Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1wte_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 2.A N GLU 5.A OE2 no hydrogen 2.904 N/A GLU 5.A N ASN 2.A OD1 no hydrogen 2.966 N/A VAL 6.A N ASN 2.A O no hydrogen 3.078 N/A ILE 7.A N LYS 3.A O no hydrogen 3.045 N/A LEU 8.A N GLN 4.A O no hydrogen 2.997 N/A LYS 9.A N GLU 5.A O no hydrogen 3.373 N/A VAL 10.A N VAL 6.A O no hydrogen 2.898 N/A GLN 11.A N ILE 7.A O no hydrogen 2.971 N/A GLU 12.A N LEU 8.A O no hydrogen 3.200 N/A CYS 13.A N LYS 9.A O no hydrogen 3.194 N/A CYS 13.A SG LYS 9.A O no hydrogen 3.441 N/A ALA 14.A N VAL 10.A O no hydrogen 2.809 N/A ALA 15.A N GLN 11.A O no hydrogen 2.775 N/A TRP 16.A N GLU 12.A O no hydrogen 3.250 N/A TRP 17.A N CYS 13.A O no hydrogen 3.053 N/A ILE 18.A N ALA 14.A O no hydrogen 2.881 N/A LEU 19.A N ALA 15.A O no hydrogen 3.352 N/A GLU 20.A N TRP 16.A O no hydrogen 3.177 N/A ARG 21.A N TRP 17.A O no hydrogen 3.000 N/A ARG 21.A NE HIS 68.A ND1 no hydrogen 3.022 N/A ARG 21.A NH2 LEU 64.A O no hydrogen 3.153 N/A ARG 21.A NH2 HIS 68.A ND1 no hydrogen 3.183 N/A GLN 22.A N ILE 18.A O no hydrogen 3.002 N/A GLN 22.A NE2 ASN 235.A OD1 no hydrogen 2.718 N/A SER 23.A N LEU 19.A O no hydrogen 2.900 N/A SER 23.A OG GLU 20.A O no hydrogen 2.740 N/A LYS 24.A N GLU 20.A O no hydrogen 3.397 N/A LYS 24.A NZ MET 29.A O no hydrogen 2.946 N/A LYS 24.A NZ HIS 63.A NE2 no hydrogen 2.614 N/A LEU 25.A N GLN 22.A O no hydrogen 2.949 N/A THR 26.A N GLN 22.A O no hydrogen 2.998 N/A LYS 27.A N SER 23.A O no hydrogen 2.843 N/A LEU 28.A N LEU 25.A O no hydrogen 3.076 N/A MET 29.A N LYS 24.A O no hydrogen 3.111 N/A SER 30.A OG HIS 245.A NE2 no hydrogen 2.944 N/A MET 33.A N SER 30.A O no hydrogen 3.150 N/A PHE 38.A N ASN 36.A OD1 no hydrogen 2.954 N/A MET 39.A N ASN 36.A O no hydrogen 3.143 N/A THR 40.A OG1 PRO 37.A O no hydrogen 3.094 N/A ILE 43.A N MET 39.A O no hydrogen 3.045 N/A PHE 44.A N THR 40.A O no hydrogen 2.997 N/A ASP 45.A N PRO 41.A O no hydrogen 3.405 N/A TYR 46.A N PHE 42.A O no hydrogen 2.925 N/A HIS 47.A N ILE 43.A O no hydrogen 3.156 N/A SER 48.A N ASP 45.A O no hydrogen 3.198 N/A LEU 49.A N PHE 44.A O no hydrogen 2.949 N/A ASN 50.A N GLU 54.A OE1 no hydrogen 2.732 N/A ASN 50.A ND2 GLU 54.A OE2 no hydrogen 3.237 N/A GLU 54.A N ASP 51.A OD1 no hydrogen 2.859 N/A LEU 55.A N ASP 51.A O no hydrogen 3.109 N/A VAL 