Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1wkz_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 3.A N GLU 3.A OE1 no hydrogen 2.841 N/A GLU 5.A N SER 1.A O no hydrogen 3.094 N/A GLU 5.A N TYR 2.A O no hydrogen 2.917 N/A LYS 6.A N GLU 3.A O no hydrogen 2.653 N/A LYS 6.A NZ GLU 9.A OE2 no hydrogen 3.221 N/A VAL 7.A N GLU 3.A O no hydrogen 2.667 N/A LYS 8.A N LEU 4.A O no hydrogen 3.064 N/A GLU 9.A N GLU 5.A O no hydrogen 3.500 N/A ARG 10.A N LYS 6.A O no hydrogen 3.119 N/A ARG 10.A N VAL 7.A O no hydrogen 2.904 N/A ARG 10.A NE SER 56.A OG no hydrogen 3.092 N/A ARG 10.A NH1 GLN 13.A OE1 no hydrogen 2.683 N/A ARG 10.A NH2 SER 56.A OG no hydrogen 3.291 N/A ILE 11.A N VAL 7.A O no hydrogen 3.008 N/A ILE 11.A N LYS 8.A O no hydrogen 2.966 N/A GLU 12.A N LYS 8.A O no hydrogen 3.268 N/A ILE 14.A N ARG 10.A O no hydrogen 3.119 N/A LEU 15.A N ILE 11.A O no hydrogen 2.754 N/A SER 16.A N GLU 12.A O no hydrogen 2.674 N/A GLN 17.A N GLN 13.A O no hydrogen 3.151 N/A PHE 18.A N LEU 15.A O no hydrogen 2.591 N/A PHE 19.A N LEU 15.A O no hydrogen 2.804 N/A MET 24.A N PRO 20.A O no hydrogen 3.218 N/A MET 24.A N GLU 21.A O no hydrogen 2.614 N/A ASP 26.A N ILE 23.A O no hydrogen 3.255 N/A LEU 27.A N MET 24.A O no hydrogen 3.314 N/A TYR 30.A OH LYS 8.A O no hydrogen 3.268 N/A ARG 37.A N MET 33.A O no hydrogen 2.808 N/A LEU 38.A N LEU 34.A O no hydrogen 2.644 N/A SER 39.A N ARG 35.A O no hydrogen 2.779 N/A SER 39.A OG ALA 165.A O no hydrogen 2.710 N/A ILE 40.A N VAL 36.A O no hydrogen 2.942 N/A LEU 41.A N ARG 37.A O no hydrogen 3.400 N/A SER 42.A N LEU 38.A O no hydrogen 3.302 N/A SER 42.A OG LEU 166.A O no hydrogen 3.201 N/A PHE 43.A N SER 39.A O no hydrogen 2.979 N/A LYS 44.A N ILE 40.A O no hydrogen 3.035 N/A LYS 44.A NZ GLU 3.A OE2 no hydrogen 2.844 N/A ASN 45.A N LEU 41.A O no hydrogen 2.901 N/A ARG 46.A N SER 42.A O no hydrogen 3.051 N/A ARG 46.A N PHE 43.A O no hydrogen 3.181 N/A GLY 47.A N PHE 43.A O no hydrogen 3.062 N/A GLY 47.A N LYS 44.A O no hydrogen 2.445 N/A VAL 48.A N PHE 43.A O no hydrogen 3.306 N/A GLY 51.A N GLU 49.A O no hydrogen 2.879 N/A SER 56.A N GLU 52.A O no hydrogen 2.802 N/A SER 56.A OG GLU 52.A O no hydrogen 2.938 N/A SER 57.A N ASP 53.A O no hydrogen 2.920 N/A SER 57.A OG ASP 53.A O no hydrogen 3.513 N/A LEU 58.A N ALA 54.A O no hydrogen 2.595 N/A ALA 59.A N ILE 55.A O no hydrogen 3.044 N/A ALA 60.A N SER 56.A O no hydrogen 