Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3w1f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 2.A SG GLU 1.A O no hydrogen 3.281 N/A CYS 2.A SG TYR 10.A O no hydrogen 3.848 N/A ILE 3.A N TYR 10.A O no hydrogen 2.944 N/A VAL 5.A N ARG 8.A O no hydrogen 2.895 N/A LYS 6.A N GLU 77.A OE2 no hydrogen 2.970 N/A ARG 8.A N VAL 5.A O no hydrogen 3.108 N/A TYR 10.A N ILE 3.A O no hydrogen 2.947 N/A SER 11.A N LEU 28.A O no hydrogen 2.816 N/A ILE 12.A N GLU 1.A O no hydrogen 2.927 N/A LEU 13.A N GLN 26.A O no hydrogen 2.884 N/A ILE 16.A N VAL 24.A O no hydrogen 2.759 N/A GLY 17.A N VAL 24.A O no hydrogen 3.211 N/A SER 18.A N GLN 157.A O no hydrogen 3.219 N/A SER 21.A OG ASN 41.A O no hydrogen 3.185 N/A LYS 23.A N TYR 39.A O no hydrogen 2.892 N/A VAL 24.A N GLY 17.A O no hydrogen 2.946 N/A PHE 25.A N ILE 37.A O no hydrogen 2.911 N/A GLN 26.A N LYS 14.A O no hydrogen 2.734 N/A VAL 27.A N TYR 35.A O no hydrogen 2.852 N/A LEU 28.A N SER 11.A O no hydrogen 3.154 N/A ASN 29.A N GLN 33.A O no hydrogen 2.983 N/A ASN 29.A ND2 GLN 33.A OE1 no hydrogen 2.684 N/A LYS 32.A N ASN 29.A O no hydrogen 2.898 N/A GLN 33.A N ASN 29.A OD1 no hydrogen 2.552 N/A TYR 35.A N VAL 27.A O no hydrogen 3.157 N/A ALA 36.A N MET 87.A O no hydrogen 2.761 N/A ILE 37.A N PHE 25.A O no hydrogen 2.934 N/A LYS 38.A N MET 85.A O no hydrogen 2.944 N/A LYS 38.A NZ GLU 56.A OE1 no hydrogen 3.412 N/A LYS 38.A NZ GLU 56.A OE2 no hydrogen 3.265 N/A TYR 39.A N LYS 23.A O no hydrogen 2.794 N/A VAL 40.A N ILE 83.A O no hydrogen 2.903 N/A ASN 41.A N SER 21.A O no hydrogen 3.008 N/A ASN 41.A ND2 TYR 39.A OH no hydrogen 2.670 N/A LEU 42.A N GLN 81.A O no hydrogen 2.754 N/A ALA 45.A N LEU 42.A O no hydrogen 2.811 N/A THR 49.A OG1 ASP 46.A O no hydrogen 3.372 N/A LEU 50.A N ASP 46.A O no hydrogen 2.935 N/A ASP 51.A N ASN 47.A O no hydrogen 2.841 N/A SER 52.A N GLN 48.A O no hydrogen 3.025 N/A SER 52.A OG THR 49.A O no hydrogen 2.432 N/A TYR 53.A N THR 49.A O no hydrogen 3.006 N/A ARG 54.A N LEU 50.A O no hydrogen 3.075 N/A ASN 55.A N ASP 51.A O no hydrogen 2.831 N/A GLU 56.A N SER 52.A O no hydrogen 2.910 N/A ILE 57.A N TYR 53.A O no hydrogen 3.066 N/A ALA 58.A N ARG 54.A O no hydrogen 3.140 N/A TYR 59.A N ASN 55.A O no hydrogen 2.978 N/A LEU 60.A N GLU 56.A O no hydrogen 2.757 N/A ASN 61.A N ILE 57.A O no hydrogen 2.824 N/A LYS 62.A N ALA 58.A O no hydrogen 2.856 N/A LEU 63.A N TYR 59.A O no hydrogen 2.732 N/A GLN 64.A N ASN 61.A O no hydrogen 3.078 