Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3zbx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 3.A N ASN 1.A OD1 no hydrogen 2.650 N/A LEU 4.A N ASN 1.A OD1 no hydrogen 3.362 N/A VAL 5.A N ASN 1.A O no hydrogen 3.119 N/A GLN 6.A N PRO 2.A O no hydrogen 3.006 N/A ALA 7.A N GLU 3.A O no hydrogen 3.236 N/A VAL 8.A N LEU 4.A O no hydrogen 3.003 N/A GLN 9.A N VAL 5.A O no hydrogen 2.935 N/A HIS 10.A N ALA 7.A O no hydrogen 3.147 N/A VAL 11.A N VAL 8.A O no hydrogen 2.897 N/A ILE 13.A N ILE 83.A O no hydrogen 2.701 N/A SER 17.A N GLY 14.A O no hydrogen 2.721 N/A LEU 18.A N PRO 15.A O no hydrogen 3.327 N/A ILE 19.A N THR 38.A O no hydrogen 2.884 N/A HIS 21.A N HIS 36.A O no hydrogen 2.776 N/A GLU 24.A N HIS 21.A O no hydrogen 3.024 N/A ILE 26.A N VAL 34.A O no hydrogen 2.886 N/A GLY 29.A N GLY 32.A O no hydrogen 3.023 N/A HIS 30.A N ASP 166.A OD1 no hydrogen 2.685 N/A PHE 31.A N ASP 166.A OD2 no hydrogen 2.807 N/A GLY 32.A N GLY 29.A O no hydrogen 3.411 N/A VAL 34.A N GLY 27.A O no hydrogen 2.751 N/A TYR 35.A N VAL 47.A O no hydrogen 2.838 N/A HIS 36.A N GLU 24.A O no hydrogen 3.091 N/A GLY 37.A N CYS 45.A O no hydrogen 3.055 N/A THR 38.A N ILE 19.A O no hydrogen 2.711 N/A LEU 39.A N ILE 43.A O no hydrogen 2.700 N/A LEU 40.A N SER 17.A O no hydrogen 2.819 N/A LYS 41.A NZ LEU 40.A O no hydrogen 3.235 N/A ILE 43.A N LEU 39.A O no hydrogen 2.659 N/A CYS 45.A N GLY 37.A O no hydrogen 2.972 N/A ALA 46.A N LEU 95.A O no hydrogen 2.785 N/A VAL 47.A N TYR 35.A O no hydrogen 2.862 N/A LYS 48.A N VAL 93.A O no hydrogen 2.752 N/A LYS 48.A NZ SER 49.A O no hydrogen 3.566 N/A LYS 48.A NZ ASP 166.A OD2 no hydrogen 2.715 N/A SER 49.A N CYS 33.A O no hydrogen 2.883 N/A ASN 51.A N SER 49.A OG no hydrogen 3.081 N/A ARG 52.A N PHE 31.A O no hydrogen 3.067 N/A ILE 53.A N LEU 50.A O no hydrogen 2.825 N/A GLU 58.A N ASP 55.A OD2 no hydrogen 3.412 N/A VAL 59.A N ASP 55.A O no hydrogen 3.024 N/A SER 60.A N ILE 56.A O no hydrogen 2.976 N/A GLN 61.A N GLY 57.A O no hydrogen 2.946 N/A GLN 61.A NE2 GLU 65.A OE2 no hydrogen 2.612 N/A PHE 62.A N GLU 58.A O no hydrogen 2.915 N/A LEU 63.A N VAL 59.A O no hydrogen 3.076 N/A THR 64.A N SER 60.A O no hydrogen 2.947 N/A THR 64.A OG1 SER 60.A O no hydrogen 2.655 N/A GLU 65.A N GLN 61.A O no hydrogen 2.984 N/A GLY 66.A N PHE 62.A O no hydrogen 3.025 N/A MET 69.A N GLY 66.A O no hydrogen 3.137 N/A LYS 70.A N ILE 67.A O no hydrogen 2.894 N/A LYS 70.A NZ ASP 71.A OD1 no hydrogen 3.159 N/A ASP 71.A N ILE 68.A