56.A N PHE 52.A O no hydrogen 2.925 N/A GLU 57.A N ASP 53.A O no hydrogen 2.887 N/A ALA 58.A N GLU 54.A O no hydrogen 3.048 N/A ILE 59.A N LEU 55.A O no hydrogen 3.057 N/A ILE 60.A N VAL 56.A O no hydrogen 2.879 N/A ALA 61.A N GLU 57.A O no hydrogen 2.952 N/A LYS 62.A N ALA 58.A O no hydrogen 3.181 N/A HIS 63.A N ILE 59.A O no hydrogen 2.982 N/A LEU 64.A N ILE 60.A O no hydrogen 2.839 N/A MET 65.A N ALA 61.A O no hydrogen 2.988 N/A THR 66.A N LYS 62.A O no hydrogen 3.058 N/A THR 66.A OG1 LYS 62.A O no hydrogen 3.291 N/A GLY 67.A N HIS 63.A O no hydrogen 2.998 N/A HIS 68.A N LEU 64.A O no hydrogen 2.837 N/A ASP 69.A N MET 65.A O no hydrogen 3.086 N/A THR 70.A N THR 66.A O no hydrogen 3.076 N/A THR 70.A OG1 THR 66.A O no hydrogen 2.867 N/A GLY 71.A N GLY 67.A O no hydrogen 2.955 N/A PHE 72.A N HIS 68.A O no hydrogen 2.945 N/A GLY 73.A N ASP 69.A O no hydrogen 3.105 N/A LYS 74.A N THR 70.A O no hydrogen 3.129 N/A LYS 74.A NZ GLU 78.A OE1 no hydrogen 3.558 N/A LYS 74.A NZ GLU 78.A OE2 no hydrogen 2.765 N/A LEU 75.A N GLY 71.A O no hydrogen 2.812 N/A ILE 76.A N PHE 72.A O no hydrogen 3.047 N/A ASP 77.A N GLY 73.A O no hydrogen 3.229 N/A GLU 78.A N LYS 74.A O no hydrogen 2.800 N/A LYS 79.A N LEU 75.A O no hydrogen 3.046 N/A ILE 80.A N LEU 75.A O no hydrogen 3.012 N/A LEU 81.A N ILE 76.A O no hydrogen 2.949 N/A ARG 83.A N LYS 79.A O no hydrogen 2.850 N/A VAL 84.A N ILE 80.A O no hydrogen 2.829 N/A PHE 85.A N LEU 81.A O no hydrogen 2.975 N/A GLY 86.A N PRO 82.A O no hydrogen 2.960 N/A ALA 87.A N LEU 81.A O no hydrogen 3.212 N/A TYR 88.A N VAL 112.A O no hydrogen 3.009 N/A LYS 89.A NZ ASP 77.A OD1 no hydrogen 3.187 N/A LYS 89.A NZ ASP 77.A OD2 no hydrogen 2.774 N/A LEU 90.A N ASP 110.A O no hydrogen 3.014 N/A TYR 94.A N ASP 91.A OD1 no hydrogen 3.013 N/A ARG 95.A N ASP 91.A O no hydrogen 2.980 N/A ARG 95.A NE PHE 101.A O no hydrogen 2.912 N/A ARG 95.A NH1 ASP 107.A OD1 no hydrogen 2.855 N/A ARG 95.A NH2 PHE 101.A O no hydrogen 3.148 N/A ARG 95.A NH2 ASP 107.A OD1 no hydrogen 2.817 N/A ALA 96.A N LYS 92.A O no hydrogen 3.111 N/A ALA 97.A N SER 93.A O no hydrogen 3.191 N/A ALA 97.A N TYR 94.A O no hydrogen 3.191 N/A ASN 98.A ND2 TYR 94.A O no hydrogen 2.718 N/A PHE 101.A N ASN 98.A O no hydrogen 2.996 N/A HIS 103.A N PRO 100.A O no hydrogen 3.284 N/A PHE 106.A N HIS 103.A O no hydrogen 3.021 N/A ASP 107.A