Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4aq8_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 7.A NE2 ASP 4.A O no hydrogen 3.363 N/A TYR 8.A N ASP 5.A O no hydrogen 2.786 N/A GLU 9.A N TRP 6.A O no hydrogen 3.304 N/A CYS 11.A N LYS 42.A O no hydrogen 3.016 N/A LYS 12.A N GLU 9.A O no hydrogen 3.203 N/A LYS 12.A NZ TYR 8.A O no hydrogen 3.449 N/A LYS 12.A NZ GLU 9.A OE1 no hydrogen 3.144 N/A ALA 14.A N LEU 40.A O no hydrogen 2.715 N/A ARG 15.A NH1 GLY 16.A O no hydrogen 2.770 N/A ARG 15.A NH1 PRO 18.A O no hydrogen 2.752 N/A ARG 15.A NH2 PRO 18.A O no hydrogen 3.043 N/A ARG 15.A NH2 THR 21.A OG1 no hydrogen 3.388 N/A THR 21.A N GLU 111.A O no hydrogen 2.933 N/A VAL 23.A N ARG 113.A O no hydrogen 3.012 N/A ILE 25.A N VAL 115.A O no hydrogen 2.942 N/A GLU 27.A N ARG 117.A O no hydrogen 3.010 N/A GLU 28.A N LEU 82.A O no hydrogen 2.792 N/A SER 29.A OG ASP 26.A O no hydrogen 2.504 N/A GLY 32.A N LEU 75.A O no hydrogen 2.864 N/A THR 33.A N ARG 30.A O no hydrogen 3.136 N/A THR 33.A OG1 ARG 30.A O no hydrogen 2.771 N/A LEU 35.A N LEU 73.A O no hydrogen 2.756 N/A VAL 36.A N LEU 73.A O no hydrogen 3.261 N/A MET 39.A N GLN 71.A O no hydrogen 3.030 N/A LEU 40.A N ASN 38.A OD1 no hydrogen 2.843 N/A ILE 41.A N GLN 71.A OE1 no hydrogen 3.000 N/A LYS 42.A N LYS 12.A O no hydrogen 2.739 N/A LYS 42.A NZ GLU 9.A OE2 no hydrogen 3.470 N/A THR 44.A N THR 51.A OG1 no hydrogen 3.039 N/A THR 51.A N THR 44.A O no hydrogen 2.907 N/A THR 51.A OG1 ASP 10.A OD2 no hydrogen 3.081 N/A GLU 53.A N VAL 100.A O no hydrogen 2.931 N/A SER 55.A N GLN 98.A O no hydrogen 2.963 N/A LYS 57.A N GLN 96.A O no hydrogen 2.824 N/A ASN 59.A ND2 VAL 64.A O no hydrogen 2.843 N/A TYR 62.A N ASN 59.A O no hydrogen 3.062 N/A VAL 64.A N ASN 59.A OD1 no hydrogen 3.342 N/A LEU 65.A N PHE 74.A O no hydrogen 2.917 N/A ASP 67.A N MET 72.A O no hydrogen 2.932 N/A VAL 69.A N ASP 67.A OD1 no hydrogen 3.133 N/A LYS 70.A N ASP 67.A OD1 no hydrogen 3.444 N/A GLN 71.A NE2 ILE 41.A O no hydrogen 3.212 N/A MET 72.A N ASP 67.A O no hydrogen 3.206 N/A LEU 73.A N VAL 36.A O no hydrogen 3.230 N/A PHE 74.A N LEU 65.A O no hydrogen 2.882 N/A LEU 75.A N THR 33.A O no hydrogen 2.875 N/A ASN 76.A N TRP 63.A O no hydrogen 2.754 N/A ASN 76.A ND2 TYR 62.A O no hydrogen 3.165 N/A THR 78.A OG1 ASN 76.A OD1 no hydrogen 3.283 N/A ARG 80.A N SER 77.A O no hydrogen 3.289 N/A ARG 80.A NH1 ASP 61.A O no hydrogen 2.911 N/A ARG 80.A NH2 ASP 61.A O no hydrogen 2.898 N/A ARG 80.A NH2 TYR 62.A O no hydrogen 3.111 N/A ARG 80.A NH2 ASN 76.A O no hydrogen 3.052 N/A ARG 84.A N GLU 27.A OE1 no hydrogen 3.164 N/A ARG 84.A NE VAL 116.A O no hydrogen 2.782 N/A ARG 84.A NH1 ASP 160.A OD2 no hydrogen 3.054 N/A ASP 85.A N ASP 83.A OD1 no hydrogen 2.970 N/A MET 88.A N ASP 85.A O no hydrogen 3.213 N/A ASN 89.A N ASP 85.A O no hydrogen 3.123 N/A ILE 90.A N ASP 83.A O no hydrogen 3.232 N/A ILE 93.A N ILE 114.A O no hydrogen 2.991 N/A VAL 95.A N VAL 112.A O no hydrogen 2.923 N/A GLN 