Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3x3h_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 2.A N ASP 255.A OD1 no hydrogen 3.083 N/A ALA 4.A N HIS 31.A ND1 no hydrogen 3.195 N/A HIS 5.A NE2 THR 34.A OG1 no hydrogen 2.836 N/A PHE 6.A N LYS 32.A O no hydrogen 2.945 N/A VAL 7.A N ILE 75.A O no hydrogen 2.901 N/A LEU 8.A N THR 34.A O no hydrogen 2.782 N/A ILE 9.A N VAL 77.A O no hydrogen 2.777 N/A HIS 10.A ND1 THR 11.A O no hydrogen 2.496 N/A THR 11.A N GLU 79.A OE1 no hydrogen 2.930 N/A HIS 14.A N THR 11.A O no hydrogen 3.232 N/A HIS 14.A ND1 ILE 12.A O no hydrogen 2.822 N/A ALA 16.A N ASP 37.A OD1 no hydrogen 2.746 N/A ILE 18.A N GLY 15.A O no hydrogen 3.073 N/A TRP 19.A N ALA 16.A O no hydrogen 2.832 N/A HIS 20.A N TRP 17.A O no hydrogen 3.030 N/A HIS 20.A ND1 TRP 17.A O no hydrogen 2.807 N/A LYS 21.A NZ LEU 240.A O no hydrogen 2.848 N/A LYS 23.A N TRP 19.A O no hydrogen 3.052 N/A LYS 23.A NZ GLU 27.A OE2 no hydrogen 2.950 N/A LEU 26.A N LEU 22.A O no hydrogen 3.056 N/A GLU 27.A N LYS 23.A O no hydrogen 2.962 N/A ARG 28.A N PRO 24.A O no hydrogen 2.860 N/A ARG 28.A NH1 GLU 244.A OE2 no hydrogen 3.176 N/A ARG 28.A NH2 GLU 244.A OE1 no hydrogen 3.339 N/A ALA 29.A N LEU 26.A O no hydrogen 3.039 N/A GLY 30.A N GLU 27.A O no hydrogen 2.860 N/A HIS 31.A N LEU 26.A O no hydrogen 3.292 N/A HIS 31.A NE2 GLN 251.A OE1 no hydrogen 2.878 N/A LYS 32.A N ALA 4.A O no hydrogen 3.002 N/A THR 34.A N PHE 6.A O no hydrogen 2.908 N/A THR 34.A OG1 HIS 5.A NE2 no hydrogen 2.836 N/A MET 38.A N HIS 10.A NE2 no hydrogen 3.053 N/A ALA 39.A N TYR 57.A O no hydrogen 3.042 N/A SER 41.A N MET 38.A O no hydrogen 3.235 N/A SER 41.A OG MET 38.A O no hydrogen 3.514 N/A SER 41.A OG ALA 39.A O no hydrogen 2.687 N/A GLY 42.A N HIS 14.A O no hydrogen 3.248 N/A ILE 43.A N ASP 37.A OD2 no hydrogen 2.974 N/A ASP 44.A N SER 41.A O no hydrogen 2.994 N/A ARG 46.A N ASP 44.A OD1 no hydrogen 2.995 N/A ARG 46.A NE ASP 44.A OD1 no hydrogen 2.816 N/A ARG 46.A NH1 GLU 59.A OE1 no hydrogen 2.901 N/A ARG 46.A NH2 ASP 44.A OD1 no hydrogen 3.458 N/A ARG 46.A NH2 ASP 44.A OD2 no hydrogen 2.625 N/A ARG 46.A NH2 GLU 59.A OE1 no hydrogen 3.062 N/A GLN 47.A N GLN 50.A OE1 no hydrogen 3.144 N/A GLN 47.A NE2 PRO 45.A O no hydrogen 3.321 N/A GLN 50.A N GLN 47.A O no hydrogen 3.047 N/A ILE 51.A N ILE 48.A O no hydrogen 2.979 N/A ASN 52.A ND2 GLU 56.A OE1 no hydrogen 2.752 N/A GLU 56.A N SER 53.A OG no hydrogen 3.226 N/A TYR 57.A N SER 53.A O no hydrogen 3.150 N/A SER 58.A N PHE 54.A O no hydrogen 3.000 N/A SER 58.A N ASP 55.A O no