Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1q17_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A OG GLY 1.A O no hydrogen 3.427 N/A SER 6.A OG SER 4.A O no hydrogen 3.126 N/A MET 14.A N SER 11.A OG no hydrogen 3.257 N/A SER 15.A N SER 11.A O no hydrogen 2.941 N/A SER 15.A OG SER 11.A O no hydrogen 3.046 N/A VAL 16.A N THR 12.A O no hydrogen 2.950 N/A ARG 17.A N GLU 13.A O no hydrogen 3.025 N/A LYS 18.A N MET 14.A O no hydrogen 2.760 N/A ILE 19.A N SER 15.A O no hydrogen 2.881 N/A ALA 20.A N VAL 16.A O no hydrogen 3.044 N/A ALA 21.A N ARG 17.A O no hydrogen 2.976 N/A HIS 22.A N LYS 18.A O no hydrogen 2.899 N/A HIS 22.A NE2 GLN 212.A O no hydrogen 3.000 N/A MET 23.A N ILE 19.A O no hydrogen 3.143 N/A LYS 24.A N ALA 20.A O no hydrogen 2.964 N/A LYS 24.A NZ GLU 276.A O no hydrogen 3.250 N/A SER 25.A N ALA 21.A O no hydrogen 2.900 N/A SER 25.A N HIS 22.A O no hydrogen 3.072 N/A SER 25.A OG ALA 21.A O no hydrogen 3.010 N/A ASN 26.A N HIS 22.A O no hydrogen 2.971 N/A ASN 26.A N MET 23.A O no hydrogen 3.232 N/A ASN 26.A ND2 HIS 22.A O no hydrogen 2.985 N/A ALA 29.A N ASN 26.A O no hydrogen 3.110 N/A VAL 31.A N VAL 112.A O no hydrogen 2.547 N/A ILE 32.A N LEU 214.A O no hydrogen 3.026 N/A PHE 33.A N ARG 115.A O no hydrogen 2.955 N/A MET 34.A N ILE 216.A O no hydrogen 2.940 N/A VAL 35.A N TYR 117.A O no hydrogen 2.924 N/A GLY 36.A N VAL 218.A O no hydrogen 3.144 N/A GLY 38.A N GLY 219.A O no hydrogen 2.781 N/A ILE 39.A N GLY 36.A O no hydrogen 3.222 N/A SER 40.A N ALA 37.A O no hydrogen 3.027 N/A SER 40.A OG ASP 122.A OD1 no hydrogen 2.711 N/A THR 41.A OG1 ALA 37.A O no hydrogen 3.550 N/A THR 41.A OG1 GLY 38.A O no hydrogen 3.333 N/A SER 42.A OG ASP 267.A OD2 no hydrogen 2.588 N/A CYS 43.A SG ARG 96.A O no hydrogen 3.351 N/A GLY 44.A N THR 41.A O no hydrogen 3.208 N/A ILE 45.A N SER 40.A O no hydrogen 3.238 N/A SER 50.A N ASP 47.A OD1 no hydrogen 2.978 N/A SER 50.A OG ASP 47.A OD1 no hydrogen 3.183 N/A SER 50.A OG ASP 47.A OD2 no hydrogen 2.488 N/A THR 53.A N PRO 51.A O no hydrogen 2.884 N/A GLY 54.A N SER 50.A O no hydrogen 2.794 N/A LEU 55.A N ASP 47.A O no hydrogen 2.786 N/A TYR 56.A N PHE 48.A O no hydrogen 3.138 N/A HIS 57.A N GLY 54.A O no hydrogen 2.674 N/A HIS 57.A NE2 ARG 49.A O no hydrogen 3.172 N/A ASN 58.A N LEU 55.A O no hydrogen 2.880 N/A ASN 58.A ND2 GLY 52.A O no hydrogen 2.989 N/A ASN 58.A ND2 GLY 54.A O no hydrogen 3.038 N/A LEU 62.A N LEU 59.A O no hydrogen 3.014 N/A LYS 63.A N ALA 60.A O no hydrogen 3.078 N/A TYR 66.A OH ASP 72.A OD2 no hydrogen 2.676 N/A GLU 68.A N GLU 68.A OE1 no hydrogen 2.549 N/A ALA 69.A N TYR 66.A O no hydrogen 2.852 N/A PHE 71.A N GLU 68.A O no hydrogen 3.243 N/A ASP 72.A N ALA 69.A O no hydrogen 3.050 N/A VAL 73.A N PHE 188.A