2.891 N/A LEU 61.A N SER 57.A O no hydrogen 3.116 N/A GLU 62.A N LEU 58.A O no hydrogen 3.491 N/A LEU 63.A N ALA 59.A O no hydrogen 2.987 N/A VAL 64.A N ALA 60.A O no hydrogen 3.044 N/A HIS 65.A N LEU 61.A O no hydrogen 3.380 N/A LEU 66.A N GLU 62.A O no hydrogen 2.959 N/A ALA 67.A N LEU 63.A O no hydrogen 2.799 N/A SER 68.A N VAL 64.A O no hydrogen 3.137 N/A SER 68.A OG HIS 65.A O no hydrogen 2.330 N/A LEU 69.A N HIS 65.A O no hydrogen 3.093 N/A LEU 69.A N LEU 66.A O no hydrogen 3.237 N/A LEU 70.A N LEU 66.A O no hydrogen 3.361 N/A HIS 71.A N ALA 67.A O no hydrogen 3.448 N/A HIS 71.A NE2 VAL 97.A O no hydrogen 3.210 N/A ASP 72.A N SER 68.A O no hydrogen 3.316 N/A ASP 73.A N LEU 69.A O no hydrogen 3.022 N/A VAL 74.A N LEU 70.A O no hydrogen 3.149 N/A ILE 75.A N HIS 71.A O no hydrogen 3.221 N/A ASP 76.A N ASP 72.A O no hydrogen 3.037 N/A GLY 77.A N ASP 73.A O no hydrogen 2.630 N/A ALA 78.A N ASP 73.A O no hydrogen 3.299 N/A ARG 79.A NH2 GLU 85.A OE2 no hydrogen 2.585 N/A ARG 81.A N LYS 84.A O no hydrogen 2.819 N/A ARG 81.A NE ASP 73.A OD2 no hydrogen 3.013 N/A ARG 81.A NH2 ASP 73.A OD1 no hydrogen 2.750 N/A ARG 81.A NH2 ASP 73.A OD2 no hydrogen 3.311 N/A LYS 84.A NZ LYS 25.A O no hydrogen 3.532 N/A THR 86.A N ARG 79.A O no hydrogen 2.763 N/A THR 86.A OG1 ALA 78.A O no hydrogen 2.536 N/A THR 86.A OG1 ASN 88.A OD1 no hydrogen 3.073 N/A PHE 89.A N THR 86.A O no hydrogen 2.935 N/A MET 90.A N THR 86.A O no hydrogen 2.991 N/A TYR 91.A N ILE 87.A O no hydrogen 2.600 N/A TYR 91.A OH ASP 26.A OD2 no hydrogen 2.438 N/A GLY 92.A N ASN 88.A O no hydrogen 2.962 N/A ALA 96.A N GLY 92.A O no hydrogen 3.175 N/A VAL 97.A N ASP 93.A O no hydrogen 2.903 N/A ALA 98.A N LYS 94.A O no hydrogen 2.824 N/A ALA 99.A N ALA 95.A O no hydrogen 2.778 N/A GLY 100.A N ALA 96.A O no hydrogen 3.251 N/A ASP 101.A N VAL 97.A O no hydrogen 3.171 N/A LEU 102.A N ALA 98.A O no hydrogen 2.853 N/A VAL 103.A N ALA 99.A O no hydrogen 2.782 N/A LEU 104.A N GLY 100.A O no hydrogen 3.359 N/A VAL 105.A N ASP 101.A O no hydrogen 3.098 N/A SER 106.A N LEU 102.A O no hydrogen 3.107 N/A SER 106.A OG VAL 103.A O no hydrogen 2.509 N/A ALA 107.A N VAL 103.A O no hydrogen 3.052 N/A PHE 108.A N LEU 104.A O no hydrogen 3.074 N/A HIS 109.A N VAL 105.A O no hydrogen 2.905 N/A THR 110.A N SER 106.A O no hydrogen 2.868 N/A THR 110.A OG1 SER 106.A O no hydrogen 3.180 N/A VAL 111.A N ALA 107.A O no hydrogen 3.013 