hydrogen 3.142 N/A SER 58.A OG PHE 54.A O no hydrogen 2.744 N/A GLU 59.A N GLU 56.A O no hydrogen 2.798 N/A LEU 62.A N SER 58.A O no hydrogen 3.113 N/A THR 63.A N GLU 59.A O no hydrogen 2.679 N/A THR 63.A OG1 GLU 59.A O no hydrogen 2.907 N/A THR 63.A OG1 GLU 59.A OE2 no hydrogen 2.434 N/A PHE 64.A N PRO 60.A O no hydrogen 2.910 N/A LEU 65.A N LEU 61.A O no hydrogen 2.989 N/A GLU 66.A N LEU 62.A O no hydrogen 2.906 N/A LYS 67.A N THR 63.A O no hydrogen 3.099 N/A LEU 68.A N LEU 65.A O no hydrogen 3.098 N/A GLU 72.A N PRO 69.A O no hydrogen 3.245 N/A VAL 74.A N LYS 96.A O no hydrogen 2.884 N/A ILE 75.A N HIS 5.A O no hydrogen 2.827 N/A ILE 76.A N ALA 99.A O no hydrogen 3.075 N/A VAL 77.A N VAL 7.A O no hydrogen 2.779 N/A GLY 78.A N VAL 101.A O no hydrogen 2.766 N/A GLU 79.A N ILE 9.A O no hydrogen 3.158 N/A SER 80.A N HIS 103.A O no hydrogen 3.327 N/A CYS 81.A N THR 11.A OG1 no hydrogen 3.089 N/A ALA 82.A N GLU 79.A O no hydrogen 2.817 N/A LEU 84.A N CYS 81.A O no hydrogen 3.039 N/A ASN 85.A ND2 SER 58.A OG no hydrogen 2.671 N/A ILE 86.A N ALA 82.A O no hydrogen 3.080 N/A ILE 86.A N GLY 83.A O no hydrogen 3.145 N/A ALA 87.A N GLY 83.A O no hydrogen 3.119 N/A ILE 88.A N LEU 84.A O no hydrogen 2.920 N/A ALA 89.A N ASN 85.A O no hydrogen 2.912 N/A ALA 90.A N ILE 86.A O no hydrogen 2.747 N/A ASP 91.A N ALA 87.A O no hydrogen 3.178 N/A ARG 92.A N ALA 89.A O no hydrogen 3.032 N/A ARG 92.A NH1 ASP 55.A OD2 no hydrogen 2.761 N/A TYR 93.A N ALA 89.A O no hydrogen 2.884 N/A TYR 93.A OH GLU 66.A OE1 no hydrogen 2.510 N/A LYS 96.A N TYR 93.A O no hydrogen 2.983 N/A LYS 96.A NZ LEU 65.A O no hydrogen 2.915 N/A LYS 96.A NZ GLU 66.A O no hydrogen 3.491 N/A LYS 96.A NZ LEU 68.A O no hydrogen 2.732 N/A ILE 97.A N VAL 94.A O no hydrogen 3.156 N/A ALA 98.A N VAL 74.A O no hydrogen 2.917 N/A GLY 100.A N PRO 199.A O no hydrogen 2.944 N/A VAL 101.A N ILE 76.A O no hydrogen 2.733 N/A PHE 102.A N VAL 201.A O no hydrogen 2.816 N/A HIS 103.A N GLY 78.A O no hydrogen 2.793 N/A HIS 103.A ND1 HIS 103.A O no hydrogen 2.639 N/A ASN 104.A N ILE 203.A O no hydrogen 2.803 N/A ASN 104.A ND2 ASP 235.A O no hydrogen 3.580 N/A ASN 104.A ND2 HIS 236.A O no hydrogen 3.008 N/A SER 105.A OG SER 80.A O no hydrogen 2.996 N/A SER 105.A OG LEU 106.A O no hydrogen 2.618 N/A LEU 106.A N SER 80.A O no hydrogen 2.848 N/A LEU 107.A N GLN 219.A OE1 no hydrogen 2.781 N/A THR 110.A OG1 PHE 190.A O no hydrogen 3.126 N/A THR 110.A OG1 GLU 192.A OE2 no hydrogen 3.564 N/A HIS 112.A N ASP 109.A OD1 no hydrogen 3.040 N/A HIS 112.A ND1 ASP 109.A OD2 no