N/A GLN 64.A NE2 LEU 60.A O no hydrogen 3.575 N/A GLN 64.A NE2 ILE 71.A O no hydrogen 3.021 N/A HIS 66.A N LEU 63.A O no hydrogen 3.013 N/A SER 67.A OG GLU 118.A OE2 no hydrogen 2.752 N/A LYS 69.A N SER 67.A OG no hydrogen 3.033 N/A LYS 69.A NZ ASP 68.A OD1 no hydrogen 2.461 N/A LYS 69.A NZ GLU 118.A OE1 no hydrogen 3.187 N/A ILE 71.A N LEU 147.A O no hydrogen 2.959 N/A ARG 72.A N GLU 88.A OE1 no hydrogen 3.108 N/A ARG 72.A NH2 GLN 64.A OE1 no hydrogen 3.108 N/A LEU 73.A N GLN 64.A OE1 no hydrogen 2.773 N/A TYR 74.A N VAL 86.A O no hydrogen 2.730 N/A ASP 75.A N VAL 86.A O no hydrogen 3.489 N/A GLU 77.A N TYR 84.A O no hydrogen 2.833 N/A THR 79.A N TYR 82.A O no hydrogen 3.045 N/A GLN 81.A N THR 79.A OG1 no hydrogen 3.006 N/A TYR 82.A N THR 79.A OG1 no hydrogen 3.390 N/A TYR 82.A OH GLU 77.A OE1 no hydrogen 2.414 N/A ILE 83.A N VAL 40.A O no hydrogen 2.817 N/A TYR 84.A N GLU 77.A O no hydrogen 2.864 N/A MET 85.A N LYS 38.A O no hydrogen 2.936 N/A VAL 86.A N ASP 75.A O no hydrogen 2.859 N/A MET 87.A N ALA 36.A O no hydrogen 2.715 N/A GLU 88.A N ARG 72.A O no hydrogen 3.143 N/A ASN 91.A N ILE 140.A O no hydrogen 2.905 N/A LEU 94.A N PHE 138.A O no hydrogen 3.211 N/A SER 96.A N ASP 93.A OD1 no hydrogen 3.048 N/A SER 96.A OG ASP 93.A OD1 no hydrogen 3.141 N/A SER 96.A OG ASP 93.A OD2 no hydrogen 2.859 N/A TRP 97.A N LEU 94.A O no hydrogen 2.858 N/A LEU 98.A N LEU 94.A O no hydrogen 2.951 N/A LEU 98.A N ASN 95.A O no hydrogen 3.270 N/A LYS 101.A N TRP 97.A O no hydrogen 3.217 N/A GLU 108.A N ASP 105.A OD2 no hydrogen 3.138 N/A ARG 109.A N ASP 105.A O no hydrogen 2.882 N/A ARG 109.A NH1 MET 191.A O no hydrogen 2.954 N/A LYS 110.A N PRO 106.A O no hydrogen 3.076 N/A SER 111.A N TRP 107.A O no hydrogen 3.132 N/A TYR 112.A N GLU 108.A O no hydrogen 2.781 N/A TRP 113.A N ARG 109.A O no hydrogen 2.982 N/A LYS 114.A N LYS 110.A O no hydrogen 2.854 N/A ASN 115.A N SER 111.A O no hydrogen 3.049 N/A MET 116.A N TYR 112.A O no hydrogen 2.978 N/A LEU 117.A N TRP 113.A O no hydrogen 3.000 N/A GLU 118.A N LYS 114.A O no hydrogen 2.985 N/A ALA 119.A N ASN 115.A O no hydrogen 3.085 N/A VAL 120.A N MET 116.A O no hydrogen 2.868 N/A HIS 121.A N LEU 117.A O no hydrogen 2.682 N/A THR 122.A N GLU 118.A O no hydrogen 2.933 N/A THR 122.A OG1 GLU 118.A O no hydrogen 2.833 N/A ILE 123.A N ALA 119.A O no hydrogen 3.231 N/A HIS 124.A N VAL 120.A O no hydrogen 3.105 N/A HIS 124.A NE2 ASP 180.A OD2 no hydrogen 2.627 N/A GLN 125.A N HIS 