Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4xyf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 6.A N ASP 3.A O no hydrogen 3.080 N/A LEU 7.A N LEU 4.A O no hydrogen 3.413 N/A GLU 10.A N ASN 8.A OD1 no hydrogen 3.296 N/A LEU 11.A N ASN 8.A O no hydrogen 2.909 N/A ALA 14.A N LEU 11.A O no hydrogen 3.023 N/A VAL 15.A N VAL 12.A O no hydrogen 3.211 N/A GLN 16.A NE2 GLN 13.A O no hydrogen 3.436 N/A HIS 17.A N ALA 14.A O no hydrogen 3.076 N/A VAL 18.A N VAL 15.A O no hydrogen 3.177 N/A VAL 19.A N VAL 15.A O no hydrogen 3.108 N/A ILE 20.A N ILE 89.A O no hydrogen 2.718 N/A SER 24.A N GLY 21.A O no hydrogen 2.821 N/A LEU 25.A N PRO 22.A O no hydrogen 3.470 N/A ILE 26.A N THR 45.A O no hydrogen 2.972 N/A HIS 28.A N HIS 43.A O no hydrogen 3.029 N/A ILE 33.A N VAL 41.A O no hydrogen 2.830 N/A GLY 34.A N VAL 41.A O no hydrogen 3.333 N/A GLY 36.A N GLY 39.A O no hydrogen 2.863 N/A HIS 37.A N MET 173.A O no hydrogen 3.334 N/A PHE 38.A N ASP 172.A OD1 no hydrogen 3.117 N/A PHE 38.A N ASP 172.A OD2 no hydrogen 2.978 N/A VAL 41.A N GLY 34.A O no hydrogen 2.864 N/A TYR 42.A N VAL 53.A O no hydrogen 2.853 N/A GLY 44.A N CYS 51.A O no hydrogen 3.005 N/A THR 45.A N ILE 26.A O no hydrogen 2.878 N/A LEU 46.A N ILE 49.A O no hydrogen 2.949 N/A LEU 47.A N SER 24.A O no hydrogen 3.066 N/A ILE 49.A N LEU 46.A O no hydrogen 2.893 N/A CYS 51.A N GLY 44.A O no hydrogen 2.853 N/A ALA 52.A N LEU 101.A O no hydrogen 2.705 N/A VAL 53.A N TYR 42.A O no hydrogen 2.864 N/A LYS 54.A N VAL 99.A O no hydrogen 2.779 N/A LYS 54.A NZ ASP 172.A OD2 no hydrogen 2.462 N/A LYS 54.A NZ TYR 174.A OH no hydrogen 3.103 N/A SER 55.A N CYS 40.A O no hydrogen 2.935 N/A ASN 57.A N SER 55.A OG no hydrogen 3.306 N/A ARG 58.A N PHE 38.A O no hydrogen 3.143 N/A ARG 58.A NH1 HIS 37.A O no hydrogen 2.956 N/A ILE 59.A N LEU 56.A O no hydrogen 3.218 N/A GLY 63.A N ASP 61.A OD1 no hydrogen 3.526 N/A SER 66.A OG ALA 6.A O no hydrogen 3.361 N/A PHE 68.A N GLU 64.A O no hydrogen 3.025 N/A LEU 69.A N VAL 65.A O no hydrogen 2.957 N/A THR 70.A N SER 66.A O no hydrogen 3.077 N/A THR 70.A OG1 SER 66.A O no hydrogen 2.551 N/A GLU 71.A N GLN 67.A O no hydrogen 2.856 N/A GLY 72.A N PHE 68.A O no hydrogen 3.055 N/A ILE 73.A N LEU 69.A O no hydrogen 2.819 N/A ILE 74.A N THR 70.A O no hydrogen 2.968 N/A MET 75.A N GLU 71.A O no hydrogen 2.952 N/A LYS 76.A N GLY 72.A O no hydrogen 2.777 N/A LYS 76.A NZ HIS 17.A O no hydrogen 3.072 N/A ASP 77.A N ILE 73.A O no hydrogen 3.309 N/A PHE 78.A N MET 75.A O no hydrogen 3.185 N/A SER 