hydrogen 2.913 N/A SER 113.A OG SER 115.A OG no hydrogen 3.188 N/A SER 113.A OG ALA 185.A O no hydrogen 3.474 N/A SER 115.A N SER 113.A OG no hydrogen 3.349 N/A SER 115.A OG SER 113.A OG no hydrogen 3.188 N/A SER 115.A OG GLU 119.A OE1 no hydrogen 2.893 N/A TYR 116.A N SER 113.A O no hydrogen 3.132 N/A GLU 119.A N SER 115.A O no hydrogen 2.847 N/A LYS 120.A N TYR 116.A O no hydrogen 3.052 N/A LYS 120.A NZ GLU 123.A OE1 no hydrogen 3.343 N/A LEU 121.A N THR 117.A O no hydrogen 2.922 N/A LEU 122.A N VAL 118.A O no hydrogen 3.025 N/A GLU 123.A N GLU 119.A O no hydrogen 2.947 N/A SER 124.A N LYS 120.A O no hydrogen 2.941 N/A PHE 125.A N LEU 121.A O no hydrogen 2.777 N/A TRP 128.A NE1 PHE 125.A O no hydrogen 2.899 N/A ARG 129.A N ASP 127.A OD2 no hydrogen 3.180 N/A ARG 129.A NE ASN 157.A OD1 no hydrogen 3.097 N/A ARG 129.A NH1 GLU 156.A OE1 no hydrogen 3.064 N/A ARG 129.A NH2 GLU 156.A OE1 no hydrogen 2.534 N/A ARG 129.A NH2 ASN 157.A OD1 no hydrogen 3.174 N/A THR 131.A N TRP 128.A O no hydrogen 3.097 N/A THR 131.A OG1 TRP 128.A O no hydrogen 2.730 N/A GLU 132.A N LYS 148.A O no hydrogen 2.982 N/A PHE 134.A N THR 146.A O no hydrogen 2.993 N/A PHE 136.A N ILE 144.A O no hydrogen 3.129 N/A ASN 138.A N GLU 142.A O no hydrogen 2.944 N/A ASN 138.A ND2 ASN 52.A O no hydrogen 3.240 N/A ILE 139.A N ASN 52.A OD1 no hydrogen 2.953 N/A THR 140.A N ASN 138.A OD1 no hydrogen 2.936 N/A THR 140.A OG1 ASN 138.A OD1 no hydrogen 3.332 N/A GLY 141.A N ASN 138.A O no hydrogen 2.886 N/A GLU 142.A N ASN 138.A OD1 no hydrogen 2.743 N/A ILE 144.A N PHE 136.A O no hydrogen 2.803 N/A THR 146.A N PHE 134.A O no hydrogen 2.984 N/A THR 146.A OG1 PHE 134.A O no hydrogen 3.440 N/A MET 147.A N GLY 177.A O no hydrogen 2.697 N/A LYS 148.A N GLU 132.A O no hydrogen 2.927 N/A GLY 150.A N THR 131.A OG1 no hydrogen 3.057 N/A VAL 152.A N ASP 130.A OD2 no hydrogen 2.819 N/A LEU 153.A N ASP 130.A OD1 no hydrogen 3.282 N/A LEU 154.A N GLY 150.A O no hydrogen 2.842 N/A ARG 155.A N PHE 151.A O no hydrogen 3.039 N/A ARG 155.A NH1 CYS 162.A O no hydrogen 3.289 N/A ARG 155.A NH2 CYS 162.A O no hydrogen 3.216 N/A ARG 155.A NH2 ASP 164.A OD2 no hydrogen 2.908 N/A GLU 156.A N VAL 152.A O no hydrogen 2.778 N/A ASN 157.A N LEU 153.A O no hydrogen 2.908 N/A ASN 157.A ND2 LYS 209.A O no hydrogen 2.935 N/A LEU 158.A N LEU 153.A O no hydrogen 3.138 N/A PHE 159.A N LEU 154.A O no hydrogen 2.743 N/A THR 160.A OG1 GLU 156.A O no hydrogen 2.803 N/A LYS 161.A N ASP 235.A OD2 no hydrogen 2.637 N/A CYS 162.A N PHE 159.A O no hydrogen 3.170 N/A CYS 162.A SG