Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3v91_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A N MET 1.A O no hydrogen 3.353 N/A ALA 5.A N LYS 97.A O no hydrogen 3.230 N/A PHE 6.A N ARG 34.A O no hydrogen 2.830 N/A VAL 7.A N VAL 99.A O no hydrogen 2.802 N/A THR 8.A N ALA 36.A O no hydrogen 2.947 N/A THR 8.A OG1 MET 101.A O no hydrogen 2.596 N/A LEU 9.A N THR 8.A OG1 no hydrogen 2.732 N/A THR 10.A N LEU 38.A O no hydrogen 2.786 N/A THR 10.A OG1 ASN 12.A O no hydrogen 2.517 N/A TYR 15.A N ASN 12.A OD1 no hydrogen 2.810 N/A ALA 16.A N ASN 12.A O no hydrogen 3.075 N/A LYS 17.A N ASP 13.A O no hydrogen 3.222 N/A LYS 17.A N ALA 14.A O no hydrogen 3.153 N/A GLY 18.A N ALA 14.A O no hydrogen 3.473 N/A ALA 19.A N TYR 15.A O no hydrogen 2.728 N/A LEU 20.A N ALA 16.A O no hydrogen 2.787 N/A VAL 21.A N LYS 17.A O no hydrogen 2.920 N/A LEU 22.A N GLY 18.A O no hydrogen 2.769 N/A GLY 23.A N ALA 19.A O no hydrogen 2.745 N/A SER 24.A N LEU 20.A O no hydrogen 2.881 N/A SER 24.A OG LEU 20.A O no hydrogen 2.650 N/A SER 25.A N VAL 21.A O no hydrogen 2.758 N/A SER 25.A OG VAL 21.A O no hydrogen 3.364 N/A SER 25.A OG LEU 22.A O no hydrogen 2.628 N/A LEU 26.A N LEU 22.A O no hydrogen 2.906 N/A LYS 27.A N GLY 23.A O no hydrogen 3.041 N/A GLN 28.A N SER 24.A O no hydrogen 2.747 N/A HIS 29.A N SER 25.A O no hydrogen 3.062 N/A HIS 29.A N LEU 26.A O no hydrogen 3.269 N/A ARG 30.A N LYS 27.A O no hydrogen 2.914 N/A THR 31.A N LEU 26.A O no hydrogen 3.193 N/A THR 31.A OG1 ASP 112.A OD1 no hydrogen 2.581 N/A THR 31.A OG1 ASP 112.A OD2 no hydrogen 3.363 N/A SER 32.A N ASP 112.A OD2 no hydrogen 2.783 N/A SER 32.A OG ASP 112.A OD2 no hydrogen 3.255 N/A ARG 33.A N THR 31.A OG1 no hydrogen 2.983 N/A ARG 33.A NE GLN 4.A OE1 no hydrogen 2.820 N/A ARG 33.A NH2 GLN 4.A OE1 no hydrogen 2.869 N/A ARG 34.A N GLN 4.A O no hydrogen 2.987 N/A LEU 35.A N ASP 56.A OD2 no hydrogen 2.714 N/A ALA 36.A N PHE 6.A O no hydrogen 2.702 N/A VAL 37.A N GLU 57.A O no hydrogen 2.816 N/A LEU 38.A N THR 8.A O no hydrogen 2.818 N/A THR 39.A N ILE 59.A O no hydrogen 2.600 N/A THR 39.A OG1 ILE 59.A O no hydrogen 3.288 N/A THR 40.A OG1 THR 11.A O no hydrogen 3.049 N/A THR 40.A OG1 GLN 42.A OE1 no hydrogen 3.489 N/A VAL 43.A N THR 40.A O no hydrogen 3.074 N/A SER 44.A N ASP 13.A OD1 no hydrogen 2.789 N/A SER 44.A OG ASP 13.A OD1 no hydrogen 3.291 N/A SER 44.A OG ASP 13.A OD2 no hydrogen 3.414 N/A SER 44.A OG THR 46.A OG1 no hydrogen 3.138 N/A THR 46.A OG1 SER 44.A OG no hydrogen 3.138 N/A MET 47.A N SER 44.A OG no hydrogen 3.351 N/A ARG 48.A N SER 44.A O no hydrogen 2.941 N/A ARG 48.A NH1 VAL 43.A O no hydrogen 2.772 N/A ARG 48.A NH2 THR 39.A OG1 no hydrogen 3.385 N/A ARG 48.A NH2 THR 40.A O no hydrogen 2.602 N/A LYS 49.A N ASP 45.A O no hydrogen 2.977 N/A ALA 50.A N THR 46.A O no hydrogen 3.064 N/A LEU 51.A N MET 47.A O no hydrogen 2.837 N/A GLU 