Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pzs_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 2.A N ASP 72.A OD2 no hydrogen 2.808 N/A ASN 2.A ND2 ASP 70.A O no hydrogen 2.856 N/A ILE 3.A N ASN 28.A O no hydrogen 2.911 N/A LEU 4.A N ALA 73.A O no hydrogen 2.880 N/A SER 5.A N TRP 30.A O no hydrogen 3.027 N/A SER 5.A OG ASN 17.A OD1 no hydrogen 2.600 N/A ILE 6.A N LEU 75.A O no hydrogen 2.915 N/A GLN 7.A N LEU 32.A O no hydrogen 3.328 N/A GLN 7.A NE2 SER 5.A OG no hydrogen 3.043 N/A VAL 10.A N SER 18.A OG no hydrogen 2.909 N/A VAL 11.A N PHE 37.A O no hydrogen 2.816 N/A PHE 12.A N SER 38.A O no hydrogen 2.930 N/A HIS 14.A N GLU 255.A OE1 no hydrogen 2.797 N/A HIS 14.A ND1 SER 18.A O no hydrogen 2.767 N/A GLY 16.A N ASP 216.A OD2 no hydrogen 2.795 N/A ASN 17.A N SER 8.A O no hydrogen 2.768 N/A ASN 17.A ND2 SER 5.A O no hydrogen 3.013 N/A ASN 17.A ND2 LEU 32.A O no hydrogen 3.582 N/A ASN 17.A ND2 ASN 33.A OD1 no hydrogen 3.009 N/A SER 18.A N ALA 15.A O no hydrogen 2.881 N/A SER 18.A OG HIS 9.A ND1 no hydrogen 3.088 N/A SER 18.A OG VAL 10.A O no hydrogen 3.163 N/A ALA 19.A N GLY 16.A O no hydrogen 3.033 N/A ALA 20.A N GLY 16.A O no hydrogen 3.111 N/A GLU 21.A N ASN 17.A O no hydrogen 2.837 N/A ARG 24.A NH1 GLU 21.A OE2 no hydrogen 2.896 N/A ARG 24.A NH2 VAL 29.A O no hydrogen 2.852 N/A ARG 25.A N PHE 22.A O no hydrogen 2.739 N/A ARG 25.A NE GLN 262.A OE1 no hydrogen 2.829 N/A ARG 25.A NH1 ARG 25.A O no hydrogen 3.418 N/A ARG 25.A NH2 GLU 263.A OE2 no hydrogen 2.910 N/A ASN 28.A N LYS 1.A O no hydrogen 2.844 N/A TRP 30.A N ILE 3.A O no hydrogen 2.760 N/A LEU 32.A N SER 5.A O no hydrogen 2.917 N/A THR 34.A N GLN 7.A O no hydrogen 2.982 N/A GLN 36.A N CYS 49.A O no hydrogen 2.924 N/A PHE 37.A N HIS 9.A O no hydrogen 3.031 N/A SER 38.A N THR 47.A O no hydrogen 2.838 N/A SER 38.A OG ASN 39.A OD1 no hydrogen 2.683 N/A SER 38.A OG THR 47.A O no hydrogen 3.549 N/A SER 38.A OG THR 47.A OG1 no hydrogen 3.388 N/A ASN 39.A ND2 HIS 40.A O no hydrogen 2.831 N/A ASN 39.A ND2 HIS 45.A O no hydrogen 2.975 N/A GLN 42.A N HIS 40.A ND1 no hydrogen 3.135 N/A TYR 43.A N HIS 40.A O no hydrogen 3.521 N/A TYR 43.A OH GLU 255.A OE2 no hydrogen 2.568 N/A GLY 44.A N THR 41.A O no hydrogen 2.976 N/A THR 47.A N SER 38.A OG no hydrogen 3.006 N/A CYS 49.A N GLN 36.A O no hydrogen 3.044 N/A HIS 54.A N PRO 51.A O no hydrogen 2.933 N/A LEU 55.A N ALA 52.A O no hydrogen 3.161 N/A THR 56.A OG1 SER 53.A O no hydrogen 3.322 N/A ASP 57.A N SER 53.A O no hydrogen 2.956 N/A ILE 58.A N HIS 54.A O no hydrogen 2.935 N/A VAL 59.A N LEU 55.A O no hydrogen 3.246 N/A GLN 60.A N THR 56.A O no hydrogen 2.995 N/A GLN 60.A NE2 ASP 64.A OD1 no hydrogen 3.222 N/A GLY 61.A N ASP 57.A O no hydrogen 3.139 N/A ILE 62.A N ILE 58.A O no hydrogen 3.127 N/A ALA 63.A N VAL 59.A O no hydrogen 3.003 N/A ASP 64.A N GLN 60.A O no hydrogen 2.739 N/A ILE 65.A N GLY 61.A