96.A N LYS 57.A O no hydrogen 2.957 N/A GLN 96.A NE2 GLU 111.A OE1 no hydrogen 2.740 N/A VAL 97.A N HIS 110.A O no hydrogen 2.870 N/A GLN 98.A N SER 55.A O no hydrogen 2.726 N/A CYS 99.A N ILE 108.A O no hydrogen 2.985 N/A VAL 100.A N GLU 53.A O no hydrogen 2.820 N/A ASN 101.A N THR 106.A O no hydrogen 2.825 N/A ASN 101.A ND2 GLN 7.A O no hydrogen 2.964 N/A ASN 101.A ND2 ASP 10.A O no hydrogen 2.996 N/A LYS 102.A N THR 51.A O no hydrogen 3.103 N/A LYS 103.A NZ GLN 7.A OE1 no hydrogen 2.652 N/A VAL 104.A N ASN 101.A OD1 no hydrogen 3.098 N/A GLY 105.A N ASN 101.A O no hydrogen 2.671 N/A ILE 108.A N CYS 99.A O no hydrogen 3.060 N/A HIS 110.A N VAL 97.A O no hydrogen 2.862 N/A HIS 110.A NE2 CYS 11.A O no hydrogen 2.775 N/A VAL 112.A N VAL 95.A O no hydrogen 2.746 N/A ARG 113.A N THR 21.A O no hydrogen 3.073 N/A ARG 113.A NH1 GLU 111.A OE2 no hydrogen 2.975 N/A ILE 114.A N ILE 93.A O no hydrogen 2.731 N/A VAL 115.A N VAL 23.A O no hydrogen 2.758 N/A VAL 116.A N HIS 91.A O no hydrogen 3.043 N/A ARG 117.A N ILE 25.A O no hydrogen 2.787 N/A ARG 117.A NE ASP 26.A OD1 no hydrogen 3.095 N/A ARG 119.A N GLU 27.A OE2 no hydrogen 2.875 N/A ARG 119.A NH1 ASP 26.A OD2 no hydrogen 2.914 N/A ASN 120.A ND2 ASP 215.A OD1 no hydrogen 3.258 N/A ASN 120.A ND2 ASP 215.A OD2 no hydrogen 3.187 N/A ASN 120.A ND2 GLU 222.A O no hydrogen 2.859 N/A ASN 122.A N ASP 159.A OD2 no hydrogen 2.936 N/A ASN 122.A ND2 ASP 85.A OD2 no hydrogen 3.180 N/A ASN 122.A ND2 ASP 159.A OD1 no hydrogen 2.838 N/A THR 125.A N THR 156.A O no hydrogen 2.891 N/A LYS 127.A N GLY 154.A O no hydrogen 3.007 N/A HIS 128.A N TYR 131.A OH no hydrogen 3.188 N/A HIS 128.A NE2 ASN 153.A OD1 no hydrogen 2.895 N/A SER 130.A OG TYR 132.A OH no hydrogen 2.739 N/A TYR 131.A N THR 229.A O no hydrogen 3.096 N/A TYR 131.A OH ASN 153.A O no hydrogen 2.694 N/A TYR 132.A OH SER 130.A OG no hydrogen 2.739 N/A ALA 133.A N THR 231.A O no hydrogen 3.090 N/A VAL 135.A N ASP 233.A O no hydrogen 2.965 N/A ASN 136.A ND2 HIS 236.A O no hydrogen 3.157 N/A GLU 137.A N GLU 235.A O no hydrogen 3.384 N/A LEU 138.A N ASN 136.A OD1 no hydrogen 3.212 N/A THR 139.A N ASN 136.A O no hydrogen 3.005 N/A THR 139.A OG1 ASN 136.A O no hydrogen 2.788 N/A GLY 142.A N LEU 195.A O no hydrogen 2.771 N/A THR 143.A N PRO 140.A O no hydrogen 3.238 N/A THR 143.A OG1 PRO 140.A O no hydrogen 2.847 N/A ILE 145.A N VAL 193.A O no hydrogen 2.827 N/A PHE 146.A N VAL 193.A O no hydrogen 3.316 N/A SER 150.A N THR 147.A O no hydrogen 2.987 N/A SER 150.A OG THR 147.A O no hydrogen 3.116 N/A ASN 153.A ND2 GLY 148.A O no hydrogen 2.984 N/A ALA 155.A N TYR 168.A OH no hydrogen 3.004 N/A THR 156.A N THR 125.A O no hydrogen 2.996 N/A ASP 159.A N ASP 157.A OD1 no hydrogen 3.007 N/A ASP 160.A N ASP 118.A OD2 no hydrogen 2.964 N/A ASN 163.A ND2 ASP 118.A OD2 no hydrogen 2.939 N/A GLY 164.A N GLY 161.A O no hydrogen 3.022 N/A GLN 165.A N PRO 162.A O no hydrogen 3.225 N/A GLU 167.A N ASN 214.A O no hydrogen 2.809 N/A TYR 