N/A GLU 112.A N PHE 108.A O no hydrogen 2.742 N/A GLU 113.A N HIS 109.A O no hydrogen 3.103 N/A GLY 115.A N GLU 112.A O no hydrogen 3.006 N/A ASN 116.A ND2 LEU 171.A O no hydrogen 3.302 N/A LEU 119.A N ASN 116.A O no hydrogen 3.098 N/A LEU 119.A N ASN 116.A OD1 no hydrogen 2.710 N/A ARG 120.A N ASN 116.A O no hydrogen 3.310 N/A ARG 120.A NH1 ASN 117.A OD1 no hydrogen 3.343 N/A ARG 120.A NH2 ASN 117.A OD1 no hydrogen 3.087 N/A ARG 121.A N ASN 117.A O no hydrogen 3.061 N/A ALA 122.A N LEU 119.A O no hydrogen 3.008 N/A PHE 123.A N LEU 119.A O no hydrogen 3.060 N/A LEU 124.A N ARG 120.A O no hydrogen 3.251 N/A ASN 125.A N ARG 121.A O no hydrogen 3.280 N/A ILE 127.A N PHE 123.A O no hydrogen 2.939 N/A GLY 128.A N LEU 124.A O no hydrogen 2.926 N/A LYS 129.A N ASN 125.A O no hydrogen 2.988 N/A MET 130.A N VAL 126.A O no hydrogen 2.786 N/A SER 131.A N ILE 127.A O no hydrogen 3.189 N/A SER 131.A N GLY 128.A O no hydrogen 2.658 N/A GLU 132.A N GLY 128.A O no hydrogen 3.038 N/A ALA 133.A N LYS 129.A O no hydrogen 3.179 N/A GLU 134.A N MET 130.A O no hydrogen 3.443 N/A LEU 135.A N SER 131.A O no hydrogen 3.346 N/A ILE 136.A N GLU 132.A O no hydrogen 2.871 N/A GLU 137.A N ALA 133.A O no hydrogen 2.994 N/A LEU 139.A N LEU 135.A O no hydrogen 2.994 N/A SER 140.A N GLU 137.A O no hydrogen 3.145 N/A SER 140.A OG ILE 136.A O no hydrogen 3.171 N/A ARG 141.A N GLN 138.A O no hydrogen 3.112 N/A LYS 143.A N SER 140.A O no hydrogen 2.813 N/A THR 146.A OG1 GLU 148.A OE1 no hydrogen 3.025 N/A THR 146.A OG1 GLU 149.A OE2 no hydrogen 2.970 N/A GLU 149.A N THR 146.A OG1 no hydrogen 3.018 N/A TYR 150.A N THR 146.A O no hydrogen 3.155 N/A TYR 150.A OH ASP 196.A OD1 no hydrogen 2.701 N/A LEU 151.A N LYS 147.A O no hydrogen 3.152 N/A ARG 152.A N GLU 148.A O no hydrogen 3.279 N/A ILE 153.A N GLU 149.A O no hydrogen 3.119 N/A ILE 153.A N TYR 150.A O no hydrogen 3.123 N/A VAL 154.A N TYR 150.A O no hydrogen 2.736 N/A GLU 155.A N LEU 151.A O no hydrogen 2.595 N/A GLY 156.A N ILE 153.A O no hydrogen 3.014 N/A LYS 157.A N ILE 153.A O no hydrogen 2.945 N/A LYS 157.A NZ GLU 137.A OE1 no hydrogen 2.834 N/A LYS 157.A NZ GLU 137.A OE2 no hydrogen 3.281 N/A SER 158.A N VAL 154.A O no hydrogen 3.210 N/A SER 158.A OG GLY 188.A O no hydrogen 3.442 N/A GLY 159.A N VAL 154.A O no hydrogen 3.116 N/A ALA 160.A N GLU 155.A O no hydrogen 3.011 N/A GLY 163.A N GLY 159.A O no hydrogen 2.960 N/A LEU 