N/A THR 206.A OG1 ILE 285.A O no hydrogen 2.840 N/A LEU 216.A N THR 212.A O no hydrogen 3.063 N/A TYR 217.A N CYS 213.A O no hydrogen 3.242 N/A GLU 218.A N ALA 214.A O no hydrogen 3.329 N/A LYS 219.A N GLU 215.A O no hydrogen 3.006 N/A LYS 219.A N LEU 216.A O no hydrogen 2.942 N/A LEU 220.A N LEU 216.A O no hydrogen 2.940 N/A GLY 223.A N LEU 220.A O no hydrogen 2.846 N/A TYR 224.A N LYS 219.A O no hydrogen 2.984 N/A TYR 224.A OH GLU 227.A OE2 no hydrogen 3.361 N/A ARG 225.A NE TRP 244.A O no hydrogen 2.667 N/A ARG 225.A NH1 LEU 220.A O no hydrogen 3.490 N/A ARG 225.A NH1 TYR 224.A O no hydrogen 2.733 N/A ARG 225.A NH2 TRP 244.A O no hydrogen 2.785 N/A LYS 228.A NZ ASP 234.A OD1 no hydrogen 2.555 N/A ASN 231.A ND2 VAL 201.A O no hydrogen 3.096 N/A ASN 231.A ND2 ASN 273.A O no hydrogen 2.953 N/A CYS 232.A N PRO 229.A O no hydrogen 3.060 N/A CYS 232.A SG ASP 233.A O no hydrogen 3.256 N/A ASP 233.A N TYR 271.A O no hydrogen 2.795 N/A GLU 235.A N ASP 233.A OD2 no hydrogen 2.712 N/A TYR 237.A N ASP 233.A O no hydrogen 3.247 N/A TYR 237.A OH LEU 226.A O no hydrogen 2.563 N/A ASP 238.A N ASP 234.A O no hydrogen 2.731 N/A LEU 239.A N GLU 235.A O no hydrogen 2.837 N/A MET 240.A N VAL 236.A O no hydrogen 3.092 N/A ARG 241.A N TYR 237.A O no hydrogen 2.876 N/A ARG 241.A NH1 TYR 237.A OH no hydrogen 3.350 N/A GLN 242.A N ASP 238.A O no hydrogen 3.095 N/A GLN 242.A N LEU 239.A O no hydrogen 3.022 N/A CYS 243.A N LEU 239.A O no hydrogen 3.374 N/A CYS 243.A SG LEU 239.A O no hydrogen 3.507 N/A TRP 244.A N ARG 241.A O no hydrogen 3.154 N/A TRP 244.A NE1 TRP 191.A O no hydrogen 2.885 N/A ARG 245.A N GLN 242.A O no hydrogen 3.218 N/A ARG 245.A NH1 GLN 242.A OE1 no hydrogen 2.959 N/A GLU 250.A N LYS 247.A O no hydrogen 2.769 N/A ARG 251.A N PRO 248.A O no hydrogen 2.819 N/A ARG 251.A NE ARG 245.A O no hydrogen 3.013 N/A ARG 251.A NH1 GLU 177.A OE2 no hydrogen 2.787 N/A ARG 251.A NH1 ASN 187.A O no hydrogen 2.687 N/A ARG 251.A NH2 GLU 177.A OE1 no hydrogen 3.226 N/A ARG 251.A NH2 GLU 177.A OE2 no hydrogen 2.779 N/A ARG 251.A NH2 ARG 245.A O no hydrogen 3.228 N/A SER 253.A N GLN 256.A OE1 no hydrogen 2.722 N/A GLN 256.A N SER 253.A OG no hydrogen 3.205 N/A ILE 257.A N SER 253.A O no hydrogen 3.025 N/A LEU 258.A N PHE 254.A O no hydrogen 2.681 N/A VAL 259.A N ALA 255.A O no hydrogen 2.670 N/A SER 260.A N GLN 256.A O no hydrogen 2.980 N/A LEU 261.A N ILE 257.A O no hydrogen 2.830 N/A ASN 262.A N LEU 258.A O no hydrogen 3.019 N/A ARG 263.A N VAL 259.A O no hydrogen 3.047 N/A ARG 263.A NH1 GLU 235.A OE2 no hydrogen 2.817 N/A ARG 263.A NH2 GLU 235.A OE2 no hydrogen 2.742 N/A MET 264.A N SER 260.A O no hydrogen 3.131 N/A LEU 265.A N LEU 261.A O no hydrogen 2.750 N/A GLU 266.A N ASN 262.A O no hydrogen 3.115 N/A GLU 267.A N ARG 263.A O no hydrogen 3.140 N/A LYS 269.A NZ ASP 233.A OD1 no hydrogen 3.401 N/A VAL 272.A N SER 108.A OG no hydrogen 3.280 N/A ASN 273.A N ASN 231.A O no hydrogen 2.751 N/A ASN 273.A ND2 THR 275.A O no hydrogen 2.958 N/A THR 274.A OG1 THR 102.A OG1 no hydrogen 3.026 N/A THR 275.A N ASN 273.A OD1 no hydrogen 2.851 N/A LEU 276.A N SER 101.A O no hydrogen 2.755 N/A TYR 282.A OH ALA 103.A O no hydrogen 2.448 N/A