ASP 235.A OD2 no hydrogen 3.384 N/A GLU 166.A N THR 163.A O no hydrogen 3.113 N/A TYR 167.A N THR 163.A O no hydrogen 3.107 N/A TYR 167.A OH PHE 151.A O no hydrogen 3.067 N/A GLU 168.A N ASP 164.A O no hydrogen 2.767 N/A LEU 169.A N GLY 165.A O no hydrogen 2.965 N/A ALA 170.A N GLU 166.A O no hydrogen 2.988 N/A LYS 171.A N TYR 167.A O no hydrogen 3.190 N/A LYS 171.A NZ GLU 168.A OE1 no hydrogen 2.793 N/A MET 172.A N GLU 168.A O no hydrogen 3.082 N/A VAL 173.A N LEU 169.A O no hydrogen 3.080 N/A VAL 173.A N ALA 170.A O no hydrogen 3.181 N/A MET 174.A N ALA 170.A O no hydrogen 2.767 N/A ARG 175.A N CYS 13.A O no hydrogen 2.934 N/A ARG 175.A NH1 GLY 42.A O no hydrogen 2.766 N/A ARG 175.A NH1 ASP 44.A O no hydrogen 2.836 N/A ARG 175.A NH2 ARG 46.A O no hydrogen 2.706 N/A GLY 177.A N MET 147.A O no hydrogen 3.070 N/A SER 178.A OG THR 145.A O no hydrogen 2.890 N/A PHE 180.A N SER 178.A OG no hydrogen 2.887 N/A ASN 182.A ND2 THR 143.A O no hydrogen 2.703 N/A LEU 184.A N PHE 180.A O no hydrogen 2.821 N/A ALA 185.A N GLN 181.A O no hydrogen 2.842 N/A GLN 186.A N VAL 183.A O no hydrogen 3.248 N/A GLN 186.A NE2 GLU 142.A OE2 no hydrogen 3.078 N/A GLN 186.A NE2 ASN 182.A O no hydrogen 3.435 N/A ARG 187.A N LEU 184.A O no hydrogen 2.739 N/A ARG 187.A NE ASP 55.A OD1 no hydrogen 2.839 N/A ARG 187.A NE ASP 55.A OD2 no hydrogen 3.394 N/A ARG 187.A NH1 PRO 188.A O no hydrogen 3.215 N/A ARG 187.A NH2 ASP 55.A OD2 no hydrogen 2.693 N/A LYS 189.A NZ VAL 111.A O no hydrogen 3.488 N/A THR 191.A N ASP 91.A OD1 no hydrogen 3.291 N/A THR 191.A N ASP 91.A OD2 no hydrogen 3.115 N/A THR 191.A OG1 ASP 91.A OD1 no hydrogen 2.560 N/A GLY 194.A N THR 191.A OG1 no hydrogen 3.066 N/A TYR 195.A N ASP 91.A OD1 no hydrogen 3.022 N/A TYR 195.A OH PRO 108.A O no hydrogen 2.618 N/A GLY 196.A N THR 191.A O no hydrogen 2.895 N/A SER 197.A N GLY 194.A O no hydrogen 2.784 N/A SER 197.A OG LYS 193.A O no hydrogen 3.132 N/A SER 197.A OG GLY 194.A O no hydrogen 2.810 N/A ILE 198.A N TYR 195.A O no hydrogen 3.274 N/A LYS 200.A N ASP 226.A OD2 no hydrogen 2.851 N/A LYS 200.A NZ TYR 195.A O no hydrogen 2.724 N/A LYS 200.A NZ GLY 196.A O no hydrogen 3.028 N/A LYS 200.A NZ ILE 198.A O no hydrogen 2.621 N/A VAL 201.A N GLY 100.A O no hydrogen 3.072 N/A TYR 202.A N LYS 227.A O no hydrogen 2.784 N/A TYR 202.A OH GLN 216.A OE1 no hydrogen 2.482 N/A ILE 203.A N PHE 102.A O no hydrogen 2.673 N/A TRP 204.A N TYR 229.A O no hydrogen 3.138 N/A THR 205.A N ASN 104.A OD1 no hydrogen 3.295 N/A THR 205.A OG1 VAL 231.A O no hydrogen 3.132 N/A THR 205.A OG1 