Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3spu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A N PHE 9.A O no hydrogen 2.914 N/A PHE 4.A N LEU 7.A O no hydrogen 2.830 N/A ASP 6.A N GLN 58.A OE1 no hydrogen 3.329 N/A LEU 7.A N PHE 4.A O no hydrogen 3.049 N/A VAL 8.A N THR 20.A O no hydrogen 3.087 N/A PHE 9.A N GLN 2.A O no hydrogen 2.710 N/A ARG 10.A N GLN 18.A O no hydrogen 3.036 N/A GLN 11.A NE2 ALA 13.A O no hydrogen 3.290 N/A LEU 12.A N VAL 16.A O no hydrogen 2.775 N/A ALA 13.A N VAL 16.A O no hydrogen 3.190 N/A VAL 16.A N ALA 13.A O no hydrogen 3.051 N/A TRP 17.A N ILE 37.A O no hydrogen 2.907 N/A GLN 18.A N ARG 10.A O no hydrogen 2.841 N/A HIS 19.A N GLY 35.A O no hydrogen 2.914 N/A HIS 19.A NE2 ASP 48.A O no hydrogen 3.043 N/A THR 20.A N VAL 8.A O no hydrogen 2.903 N/A THR 20.A OG1 ASN 34.A OD1 no hydrogen 2.883 N/A SER 21.A N SER 33.A O no hydrogen 2.983 N/A LEU 23.A N VAL 31.A O no hydrogen 2.958 N/A MET 25.A N GLY 29.A O no hydrogen 3.444 N/A GLY 29.A N MET 25.A O no hydrogen 3.099 N/A VAL 31.A N LEU 23.A O no hydrogen 3.268 N/A SER 33.A N SER 21.A O no hydrogen 2.856 N/A SER 33.A OG ASP 82.A O no hydrogen 3.485 N/A ASN 34.A N SER 207.A O no hydrogen 2.790 N/A ASN 34.A ND2 MET 206.A O no hydrogen 2.867 N/A GLY 35.A N HIS 19.A O no hydrogen 2.748 N/A LEU 36.A N VAL 47.A O no hydrogen 2.958 N/A ILE 37.A N TRP 17.A O no hydrogen 2.858 N/A VAL 38.A N LEU 45.A O no hydrogen 2.669 N/A ARG 39.A N ASN 15.A O no hydrogen 2.845 N/A ARG 39.A NE ASN 15.A OD1 no hydrogen 2.844 N/A ARG 39.A NH2 ASN 15.A OD1 no hydrogen 2.971 N/A ASP 40.A N ARG 43.A O no hydrogen 2.891 N/A ARG 43.A N ASP 40.A O no hydrogen 3.365 N/A ARG 43.A NE ASP 40.A OD2 no hydrogen 3.197 N/A ARG 43.A NH1 ASN 134.A O no hydrogen 2.858 N/A ARG 43.A NH2 ASP 40.A OD2 no hydrogen 2.782 N/A ARG 43.A NH2 ASN 134.A O no hydrogen 2.879 N/A VAL 44.A N PRO 70.A O no hydrogen 2.748 N/A LEU 45.A N VAL 38.A O no hydrogen 2.740 N/A VAL 46.A N LEU 73.A O no hydrogen 3.111 N/A VAL 47.A N LEU 36.A O no hydrogen 2.775 N/A ASP 48.A N VAL 75.A O no hydrogen 2.755 N/A THR 49.A N LYS 83.A O no hydrogen 3.004 N/A THR 49.A OG1 ALA 50.A O no hydrogen 2.741 N/A ALA 50.A N THR 56.A OG1 no hydrogen 3.160 N/A GLN 55.A N THR 52.A OG1 no hydrogen 3.048 N/A GLN 55.A NE2 TYR 22.A O no hydrogen 3.060 N/A THR 56.A N THR 