O no hydrogen 3.157 N/A ASP 74.A N ASP 72.A OD1 no hydrogen 3.048 N/A PHE 75.A N ASP 72.A O no hydrogen 3.088 N/A PHE 76.A N ASP 72.A O no hydrogen 3.071 N/A GLN 77.A N VAL 73.A O no hydrogen 3.152 N/A SER 78.A OG PHE 75.A O no hydrogen 3.308 N/A ASP 79.A N PHE 76.A O no hydrogen 3.003 N/A TYR 84.A N PRO 80.A O no hydrogen 3.033 N/A THR 85.A N LEU 81.A O no hydrogen 2.770 N/A THR 85.A OG1 LEU 81.A O no hydrogen 2.663 N/A LEU 86.A N PRO 82.A O no hydrogen 2.936 N/A ALA 87.A N PHE 83.A O no hydrogen 2.574 N/A LEU 90.A N LEU 86.A O no hydrogen 3.460 N/A TYR 91.A N LYS 88.A O no hydrogen 3.470 N/A SER 98.A N HIS 101.A ND1 no hydrogen 3.055 N/A SER 98.A OG ILE 39.A O no hydrogen 3.057 N/A SER 98.A OG HIS 101.A ND1 no hydrogen 2.722 N/A LYS 99.A NZ GLU 271.A OE2 no hydrogen 2.683 N/A PHE 100.A N ASP 267.A OD1 no hydrogen 3.060 N/A TYR 102.A N SER 98.A O no hydrogen 3.158 N/A LEU 103.A N LYS 99.A O no hydrogen 3.062 N/A LEU 104.A N PHE 100.A O no hydrogen 3.267 N/A LEU 104.A N HIS 101.A O no hydrogen 2.908 N/A LYS 105.A N HIS 101.A O no hydrogen 3.310 N/A LYS 105.A NZ GLN 108.A OE1 no hydrogen 3.053 N/A LYS 105.A NZ GLY 129.A O no hydrogen 2.728 N/A LEU 106.A N TYR 102.A O no hydrogen 2.760 N/A PHE 107.A N LEU 103.A O no hydrogen 2.998 N/A GLN 108.A N LEU 104.A O no hydrogen 3.071 N/A ASP 109.A N LYS 105.A O no hydrogen 3.048 N/A LYS 110.A N LEU 106.A O no hydrogen 3.083 N/A LYS 110.A NZ ASP 282.A OD2 no hydrogen 3.470 N/A ASP 111.A N GLN 108.A O no hydrogen 2.798 N/A VAL 112.A N PHE 107.A O no hydrogen 2.821 N/A LYS 114.A N VAL 31.A O no hydrogen 2.708 N/A ARG 115.A N VAL 31.A O no hydrogen 3.470 N/A ARG 115.A NE ASP 203.A OD2 no hydrogen 3.042 N/A ARG 115.A NH1 ASP 133.A O no hydrogen 2.716 N/A ARG 115.A NH2 ASP 203.A OD1 no hydrogen 3.103 N/A VAL 116.A N LEU 134.A O no hydrogen 2.697 N/A TYR 117.A N PHE 33.A O no hydrogen 2.799 N/A TYR 117.A OH ASP 203.A OD2 no hydrogen 2.590 N/A THR 118.A N ILE 136.A O no hydrogen 2.828 N/A THR 118.A OG1 GLU 125.A OE1 no hydrogen 3.351 N/A GLN 119.A N VAL 35.A O no hydrogen 3.241 N/A GLN 119.A NE2 VAL 35.A O no hydrogen 2.961 N/A GLN 119.A NE2 THR 220.A OG1 no hydrogen 3.112 N/A ASN 120.A N THR 118.A OG1 no hydrogen 2.961 N/A ASN 120.A ND2 GLY 36.A O no hydrogen 3.116 N/A THR 123.A OG1 ASP 122.A O no hydrogen 2.512 N/A LEU 124.A N ASP 122.A OD2 no hydrogen 2.874 N/A GLN 127.A N THR 123.A O no hydrogen 3.101 N/A GLN 127.A NE2 THR 123.A OG1 no hydrogen 3.351 N/A ALA 128.A N GLU 125.A O no hydrogen 3.121 N/A GLY 129.A N ARG 126.A O no hydrogen 3.028 N/A VAL 130.A N GLU 125.A O no hydrogen 3.348 N/A LEU 134.A N LYS 131.A O no hydrogen 3.061 N/A ILE 135.A N ASP 132.A O no hydrogen 3.166 N/A ILE 136.A N VAL 116.A O no hydrogen 2.833 N/A ALA 138.A