N PRO 104.A O no hydrogen 3.026 N/A ILE 109.A N PHE 106.A O no hydrogen 3.032 N/A ASP 110.A N LEU 123.A O no hydrogen 2.730 N/A HIS 111.A N LEU 123.A O no hydrogen 3.078 N/A HIS 111.A NE2 ASP 77.A O no hydrogen 2.699 N/A VAL 112.A N TYR 88.A O no hydrogen 2.881 N/A ILE 113.A N GLU 121.A O no hydrogen 2.780 N/A ARG 115.A N ARG 119.A O no hydrogen 2.965 N/A ARG 115.A NE GLU 121.A OE1 no hydrogen 2.899 N/A ARG 115.A NH1 TRP 206.A O no hydrogen 3.412 N/A ARG 115.A NH1 LEU 207.A O no hydrogen 2.934 N/A ARG 115.A NH1 ASN 209.A OD1 no hydrogen 2.854 N/A ARG 115.A NH2 GLU 121.A OE1 no hydrogen 3.167 N/A ARG 115.A NH2 TRP 206.A O no hydrogen 2.888 N/A GLY 118.A N ARG 115.A O no hydrogen 3.005 N/A ARG 119.A N ASP 117.A OD1 no hydrogen 2.964 N/A ARG 119.A NH1 ASP 117.A OD2 no hydrogen 3.202 N/A ILE 120.A N ASP 156.A OD2 no hydrogen 2.809 N/A GLU 121.A N ILE 113.A O no hydrogen 3.030 N/A LEU 122.A N ASN 157.A O no hydrogen 2.981 N/A LEU 123.A N HIS 111.A O no hydrogen 2.822 N/A SER 124.A N VAL 159.A O no hydrogen 2.956 N/A SER 124.A OG GLU 108.A O no hydrogen 2.622 N/A LEU 125.A N ASP 110.A OD2 no hydrogen 2.718 N/A LYS 126.A N GLY 161.A O no hydrogen 2.802 N/A GLY 128.A N THR 131.A OG1 no hydrogen 3.024 N/A LYS 129.A NZ GLY 169.A O no hydrogen 3.147 N/A THR 131.A N GLY 128.A O no hydrogen 3.298 N/A THR 131.A OG1 GLY 128.A O no hydrogen 3.068 N/A MET 136.A N GLN 133.A OE1 no hydrogen 2.916 N/A ALA 137.A N GLN 133.A O no hydrogen 2.949 N/A VAL 138.A N LEU 134.A O no hydrogen 3.031 N/A GLN 139.A N THR 135.A O no hydrogen 3.174 N/A LEU 140.A N MET 136.A O no hydrogen 2.847 N/A ASN 141.A N ALA 137.A O no hydrogen 2.996 N/A ASN 141.A ND2 LEU 177.A O no hydrogen 3.037 N/A ASN 141.A ND2 ILE 189.A O no hydrogen 2.774 N/A LYS 142.A N VAL 138.A O no hydrogen 2.987 N/A ALA 143.A N GLN 139.A O no hydrogen 3.039 N/A PHE 144.A N LEU 140.A O no hydrogen 2.951 N/A HIS 145.A N ASN 141.A O no hydrogen 2.935 N/A GLU 146.A N LYS 142.A O no hydrogen 3.189 N/A ILE 147.A N ALA 143.A O no hydrogen 3.234 N/A ILE 148.A N PHE 144.A O no hydrogen 2.935 N/A ASN 149.A N HIS 145.A O no hydrogen 2.941 N/A ASN 149.A ND2 HIS 145.A O no hydrogen 2.679 N/A ASN 150.A N GLU 146.A O no hydrogen 2.746 N/A TYR 151.A N ILE 147.A O no hydrogen 2.765 N/A VAL 154.A N TYR 151.A O no hydrogen 3.176 N/A ASP 156.A N ILE 120.A O no hydrogen 2.741 N/A ASN 