52.A O no hydrogen 2.978 N/A THR 56.A OG1 THR 52.A O no hydrogen 2.978 N/A ALA 57.A N ASP 53.A O no hydrogen 2.906 N/A GLN 58.A N ASP 54.A O no hydrogen 3.278 N/A GLN 58.A NE2 ASP 54.A O no hydrogen 3.659 N/A ILE 59.A N GLN 55.A O no hydrogen 3.172 N/A LEU 60.A N THR 56.A O no hydrogen 3.152 N/A ASN 61.A N ALA 57.A O no hydrogen 2.752 N/A TRP 62.A N GLN 58.A O no hydrogen 2.830 N/A ILE 63.A N ILE 59.A O no hydrogen 2.796 N/A LYS 64.A N LEU 60.A O no hydrogen 2.973 N/A LYS 64.A NZ ASN 68.A OD1 no hydrogen 2.644 N/A GLN 65.A N ASN 61.A O no hydrogen 3.053 N/A GLU 66.A N TRP 62.A O no hydrogen 2.900 N/A ILE 67.A N ILE 63.A O no hydrogen 2.882 N/A ASN 68.A N ILE 63.A O no hydrogen 2.908 N/A ALA 72.A N VAL 44.A O no hydrogen 2.886 N/A ALA 74.A N ALA 96.A O no hydrogen 2.927 N/A VAL 75.A N VAL 46.A O no hydrogen 2.934 N/A VAL 76.A N TYR 98.A O no hydrogen 2.999 N/A THR 77.A N ASP 48.A OD1 no hydrogen 2.855 N/A THR 77.A OG1 ASP 48.A OD2 no hydrogen 3.502 N/A HIS 78.A NE2 HIS 80.A ND1 no hydrogen 2.940 N/A ALA 79.A N ASP 150.A OD1 no hydrogen 2.930 N/A HIS 80.A N HIS 78.A O no hydrogen 2.992 N/A HIS 80.A NE2 ASP 181.A OD2 no hydrogen 3.117 N/A GLN 81.A NE2 TRP 51.A O no hydrogen 3.159 N/A LYS 83.A N HIS 80.A O no hydrogen 3.072 N/A LYS 83.A NZ SER 33.A OG no hydrogen 3.411 N/A LYS 83.A NZ ASP 48.A OD2 no hydrogen 3.203 N/A LYS 83.A NZ SER 207.A OG no hydrogen 2.863 N/A MET 84.A N HIS 80.A O no hydrogen 3.011 N/A GLY 85.A N GLN 81.A O no hydrogen 2.934 N/A GLY 86.A N THR 49.A OG1 no hydrogen 2.969 N/A ALA 89.A N ASP 53.A OD2 no hydrogen 3.067 N/A ALA 89.A N GLY 86.A O no hydrogen 3.160 N/A LEU 90.A N GLY 86.A O no hydrogen 3.312 N/A HIS 91.A N MET 87.A O no hydrogen 3.005 N/A HIS 91.A NE2 THR 97.A OG1 no hydrogen 2.710 N/A ALA 92.A N ASP 88.A O no hydrogen 2.945 N/A ALA 93.A N ALA 89.A O no hydrogen 3.240 N/A GLY 94.A N HIS 91.A O no hydrogen 2.795 N/A ILE 95.A N LEU 90.A O no hydrogen 2.980 N/A THR 97.A OG1 HIS 91.A NE2 no hydrogen 2.710 N/A TYR 98.A N ALA 74.A O no hydrogen 2.901 N/A ALA 99.A N HIS 117.A O no hydrogen 3.218 N/A ASN 100.A ND2 ASP 150.A O no hydrogen 3.000 N/A ALA 101.A N LEU 119.A O no hydrogen 3.033 N/A LEU 102.A N ASN 100.A OD1 no hydrogen 3.316 N/A SER 103.A OG ASP 150.A OD1 no hydrogen 2.509 N/A ASN 104.A N ASN 100.A O no hydrogen 2.940 N/A ASN 104.A ND2 