O no hydrogen 3.264 N/A ILE 65.A N ILE 62.A O no hydrogen 3.268 N/A ASP 66.A N.A ALA 63.A O no hydrogen 2.913 N/A ASP 66.A N.B ALA 63.A O no hydrogen 2.901 N/A ARG 67.A N ILE 62.A O no hydrogen 3.120 N/A ARG 67.A NH1 ASP 70.A OD2 no hydrogen 2.779 N/A LYS 69.A NZ ASP 66.A OD2.A no hydrogen 3.538 N/A ASP 70.A N ARG 67.A O no hydrogen 2.933 N/A CYS 71.A N LEU 68.A O no hydrogen 3.050 N/A CYS 71.A SG ALA 73.A O no hydrogen 3.191 N/A ASP 72.A N ASN 2.A O no hydrogen 2.847 N/A ALA 73.A N ASN 2.A O no hydrogen 3.351 N/A VAL 74.A N TRP 103.A O no hydrogen 2.817 N/A LEU 75.A N LEU 4.A O no hydrogen 2.887 N/A SER 76.A N PHE 105.A O no hydrogen 3.063 N/A SER 76.A OG TYR 104.A OH no hydrogen 2.724 N/A GLY 80.A N GLN 84.A OE1 no hydrogen 2.976 N/A GLN 84.A N SER 81.A OG no hydrogen 3.159 N/A GLY 85.A N SER 81.A O no hydrogen 3.045 N/A SER 86.A N PRO 82.A O no hydrogen 2.794 N/A SER 86.A OG GLU 83.A O no hydrogen 2.982 N/A HIS 87.A N GLU 83.A O no hydrogen 3.154 N/A HIS 87.A ND1 GLU 83.A O no hydrogen 2.994 N/A ILE 88.A N GLN 84.A O no hydrogen 3.005 N/A LEU 89.A N GLY 85.A O no hydrogen 3.083 N/A ALA 90.A N SER 86.A O no hydrogen 3.025 N/A ALA 91.A N HIS 87.A O no hydrogen 2.993 N/A VAL 92.A N ILE 88.A O no hydrogen 2.957 N/A ALA 93.A N LEU 89.A O no hydrogen 2.972 N/A GLN 94.A N ALA 90.A O no hydrogen 2.970 N/A GLN 94.A NE2 GLN 60.A OE1 no hydrogen 2.938 N/A VAL 95.A N ALA 91.A O no hydrogen 2.978 N/A LYS 96.A N VAL 92.A O no hydrogen 2.929 N/A LYS 96.A NZ ASP 135.A OD1 no hydrogen 3.427 N/A LYS 96.A NZ ASP 135.A OD2 no hydrogen 2.777 N/A GLN 97.A N ALA 93.A O no hydrogen 3.111 N/A ALA 98.A N GLN 94.A O no hydrogen 3.194 N/A ASN 99.A N VAL 95.A O no hydrogen 2.718 N/A ASN 99.A ND2 CYS 71.A O no hydrogen 2.712 N/A ASP 101.A N ASN 99.A OD1 no hydrogen 2.947 N/A ALA 102.A N ASN 99.A O no hydrogen 3.052 N/A TRP 103.A N ASP 72.A O no hydrogen 3.063 N/A TYR 104.A N ASP 135.A OD2 no hydrogen 2.778 N/A TYR 104.A OH SER 76.A OG no hydrogen 2.724 N/A PHE 105.A N VAL 74.A O no hydrogen 2.825 N/A CYS 106.A SG TYR 104.A OH no hydrogen 3.748 N/A ASP 107.A N SER 76.A O no hydrogen 3.004 N/A VAL 109.A N ASP 107.A O no hydrogen 2.961 N/A HIS 111.A N GLY 115.A O no hydrogen 3.155 N/A GLY 115.A N HIS 111.A O no hydrogen 2.822 N/A CYS 116.A SG.B VAL 118.A O no hydrogen 3.720 N/A VAL 122.A N ALA 119.A O no hydrogen 3.035 N/A ALA 123.A N ALA 119.A O no hydrogen 3.433 N/A GLU 124.A N PRO 120.A O no hydrogen 3.002 N/A PHE 125.A N GLY 121.A O no hydrogen 2.856 N/A PHE 126.A N VAL 122.A O no hydrogen 2.977 N/A CYS 127.A N ALA 123.A O no hydrogen 3.102 N/A CYS 127.A SG LEU 146.A O no hydrogen 4.041 N/A ASN 128.A N GLU 124.A O no hydrogen 2.832 N/A GLU 129.A N PHE 125.A O no hydrogen 2.847 N/A ALA 130.A N PHE 125.A O no hydrogen 3.045 N/A LEU 131.A N PHE 126.A O no hydrogen 2.936 N/A SER 134.A N LEU 131.A O no hydrogen 3.171 N/A SER 134.A OG LEU 131.A