O no hydrogen 2.659 N/A PHE 72.A N MET 69.A O no hydrogen 3.184 N/A SER 73.A N TYR 132.A OH no hydrogen 2.915 N/A ASN 76.A N HIS 74.A ND1 no hydrogen 2.866 N/A ASN 76.A ND2 GLN 125.A OE1 no hydrogen 3.019 N/A ASN 76.A ND2 VAL 156.A O no hydrogen 3.104 N/A VAL 77.A N HIS 74.A O no hydrogen 3.037 N/A LEU 78.A N VAL 158.A O no hydrogen 3.030 N/A LEU 81.A N VAL 94.A O no hydrogen 2.933 N/A GLY 82.A N VAL 94.A O no hydrogen 3.151 N/A ILE 83.A N VAL 11.A O no hydrogen 2.999 N/A CYS 84.A N LEU 92.A O no hydrogen 2.899 N/A CYS 84.A SG ILE 13.A O no hydrogen 3.278 N/A ARG 86.A NE SER 90.A O no hydrogen 2.843 N/A ARG 86.A NH2 SER 90.A O no hydrogen 2.836 N/A SER 90.A OG LEU 50.A O no hydrogen 3.454 N/A SER 90.A OG ILE 53.A O no hydrogen 2.831 N/A LEU 92.A N CYS 84.A O no hydrogen 3.028 N/A VAL 93.A N LYS 48.A O no hydrogen 2.987 N/A VAL 94.A N GLY 82.A O no hydrogen 2.891 N/A LEU 95.A N ALA 46.A O no hydrogen 2.799 N/A HIS 100.A N LEU 150.A O no hydrogen 2.966 N/A HIS 100.A ND1 ASP 151.A O no hydrogen 2.821 N/A GLY 101.A N MET 98.A O no hydrogen 2.953 N/A LEU 103.A N CYS 148.A O no hydrogen 2.684 N/A ARG 104.A N ALA 145.A O no hydrogen 3.149 N/A ARG 104.A NE GLY 218.A O no hydrogen 3.299 N/A ARG 104.A NH2 GLY 218.A O no hydrogen 3.028 N/A ASN 105.A N ASP 102.A OD2 no hydrogen 2.996 N/A ASN 105.A ND2 ASP 102.A OD1 no hydrogen 2.793 N/A PHE 106.A N ASP 102.A O no hydrogen 3.179 N/A ILE 107.A N LEU 103.A O no hydrogen 3.044 N/A ARG 108.A N ARG 104.A O no hydrogen 3.162 N/A ASN 109.A N ASN 105.A O no hydrogen 3.159 N/A THR 111.A N ASN 109.A OD1 no hydrogen 2.902 N/A THR 111.A OG1 ASN 109.A OD1 no hydrogen 3.060 N/A HIS 112.A N ASN 109.A O no hydrogen 3.148 N/A ASN 113.A N ASN 109.A O no hydrogen 3.483 N/A THR 115.A N ASP 118.A OD2 no hydrogen 3.030 N/A ASP 118.A N THR 115.A OG1 no hydrogen 3.064 N/A LEU 119.A N THR 115.A O no hydrogen 3.095 N/A ILE 120.A N VAL 116.A O no hydrogen 3.027 N/A GLY 121.A N LYS 117.A O no hydrogen 2.936 N/A PHE 122.A N ASP 118.A O no hydrogen 2.967 N/A GLY 123.A N LEU 119.A O no hydrogen 3.071 N/A LEU 124.A N ILE 120.A O no hydrogen 2.910 N/A GLN 125.A N GLY 121.A O no hydrogen 3.108 N/A GLN 125.A NE2 PHE 154.A O no hydrogen 3.286 N/A VAL 126.A N PHE 122.A O no hydrogen 3.157 N/A ALA 127.A N GLY 123.A O no hydrogen 2.933 N/A LYS 128.A N LEU 124.A O no hydrogen 3.104 N/A GLY 129.A N GLN 125.A O no hydrogen 3.117 N/A MET 130.A N VAL 126.A O no hydrogen 2.864 N/A LYS 131.A N ALA 127.A O no hydrogen 2.891 N/A TYR 