HIS 117.A O no hydrogen 3.038 N/A ASN 104.A ND2 SER 118.A OG no hydrogen 2.862 N/A GLN 105.A N ALA 101.A O no hydrogen 2.877 N/A LEU 106.A N LEU 102.A O no hydrogen 2.731 N/A ALA 107.A N SER 103.A O no hydrogen 2.803 N/A GLU 110.A N LEU 106.A O no hydrogen 3.136 N/A MET 112.A N ALA 107.A O no hydrogen 2.828 N/A ALA 115.A N ASN 104.A OD1 no hydrogen 2.758 N/A GLN 116.A N THR 97.A OG1 no hydrogen 2.842 N/A GLN 116.A NE2 ILE 95.A O no hydrogen 3.543 N/A HIS 117.A N THR 97.A O no hydrogen 2.983 N/A LEU 119.A N ALA 99.A O no hydrogen 2.766 N/A ALA 122.A N TRP 126.A O no hydrogen 2.967 N/A GLY 125.A N ALA 122.A O no hydrogen 2.801 N/A TRP 126.A N ASN 124.A OD1 no hydrogen 3.164 N/A VAL 127.A N VAL 140.A O no hydrogen 3.170 N/A GLU 128.A N THR 120.A O no hydrogen 2.809 N/A THR 131.A N GLU 128.A O no hydrogen 2.828 N/A THR 131.A OG1 SER 118.A O no hydrogen 2.656 N/A ALA 132.A N PRO 129.A O no hydrogen 3.075 N/A LEU 138.A N PHE 135.A O no hydrogen 2.860 N/A LYS 139.A N GLY 155.A O no hydrogen 2.823 N/A PHE 141.A N THR 153.A O no hydrogen 2.881 N/A TYR 142.A N GLY 125.A O no hydrogen 2.767 N/A TYR 142.A OH SER 149.A O no hydrogen 2.779 N/A GLY 146.A N THR 148.A O no hydrogen 3.061 N/A HIS 147.A NE2 HIS 80.A ND1 no hydrogen 3.171 N/A THR 148.A OG1 ASP 150.A OD2 no hydrogen 3.052 N/A ILE 152.A N THR 77.A O no hydrogen 2.936 N/A THR 153.A N PHE 141.A O no hydrogen 2.952 N/A VAL 154.A N PHE 163.A O no hydrogen 3.057 N/A GLY 155.A N LYS 139.A O no hydrogen 2.800 N/A ILE 156.A N ILE 161.A O no hydrogen 2.990 N/A ASP 157.A N PRO 137.A O no hydrogen 2.873 N/A THR 159.A N ILE 156.A O no hydrogen 3.287 N/A THR 159.A OG1 ILE 156.A O no hydrogen 2.539 N/A ILE 161.A N THR 159.A OG1 no hydrogen 3.071 N/A ALA 162.A N MET 203.A O no hydrogen 3.042 N/A PHE 163.A N VAL 154.A O no hydrogen 2.734 N/A GLY 164.A N VAL 205.A O no hydrogen 3.061 N/A CYS 166.A SG ASP 82.A OD1 no hydrogen 3.529 N/A CYS 166.A SG SER 207.A OG no hydrogen 3.073 N/A CYS 166.A SG HIS 208.A NE2 no hydrogen 3.651 N/A LEU 167.A N GLY 164.A O no hydrogen 3.151 N/A LYS 169.A N THR 220.A OG1 no hydrogen 2.551 N/A LYS 169.A NZ CYS 166.A O no hydrogen 3.100 N/A SER 171.A N ASP 212.A OD2 no hydrogen 3.415 N/A SER 171.A OG ASP 212.A OD2 no hydrogen 2.887 N/A LYS 172.A N ASP 170.A OD1 no hydrogen 2.571 N/A ALA 173.A N ASP 170.A O no