N THR 118.A O no hydrogen 3.027 N/A GLY 140.A N GLU 137.A O no hydrogen 2.950 N/A SER 141.A N ALA 184.A O no hydrogen 3.194 N/A ALA 143.A N SER 141.A OG no hydrogen 3.229 N/A CYS 145.A N TYR 154.A O no hydrogen 2.819 N/A CYS 145.A SG PRO 155.A O no hydrogen 3.722 N/A HIS 146.A N LYS 182.A O no hydrogen 2.877 N/A HIS 146.A ND1 LYS 182.A O no hydrogen 3.154 N/A HIS 146.A NE2 GLU 190.A OE2 no hydrogen 3.336 N/A CYS 147.A N LYS 152.A O no hydrogen 2.822 N/A CYS 147.A SG LEU 180.A O no hydrogen 4.029 N/A ILE 148.A N LEU 180.A O no hydrogen 2.957 N/A GLY 151.A N CYS 147.A O no hydrogen 3.078 N/A TYR 154.A N CYS 145.A O no hydrogen 2.935 N/A GLN 157.A N GLN 157.A OE1 no hydrogen 2.367 N/A LYS 160.A N PRO 156.A O no hydrogen 3.146 N/A SER 161.A N GLN 157.A O no hydrogen 2.904 N/A SER 161.A OG GLN 157.A O no hydrogen 3.145 N/A SER 161.A OG VAL 158.A O no hydrogen 2.751 N/A LYS 162.A N VAL 158.A O no hydrogen 3.211 N/A LYS 162.A NZ GLU 165.A OE1 no hydrogen 3.439 N/A LYS 162.A NZ GLU 165.A OE2 no hydrogen 3.078 N/A LYS 162.A NZ ASP 170.A O no hydrogen 2.938 N/A ALA 164.A N SER 161.A O no hydrogen 2.953 N/A GLU 165.A N SER 161.A O no hydrogen 3.444 N/A LYS 169.A NZ PRO 167.A O no hydrogen 3.125 N/A CYS 174.A N GLU 179.A O no hydrogen 2.722 N/A CYS 174.A SG TYR 154.A OH no hydrogen 2.799 N/A GLY 178.A N CYS 174.A O no hydrogen 2.780 N/A VAL 181.A N VAL 172.A O no hydrogen 3.332 N/A LYS 182.A N HIS 146.A O no hydrogen 2.962 N/A LYS 182.A NZ PRO 183.A O no hydrogen 3.338 N/A LYS 182.A NZ ILE 185.A O no hydrogen 2.942 N/A LYS 182.A NZ GLU 190.A OE1 no hydrogen 2.841 N/A ALA 184.A N HIS 144.A O no hydrogen 3.024 N/A ILE 185.A N PRO 183.A O no hydrogen 2.675 N/A VAL 186.A N HIS 139.A O no hydrogen 2.850 N/A PHE 187.A N GLU 190.A OE1 no hydrogen 2.964 N/A PHE 188.A N PHE 71.A O no hydrogen 2.614 N/A GLU 190.A N PHE 187.A O no hydrogen 2.913 N/A PHE 196.A N PRO 193.A O no hydrogen 2.925 N/A GLU 198.A N ASP 194.A O no hydrogen 3.109 N/A THR 199.A N SER 195.A O no hydrogen 2.715 N/A THR 199.A OG1 SER 195.A O no hydrogen 2.595 N/A TRP 200.A N PHE 196.A O no hydrogen 3.026 N/A TRP 200.A NE1 GLU 233.A OE1 no hydrogen 2.809 N/A LEU 201.A N SER 197.A O no hydrogen 2.928 N/A ASN 202.A N GLU 198.A O no hydrogen 3.146 N/A ASP 203.A N THR 199.A O no hydrogen 2.681 N/A SER 204.A N TRP 200.A O no hydrogen 2.680 N/A SER 204.A OG TRP 200.A O no hydrogen 2.808 N/A TRP 206.A N ASN 202.A O no hydrogen 3.055 N/A LEU 207.A N ASP 203.A O no hydrogen 2.997 N/A ARG 208.A N SER 204.A O no hydrogen 2.974 N/A GLU 209.A N GLU 205.A O no hydrogen 2.681 N/A LYS 210.A N TRP 206.A O no hydrogen 3.095 N/A LYS 210.A N LEU 207.A O no hydrogen 2.770 N/A VAL 215.A N LYS 239.A O no hydrogen 3.281 N/A ILE 216.A N ILE 32.A O no