132.A N LYS 128.A O no hydrogen 3.100 N/A LEU 133.A N GLY 129.A O no hydrogen 3.081 N/A ALA 134.A N MET 130.A O no hydrogen 2.944 N/A SER 135.A N LYS 131.A O no hydrogen 3.166 N/A SER 135.A OG TYR 132.A O no hydrogen 2.550 N/A LYS 136.A N TYR 132.A O no hydrogen 3.210 N/A LYS 136.A N LEU 133.A O no hydrogen 3.089 N/A LYS 137.A N ALA 134.A O no hydrogen 2.840 N/A PHE 138.A N LEU 133.A O no hydrogen 2.902 N/A HIS 140.A N ASP 203.A OD2 no hydrogen 2.732 N/A ARG 141.A N ASP 203.A OD1 no hydrogen 3.050 N/A ALA 145.A N GLU 213.A OE2 no hydrogen 3.137 N/A ARG 146.A NE TYR 173.A OH no hydrogen 3.175 N/A ARG 146.A NH2 ASP 142.A OD1 no hydrogen 3.394 N/A ARG 146.A NH2 TYR 173.A OH no hydrogen 3.524 N/A ASN 147.A N ALA 144.A O no hydrogen 2.726 N/A ASN 147.A ND2 ASP 142.A O no hydrogen 2.753 N/A ASN 147.A ND2 TYR 173.A OH no hydrogen 3.517 N/A CYS 148.A N ALA 145.A O no hydrogen 3.464 N/A CYS 148.A SG ALA 144.A O no hydrogen 3.731 N/A MET 149.A N LYS 157.A O no hydrogen 2.794 N/A LEU 150.A N GLY 101.A O no hydrogen 2.932 N/A ASP 151.A N THR 155.A O no hydrogen 3.068 N/A GLU 152.A N GLU 152.A OE1 no hydrogen 2.644 N/A LYS 153.A N ASP 151.A OD1 no hydrogen 2.766 N/A PHE 154.A N ASP 151.A O no hydrogen 2.890 N/A THR 155.A N ASP 151.A OD1 no hydrogen 2.941 N/A VAL 156.A N GLN 125.A OE1 no hydrogen 2.858 N/A LYS 157.A N MET 149.A O no hydrogen 2.607 N/A LYS 157.A NZ PRO 75.A O no hydrogen 2.815 N/A VAL 158.A N ASN 76.A O no hydrogen 3.025 N/A ALA 159.A N ASN 147.A O no hydrogen 2.862 N/A ALA 164.A N PHE 161.A O no hydrogen 3.084 N/A ARG 165.A N GLY 162.A O no hydrogen 3.036 N/A ASP 166.A N ASP 160.A OD1 no hydrogen 2.733 N/A MET 167.A N ASP 166.A OD1 no hydrogen 2.596 N/A TYR 168.A OH ALA 164.A O no hydrogen 2.663 N/A GLU 171.A N ASP 169.A OD1 no hydrogen 3.299 N/A TYR 172.A N ASP 169.A O no hydrogen 3.380 N/A TYR 173.A N LYS 170.A O no hydrogen 3.202 N/A TYR 173.A OH ASP 142.A OD1 no hydrogen 3.334 N/A TYR 173.A OH ASP 142.A OD2 no hydrogen 2.551 N/A SER 174.A N LEU 183.A O no hydrogen 2.754 N/A HIS 176.A N SER 174.A OG no hydrogen 3.020 N/A HIS 176.A ND1 THR 227.A OG1 no hydrogen 2.774 N/A ASN 177.A N VAL 175.A O no hydrogen 2.831 N/A ASN 177.A ND2 ALA 181.A O no hydrogen 2.958 N/A LYS 178.A NZ GLN 194.A O no hydrogen 2.636 N/A THR 179.A N ASN 177.A OD1 no hydrogen 2.896 N/A THR 179.A OG1 ASN 177.A OD1 no hydrogen 2.608 N/A GLY 180.A N ASN 177.A O no hydrogen 3.089 N/A ALA 181.A N THR 179.A OG1 no hydrogen 2.756 N/A LYS 182.A NZ TYR 173.A