hydrogen 2.855 N/A GLY 177.A N SER 175.A OG no hydrogen 3.311 N/A ALA 182.A N LEU 179.A O no hydrogen 3.162 N/A ASP 183.A N GLY 146.A O no hydrogen 2.750 N/A HIS 186.A N ASP 183.A OD2 no hydrogen 2.878 N/A TYR 187.A OH LEU 167.A O no hydrogen 2.427 N/A SER 190.A N HIS 186.A O no hydrogen 2.911 N/A SER 190.A OG PRO 143.A O no hydrogen 3.287 N/A SER 190.A OG PRO 145.A O no hydrogen 2.478 N/A SER 190.A OG HIS 186.A O no hydrogen 3.225 N/A ALA 191.A N TYR 187.A O no hydrogen 2.766 N/A ARG 192.A N ALA 188.A O no hydrogen 3.064 N/A ARG 192.A NH2 ASP 225.A OD2 no hydrogen 2.794 N/A ALA 193.A N ALA 189.A O no hydrogen 2.818 N/A PHE 194.A N SER 190.A O no hydrogen 3.010 N/A GLY 195.A N ALA 191.A O no hydrogen 3.227 N/A ALA 196.A N ARG 192.A O no hydrogen 2.779 N/A ALA 197.A N ALA 193.A O no hydrogen 2.752 N/A PHE 198.A N PHE 194.A O no hydrogen 3.181 N/A ALA 201.A N PHE 198.A O no hydrogen 3.098 N/A SER 202.A N ASP 160.A O no hydrogen 3.000 N/A MET 203.A N ASP 160.A O no hydrogen 2.904 N/A ILE 204.A N ASP 212.A O no hydrogen 2.910 N/A VAL 205.A N ALA 162.A O no hydrogen 2.750 N/A SER 207.A N GLY 165.A O no hydrogen 3.078 N/A HIS 208.A ND1 ALA 32.A O no hydrogen 2.775 N/A ASP 212.A N ILE 204.A O no hydrogen 3.107 N/A SER 213.A N ASP 212.A OD1 no hydrogen 2.712 N/A ARG 214.A NH1 PHE 198.A O no hydrogen 2.771 N/A ARG 214.A NH1 ALA 201.A O no hydrogen 2.735 N/A ARG 214.A NH2 GLY 195.A O no hydrogen 2.909 N/A ALA 215.A N SER 213.A OG no hydrogen 3.042 N/A ALA 216.A N SER 213.A O no hydrogen 2.965 N/A ILE 217.A N ARG 214.A O no hydrogen 2.927 N/A THR 218.A N ARG 214.A O no hydrogen 3.369 N/A HIS 219.A N ALA 215.A O no hydrogen 2.799 N/A HIS 219.A NE2 ALA 173.A O no hydrogen 2.611 N/A THR 220.A N ALA 216.A O no hydrogen 2.876 N/A THR 220.A OG1 ALA 216.A O no hydrogen 2.818 N/A ALA 221.A N ILE 217.A O no hydrogen 3.006 N/A ARG 222.A N THR 218.A O no hydrogen 3.090 N/A MET 223.A N HIS 219.A O no hydrogen 3.040 N/A ALA 224.A N THR 220.A O no hydrogen 2.950 N/A ASP 225.A N ALA 221.A O no hydrogen 2.804 N/A LYS 226.A N ARG 222.A O no hydrogen 3.188 N/A LEU 227.A N MET 223.A O no hydrogen 3.257 N/A ARG 228.A N ALA 224.A O no hydrogen 3.297 N/A VAL 231.A N.T VAL 231.A O.T no hydrogen 2.837 N/A VAL 231.A O.T PRO 232.A O.T no hydrogen 3.150 N/A PRO 232.A O.T VAL 231.A O.T no hydrogen 3.150 N/A