52.A N ARG 48.A O no hydrogen 2.860 N/A ILE 53.A N LYS 49.A O no hydrogen 3.205 N/A ILE 53.A N ALA 50.A O no hydrogen 2.985 N/A VAL 54.A N ALA 50.A O no hydrogen 3.020 N/A PHE 55.A N LEU 51.A O no hydrogen 2.718 N/A GLU 57.A N LEU 35.A O no hydrogen 3.029 N/A ILE 59.A N VAL 37.A O no hydrogen 2.795 N/A VAL 61.A N THR 39.A O no hydrogen 2.611 N/A LEU 64.A N ASP 62.A OD1 no hydrogen 3.296 N/A ASP 65.A N ASP 62.A O no hydrogen 2.991 N/A GLY 67.A N ASP 65.A OD1 no hydrogen 2.475 N/A ASP 68.A N ASP 65.A O no hydrogen 2.984 N/A SER 69.A OG TYR 146.A OH no hydrogen 2.651 N/A ALA 70.A N ASP 68.A OD1 no hydrogen 2.813 N/A HIS 71.A N ASP 68.A O no hydrogen 2.946 N/A HIS 71.A ND1 ILE 63.A O no hydrogen 2.665 N/A LEU 74.A N ALA 70.A O no hydrogen 2.886 N/A MET 75.A N HIS 71.A O no hydrogen 2.898 N/A LYS 76.A N LEU 72.A O no hydrogen 3.189 N/A LYS 76.A NZ SER 154.A O no hydrogen 3.203 N/A ARG 77.A N THR 73.A O no hydrogen 2.800 N/A ARG 77.A NE SER 154.A O no hydrogen 3.009 N/A ARG 77.A NH2 SER 154.A O no hydrogen 2.953 N/A GLU 79.A N GLU 79.A OE2 no hydrogen 2.730 N/A LEU 80.A N ARG 77.A O no hydrogen 2.956 N/A LEU 84.A N LEU 80.A O no hydrogen 2.812 N/A THR 85.A N GLY 81.A O no hydrogen 2.967 N/A THR 85.A OG1 GLY 81.A O no hydrogen 2.795 N/A LYS 86.A N VAL 82.A O no hydrogen 2.817 N/A LYS 86.A NZ ASP 102.A OD1 no hydrogen 3.329 N/A LYS 86.A NZ SER 134.A O no hydrogen 2.688 N/A LYS 86.A NZ ASP 163.A OD2 no hydrogen 2.657 N/A LEU 87.A N MET 83.A O no hydrogen 2.855 N/A HIS 88.A N THR 85.A O no hydrogen 3.090 N/A HIS 88.A ND1 LEU 84.A O no hydrogen 2.793 N/A HIS 88.A NE2 ASP 68.A OD1 no hydrogen 2.868 N/A HIS 88.A NE2 ASP 68.A OD2 no hydrogen 2.725 N/A CYS 89.A N LYS 86.A O no hydrogen 2.795 N/A CYS 89.A SG LYS 86.A O no hydrogen 3.063 N/A TRP 90.A N LEU 87.A O no hydrogen 3.018 N/A TRP 90.A NE1 GLU 119.A OE1 no hydrogen 2.641 N/A SER 91.A N HIS 88.A O no hydrogen 2.891 N/A LEU 92.A N CYS 89.A O no hydrogen 3.343 N/A THR 93.A N SER 91.A O no hydrogen 2.900 N/A TYR 95.A N LEU 92.A O no hydrogen 2.887 N/A TYR 95.A OH GLU 57.A OE1 no hydrogen 2.531 N/A SER 96.A N ASP 3.A O no hydrogen 2.705 N/A SER 96.A OG ASP 3.A O no hydrogen 3.430 N/A SER 96.A OG ASP 3.A OD1 no hydrogen 3.189 N/A SER 96.A OG ASP 3.A OD2 no hydrogen 3.277 N/A LYS 97.A NZ PHE 115.A O no hydrogen 2.906 N/A LYS 97.A NZ ARG 117.A O no hydrogen 2.655 N/A CYS 98.A N TYR 139.A O no hydrogen 2.927 N/A CYS 98.A SG TYR 139.A OH no hydrogen 3.649 N/A VAL 99.A N ALA 5.A O no hydrogen 2.929 N/A PHE 100.A N PHE 137.A O no hydrogen 2.755 N/A MET 101.A N VAL 7.A O no hydrogen 2.764 N/A ASP 102.A N GLY 135.A O no hydrogen 2.716 N/A THR 105.A N ASP 102.A O no hydrogen 3.074 N/A THR 105.A OG1 ASP 102.A O no hydrogen 2.714 N/A LEU 106.A N VAL 211.A O no hydrogen 2.792 N/A VAL 107.A N SER 25.A OG no hydrogen 3.099 N/A LEU 108.A N LYS 209.A O no hydrogen 2.649 N/A LEU 