79.A N TYR 138.A OH no hydrogen 2.870 N/A ASN 82.A N HIS 80.A ND1 no hydrogen 3.024 N/A ASN 82.A ND2 VAL 162.A O no hydrogen 2.993 N/A VAL 83.A N HIS 80.A O no hydrogen 3.077 N/A LEU 84.A N VAL 164.A O no hydrogen 2.759 N/A LEU 87.A N VAL 100.A O no hydrogen 2.943 N/A GLY 88.A N VAL 100.A O no hydrogen 3.273 N/A ILE 89.A N VAL 18.A O no hydrogen 2.908 N/A CYS 90.A N LEU 98.A O no hydrogen 3.029 N/A CYS 90.A SG ILE 20.A O no hydrogen 3.586 N/A ARG 92.A NE SER 96.A O no hydrogen 2.721 N/A SER 93.A OG GLU 94.A OE1 no hydrogen 2.749 N/A LEU 98.A N CYS 90.A O no hydrogen 2.805 N/A VAL 99.A N LYS 54.A O no hydrogen 2.868 N/A VAL 100.A N GLY 88.A O no hydrogen 2.877 N/A LEU 101.A N ALA 52.A O no hydrogen 2.823 N/A HIS 106.A N LEU 156.A O no hydrogen 2.935 N/A GLY 107.A N MET 104.A O no hydrogen 3.106 N/A LEU 109.A N CYS 154.A O no hydrogen 2.756 N/A ARG 110.A N ALA 151.A O no hydrogen 3.170 N/A ARG 110.A NE GLY 224.A O no hydrogen 3.038 N/A ARG 110.A NH2 GLY 224.A O no hydrogen 2.909 N/A ASN 111.A N ASP 108.A OD2 no hydrogen 3.047 N/A ASN 111.A ND2 ASP 108.A OD1 no hydrogen 2.741 N/A PHE 112.A N ASP 108.A O no hydrogen 3.017 N/A ILE 113.A N LEU 109.A O no hydrogen 3.066 N/A ARG 114.A N ARG 110.A O no hydrogen 3.107 N/A ARG 114.A N ASN 111.A O no hydrogen 3.226 N/A ARG 114.A NH2 GLY 224.A O no hydrogen 3.218 N/A ASN 115.A N PHE 112.A O no hydrogen 3.295 N/A THR 117.A N ASN 115.A OD1 no hydrogen 2.649 N/A THR 117.A OG1 ASN 115.A OD1 no hydrogen 2.716 N/A HIS 118.A N ASN 115.A O no hydrogen 3.254 N/A THR 121.A N ASP 124.A OD2 no hydrogen 2.804 N/A THR 121.A OG1 GLY 290.A O no hydrogen 2.939 N/A LYS 123.A NZ PHE 285.A O no hydrogen 2.823 N/A LYS 123.A NZ PHE 288.A O no hydrogen 3.082 N/A ASP 124.A N THR 121.A OG1 no hydrogen 3.028 N/A LEU 125.A N THR 121.A O no hydrogen 3.009 N/A ILE 126.A N VAL 122.A O no hydrogen 3.027 N/A GLY 127.A N LYS 123.A O no hydrogen 2.882 N/A PHE 128.A N ASP 124.A O no hydrogen 2.825 N/A GLY 129.A N LEU 125.A O no hydrogen 3.086 N/A LEU 130.A N ILE 126.A O no hydrogen 2.851 N/A GLN 131.A N GLY 127.A O no hydrogen 3.047 N/A GLN 131.A NE2 GLY 127.A O no hydrogen 3.432 N/A VAL 132.A N PHE 128.A O no hydrogen 3.069 N/A ALA 133.A N GLY 129.A O no hydrogen 2.953 N/A LYS 134.A N LEU 130.A O no hydrogen 2.942 N/A GLY 135.A N GLN 131.A O no hydrogen 3.017 N/A MET 136.A N VAL 132.A O no hydrogen 2.900 N/A LYS 137.A N ALA 133.A O no hydrogen 2.837 N/A TYR 138.A N LYS 134.A O no hydrogen 3.066 N/A LEU 139.A N GLY 135.A O no hydrogen 2.942 N/A ALA 140.A N MET 