Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4c1k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A N GLU 151.A OE2 no hydrogen 2.800 N/A TYR 3.A N GLU 151.A OE1 no hydrogen 2.939 N/A SER 4.A N MET 1.A O no hydrogen 3.159 N/A SER 4.A OG MET 1.A O no hydrogen 3.050 N/A SER 4.A OG GLU 6.A OE1 no hydrogen 3.268 N/A LYS 5.A NZ LYS 188.A O no hydrogen 2.931 N/A TYR 7.A N SER 4.A O no hydrogen 3.204 N/A TYR 7.A OH GLU 159.A OE2 no hydrogen 3.106 N/A LYS 8.A NZ GLU 159.A OE1 no hydrogen 2.945 N/A LYS 10.A NZ GLY 21.A O no hydrogen 3.285 N/A THR 11.A N HIS 192.A O no hydrogen 2.988 N/A THR 11.A OG1 HIS 192.A ND1 no hydrogen 2.471 N/A VAL 13.A N PHE 20.A O no hydrogen 2.848 N/A ILE 15.A N VAL 18.A O no hydrogen 2.909 N/A ASP 17.A N ASP 17.A OD1 no hydrogen 2.535 N/A VAL 18.A N ILE 15.A O no hydrogen 2.818 N/A PHE 20.A N VAL 13.A O no hydrogen 2.899 N/A THR 25.A N ASP 222.A O no hydrogen 2.955 N/A THR 25.A OG1 LYS 19.A O no hydrogen 3.268 N/A ILE 27.A N ILE 224.A O no hydrogen 2.847 N/A ALA 28.A N VAL 53.A O no hydrogen 3.189 N/A GLY 29.A N VAL 226.A O no hydrogen 3.286 N/A CYS 31.A N GLN 242.A OE1 no hydrogen 2.800 N/A CYS 31.A SG SER 237.A OG no hydrogen 3.045 N/A CYS 31.A SG ASP 238.A OD2 no hydrogen 3.494 N/A SER 32.A OG SER 237.A OG no hydrogen 3.187 N/A ILE 33.A N GLY 57.A O no hydrogen 2.948 N/A GLU 34.A N GLN 38.A OE1 no hydrogen 2.865 N/A ARG 36.A NE GLU 81.A OE1 no hydrogen 2.704 N/A ARG 36.A NE GLU 81.A OE2 no hydrogen 3.450 N/A ARG 36.A NH2 GLU 81.A OE1 no hydrogen 2.588 N/A GLN 38.A N SER 35.A OG no hydrogen 2.794 N/A GLN 38.A NE2 SER 32.A O no hydrogen 2.933 N/A ILE 39.A N SER 35.A O no hydrogen 3.291 N/A MET 40.A N ARG 36.A O no hydrogen 3.028 N/A LYS 41.A N ASP 37.A O no hydrogen 2.938 N/A VAL 42.A N GLN 38.A O no hydrogen 2.858 N/A ALA 43.A N ILE 39.A O no hydrogen 2.836 N/A GLU 44.A N MET 40.A O no hydrogen 2.859 N/A PHE 45.A N LYS 41.A O no hydrogen 3.141 N/A LEU 46.A N VAL 42.A O no hydrogen 2.924 N/A ALA 47.A N ALA 43.A O no hydrogen 2.963 N/A GLU 48.A N GLU 44.A O no hydrogen 3.022 N/A VAL 49.A N PHE 45.A O no hydrogen 3.243 N/A VAL 49.A N LEU 46.A O no hydrogen 3.202 N/A GLY 50.A N ALA 47.A O no hydrogen 3.349 N/A ILE 51.A N LEU 46.A O no hydrogen 2.814 N/A LEU 54.A N VAL 89.A O no hydrogen 2.791 N/A ARG 55.A N ALA 28.A O no hydrogen 3.007 N/A ARG 55.A NE PRO 30.A O no hydrogen 3.213 N/A ARG 55.A NH2 PRO 30.A O no hydrogen 3.371 N/A ARG 55.A NH2 CYS 31.A O no hydrogen 3.381 N/A GLY 57.A N CYS 31.A O no hydrogen 2.863 N/A LYS 60.A N GLN 69.A O no hydrogen 2.967 N/A LYS 60.A NZ CYS 31.A O no hydrogen 3.264 N/A ARG 62.A NH1 PHE 68.A O no hydrogen 3.071 N/A TYR 66.A N SER 64.A OG no hydrogen 3.088 N/A SER 67.A N SER 64.A O no hydrogen 3.164 N/A SER 67.A OG SER 64.A O no hydrogen 3.460 N/A GLN 69.A NE2 SER 67.A O no hydrogen 3.122 N/A GLY 72.A N ALA 58.A O no hydrogen 2.811 N/A ALA 75.A N GLY 72.A O no hydrogen 2.861 N/A LEU 76.A N GLY 72.A O no hydrogen 3.077 N/A ARG 77.A N GLU 73.A O no hydrogen 2.909 N/A ARG 77.A NH2 GLU 73.A OE2 no hydrogen 3.457 N/A TRP 78.A N LYS 74.A O no hydrogen 3.207 N/A MET 79.A N ALA 75.A O no hydrogen 2.836 N/A ARG 80.A N LEU 76.A O no hydrogen 2.792 N/A ARG 80.A NE