114.A N ILE 111.A O no hydrogen 2.902 N/A PHE 115.A N ASP 112.A O no hydrogen 3.089 N/A GLU 116.A N ASP 113.A O no hydrogen 3.163 N/A ARG 117.A N LEU 114.A O no hydrogen 2.844 N/A ARG 117.A NH1 ARG 180.A O no hydrogen 2.778 N/A SER 121.A N VAL 138.A O no hydrogen 3.257 N/A SER 121.A OG GLU 118.A O no hydrogen 2.540 N/A ALA 122.A N LYS 181.A O no hydrogen 2.947 N/A ASP 125.A N CYS 131.A O no hydrogen 2.828 N/A CYS 131.A N TRP 128.A O no hydrogen 2.845 N/A PHE 132.A N ASN 168.A OD1 no hydrogen 2.890 N/A ASN 133.A N ALA 123.A O no hydrogen 2.734 N/A ASN 133.A ND2 ASP 125.A OD2 no hydrogen 2.797 N/A SER 134.A OG ASP 163.A OD2 no hydrogen 2.538 N/A GLY 135.A N ASN 133.A OD1 no hydrogen 2.823 N/A PHE 137.A N PHE 100.A O no hydrogen 2.938 N/A VAL 138.A N SER 121.A O no hydrogen 2.802 N/A TYR 139.A N CYS 98.A O no hydrogen 2.930 N/A TYR 139.A OH CYS 89.A O no hydrogen 2.748 N/A GLN 140.A N GLU 119.A OE1 no hydrogen 2.654 N/A SER 142.A N TRP 90.A O no hydrogen 2.770 N/A SER 142.A OG THR 145.A OG1 no hydrogen 3.308 N/A THR 145.A N SER 142.A OG no hydrogen 2.960 N/A THR 145.A OG1 SER 142.A OG no hydrogen 3.308 N/A TYR 146.A N SER 142.A O no hydrogen 2.869 N/A TYR 146.A OH SER 69.A OG no hydrogen 2.651 N/A ASN 147.A N VAL 143.A O no hydrogen 2.762 N/A GLN 148.A N GLU 144.A O no hydrogen 2.880 N/A LEU 149.A N THR 145.A O no hydrogen 2.775 N/A LEU 150.A N TYR 146.A O no hydrogen 2.794 N/A HIS 151.A N ASN 147.A O no hydrogen 2.815 N/A VAL 152.A N GLN 148.A O no hydrogen 2.994 N/A ALA 153.A N LEU 149.A O no hydrogen 2.819 N/A SER 154.A N LEU 150.A O no hydrogen 2.891 N/A GLU 155.A N HIS 151.A O no hydrogen 2.908 N/A GLN 156.A N VAL 152.A O no hydrogen 2.730 N/A GLY 157.A N ALA 153.A O no hydrogen 2.795 N/A SER 158.A OG ASP 160.A OD1 no hydrogen 2.869 N/A SER 158.A OG GLY 162.A O no hydrogen 2.459 N/A ASP 160.A N SER 158.A OG no hydrogen 3.401 N/A GLY 161.A N SER 158.A O no hydrogen 3.188 N/A GLY 162.A N ASP 160.A OD1 no hydrogen 2.856 N/A GLY 165.A N ASP 160.A OD1 no hydrogen 2.910 N/A LEU 167.A N ASP 163.A O no hydrogen 2.731 N/A ASN 168.A N GLN 164.A O no hydrogen 2.919 N/A ASN 168.A ND2 PHE 132.A O no hydrogen 2.931 N/A ASN 168.A ND2 GLN 164.A O no hydrogen 2.899 N/A THR 169.A N GLY 165.A O no hydrogen 2.875 N/A THR 169.A OG1 GLY 165.A O no hydrogen 2.914 N/A PHE 170.A N LEU 166.A O no hydrogen 2.851 N/A PHE 171.A N LEU 167.A O no hydrogen 2.679 N/A ASN 172.A ND2 THR 169.A O no hydrogen 2.719 N/A TRP 174.A NE1 ALA 122.A O no hydrogen 3.127 N/A TRP 174.A NE1 LYS 181.A O no hydrogen 2.767 N/A THR 176.A N SER 173.A O no hydrogen 3.072 N/A THR 176.A OG1 SER 173.A O no hydrogen 3.408 N/A THR 176.A OG1 THR 177.A OG1 no hydrogen 3.368 N/A THR 177.A OG1 SER 173.A O no hydrogen 3.045 N/A THR 177.A OG1 THR 176.A OG1 no hydrogen 3.368 N/A ARG 180.A N ASP 178.A OD1 no hydrogen 2.937 N/A LYS 181.A N ASP 178.A O no hydrogen 2.824 