136.A O no hydrogen 2.809 N/A SER 141.A N LYS 137.A O no hydrogen 2.961 N/A SER 141.A OG TYR 138.A O no hydrogen 2.660 N/A LYS 142.A N TYR 138.A O no hydrogen 3.194 N/A LYS 142.A N LEU 139.A O no hydrogen 3.053 N/A LYS 143.A N ALA 140.A O no hydrogen 2.906 N/A PHE 144.A N LEU 139.A O no hydrogen 3.006 N/A HIS 146.A N ASP 209.A OD2 no hydrogen 2.948 N/A HIS 146.A NE2 ALA 165.A O no hydrogen 2.757 N/A ARG 147.A N ASP 209.A OD1 no hydrogen 3.020 N/A ASP 148.A N HIS 146.A ND1 no hydrogen 3.011 N/A ALA 151.A N GLU 219.A OE1 no hydrogen 2.970 N/A ARG 152.A NE TYR 179.A OH no hydrogen 2.957 N/A ARG 152.A NH1 ASP 148.A OD1 no hydrogen 3.029 N/A ARG 152.A NH1 TYR 179.A OH no hydrogen 3.363 N/A ASN 153.A N ALA 150.A O no hydrogen 2.991 N/A ASN 153.A ND2 ASP 148.A O no hydrogen 2.843 N/A ASN 153.A ND2 TYR 179.A OH no hydrogen 3.472 N/A CYS 154.A N ALA 151.A O no hydrogen 3.439 N/A CYS 154.A SG ALA 150.A O no hydrogen 3.697 N/A MET 155.A N LYS 163.A O no hydrogen 2.885 N/A LEU 156.A N GLY 107.A O no hydrogen 2.769 N/A ASP 157.A N THR 161.A O no hydrogen 3.210 N/A GLU 158.A N GLU 158.A OE1 no hydrogen 2.811 N/A LYS 159.A N ASP 157.A OD1 no hydrogen 2.950 N/A PHE 160.A N ASP 157.A O no hydrogen 2.816 N/A THR 161.A N ASP 157.A OD1 no hydrogen 2.939 N/A VAL 162.A N GLN 131.A OE1 no hydrogen 2.769 N/A LYS 163.A N MET 155.A O no hydrogen 2.826 N/A LYS 163.A NZ PRO 81.A O no hydrogen 2.630 N/A VAL 164.A N ASN 82.A O no hydrogen 2.794 N/A ALA 165.A N ASN 153.A O no hydrogen 2.965 N/A ALA 170.A N PHE 167.A O no hydrogen 3.034 N/A ARG 171.A N GLY 168.A O no hydrogen 3.198 N/A ARG 171.A NH1 HIS 146.A O no hydrogen 2.487 N/A ASP 172.A N ASP 166.A OD1 no hydrogen 2.905 N/A MET 173.A N ASP 172.A OD1 no hydrogen 2.739 N/A TYR 174.A OH ALA 170.A O no hydrogen 2.576 N/A LYS 176.A NZ HIS 37.A ND1 no hydrogen 3.207 N/A GLU 177.A N ASP 175.A OD1 no hydrogen 3.415 N/A TYR 178.A N ASP 175.A O no hydrogen 3.330 N/A TYR 179.A N LYS 176.A O no hydrogen 3.196 N/A TYR 179.A OH ASP 148.A OD1 no hydrogen 3.309 N/A TYR 179.A OH ASP 148.A OD2 no hydrogen 2.503 N/A SER 180.A N LEU 189.A O no hydrogen 3.000 N/A HIS 182.A N ALA 187.A O no hydrogen 2.734 N/A LYS 184.A N HIS 182.A ND1 no hydrogen 3.348 N/A THR 185.A N HIS 182.A ND1 no hydrogen 3.287 N/A THR 185.A OG1 HIS 182.A ND1 no hydrogen 3.328 N/A GLY 186.A N HIS 182.A O no hydrogen 2.818 N/A ALA 187.A N THR 185.A OG1 no hydrogen 3.261 N/A LEU 189.A N SER 180.A O no hydrogen 2.894 N/A VAL 191.A N LEU 189.A O no hydrogen 2.847 N/A LYS 192.A NZ TYR 228.A O