121.A O no hydrogen 2.885 N/A HIS 126.A N ILE 123.A O no hydrogen 3.046 N/A GLY 127.A N HIS 124.A O no hydrogen 2.839 N/A ILE 128.A N ILE 123.A O no hydrogen 2.867 N/A LYS 134.A N ASN 137.A OD1 no hydrogen 3.122 N/A LYS 134.A NZ ASP 132.A O no hydrogen 2.709 N/A LYS 134.A NZ ASP 132.A OD1 no hydrogen 2.776 N/A ASN 137.A N LYS 134.A O no hydrogen 2.858 N/A PHE 138.A N PRO 135.A O no hydrogen 3.202 N/A LEU 139.A N LYS 146.A O no hydrogen 2.934 N/A ILE 140.A N ILE 92.A O no hydrogen 3.152 N/A VAL 141.A N MET 144.A O no hydrogen 2.869 N/A LEU 145.A N ASN 115.A OD1 no hydrogen 3.093 N/A LYS 146.A N LEU 139.A O no hydrogen 2.982 N/A LYS 146.A NZ ASP 68.A O no hydrogen 3.264 N/A LYS 146.A NZ GLU 88.A OE1 no hydrogen 3.182 N/A LYS 146.A NZ GLU 88.A OE2 no hydrogen 2.631 N/A LEU 147.A N LYS 69.A O no hydrogen 2.804 N/A ILE 148.A N ASN 137.A O no hydrogen 2.871 N/A ASP 159.A N ILE 16.A O no hydrogen 2.500 N/A ASN 163.A N THR 161.A OG1 no hydrogen 2.909 N/A GLU 168.A N GLU 168.A OE1 no hydrogen 2.595 N/A ALA 169.A N PRO 166.A O no hydrogen 2.934 N/A ILE 170.A N PRO 166.A O no hydrogen 3.315 N/A ILE 170.A N PRO 167.A O no hydrogen 2.805 N/A LYS 171.A N PRO 167.A O no hydrogen 2.762 N/A LYS 178.A N SER 176.A OG no hydrogen 2.878 N/A LYS 178.A NZ PRO 240.A O no hydrogen 2.748 N/A LYS 178.A NZ ARG 243.A O no hydrogen 3.062 N/A SER 179.A N SER 176.A O no hydrogen 3.074 N/A SER 179.A OG SER 176.A O no hydrogen 2.967 N/A ASP 180.A N PRO 177.A O no hydrogen 3.191 N/A VAL 181.A N LYS 178.A O no hydrogen 2.860 N/A TRP 182.A N LYS 178.A O no hydrogen 3.310 N/A SER 183.A N SER 179.A O no hydrogen 3.373 N/A SER 183.A OG TYR 164.A O no hydrogen 3.239 N/A SER 183.A OG SER 179.A O no hydrogen 3.279 N/A LEU 184.A N ASP 180.A O no hydrogen 2.907 N/A GLY 185.A N VAL 181.A O no hydrogen 2.848 N/A CYS 186.A N TRP 182.A O no hydrogen 2.942 N/A CYS 186.A SG ASN 163.A O no hydrogen 3.876 N/A CYS 186.A SG TRP 182.A O no hydrogen 3.567 N/A ILE 187.A N SER 183.A O no hydrogen 3.196 N/A LEU 188.A N LEU 184.A O no hydrogen 2.990 N/A TYR 189.A N GLY 185.A O no hydrogen 2.702 N/A TYR 189.A OH GLU 219.A O no hydrogen 2.663 N/A TYR 190.A N CYS 186.A O no hydrogen 3.134 N/A TYR 190.A OH LEU 98.A O no hydrogen 3.239 N/A MET 191.A N ILE 187.A O no hydrogen 3.222 N/A THR 192.A N TYR 189.A O no hydrogen 3.086 N/A THR 192.A OG1 LEU 188.A O no hydrogen 3.401 N/A THR 192.A OG1 TYR 189.A O no hydrogen 2.817 N/A TYR 193.A N TYR 189.A O no hydrogen 2.936 