N/A LYS 181.A NZ GLU 119.A O no hydrogen 3.029 N/A HIS 182.A N ILE 179.A O no hydrogen 2.924 N/A HIS 182.A NE2 TRP 174.A O no hydrogen 3.140 N/A LEU 183.A N ALA 122.A O no hydrogen 2.931 N/A TYR 187.A N PRO 184.A O no hydrogen 2.817 N/A TYR 187.A OH ASP 113.A OD1 no hydrogen 2.709 N/A ASN 188.A N PHE 185.A O no hydrogen 2.942 N/A ASN 188.A ND2 ASN 133.A O no hydrogen 3.669 N/A ASN 188.A ND2 ASN 133.A OD1 no hydrogen 2.709 N/A LEU 189.A N VAL 210.A O no hydrogen 2.833 N/A SER 191.A N HIS 212.A O no hydrogen 2.778 N/A SER 191.A OG HIS 212.A O no hydrogen 3.242 N/A SER 193.A N SER 190.A O no hydrogen 2.828 N/A TYR 195.A N ILE 192.A O no hydrogen 3.258 N/A SER 196.A N ILE 192.A O no hydrogen 3.046 N/A TYR 197.A N SER 193.A O no hydrogen 3.426 N/A PHE 201.A N TYR 197.A O no hydrogen 2.987 N/A LYS 202.A N LEU 198.A O no hydrogen 2.653 N/A ALA 203.A N PRO 199.A O no hydrogen 2.776 N/A PHE 204.A N ALA 200.A O no hydrogen 2.727 N/A GLY 205.A N PHE 201.A O no hydrogen 2.537 N/A ASN 207.A N PHE 204.A O no hydrogen 3.007 N/A ALA 208.A N GLY 205.A O no hydrogen 2.923 N/A LYS 209.A N ILE 186.A O no hydrogen 2.737 N/A VAL 210.A N ILE 186.A O no hydrogen 2.881 N/A VAL 211.A N LEU 106.A O no hydrogen 2.826 N/A HIS 212.A N LEU 189.A O no hydrogen 2.740 N/A PHE 213.A N ASP 104.A O no hydrogen 2.878 N/A LEU 214.A N HIS 212.A O no hydrogen 3.008 N/A LYS 218.A NZ ASP 104.A OD2 no hydrogen 2.589 N/A LYS 218.A NZ PHE 213.A O no hydrogen 2.740 N/A ASN 221.A N LYS 218.A O no hydrogen 2.788 N/A TYR 222.A N PRO 219.A O no hydrogen 3.353 N/A ASP 225.A N SER 230.A O no hydrogen 2.950 N/A LYS 227.A N ASP 225.A OD1 no hydrogen 2.834 N/A THR 228.A N ASP 225.A OD1 no hydrogen 3.100 N/A THR 228.A OG1 SER 230.A OG no hydrogen 3.018 N/A SER 230.A N ASP 225.A O no hydrogen 3.192 N/A SER 230.A OG THR 228.A OG1 no hydrogen 3.018 N/A VAL 231.A N ASN 240.A OD1 no hydrogen 2.811 N/A ARG 232.A N THR 223.A O no hydrogen 2.698 N/A ASN 240.A N PRO 236.A O no hydrogen 2.732 N/A VAL 241.A N GLN 237.A O no hydrogen 3.075 N/A TRP 242.A N PHE 238.A O no hydrogen 2.945 N/A TRP 243.A N LEU 239.A O no hydrogen 2.772 N/A TRP 243.A NE1 PRO 219.A O no hydrogen 2.484 N/A ASP 244.A N ASN 240.A O no hydrogen 2.816 N/A ILE 245.A N VAL 241.A O no hydrogen 2.965 N/A PHE 246.A N TRP 242.A O no hydrogen 2.834 N/A THR 247.A N TRP 243.A O no hydrogen 2.663 N/A THR 247.A OG1 TRP 243.A O no hydrogen 2.638 N/A THR 248.A N ASP 244.A O no hydrogen 2.657 N/A THR 248.A OG1 ASP 244.A O no hydrogen 2.620 N/A THR 248.A OG1 ASP 244.A OD1 no hydrogen 2.921 N/A SER 249.A N ILE 245.A O no hydrogen 2.734 N/A VAL 250.A N ILE 245.A O no hydrogen 3.155 N/A VAL 251.A N PHE 246.A O no hydrogen 2.768 N/A LEU 254.A N VAL 250.A O no hydrogen 3.094 N/A GLN 255.A N VAL 251.A O no hydrogen 3.080 N/A GLN 256.A N LEU 254.A O no hydrogen 2.567 N/A GLN 256.A NE2 LEU 254.A O no hydrogen 3.379 N/A