no hydrogen 2.609 N/A LYS 192.A NZ VAL 231.A O no hydrogen 2.755 N/A TRP 193.A N PRO 190.A O no hydrogen 2.836 N/A TRP 193.A NE1 GLU 219.A OE1 no hydrogen 2.913 N/A MET 194.A N VAL 191.A O no hydrogen 3.118 N/A GLU 197.A N GLU 197.A OE2 no hydrogen 2.786 N/A SER 198.A OG LYS 203.A O no hydrogen 2.716 N/A LEU 199.A N ALA 195.A O no hydrogen 2.995 N/A GLN 200.A N LEU 196.A O no hydrogen 3.149 N/A THR 201.A N GLU 197.A O no hydrogen 2.768 N/A THR 201.A OG1 GLU 197.A O no hydrogen 2.842 N/A GLN 202.A N SER 198.A O no hydrogen 2.662 N/A GLN 202.A NE2 THR 185.A OG1 no hydrogen 2.630 N/A LYS 203.A N THR 201.A OG1 no hydrogen 3.103 N/A THR 205.A N SER 208.A OG no hydrogen 2.694 N/A LYS 207.A NZ ARG 271.A O no hydrogen 2.754 N/A SER 208.A N THR 205.A OG1 no hydrogen 3.137 N/A SER 208.A OG THR 205.A O no hydrogen 2.837 N/A ASP 209.A N THR 205.A O no hydrogen 2.968 N/A VAL 210.A N THR 206.A O no hydrogen 2.946 N/A TRP 211.A N LYS 207.A O no hydrogen 3.240 N/A SER 212.A N SER 208.A O no hydrogen 3.122 N/A SER 212.A OG TRP 193.A O no hydrogen 2.722 N/A SER 212.A OG SER 208.A O no hydrogen 3.170 N/A PHE 213.A N ASP 209.A O no hydrogen 2.838 N/A GLY 214.A N VAL 210.A O no hydrogen 3.050 N/A VAL 215.A N TRP 211.A O no hydrogen 3.290 N/A LEU 216.A N SER 212.A O no hydrogen 2.862 N/A LEU 217.A N PHE 213.A O no hydrogen 2.889 N/A TRP 218.A N GLY 214.A O no hydrogen 3.148 N/A TRP 218.A NE1 LEU 247.A O no hydrogen 2.768 N/A GLU 219.A N VAL 215.A O no hydrogen 2.862 N/A LEU 220.A N LEU 216.A O no hydrogen 2.914 N/A MET 221.A N LEU 217.A O no hydrogen 3.041 N/A THR 222.A N TRP 218.A O no hydrogen 3.064 N/A THR 222.A OG1 TRP 218.A O no hydrogen 2.991 N/A THR 222.A OG1 GLU 219.A O no hydrogen 3.165 N/A ARG 223.A N LEU 220.A O no hydrogen 3.017 N/A ARG 223.A NE.A ILE 113.A O no hydrogen 2.791 N/A ARG 223.A NH1.A ILE 113.A O no hydrogen 3.259 N/A ARG 223.A NH1.A HIS 118.A O no hydrogen 2.785 N/A ARG 223.A NH1.B PRO 120.A O no hydrogen 3.031 N/A ARG 223.A NH2.B PRO 120.A O no hydrogen 2.753 N/A GLY 224.A N GLU 219.A O no hydrogen 2.714 N/A ALA 225.A N THR 222.A OG1 no hydrogen 3.190 N/A VAL 231.A N TYR 228.A O no hydrogen 3.130 N/A PHE 234.A N THR 233.A OG1 no hydrogen 2.541 N/A ASP 235.A N ASN 232.A O no hydrogen 2.954 N/A ILE 236.A N THR 233.A O no hydrogen 3.078 N/A TYR 239.A N ASP 235.A O no hydrogen 3.007 N/A LEU 240.A N ILE 236.A O no hydrogen 2.822 N/A LEU 241.A N THR 237.A O no hydrogen 2.986 N/A GLN 242.A N TYR 239.A O no hydrogen 3.098 N/A GLY 243.A N LEU 240.A O no hydrogen 2.965 