Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ay8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A N ASP 58.A O no hydrogen 2.990 N/A LEU 5.A N GLN 29.A O no hydrogen 2.787 N/A TYR 6.A N THR 56.A O no hydrogen 2.722 N/A HIS 7.A N GLU 31.A O no hydrogen 2.907 N/A PHE 8.A N SER 14.A OG no hydrogen 3.030 N/A SER 11.A N PHE 8.A O no hydrogen 2.871 N/A SER 14.A N SER 11.A OG no hydrogen 3.128 N/A ARG 15.A N SER 11.A O no hydrogen 2.870 N/A ARG 15.A NE PRO 9.A O no hydrogen 2.782 N/A ARG 15.A NH1 VAL 10.A O no hydrogen 3.026 N/A ARG 15.A NH1 SER 168.A OG no hydrogen 2.919 N/A ARG 15.A NH2 ALA 164.A O no hydrogen 3.151 N/A ARG 15.A NH2 SER 168.A OG no hydrogen 3.421 N/A ARG 15.A NH2 ASN 198.A OD1 no hydrogen 2.973 N/A GLY 16.A N GLY 12.A O no hydrogen 2.803 N/A ALA 17.A N PRO 13.A O no hydrogen 3.106 N/A LEU 18.A N SER 14.A O no hydrogen 3.191 N/A LEU 19.A N ARG 15.A O no hydrogen 2.858 N/A ALA 20.A N GLY 16.A O no hydrogen 3.165 N/A ALA 21.A N ALA 17.A O no hydrogen 3.159 N/A ARG 22.A N LEU 18.A O no hydrogen 2.819 N/A ARG 22.A NE GLU 197.A OE1 no hydrogen 2.822 N/A ARG 22.A NH2 GLU 197.A OE1 no hydrogen 3.359 N/A ARG 22.A NH2 GLU 197.A OE2 no hydrogen 2.901 N/A ALA 23.A N LEU 19.A O no hydrogen 2.882 N/A ILE 24.A N ALA 20.A O no hydrogen 3.022 N/A GLY 25.A N ALA 21.A O no hydrogen 3.010 N/A ILE 26.A N ALA 21.A O no hydrogen 3.219 N/A GLN 29.A N LEU 3.A O no hydrogen 2.823 N/A GLU 31.A N LEU 5.A O no hydrogen 2.935 N/A VAL 33.A N HIS 7.A O no hydrogen 2.774 N/A LYS 37.A N ASN 34.A O no hydrogen 3.174 N/A LYS 38.A NZ LEU 35.A O no hydrogen 3.449 N/A GLN 40.A N LYS 37.A O no hydrogen 3.089 N/A LEU 41.A N LYS 38.A O no hydrogen 3.202 N/A SER 44.A OG GLU 31.A OE1.A no hydrogen 3.452 N/A PHE 45.A N GLN 42.A O no hydrogen 3.174 N/A LEU 46.A N GLN 42.A O no hydrogen 3.226 N/A LYS 47.A N GLU 43.A O no hydrogen 3.084 N/A ASN 49.A ND2 THR 56.A OG1 no hydrogen 3.222 N/A CYS 53.A N GLN 51.A O no hydrogen 2.611 N/A CYS 53.A SG.A GLN 51.A O no hydrogen 3.917 N/A THR 56.A N TYR 6.A O no hydrogen 3.172 N/A THR 56.A OG1 CYS 53.A O no hydrogen 2.459 N/A LEU 57.A N LEU 64.A O no hydrogen 2.670 N/A ASP 58.A N LYS 4.A O no hydrogen 2.772 N/A ASP 59.A N PHE 62.A O no hydrogen 2.863 N/A ASN 61.A N ASP 58.A OD1 no hydrogen 2.743 N/A PHE 62.A N ASP 59.A O no hydrogen 3.075 N/A LEU 64.A N LEU 57.A O no hydrogen 2.819 N/A SER 67.A OG.B PRO 13.A O no hydrogen 2.615 N/A ARG 68.A N GLU 66.A OE2.A no hydrogen 2.984 N/A ARG 68.A NE ASP 102.A OD2 no hydrogen 2.815 N/A ARG 68.A NH2 ASP 