157.A ND2 GLU 121.A OE2 no hydrogen 3.028 N/A ILE 158.A N LYS 194.A O no hydrogen 2.991 N/A VAL 159.A N LEU 122.A O no hydrogen 2.873 N/A VAL 160.A N HIS 196.A O no hydrogen 2.771 N/A GLY 161.A N SER 124.A O no hydrogen 2.923 N/A VAL 162.A N TYR 198.A O no hydrogen 2.833 N/A PHE 163.A N LYS 126.A O no hydrogen 2.997 N/A TYR 164.A N ALA 127.A O no hydrogen 2.979 N/A LEU 170.A N SER 167.A O no hydrogen 3.219 N/A LYS 173.A N THR 171.A OG1 no hydrogen 3.341 N/A LYS 173.A NZ ASP 172.A OD1 no hydrogen 2.693 N/A TYR 174.A N THR 171.A O no hydrogen 3.303 N/A TYR 174.A OH GLY 128.A O no hydrogen 2.729 N/A ARG 175.A N ASP 172.A O no hydrogen 2.836 N/A ARG 175.A NH2 THR 182.A OG1 no hydrogen 2.677 N/A ILE 176.A N ASP 172.A O no hydrogen 2.944 N/A LEU 177.A N LYS 173.A O no hydrogen 3.013 N/A ARG 178.A NH1 VAL 195.A O no hydrogen 3.153 N/A GLY 179.A N ILE 176.A O no hydrogen 2.947 N/A ILE 180.A N ARG 175.A O no hydrogen 3.085 N/A ILE 189.A N ASN 141.A OD1 no hydrogen 2.870 N/A ILE 191.A N ARG 178.A O no hydrogen 2.960 N/A ARG 192.A N ASP 190.A OD1 no hydrogen 3.177 N/A ARG 192.A NE ASP 190.A OD1 no hydrogen 2.822 N/A LYS 194.A N ILE 191.A O no hydrogen 2.944 N/A VAL 195.A N ILE 191.A O no hydrogen 3.119 N/A HIS 196.A N ILE 158.A O no hydrogen 3.031 N/A TYR 198.A N VAL 160.A O no hydrogen 3.086 N/A ALA 199.A N GLU 202.A OE1 no hydrogen 2.907 N/A GLY 200.A N VAL 162.A O no hydrogen 2.854 N/A PHE 203.A N ALA 199.A O no hydrogen 3.353 N/A TRP 204.A N GLY 200.A O no hydrogen 3.173 N/A TRP 204.A NE1 PHE 163.A O no hydrogen 2.802 N/A SER 205.A N LYS 201.A O no hydrogen 2.928 N/A TRP 206.A N GLU 202.A O no hydrogen 2.921 N/A TRP 206.A NE1 GLU 121.A OE2 no hydrogen 3.050 N/A LEU 207.A N PHE 203.A O no hydrogen 2.876 N/A ASN 208.A N TRP 204.A O no hydrogen 3.096 N/A GLY 210.A N SER 205.A O no hydrogen 2.811 N/A GLU 211.A N ASN 208.A O no hydrogen 3.117 N/A THR 214.A N GLU 211.A O no hydrogen 3.204 N/A THR 214.A OG1 ASN 208.A OD1 no hydrogen 3.133 N/A THR 214.A OG1 GLU 211.A O no hydrogen 2.624 N/A GLN 215.A NE2 HIS 216.A NE2 no hydrogen 3.658 N/A HIS 216.A N GLU 213.A O no hydrogen 2.984 N/A TRP 217.A N GLU 213.A O no hydrogen 3.293 N/A VAL 218.A N THR 214.A O no hydrogen 2.923 N/A LEU 219.A N GLN 215.A O no hydrogen 3.007 N/A GLU 220.A N HIS 216.A O no hydrogen 2.811 N/A GLY 221.A N TRP 217.A O no hydrogen 3.010 N/A