164.A N ALA 160.A O no hydrogen 3.127 N/A ALA 165.A N LEU 161.A O no hydrogen 2.981 N/A LEU 166.A N PHE 162.A O no hydrogen 3.116 N/A GLN 167.A N GLY 163.A O no hydrogen 2.559 N/A LEU 171.A N GLN 167.A O no hydrogen 3.443 N/A LEU 172.A N LEU 168.A O no hydrogen 3.456 N/A GLU 173.A N PRO 169.A O no hydrogen 3.314 N/A GLY 174.A N ALA 170.A O no hydrogen 2.965 N/A GLY 174.A N LEU 171.A O no hydrogen 3.154 N/A GLU 175.A N ALA 170.A O no hydrogen 3.199 N/A TYR 181.A N GLY 177.A O no hydrogen 3.018 N/A ASN 182.A N GLU 178.A O no hydrogen 3.046 N/A LEU 183.A N LEU 180.A O no hydrogen 3.099 N/A GLY 184.A N LEU 180.A O no hydrogen 3.133 N/A VAL 185.A N TYR 181.A O no hydrogen 2.961 N/A THR 186.A OG1 ASN 182.A O no hydrogen 3.276 N/A ILE 187.A N LEU 183.A O no hydrogen 2.838 N/A GLY 188.A N GLY 184.A O no hydrogen 2.673 N/A THR 189.A N VAL 185.A O no hydrogen 2.833 N/A THR 189.A OG1 VAL 185.A O no hydrogen 3.238 N/A ILE 190.A N THR 186.A O no hydrogen 3.008 N/A TYR 191.A N ILE 187.A O no hydrogen 2.723 N/A GLN 192.A N GLY 188.A O no hydrogen 2.899 N/A GLN 192.A N THR 189.A O no hydrogen 2.804 N/A GLN 192.A NE2 GLN 192.A O no hydrogen 3.387 N/A GLN 192.A NE2 ASP 196.A OD2 no hydrogen 3.045 N/A MET 193.A N THR 189.A O no hydrogen 2.930 N/A PHE 194.A N ILE 190.A O no hydrogen 3.037 N/A ASP 195.A N TYR 191.A O no hydrogen 3.415 N/A ASP 196.A N GLN 192.A O no hydrogen 2.777 N/A ILE 197.A N MET 193.A O no hydrogen 3.296 N/A MET 198.A N PHE 194.A O no hydrogen 2.988 N/A ASP 199.A N ASP 195.A O no hydrogen 3.015 N/A PHE 200.A N ASP 196.A O no hydrogen 3.044 N/A ALA 201.A N ILE 197.A O no hydrogen 2.636 N/A GLY 202.A N ASP 199.A O no hydrogen 3.385 N/A MET 203.A N PHE 200.A O no hydrogen 3.530 N/A GLY 207.A N PHE 211.A O no hydrogen 3.395 N/A GLY 210.A N GLY 207.A O no hydrogen 3.356 N/A LYS 215.A N ASP 199.A OD2 no hydrogen 2.875 N/A LYS 215.A NZ ASP 195.A OD2 no hydrogen 3.422 N/A GLY 217.A N LEU 214.A O no hydrogen 2.642 N/A SER 220.A N VAL 218.A O no hydrogen 2.512 N/A PHE 221.A N ASP 196.A OD1 no hydrogen 3.117 N/A VAL 224.A N SER 220.A O no hydrogen 2.685 N/A THR 225.A N PHE 221.A O no hydrogen 2.919 N/A THR 225.A OG1 PHE 221.A O no hydrogen 2.953 N/A ALA 226.A N PRO 222.A O no hydrogen 3.205 N/A MET 227.A N LEU 223.A O no hydrogen 3.372 N/A GLU 228.A N VAL 224.A O no hydrogen 3.113 N/A LYS 229.A N THR 225.A O no hydrogen 3.385 N/A LYS 229.A NZ GLU 257.A OE1 no