O no hydrogen 2.832 N/A ASP 135.A N TYR 104.A O no hydrogen 2.918 N/A ALA 137.A N CYS 106.A O no hydrogen 3.187 N/A ASN 139.A N GLU 142.A OE1 no hydrogen 2.850 N/A ASN 139.A ND2 GLY 110.A O no hydrogen 2.780 N/A LEU 140.A N HIS 176.A O no hydrogen 2.842 N/A GLU 142.A N ASN 139.A OD1 no hydrogen 2.881 N/A LEU 143.A N ASN 139.A O no hydrogen 2.865 N/A GLU 144.A N LEU 140.A O no hydrogen 3.037 N/A GLN 145.A N LEU 141.A O no hydrogen 2.988 N/A LEU 146.A N GLU 142.A O no hydrogen 2.973 N/A SER 147.A N LEU 143.A O no hydrogen 3.282 N/A SER 147.A OG LEU 143.A O no hydrogen 2.776 N/A SER 147.A OG GLU 144.A O no hydrogen 3.542 N/A GLY 148.A N GLU 144.A O no hydrogen 2.771 N/A GLU 149.A N SER 147.A OG no hydrogen 3.396 N/A VAL 151.A N GLU 144.A OE2 no hydrogen 2.731 N/A GLU 152.A N GLN 156.A OE1 no hydrogen 3.149 N/A GLN 156.A N ASN 153.A OD1 no hydrogen 2.857 N/A ALA 157.A N ASN 153.A O no hydrogen 2.838 N/A VAL 158.A N VAL 154.A O no hydrogen 2.880 N/A GLN 159.A N GLU 155.A O no hydrogen 3.344 N/A VAL 160.A N GLN 156.A O no hydrogen 2.830 N/A ALA 161.A N ALA 157.A O no hydrogen 2.826 N/A ARG 162.A N VAL 158.A O no hydrogen 3.074 N/A ARG 162.A NE THR 192.A O no hydrogen 2.751 N/A ARG 162.A NH2 THR 192.A O no hydrogen 3.041 N/A SER 163.A N GLN 159.A O no hydrogen 3.016 N/A SER 163.A OG VAL 160.A O no hydrogen 2.576 N/A LEU 164.A N VAL 160.A O no hydrogen 3.093 N/A CYS 165.A N ALA 161.A O no hydrogen 3.176 N/A CYS 165.A SG ALA 161.A O no hydrogen 3.689 N/A CYS 165.A SG PRO 169.A O no hydrogen 3.196 N/A ALA 166.A N ARG 162.A O no hydrogen 3.323 N/A ARG 167.A N LEU 164.A O no hydrogen 3.045 N/A ARG 167.A NH1 LEU 146.A O no hydrogen 2.859 N/A ARG 167.A NH2 LEU 146.A O no hydrogen 3.253 N/A GLY 168.A N CYS 165.A O no hydrogen 2.960 N/A LYS 170.A N ASP 135.A O no hydrogen 2.733 N/A VAL 171.A N ASP 135.A O no hydrogen 3.314 N/A VAL 172.A N VAL 191.A O no hydrogen 2.927 N/A LEU 173.A N ILE 136.A O no hydrogen 2.846 N/A VAL 174.A N LEU 189.A O no hydrogen 2.712 N/A LYS 175.A N PRO 138.A O no hydrogen 3.084 N/A LYS 175.A NZ ASP 107.A OD1 no hydrogen 2.578 N/A LYS 175.A NZ ALA 137.A O no hydrogen 2.753 N/A LYS 175.A NZ GLU 142.A OE1 no hydrogen 2.883 N/A LEU 177.A N GLU 188.A O no hydrogen 3.004 N/A SER 178.A N HIS 176.A ND1 no hydrogen 3.119 N/A ARG 179.A NH1 VAL 151.A O no hydrogen 2.673 N/A ARG 179.A NH2 GLU 144.A OE2 no hydrogen 2.776 N/A ALA 180.A N LEU 177.A O no hydrogen 3.066 N/A GLY 181.A N SER 178.A O no hydrogen 3.175 N/A TYR 182.A N GLU 188.A OE1 no hydrogen 2.779 N/A HIS 183.A N GLU 188.A OE2 no hydrogen 2.922 N/A CYS 186.A N HIS 183.A O no hydrogen 3.017 N/A PHE 187.A N ARG 201.A O no hydrogen 2.867 N/A LEU 190.A N TRP 197.A O no hydrogen 2.844 N/A VAL 191.A N VAL 172.A O no hydrogen 2.733 N/A THR 192.A N ASP 195.A O no hydrogen 2.847 N/A THR 192.A OG1 ASP 195.A O no hydrogen 3.199 N/A ASP 195.A N THR 192.A OG1 no