ILE 222.A N VAL 218.A O no hydrogen 3.196 N/A GLU 223.A N LEU 219.A O no hydrogen 2.895 N/A ARG 224.A N GLU 220.A O no hydrogen 2.954 N/A ARG 224.A NH2 GLU 220.A OE2 no hydrogen 3.316 N/A ALA 225.A N GLY 221.A O no hydrogen 3.142 N/A VAL 226.A N ILE 222.A O no hydrogen 2.907 N/A LYS 227.A N GLU 223.A O no hydrogen 3.030 N/A GLU 228.A N ARG 224.A O no hydrogen 2.950 N/A ALA 229.A N ALA 225.A O no hydrogen 2.931 N/A ASP 230.A N VAL 226.A O no hydrogen 3.260 N/A ASN 235.A N ILE 231.A O no hydrogen 3.173 N/A ASN 235.A ND2 GLN 22.A OE1 no hydrogen 3.188 N/A LYS 236.A N GLU 233.A O no hydrogen 3.341 N/A LEU 238.A N LYS 234.A O no hydrogen 3.339 N/A ILE 239.A N ASN 235.A O no hydrogen 2.780 N/A GLU 240.A N LYS 236.A O no hydrogen 3.134 N/A LYS 241.A N ASP 237.A O no hydrogen 2.947 N/A LYS 241.A NZ GLU 244.A OE1 no hydrogen 3.544 N/A PHE 242.A N LEU 238.A O no hydrogen 3.094 N/A LYS 243.A N ILE 239.A O no hydrogen 2.950 N/A LYS 243.A NZ ASP 53.A OD1 no hydrogen 2.950 N/A LYS 243.A NZ GLU 240.A OE2 no hydrogen 3.410 N/A GLU 244.A N GLU 240.A O no hydrogen 2.935 N/A HIS 245.A N LYS 241.A O no hydrogen 2.887 N/A HIS 245.A NE2 SER 30.A OG no hydrogen 2.944 N/A VAL 246.A N PHE 242.A O no hydrogen 3.140 N/A ALA 247.A N LYS 243.A O no hydrogen 3.102 N/A LYS 248.A N GLU 244.A O no hydrogen 3.212 N/A LYS 249.A N VAL 246.A O no hydrogen 2.975 N/A LYS 249.A NZ SER 30.A OG no hydrogen 2.591 N/A TYR 250.A N ALA 247.A O no hydrogen 2.906 N/A ASN 251.A N ALA 247.A O no hydrogen 2.736 N/A GLN 253.A N TYR 250.A O no hydrogen 2.871 N/A GLN 253.A NE2 LYS 249.A O no hydrogen 2.929 N/A VAL 254.A N TYR 250.A O no hydrogen 2.938 N/A ASN 256.A N THR 260.A O no hydrogen 2.821 N/A ASN 256.A ND2 THR 260.A OG1 no hydrogen 2.947 N/A GLY 259.A N ASN 256.A O no hydrogen 2.973 N/A THR 260.A N ASP 258.A OD1 no hydrogen 2.940 N/A THR 260.A OG1 ASP 258.A OD1 no hydrogen 2.691 N/A THR 260.A OG1 ASP 258.A OD2 no hydrogen 3.555 N/A GLN 262.A N VAL 254.A O no hydrogen 2.633 N/A LYS 265.A N GLN 262.A O no hydrogen 2.822 N/A LYS 265.A NZ GLU 268.A OE1 no hydrogen 3.041 N/A LEU 266.A N GLN 262.A O no hydrogen 3.167 N/A LEU 267.A N TRP 263.A O no hydrogen 2.942 N/A GLU 268.A N HIS 264.A O no hydrogen 2.998 N/A MET 269.A N LYS 265.A O no hydrogen 3.101 N/A ILE 270.A N LEU 266.A O no hydrogen 3.089 N/A ASN 271.A N LEU 267.A O no hydrogen 2.874 N/A