O no hydrogen 3.437 N/A LEU 183.A N SER 174.A O no hydrogen 2.956 N/A VAL 185.A N LEU 183.A O no hydrogen 3.033 N/A LYS 186.A NZ TYR 222.A O no hydrogen 2.950 N/A LYS 186.A NZ VAL 225.A O no hydrogen 2.975 N/A TRP 187.A N PRO 184.A O no hydrogen 3.061 N/A TRP 187.A NE1 GLU 213.A OE2 no hydrogen 2.780 N/A MET 188.A N VAL 185.A O no hydrogen 3.472 N/A GLU 191.A N GLU 191.A OE1 no hydrogen 2.706 N/A SER 192.A N ALA 189.A O no hydrogen 2.829 N/A SER 192.A OG LYS 197.A O no hydrogen 2.580 N/A LEU 193.A N ALA 189.A O no hydrogen 3.100 N/A GLN 194.A N LEU 190.A O no hydrogen 3.024 N/A GLN 194.A NE2 LEU 190.A O no hydrogen 3.671 N/A THR 195.A N GLU 191.A O no hydrogen 2.737 N/A THR 195.A OG1 GLU 191.A O no hydrogen 2.704 N/A GLN 196.A N SER 192.A O no hydrogen 2.785 N/A LYS 197.A N THR 195.A OG1 no hydrogen 3.264 N/A THR 199.A N SER 202.A OG no hydrogen 2.790 N/A LYS 201.A NZ ARG 265.A O no hydrogen 2.696 N/A LYS 201.A NZ PRO 266.A O no hydrogen 3.394 N/A SER 202.A N THR 199.A O no hydrogen 3.184 N/A SER 202.A N THR 199.A OG1 no hydrogen 3.257 N/A SER 202.A OG THR 199.A O no hydrogen 2.658 N/A ASP 203.A N THR 199.A O no hydrogen 3.048 N/A VAL 204.A N THR 200.A O no hydrogen 2.914 N/A TRP 205.A N LYS 201.A O no hydrogen 3.195 N/A SER 206.A N SER 202.A O no hydrogen 3.077 N/A SER 206.A OG TRP 187.A O no hydrogen 2.798 N/A SER 206.A OG SER 202.A O no hydrogen 3.362 N/A PHE 207.A N ASP 203.A O no hydrogen 2.810 N/A GLY 208.A N VAL 204.A O no hydrogen 3.010 N/A VAL 209.A N TRP 205.A O no hydrogen 3.212 N/A LEU 210.A N SER 206.A O no hydrogen 2.873 N/A LEU 211.A N PHE 207.A O no hydrogen 2.840 N/A TRP 212.A N GLY 208.A O no hydrogen 3.148 N/A TRP 212.A NE1 LEU 241.A O no hydrogen 2.884 N/A GLU 213.A N VAL 209.A O no hydrogen 2.886 N/A LEU 214.A N LEU 210.A O no hydrogen 2.918 N/A MET 215.A N LEU 211.A O no hydrogen 3.125 N/A THR 216.A N TRP 212.A O no hydrogen 3.127 N/A THR 216.A OG1 TRP 212.A O no hydrogen 3.164 N/A THR 216.A OG1 GLU 213.A O no hydrogen 3.159 N/A ARG 217.A N LEU 214.A O no hydrogen 2.990 N/A ARG 217.A NH2 ASN 109.A O no hydrogen 3.492 N/A GLY 218.A N GLU 213.A O no hydrogen 2.735 N/A ALA 219.A N THR 216.A OG1 no hydrogen 3.143 N/A VAL 225.A N TYR 222.A O no hydrogen 3.131 N/A THR 227.A OG1 HIS 176.A ND1 no hydrogen 2.774 N/A THR 227.A OG1 ASN 226.A OD1 no hydrogen 3.370 N/A PHE 228.A N ASN 226.A OD1 no hydrogen 2.721 N/A ASP 229.A N ASN 226.A O no hydrogen 2.852 N/A TYR 233.A N ASP 229.A O no hydrogen 2.948 N/A LEU 234.A