102.A OD2 no hydrogen 2.832 N/A ILE 70.A N GLU 66.A O no hydrogen 2.979 N/A ALA 71.A N SER 67.A O no hydrogen 2.975 N/A CYS 72.A N ARG 68.A O no hydrogen 3.098 N/A CYS 72.A SG ARG 68.A O no hydrogen 3.324 N/A TYR 73.A N ALA 69.A O no hydrogen 2.907 N/A TYR 73.A OH ASP 59.A OD2 no hydrogen 2.496 N/A LEU 74.A N ILE 70.A O no hydrogen 2.798 N/A ALA 75.A N ALA 71.A O no hydrogen 2.983 N/A ASP 76.A N CYS 72.A O no hydrogen 3.108 N/A LYS 77.A N TYR 73.A O no hydrogen 2.827 N/A LYS 77.A NZ ASP 59.A OD2 no hydrogen 3.323 N/A LYS 77.A NZ TYR 73.A OH no hydrogen 3.445 N/A LYS 77.A NZ TYR 78.A OH no hydrogen 3.225 N/A TYR 78.A N LEU 74.A O no hydrogen 2.879 N/A TYR 78.A OH ASP 59.A OD1 no hydrogen 3.067 N/A TYR 78.A OH ASP 59.A OD2 no hydrogen 2.853 N/A GLY 79.A N ALA 75.A O no hydrogen 2.955 N/A GLN 83.A N.A ASP 81.A OD2 no hydrogen 3.369 N/A TYR 85.A N ASP 82.A O.A no hydrogen 3.030 N/A TYR 85.A OH ASN 96.A OD1 no hydrogen 2.588 N/A LYS 87.A N ASP 82.A OD1.A no hydrogen 2.916 N/A LYS 87.A N ASP 82.A OD2.A no hydrogen 3.107 N/A LYS 87.A N ASP 82.A OD2.B no hydrogen 3.066 N/A LYS 87.A NZ ASP 76.A OD1 no hydrogen 3.419 N/A LYS 91.A N ASP 88.A OD2 no hydrogen 2.885 N/A ARG 92.A N ASP 88.A O no hydrogen 2.741 N/A ARG 92.A NE PRO 86.A O no hydrogen 2.778 N/A ARG 92.A NH1 ASP 76.A OD1 no hydrogen 3.420 N/A ARG 92.A NH1 ASP 76.A OD2 no hydrogen 2.657 N/A ARG 92.A NH2 ASP 76.A OD1 no hydrogen 2.777 N/A ARG 92.A NH2 TYR 85.A O no hydrogen 2.922 N/A ARG 92.A NH2 PRO 86.A O no hydrogen 3.382 N/A ALA 93.A N LEU 89.A O no hydrogen 2.901 N/A VAL 94.A N GLN 90.A O no hydrogen 3.148 N/A VAL 95.A N LYS 91.A O no hydrogen 3.226 N/A ASN 96.A N ARG 92.A O no hydrogen 2.832 N/A GLN 97.A N ALA 93.A O no hydrogen 2.825 N/A ARG 98.A N VAL 94.A O no hydrogen 2.992 N/A ARG 98.A NE VAL 150.A O no hydrogen 2.765 N/A ARG 98.A NH2 VAL 150.A O no hydrogen 3.273 N/A LEU 99.A N VAL 95.A O no hydrogen 2.931 N/A TYR 100.A N ASN 96.A O no hydrogen 2.780 N/A PHE 101.A N GLN 97.A O no hydrogen 2.854 N/A ASP 102.A N ARG 98.A O no hydrogen 2.854 N/A SER 103.A N LEU 99.A O no hydrogen 2.973 N/A SER 103.A OG TYR 100.A O no hydrogen 3.007 N/A ALA 104.A N TYR 100.A O no hydrogen 2.750 N/A SER 105.A N PHE 101.A O no hydrogen 3.014 N/A LEU 106.A N PHE 101.A O no hydrogen 3.064 N/A TYR 107.A N ASP 102.A O no hydrogen 2.871 N/A LYS 109.A N SER 105.A O no hydrogen 3.218 N/A LYS 109.A N LEU 106.A O no hydrogen 3.178 N/A LYS 109.A NZ ASP 132.A O no hydrogen 3.198 N/A LYS 109.A NZ ASP 132.A OD1 no hydrogen 2.877 N/A LYS 