N/A TYR 193.A OH PRO 221.A O no hydrogen 2.558 N/A LYS 195.A NZ THR 196.A O no hydrogen 2.926 N/A THR 196.A N GLN 199.A OE1 no hydrogen 3.193 N/A PHE 198.A N THR 196.A OG1 no hydrogen 3.290 N/A GLN 200.A NE2 PRO 197.A O no hydrogen 3.006 N/A ILE 201.A N PHE 198.A O no hydrogen 3.156 N/A SER 206.A N ASN 203.A O no hydrogen 3.238 N/A SER 206.A OG ASN 203.A O no hydrogen 2.956 N/A LYS 207.A N GLN 204.A O no hydrogen 3.099 N/A LEU 208.A N GLN 204.A O no hydrogen 3.370 N/A HIS 209.A N SER 206.A O no hydrogen 3.062 N/A ALA 210.A N SER 206.A O no hydrogen 3.396 N/A ASP 213.A N HIS 209.A O no hydrogen 3.247 N/A ASP 213.A N ALA 210.A O no hydrogen 3.197 N/A ASN 215.A N ASP 213.A OD1 no hydrogen 3.164 N/A GLN 229.A N GLU 225.A O no hydrogen 3.366 N/A ASP 230.A N LYS 226.A O no hydrogen 3.201 N/A VAL 231.A N ASP 227.A O no hydrogen 2.981 N/A LEU 232.A N LEU 228.A O no hydrogen 3.011 N/A LYS 233.A N GLN 229.A O no hydrogen 3.104 N/A CYS 234.A N ASP 230.A O no hydrogen 2.753 N/A CYS 234.A SG ASP 230.A O no hydrogen 3.141 N/A CYS 234.A SG ASP 230.A OD1 no hydrogen 3.476 N/A CYS 234.A SG ASP 230.A OD2 no hydrogen 3.354 N/A CYS 235.A N VAL 231.A O no hydrogen 2.779 N/A CYS 235.A SG VAL 231.A O no hydrogen 3.341 N/A LEU 236.A N LEU 232.A O no hydrogen 3.023 N/A ARG 238.A NE ILE 211.A O no hydrogen 2.533 N/A ARG 238.A NH2 ALA 210.A O no hydrogen 2.807 N/A ARG 238.A NH2 ILE 211.A O no hydrogen 3.440 N/A LYS 241.A N ASP 239.A OD1 no hydrogen 3.282 N/A GLN 242.A N ASP 239.A O no hydrogen 2.644 N/A ARG 243.A N PRO 240.A O no hydrogen 3.352 N/A ARG 243.A NE CYS 235.A O no hydrogen 3.231 N/A ARG 243.A NE LYS 237.A O no hydrogen 2.911 N/A ARG 243.A NH1 GLU 168.A OE2 no hydrogen 2.692 N/A ARG 243.A NH1 LYS 178.A O no hydrogen 3.305 N/A ARG 243.A NH2 GLU 168.A OE1 no hydrogen 3.120 N/A ARG 243.A NH2 LYS 237.A O no hydrogen 2.992 N/A ILE 244.A N CYS 234.A O no hydrogen 3.249 N/A SER 245.A N GLU 248.A OE1 no hydrogen 2.798 N/A GLU 248.A N SER 245.A OG no hydrogen 2.863 N/A LEU 249.A N SER 245.A O no hydrogen 2.664 N/A LEU 250.A N ILE 246.A O no hydrogen 2.796 N/A ALA 251.A N GLU 248.A O no hydrogen 2.989 N/A HIS 252.A N LEU 249.A O no hydrogen 3.064 N/A HIS 252.A NE2 ASP 230.A OD2 no hydrogen 2.732 N/A TYR 254.A N HIS 252.A ND1 no hydrogen 3.008 N/A VAL 255.A N HIS 252.A O no hydrogen 3.163 N/A GLN 256.A N PRO 253.A O no hydrogen 3.127 N/A GLN 256.A NE2 LEU 250.A O no hydrogen 3.033 N/A ILE 257.A N PRO 253.A O no hydrogen 2.731 N/A