N ILE 230.A O no hydrogen 3.153 N/A LEU 235.A N THR 231.A O no hydrogen 2.904 N/A GLN 236.A N VAL 232.A O no hydrogen 2.975 N/A GLY 237.A N LEU 234.A O no hydrogen 2.979 N/A ARG 238.A N TYR 233.A O no hydrogen 3.278 N/A ARG 239.A NE TRP 258.A O no hydrogen 3.162 N/A ARG 239.A NH1 LEU 234.A O no hydrogen 3.010 N/A ARG 239.A NH1 ARG 238.A O no hydrogen 2.812 N/A ARG 239.A NH2 TRP 258.A O no hydrogen 2.935 N/A GLN 242.A NE2 CYS 246.A O no hydrogen 2.907 N/A GLN 242.A NE2 ASP 248.A OD1 no hydrogen 2.774 N/A CYS 246.A N PRO 243.A O no hydrogen 2.990 N/A CYS 246.A SG PRO 247.A O no hydrogen 3.338 N/A LEU 250.A N PRO 247.A O no hydrogen 2.947 N/A TYR 251.A N PRO 247.A O no hydrogen 3.109 N/A TYR 251.A OH LEU 240.A O no hydrogen 2.787 N/A GLU 252.A N ASP 248.A O no hydrogen 3.021 N/A VAL 253.A N PRO 249.A O no hydrogen 3.311 N/A MET 254.A N LEU 250.A O no hydrogen 3.036 N/A LEU 255.A N TYR 251.A O no hydrogen 3.039 N/A LYS 256.A N GLU 252.A O no hydrogen 3.175 N/A CYS 257.A N VAL 253.A O no hydrogen 3.148 N/A CYS 257.A SG VAL 204.A O no hydrogen 3.633 N/A CYS 257.A SG VAL 253.A O no hydrogen 3.453 N/A TRP 258.A N LEU 255.A O no hydrogen 3.045 N/A TRP 258.A NE1 TRP 205.A O no hydrogen 3.166 N/A HIS 259.A N LYS 256.A O no hydrogen 3.322 N/A GLU 263.A N GLU 263.A OE1 no hydrogen 2.774 N/A MET 264.A N LYS 261.A O no hydrogen 2.916 N/A ARG 265.A N ALA 262.A O no hydrogen 3.076 N/A ARG 265.A NE LYS 201.A O no hydrogen 3.212 N/A ARG 265.A NH1 HIS 259.A O no hydrogen 2.743 N/A ARG 265.A NH2 GLU 191.A OE2 no hydrogen 2.580 N/A ARG 265.A NH2 LYS 201.A O no hydrogen 2.985 N/A GLU 270.A N SER 267.A OG no hydrogen 3.098 N/A LEU 271.A N SER 267.A O no hydrogen 2.888 N/A VAL 272.A N PHE 268.A O no hydrogen 2.899 N/A SER 273.A N SER 269.A O no hydrogen 3.300 N/A SER 273.A OG SER 269.A O no hydrogen 3.375 N/A ARG 274.A N GLU 270.A O no hydrogen 2.950 N/A ARG 274.A NE GLU 270.A OE2 no hydrogen 2.768 N/A ARG 274.A NH2 GLU 270.A OE2 no hydrogen 3.251 N/A ILE 275.A N LEU 271.A O no hydrogen 2.875 N/A SER 276.A N VAL 272.A O no hydrogen 2.954 N/A ALA 277.A N SER 273.A O no hydrogen 2.975 N/A ILE 278.A N ARG 274.A O no hydrogen 2.976 N/A PHE 279.A N ILE 275.A O no hydrogen 2.674 N/A SER 280.A N SER 276.A O no hydrogen 3.107 N/A SER 280.A OG SER 276.A O no hydrogen 2.985 N/A THR 281.A N ILE 278.A O no hydrogen 3.209 N/A THR 281.A OG1 ILE 278.A O no hydrogen 2.726 N/A PHE 282.A N PHE 279.A O no hydrogen 3.002 N/A ILE 283.A N PHE 279.A O no hydrogen 3.529 N/A