hydrogen 2.833 N/A VAL 217.A N VAL 241.A O no hydrogen 2.792 N/A VAL 218.A N MET 34.A O no hydrogen 2.903 N/A GLY 219.A N CYS 243.A O no hydrogen 3.199 N/A LEU 222.A N THR 220.A OG1 no hydrogen 3.195 N/A ALA 228.A N VAL 224.A O no hydrogen 2.905 N/A SER 229.A N PRO 226.A O no hydrogen 3.038 N/A SER 229.A OG PRO 226.A O no hydrogen 3.503 N/A LEU 230.A N PHE 227.A O no hydrogen 2.791 N/A GLU 233.A N LEU 230.A O no hydrogen 3.121 N/A ILE 234.A N PRO 231.A O no hydrogen 3.123 N/A VAL 238.A N PRO 235.A O no hydrogen 2.720 N/A LYS 239.A NZ THR 258.A O no hydrogen 3.150 N/A ARG 240.A NE ASP 259.A OD1 no hydrogen 3.041 N/A ARG 240.A NH1 PRO 231.A O no hydrogen 3.220 N/A ARG 240.A NH1 ASP 250.A OD2 no hydrogen 2.598 N/A ARG 240.A NH2 ASP 250.A OD2 no hydrogen 3.458 N/A ARG 240.A NH2 ASP 259.A OD1 no hydrogen 3.546 N/A ARG 240.A NH2 ASP 259.A OD2 no hydrogen 2.633 N/A VAL 241.A N VAL 215.A O no hydrogen 2.994 N/A LEU 242.A N LEU 260.A O no hydrogen 2.825 N/A CYS 243.A N VAL 217.A O no hydrogen 2.775 N/A CYS 243.A SG GLN 264.A O no hydrogen 3.730 N/A ASN 244.A N VAL 262.A O no hydrogen 3.039 N/A PHE 251.A N VAL 248.A O no hydrogen 3.213 N/A LYS 252.A N GLY 249.A O no hydrogen 2.896 N/A ALA 253.A N GLY 249.A O no hydrogen 3.041 N/A LYS 255.A NZ SER 8.A O no hydrogen 3.045 N/A LYS 255.A NZ ARG 256.A O no hydrogen 3.387 N/A ARG 256.A N ASP 259.A OD2 no hydrogen 2.769 N/A ARG 256.A NH1 ILE 234.A O no hydrogen 3.009 N/A ARG 256.A NH1 PRO 235.A O no hydrogen 3.342 N/A ARG 256.A NH2 ILE 234.A O no hydrogen 2.824 N/A ASP 259.A N ARG 256.A O no hydrogen 2.936 N/A LEU 260.A N ARG 240.A O no hydrogen 3.074 N/A VAL 262.A N LEU 242.A O no hydrogen 2.745 N/A HIS 263.A ND1 ASN 244.A O no hydrogen 3.161 N/A SER 266.A OG GLY 38.A O no hydrogen 3.501 N/A PHE 269.A N TYR 265.A O no hydrogen 2.953 N/A ALA 270.A N SER 266.A O no hydrogen 2.895 N/A GLU 271.A N ASP 267.A O no hydrogen 2.790 N/A GLN 272.A N GLU 268.A O no hydrogen 2.813 N/A LEU 273.A N PHE 269.A O no hydrogen 2.742 N/A VAL 274.A N ALA 270.A O no hydrogen 2.914 N/A GLU 276.A N GLN 272.A O no hydrogen 3.219 N/A LEU 277.A N LEU 273.A O no hydrogen 3.168 N/A GLY 278.A N GLU 275.A O no hydrogen 2.994 N/A TRP 279.A N VAL 274.A O no hydrogen 3.119 N/A GLN 280.A N GLN 280.A OE1 no hydrogen 2.511 N/A PHE 283.A N TRP 279.A O no hydrogen 3.333 N/A GLU 284.A N GLN 280.A O no hydrogen 3.158 N/A LYS 285.A N GLU 281.A O no hydrogen 2.995 N/A ILE 286.A N ASP 282.A O no hydrogen 2.905 N/A LEU 287.A N PHE 283.A O no hydrogen 2.933 N/A THR 288.A N GLU 284.A O no hydrogen 3.106 N/A THR 288.A OG1 GLU 284.A O no hydrogen 3.133 N/A ALA 289.A N LYS 285.A O no hydrogen 2.764 N/A GLN 290.A N ILE 286.A O no hydrogen 3.031 N/A GLN 290.A NE2 ALA 128.A O no hydrogen 2.838 N/A