109.A NZ THR 136.A OG1 no hydrogen 2.681 N/A ILE 110.A N LEU 106.A O no hydrogen 3.135 N/A ARG 111.A N TYR 107.A O no hydrogen 2.822 N/A ALA 112.A N VAL 108.A O no hydrogen 2.952 N/A ILE 113.A N ILE 110.A O no hydrogen 3.139 N/A CYS 114.A N ILE 110.A O no hydrogen 2.881 N/A CYS 114.A SG ILE 110.A O no hydrogen 3.534 N/A PHE 115.A N ARG 111.A O no hydrogen 2.889 N/A LEU 118.A N CYS 114.A O no hydrogen 2.909 N/A PHE 119.A N PHE 115.A O no hydrogen 2.990 N/A LEU 120.A N PRO 116.A O no hydrogen 2.896 N/A GLU 122.A N PRO 116.A O no hydrogen 2.955 N/A THR 123.A N GLU 122.A OE2 no hydrogen 3.008 N/A GLU 124.A N GLU 122.A OE2 no hydrogen 3.206 N/A LYS 126.A NZ.B GLU 122.A OE1 no hydrogen 3.213 N/A LYS 126.A NZ.B GLU 122.A OE2 no hydrogen 3.154 N/A LYS 126.A NZ.B GLU 124.A OE2 no hydrogen 3.146 N/A LYS 130.A N LYS 126.A O no hydrogen 2.984 N/A ASP 131.A N GLN 127.A O no hydrogen 2.907 N/A ASP 132.A N SER 128.A O no hydrogen 3.026 N/A LEU 133.A N LEU 129.A O no hydrogen 3.010 N/A ASN 134.A N LYS 130.A O no hydrogen 2.911 N/A SER 135.A N ASP 131.A O no hydrogen 2.970 N/A THR 136.A N ASP 132.A O no hydrogen 3.336 N/A LEU 137.A N LEU 133.A O no hydrogen 2.804 N/A SER 138.A N ASN 134.A O no hydrogen 2.920 N/A PHE 139.A N SER 135.A O no hydrogen 3.369 N/A LEU 140.A N THR 136.A O no hydrogen 3.094 N/A ASN 141.A N LEU 137.A O no hydrogen 2.785 N/A GLN 142.A N SER 138.A O no hydrogen 3.081 N/A PHE 143.A N PHE 139.A O no hydrogen 2.997 N/A LEU 144.A N LEU 140.A O no hydrogen 3.185 N/A GLU 145.A N GLN 142.A O no hydrogen 2.912 N/A THR 147.A OG1 TRP 149.A O no hydrogen 2.613 N/A LYS 148.A N ASP 153.A OD1 no hydrogen 2.926 N/A TRP 149.A N ALA 152.A O no hydrogen 3.135 N/A VAL 150.A N ASP 159.A OD1 no hydrogen 2.779 N/A THR 156.A N ASP 159.A OD2 no hydrogen 2.783 N/A THR 156.A OG1 ASP 159.A OD2 no hydrogen 3.435 N/A ILE 157.A N TRP 84.A O no hydrogen 2.930 N/A ALA 158.A N THR 156.A OG1 no hydrogen 3.267 N/A ASP 159.A N THR 156.A O no hydrogen 2.947 N/A THR 160.A N THR 156.A O no hydrogen 3.442 N/A THR 160.A OG1 ILE 157.A O no hydrogen 2.942 N/A SER 161.A N ILE 157.A O no hydrogen 3.192 N/A ILE 162.A N ALA 158.A O no hydrogen 3.036 N/A TYR 163.A N ASP 159.A O no hydrogen 2.785 N/A TYR 163.A OH GLU 199.A OE2 no hydrogen 2.526 N/A ALA 164.A N THR 160.A O no hydrogen 3.039 N/A SER 165.A N SER 161.A O no hydrogen 3.065 N/A SER 165.A OG ASP 102.A OD1 no hydrogen 2.586 N/A SER 165.A OG ASP 102.A OD2 no hydrogen 3.509 N/A SER 165.A OG SER 161.A O no hydrogen 3.465 N/A MET 166.A N ILE 162.A O