168.A N MET 188.A O no hydrogen 2.815 N/A VAL 169.A N GLN 212.A O no hydrogen 2.990 N/A GLN 171.A N ILE 210.A O no hydrogen 2.725 N/A GLN 171.A NE2 VAL 169.A O no hydrogen 3.148 N/A ASN 173.A ND2 TYR 208.A O no hydrogen 2.823 N/A GLU 175.A N ASN 173.A OD1 no hydrogen 2.902 N/A ASP 176.A N ASN 173.A O no hydrogen 2.793 N/A SER 179.A N ASP 176.A O no hydrogen 3.047 N/A SER 179.A OG ASP 176.A O no hydrogen 3.076 N/A SER 179.A OG TYR 208.A O no hydrogen 3.013 N/A ASP 181.A N THR 178.A O no hydrogen 2.968 N/A THR 182.A N THR 178.A O no hydrogen 2.937 N/A THR 182.A OG1 THR 178.A O no hydrogen 3.070 N/A PHE 183.A N SER 179.A O no hydrogen 3.248 N/A GLU 184.A N VAL 194.A O no hydrogen 3.056 N/A THR 190.A N LEU 187.A O no hydrogen 3.175 N/A THR 190.A OG1 LEU 187.A O no hydrogen 3.015 N/A GLY 191.A N LEU 187.A O no hydrogen 3.156 N/A ASN 192.A N THR 190.A OG1 no hydrogen 3.237 N/A ASN 192.A ND2 PHE 146.A O no hydrogen 3.448 N/A VAL 193.A N PHE 146.A O no hydrogen 3.137 N/A VAL 194.A N GLU 184.A O no hydrogen 2.899 N/A LEU 195.A N THR 143.A O no hydrogen 2.946 N/A ARG 196.A N THR 182.A O no hydrogen 2.656 N/A ARG 196.A NH1 ASP 181.A O no hydrogen 2.951 N/A ARG 198.A NE LEU 199.A O no hydrogen 2.559 N/A TYR 201.A N GLU 137.A OE1 no hydrogen 3.130 N/A GLU 202.A N ASN 200.A OD1 no hydrogen 3.226 N/A ASP 203.A N ASN 200.A O no hydrogen 3.021 N/A LYS 204.A N ASN 200.A O no hydrogen 3.111 N/A LYS 204.A NZ ASP 176.A OD1 no hydrogen 2.696 N/A LYS 204.A NZ ASP 176.A OD2 no hydrogen 3.527 N/A LYS 204.A NZ ARG 206.A O no hydrogen 2.924 N/A ARG 206.A NE ASP 233.A OD1 no hydrogen 2.879 N/A ARG 206.A NH1 TYR 208.A OH no hydrogen 3.323 N/A TYR 207.A N VAL 232.A O no hydrogen 2.941 N/A TYR 208.A N ASP 176.A OD2 no hydrogen 2.717 N/A VAL 209.A N LEU 230.A O no hydrogen 2.772 N/A ILE 211.A N THR 228.A O no hydrogen 2.914 N/A GLN 212.A N VAL 169.A O no hydrogen 2.940 N/A ALA 213.A N THR 226.A O no hydrogen 2.667 N/A ASN 214.A N GLU 167.A O no hydrogen 2.871 N/A ASN 214.A ND2 GLU 167.A OE1 no hydrogen 3.192 N/A ASN 214.A ND2 ASP 215.A O no hydrogen 2.685 N/A ASP 215.A N ARG 224.A O no hydrogen 3.034 N/A ARG 216.A N PRO 162.A O no hydrogen 2.941 N/A ARG 216.A NH1 GLU 167.A OE2 no hydrogen 2.858 N/A GLU 222.A N ASN 219.A O no hydrogen 2.558 N/A ARG 223.A N LEU 220.A O no hydrogen 3.280 N/A ARG 223.A NE ALA 217.A O no hydrogen 2.909 N/A ARG 223.A NH2 ALA 217.A O no hydrogen 3.352 N/A ARG 224.A N ASP 215.A OD1 no hydrogen 3.008 N/A ARG 224.A NH1 SER 123.A OG no hydrogen 3.060 N/A THR 226.A N ALA 213.A O no hydrogen 2.753 N/A THR 226.A OG1 PRO 124.A O no hydrogen 2.520 N/A THR 228.A N ILE 211.A O no hydrogen 2.910 N/A LEU 230.A N VAL 209.A O no hydrogen 2.723 N/A THR 231.A N TYR 131.A O no hydrogen 3.020 N/A VAL 232.A N TYR 207.A O no hydrogen 2.834 N/A ASP 233.A N ALA 133.A O no hydrogen 2.907 N/A LEU 234.A N THR 205.A O no hydrogen 3.009 N/A GLU 235.A N VAL 135.A O no hydrogen 2.899 N/A HIS 237.A N GLU 137.A OE2 no hydrogen 3.331 N/A