hydrogen 2.659 N/A PHE 230.A N ALA 226.A O no hydrogen 2.785 N/A ALA 233.A N PHE 230.A O no hydrogen 2.913 N/A ARG 234.A N PHE 230.A O no hydrogen 3.254 N/A ARG 234.A NH1 MET 227.A O no hydrogen 2.795 N/A GLN 235.A N PRO 231.A O no hydrogen 2.587 N/A MET 236.A N GLU 232.A O no hydrogen 3.154 N/A PHE 237.A N ALA 233.A O no hydrogen 2.977 N/A GLU 238.A N GLN 235.A O no hydrogen 3.022 N/A ARG 240.A N PHE 237.A O no hydrogen 3.176 N/A ARG 240.A NH1 PHE 237.A O no hydrogen 3.531 N/A ASP 241.A N MET 236.A O no hydrogen 2.935 N/A TRP 242.A N ARG 240.A O no hydrogen 2.777 N/A TRP 242.A NE1 GLY 210.A O no hydrogen 3.041 N/A GLY 244.A N ASP 241.A OD1 no hydrogen 3.290 N/A LEU 245.A N ASP 241.A O no hydrogen 2.782 N/A MET 246.A N TRP 242.A O no hydrogen 2.706 N/A SER 247.A N SER 243.A O no hydrogen 3.156 N/A PHE 248.A N GLY 244.A O no hydrogen 2.626 N/A MET 249.A N LEU 245.A O no hydrogen 2.848 N/A ARG 250.A N MET 246.A O no hydrogen 3.223 N/A GLU 251.A N SER 247.A O no hydrogen 3.091 N/A LYS 252.A N PHE 248.A O no hydrogen 3.067 N/A LYS 252.A N MET 249.A O no hydrogen 3.269 N/A LYS 252.A NZ GLU 251.A OE2 no hydrogen 3.378 N/A GLY 253.A N ARG 250.A O no hydrogen 3.341 N/A GLU 257.A N GLY 253.A O no hydrogen 2.942 N/A CYS 258.A N ILE 254.A O no hydrogen 2.997 N/A CYS 258.A SG THR 225.A OG1 no hydrogen 3.726 N/A CYS 258.A SG ILE 254.A O no hydrogen 3.179 N/A GLU 259.A N LEU 255.A O no hydrogen 3.093 N/A GLU 260.A N LYS 256.A O no hydrogen 3.006 N/A THR 261.A N GLU 257.A O no hydrogen 2.756 N/A THR 261.A OG1 GLU 257.A O no hydrogen 2.875 N/A LEU 262.A N CYS 258.A O no hydrogen 2.857 N/A LYS 263.A N GLU 259.A O no hydrogen 3.165 N/A VAL 264.A N GLU 260.A O no hydrogen 3.044 N/A LEU 265.A N THR 261.A O no hydrogen 3.514 N/A VAL 266.A N LEU 262.A O no hydrogen 3.221 N/A LYS 267.A N LYS 263.A O no hydrogen 2.945 N/A ASN 268.A N VAL 264.A O no hydrogen 2.859 N/A VAL 269.A N LEU 265.A O no hydrogen 3.097 N/A VAL 269.A N VAL 266.A O no hydrogen 2.582 N/A ILE 270.A N VAL 266.A O no hydrogen 3.023 N/A ILE 271.A N LYS 267.A O no hydrogen 2.728 N/A GLU 272.A N ASN 268.A O no hydrogen 3.087 N/A ASN 273.A N VAL 269.A O no hydrogen 2.932 N/A ASN 273.A N ILE 270.A O no hydrogen 3.349 N/A TRP 275.A NE1 ASN 273.A OD1 no hydrogen 3.103 N/A LEU 276.A N ASN 273.A O no hydrogen 2.828 N/A ARG 277.A N SER 274.A O no hydrogen 3.068 N/A ARG 277.A NH2 SER 274.A OG no hydrogen 3.123 N/A