no hydrogen 2.819 N/A SER 167.A N TYR 163.A O no hydrogen 2.824 N/A SER 167.A OG TYR 163.A O no hydrogen 2.868 N/A SER 167.A OG ALA 164.A O no hydrogen 3.086 N/A SER 168.A OG ALA 164.A O no hydrogen 2.612 N/A ILE 169.A N SER 165.A O no hydrogen 3.389 N/A LEU 170.A N MET 166.A O no hydrogen 2.943 N/A ALA 171.A N SER 167.A O no hydrogen 3.006 N/A VAL 172.A N SER 168.A O no hydrogen 3.310 N/A GLY 173.A N ILE 169.A O no hydrogen 2.997 N/A SER 177.A N ASP 175.A OD1 no hydrogen 3.009 N/A SER 177.A OG ASP 175.A OD1 no hydrogen 2.719 N/A PHE 179.A N ILE 176.A O no hydrogen 2.729 N/A ASN 181.A N ASN 141.A OD1 no hydrogen 2.940 N/A ASN 181.A ND2 ASN 141.A O no hydrogen 2.970 N/A ASN 181.A ND2 GLU 145.A OE1 no hydrogen 2.705 N/A GLN 183.A N PHE 179.A O no hydrogen 3.158 N/A ARG 184.A N PRO 180.A O no hydrogen 2.997 N/A ARG 184.A NH1 LEU 144.A O no hydrogen 3.001 N/A ARG 184.A NH2 LEU 144.A O no hydrogen 2.842 N/A ARG 184.A NH2 LYS 148.A O no hydrogen 2.929 N/A TRP 185.A N ASN 181.A O no hydrogen 3.012 N/A TRP 185.A NE1 ASP 159.A OD1 no hydrogen 2.972 N/A ILE 186.A N.A ILE 182.A O no hydrogen 2.836 N/A ILE 186.A N.B ILE 182.A O no hydrogen 2.828 N/A ASP 188.A N ARG 184.A O no hydrogen 3.237 N/A CYS 189.A N TRP 185.A O no hydrogen 2.815 N/A CYS 189.A SG TRP 185.A O no hydrogen 3.395 N/A LEU 190.A N LYS 187.A O no hydrogen 3.226 N/A LEU 191.A N ASP 188.A O no hydrogen 3.037 N/A LEU 192.A N CYS 189.A O no hydrogen 2.955 N/A ALA 195.A N LEU 192.A O no hydrogen 3.160 N/A ASN 198.A N GLY 194.A O no hydrogen 3.004 N/A ASN 198.A ND2 SER 167.A OG no hydrogen 2.955 N/A GLU 199.A N ALA 195.A O no hydrogen 2.810 N/A ASP 200.A N PRO 196.A O no hydrogen 2.937 N/A GLY 201.A N GLU 197.A O no hydrogen 3.431 N/A ALA 202.A N ASN 198.A O no hydrogen 2.905 N/A ARG 203.A N GLU 199.A O no hydrogen 2.912 N/A THR 204.A N ASP 200.A O no hydrogen 3.148 N/A THR 204.A OG1 ASP 200.A O no hydrogen 3.132 N/A PHE 205.A N GLY 201.A O no hydrogen 2.968 N/A GLY 206.A N ALA 202.A O no hydrogen 2.708 N/A ASP 207.A N ARG 203.A O no hydrogen 2.837 N/A ALA 208.A N THR 204.A O no hydrogen 3.119 N/A VAL 209.A N PHE 205.A O no hydrogen 3.103 N/A LYS 210.A N.A GLY 206.A O no hydrogen 2.970 N/A LYS 210.A N.B GLY 206.A O no hydrogen 3.007 N/A LYS 210.A NZ.A ALA 171.A O no hydrogen 2.860 N/A LYS 211.A N ASP 207.A O no hydrogen 2.958 N/A ASN 212.A N VAL 209.A O no hydrogen 3.031 N/A ASN 212.A ND2 ILE 117.A O no hydrogen 2.961 N/A ILE 213.A N LYS 210.A O.A no hydrogen 2.844 N/A LYS 214.A N THR 123.A O no hydrogen 3.097 N/A