N/A ARG 244.A N LEU 240.A O no hydrogen 3.194 N/A ARG 244.A NE GLN 242.A OE1 no hydrogen 2.809 N/A ARG 244.A NH1 GLN 242.A OE1 no hydrogen 3.453 N/A ARG 245.A NE TRP 264.A O no hydrogen 3.283 N/A ARG 245.A NH1 ARG 244.A O no hydrogen 3.063 N/A ARG 245.A NH2 TRP 264.A O no hydrogen 2.751 N/A GLN 248.A NE2 CYS 252.A O no hydrogen 2.840 N/A GLN 248.A NE2 ASP 254.A OD1 no hydrogen 2.878 N/A CYS 252.A N PRO 249.A O no hydrogen 3.101 N/A CYS 252.A SG PRO 253.A O no hydrogen 3.367 N/A TYR 257.A N PRO 253.A O no hydrogen 3.077 N/A TYR 257.A OH LEU 246.A O no hydrogen 2.603 N/A GLU 258.A N ASP 254.A O no hydrogen 2.951 N/A VAL 259.A N PRO 255.A O no hydrogen 3.031 N/A MET 260.A N LEU 256.A O no hydrogen 3.076 N/A LEU 261.A N TYR 257.A O no hydrogen 2.970 N/A LYS 262.A N GLU 258.A O no hydrogen 3.097 N/A CYS 263.A N VAL 259.A O no hydrogen 2.927 N/A CYS 263.A SG VAL 259.A O no hydrogen 3.449 N/A TRP 264.A N MET 260.A O no hydrogen 3.030 N/A TRP 264.A NE1 TRP 211.A O no hydrogen 3.143 N/A HIS 265.A N LYS 262.A O no hydrogen 3.241 N/A LYS 267.A N HIS 265.A ND1 no hydrogen 2.997 N/A LYS 267.A NZ GLU 269.A OE2 no hydrogen 2.709 N/A GLU 269.A N GLU 269.A OE1 no hydrogen 2.678 N/A MET 270.A N LYS 267.A O no hydrogen 2.910 N/A ARG 271.A N ALA 268.A O no hydrogen 3.112 N/A ARG 271.A NE HIS 265.A O no hydrogen 2.878 N/A ARG 271.A NH1 GLU 197.A OE1 no hydrogen 2.681 N/A ARG 271.A NH1 LYS 207.A O no hydrogen 3.086 N/A ARG 271.A NH2 GLU 197.A OE1 no hydrogen 3.503 N/A ARG 271.A NH2 GLU 197.A OE2 no hydrogen 2.879 N/A ARG 271.A NH2 HIS 265.A O no hydrogen 3.013 N/A GLU 276.A N SER 273.A OG no hydrogen 3.103 N/A LEU 277.A N SER 273.A O no hydrogen 3.003 N/A VAL 278.A N PHE 274.A O no hydrogen 2.905 N/A SER 279.A N SER 275.A O no hydrogen 3.017 N/A ARG 280.A N GLU 276.A O no hydrogen 2.874 N/A ARG 280.A NE GLU 276.A OE2 no hydrogen 2.735 N/A ARG 280.A NH1 GLU 276.A OE2 no hydrogen 3.288 N/A ILE 281.A N LEU 277.A O no hydrogen 2.914 N/A SER 282.A N VAL 278.A O no hydrogen 2.915 N/A SER 282.A OG.A VAL 278.A O no hydrogen 3.302 N/A SER 282.A OG.A SER 279.A O no hydrogen 2.847 N/A SER 282.A OG.B VAL 278.A O no hydrogen 2.464 N/A ALA 283.A N SER 279.A O no hydrogen 3.222 N/A ILE 284.A N ARG 280.A O no hydrogen 3.188 N/A PHE 285.A N ILE 281.A O no hydrogen 2.843 N/A SER 286.A N SER 282.A O no hydrogen 2.992 N/A SER 286.A OG ALA 283.A O no hydrogen 2.582 N/A THR 287.A N ILE 284.A O no hydrogen 3.041 N/A THR 287.A OG1 ILE 284.A O no hydrogen 2.654 N/A PHE 288.A N PHE 285.A O no hydrogen 3.228 N/A