GLY 233.A O no hydrogen 2.614 N/A GLN 207.A N THR 205.A OG1 no hydrogen 3.013 N/A ASP 208.A N THR 205.A O no hydrogen 3.446 N/A LYS 209.A NZ GLN 207.A OE1 no hydrogen 3.368 N/A ILE 210.A N ASP 208.A OD1 no hydrogen 2.908 N/A PHE 211.A N ASP 208.A OD1 no hydrogen 2.772 N/A GLN 216.A N LEU 212.A O no hydrogen 2.893 N/A GLN 216.A NE2 ASN 104.A OD1 no hydrogen 2.830 N/A GLN 216.A NE2 PHE 211.A O no hydrogen 2.979 N/A ARG 217.A N PRO 213.A O no hydrogen 2.779 N/A TRP 218.A N ASP 214.A O no hydrogen 2.855 N/A GLN 219.A N PHE 215.A O no hydrogen 2.848 N/A GLN 219.A NE2 SER 105.A O no hydrogen 2.887 N/A GLN 219.A NE2 TYR 202.A OH no hydrogen 3.006 N/A ILE 220.A N GLN 216.A O no hydrogen 3.142 N/A ALA 221.A N ARG 217.A O no hydrogen 3.019 N/A ASN 222.A N TRP 218.A O no hydrogen 2.921 N/A ASN 222.A ND2 ASP 109.A OD2 no hydrogen 3.196 N/A TYR 223.A N GLN 219.A O no hydrogen 3.196 N/A LYS 227.A N LYS 200.A O no hydrogen 3.226 N/A LYS 227.A NZ TYR 257.A OH no hydrogen 3.247 N/A TYR 229.A N TYR 202.A O no hydrogen 2.800 N/A TYR 229.A OH GLU 252.A OE1 no hydrogen 3.143 N/A VAL 231.A N TRP 204.A O no hydrogen 2.688 N/A HIS 236.A ND1 ASP 208.A OD2 no hydrogen 2.661 N/A HIS 236.A NE2 SER 80.A OG no hydrogen 2.282 N/A LYS 237.A N ASP 235.A OD1 no hydrogen 2.955 N/A LYS 237.A NZ GLU 79.A OE1 no hydrogen 3.219 N/A LYS 237.A NZ GLU 79.A OE2 no hydrogen 2.672 N/A GLN 239.A N GLN 239.A OE1 no hydrogen 2.911 N/A GLN 239.A NE2 GLU 79.A OE2 no hydrogen 2.892 N/A LEU 240.A N LYS 237.A O no hydrogen 2.978 N/A THR 241.A N LYS 237.A O no hydrogen 3.010 N/A THR 241.A OG1 ASP 235.A OD1 no hydrogen 2.942 N/A THR 241.A OG1 LYS 237.A O no hydrogen 2.963 N/A LYS 242.A N LEU 238.A O no hydrogen 2.610 N/A THR 243.A OG1 GLN 239.A O no hydrogen 2.707 N/A THR 243.A OG1 LEU 240.A O no hydrogen 3.108 N/A VAL 246.A N LYS 242.A O no hydrogen 2.993 N/A ALA 247.A N THR 243.A O no hydrogen 2.904 N/A HIS 248.A N GLU 244.A O no hydrogen 3.073 N/A ILE 249.A N GLU 245.A O no hydrogen 2.954 N/A LEU 250.A N VAL 246.A O no hydrogen 2.856 N/A GLN 251.A N ALA 247.A O no hydrogen 2.978 N/A GLN 251.A NE2 VAL 2.A O no hydrogen 3.321 N/A GLN 251.A NE2 GLN 251.A O no hydrogen 3.337 N/A GLN 251.A NE2 ASP 255.A OD1 no hydrogen 2.913 N/A GLU 252.A N HIS 248.A O no hydrogen 3.284 N/A VAL 253.A N ILE 249.A O no hydrogen 2.960 N/A ALA 254.A N LEU 250.A O no hydrogen 2.840 N/A ASP 255.A N GLN 251.A O no hydrogen 2.840 N/A ALA 256.A N GLU 252.A O no hydrogen 3.104 N/A TYR 257.A N VAL 253.A O no hydrogen 2.964 N/A ALA 258.A N ALA 254.A O no hydrogen 2.847 N/A