hydrogen 3.210 N/A TRP 197.A N LEU 190.A O no hydrogen 2.919 N/A HIS 198.A N VAL 275.A O no hydrogen 2.868 N/A CYS 200.A SG HIS 198.A NE2 no hydrogen 3.245 N/A ARG 201.A N PHE 187.A O no hydrogen 2.952 N/A ARG 201.A NH2 THR 240.A O no hydrogen 3.053 N/A GLY 207.A N ASP 205.A OD1 no hydrogen 3.232 N/A LEU 217.A N GLY 213.A O no hydrogen 2.831 N/A THR 218.A N VAL 214.A O no hydrogen 2.890 N/A THR 218.A OG1 VAL 214.A O no hydrogen 2.828 N/A SER 219.A N GLY 215.A O no hydrogen 2.982 N/A SER 219.A OG ASP 107.A OD2 no hydrogen 2.946 N/A SER 219.A OG GLY 215.A O no hydrogen 3.194 N/A GLY 220.A N ASP 216.A O no hydrogen 3.041 N/A LEU 221.A N LEU 217.A O no hydrogen 2.912 N/A LEU 222.A N THR 218.A O no hydrogen 2.988 N/A LEU 223.A N SER 219.A O no hydrogen 3.133 N/A VAL 224.A N GLY 220.A O no hydrogen 3.137 N/A ASN 225.A N LEU 221.A O no hydrogen 3.109 N/A ASN 225.A ND2 LEU 221.A O no hydrogen 2.832 N/A ASN 225.A ND2 HIS 238.A ND1 no hydrogen 3.164 N/A LEU 226.A N LEU 222.A O no hydrogen 2.994 N/A LEU 227.A N LEU 223.A O no hydrogen 2.812 N/A LYS 228.A N VAL 224.A O no hydrogen 2.966 N/A GLY 229.A N LEU 226.A O no hydrogen 2.996 N/A GLU 230.A N ASN 225.A O no hydrogen 3.033 N/A ALA 235.A N PRO 231.A O no hydrogen 2.806 N/A LEU 236.A N LEU 232.A O no hydrogen 2.957 N/A GLU 237.A N ASP 233.A O no hydrogen 2.977 N/A HIS 238.A N LYS 234.A O no hydrogen 2.953 N/A HIS 238.A NE2 ILE 265.A O no hydrogen 2.737 N/A VAL 239.A N ALA 235.A O no hydrogen 3.019 N/A THR 240.A N LEU 236.A O no hydrogen 2.929 N/A THR 240.A OG1 LEU 236.A O no hydrogen 2.782 N/A ALA 241.A N GLU 237.A O no hydrogen 3.080 N/A ALA 242.A N HIS 238.A O no hydrogen 2.765 N/A VAL 243.A N VAL 239.A O no hydrogen 2.957 N/A TYR 244.A N THR 240.A O no hydrogen 3.179 N/A GLU 245.A N ALA 241.A O no hydrogen 2.956 N/A VAL 246.A N ALA 242.A O no hydrogen 3.188 N/A LYS 248.A N GLU 245.A O no hydrogen 2.969 N/A LYS 248.A NZ GLU 251.A OE2 no hydrogen 3.432 N/A THR 249.A N VAL 246.A O no hydrogen 2.965 N/A THR 249.A OG1 VAL 246.A O no hydrogen 2.673 N/A GLU 251.A N LEU 247.A O no hydrogen 2.990 N/A GLU 253.A N THR 249.A O no hydrogen 3.068 N/A GLN 257.A N THR 249.A OG1 no hydrogen 2.882 N/A GLN 257.A NE2 GLU 255.A O no hydrogen 2.898 N/A VAL 258.A N LEU 256.A O no hydrogen 2.955 N/A ALA 261.A N GLN 257.A O no hydrogen 3.174 N/A GLN 262.A N VAL 259.A O no hydrogen 3.156 N/A GLN 262.A NE2 VAL 259.A O no hydrogen 3.447 N/A THR 264.A N ALA 261.A O no hydrogen 3.102 N/A THR 264.A OG1 ALA 261.A O no hydrogen 2.887 N/A ILE 265.A N GLN 262.A O no hydrogen 3.238 N/A THR 267.A N GLU 263.A O no hydrogen 3.184 N/A ILE 269.A N GLU 245.A OE2 no hydrogen 2.616 N/A CYS 270.A N GLU 245.A OE2 no hydrogen 2.985 N/A CYS 270.A SG GLU 245.A OE2 no hydrogen 3.818 N/A ALA 274.A N GLU 237.A OE2 no hydrogen 2.942 N/A VAL 275.A N HIS 198.A O no hydrogen 2.788 N/A LEU 277.A N ALA 196.A O no hydrogen 2.846 N/A