TYR 106.A O no hydrogen 2.867 N/A ARG 80.A NH1 ASP 84.A OD1 no hydrogen 2.955 N/A ARG 80.A NH2 TYR 106.A O no hydrogen 2.795 N/A ARG 80.A NH2 ASP 108.A OD2 no hydrogen 3.178 N/A GLU 81.A N ARG 77.A O no hydrogen 2.862 N/A ALA 82.A N TRP 78.A O no hydrogen 2.956 N/A ALA 83.A N MET 79.A O no hydrogen 2.763 N/A ASP 84.A N ARG 80.A O no hydrogen 2.796 N/A GLU 85.A N GLU 81.A O no hydrogen 2.853 N/A TYR 86.A N ALA 82.A O no hydrogen 2.969 N/A GLY 87.A N ALA 83.A O no hydrogen 2.735 N/A LEU 88.A N ALA 83.A O no hydrogen 3.130 N/A VAL 89.A N LYS 52.A O no hydrogen 2.815 N/A THR 90.A N ASP 108.A OD2 no hydrogen 2.982 N/A THR 90.A OG1 SER 107.A OG no hydrogen 2.754 N/A THR 90.A OG1 ASP 108.A OD2 no hydrogen 3.567 N/A VAL 91.A N LEU 54.A O no hydrogen 2.952 N/A THR 92.A N ILE 109.A O no hydrogen 3.322 N/A THR 92.A OG1 GLY 56.A O no hydrogen 2.540 N/A VAL 94.A N GLN 111.A O no hydrogen 3.004 N/A MET 95.A N HIS 99.A NE2.B no hydrogen 2.873 N/A THR 97.A OG1 ASP 96.A OD1 no hydrogen 3.367 N/A ARG 98.A N ASP 96.A OD1 no hydrogen 2.999 N/A ARG 98.A NE ASP 96.A OD1 no hydrogen 3.483 N/A ARG 98.A NE ASP 96.A OD2 no hydrogen 3.052 N/A ARG 98.A NH2 ASP 96.A OD2 no hydrogen 2.937 N/A HIS 99.A N.A ASP 96.A O no hydrogen 3.009 N/A HIS 99.A N.B ASP 96.A O no hydrogen 3.089 N/A VAL 100.A N THR 97.A O no hydrogen 3.466 N/A VAL 103.A N HIS 99.A O.A no hydrogen 2.883 N/A VAL 103.A N HIS 99.A O.B no hydrogen 2.874 N/A ALA 104.A N VAL 100.A O no hydrogen 2.779 N/A LYS 105.A N GLU 101.A O no hydrogen 2.918 N/A TYR 106.A N VAL 103.A O no hydrogen 3.032 N/A TYR 106.A OH GLU 73.A OE2 no hydrogen 2.598 N/A SER 107.A N VAL 103.A O no hydrogen 2.757 N/A SER 107.A OG THR 90.A O no hydrogen 3.349 N/A SER 107.A OG THR 90.A OG1 no hydrogen 2.754 N/A SER 107.A OG ILE 109.A O no hydrogen 3.115 N/A ASP 108.A N THR 90.A OG1 no hydrogen 3.051 N/A ILE 109.A N THR 90.A O no hydrogen 2.921 N/A LEU 110.A N PRO 132.A O no hydrogen 2.919 N/A GLN 111.A N THR 92.A O no hydrogen 2.824 N/A ILE 112.A N LEU 134.A O no hydrogen 2.748 N/A ASN 116.A N GLY 113.A O no hydrogen 2.779 N/A SER 117.A N ALA 114.A O no hydrogen 3.079 N/A SER 117.A OG LYS 136.A O no hydrogen 2.607 N/A ASN 119.A N ASN 116.A O no hydrogen 3.021 N/A ASN 119.A ND2 ASN 116.A OD1 no hydrogen 3.150 N/A LEU 122.A N ASN 119.A OD1 no hydrogen 3.095 N/A LEU 123.A N ASN 119.A O no hydrogen 2.986 N/A LYS 124.A N PHE 120.A O no hydrogen 2.789 N/A LYS 124.A NZ GLU 121.A OE2 no hydrogen 2.962 N/A GLU 125.A N GLU 121.A O no hydrogen 3.049 N/A VAL 126.A N LEU 122.A O no hydrogen 3.176 N/A GLY 127.A N LEU 123.A O no hydrogen 3.020 N/A LYS 128.A N GLU 125.A O no hydrogen 3.195 N/A LYS 128.A NZ GLU 125.A OE1 no hydrogen 3.455 N/A VAL 129.A N VAL 126.A O no hydrogen 3.458 N/A ASN 131.A ND2 ALA 104.A O no hydrogen 3.017 N/A ASN 131.A ND2 SER 107.A O no hydrogen 2.719 N/A ASN 131.A ND2 ASP 108.A O no hydrogen 3.338 N/A VAL 133.A N ASN 160.A O no hydrogen 2.957 N/A LEU 134.A N LEU 110.A O no hydrogen 2.765 N/A LEU 135.A N ILE 162.A O no hydrogen 2.751 N/A LYS 136.A N ILE 112.A O no hydrogen 3.157 N/A LYS 136.A NZ ASP 198.A OD2 no hydrogen 2.895 N/A ARG 137.A N CYS 164.A O no hydrogen 2.971 N/A ARG 137.A NE ASN 141.A O no hydrogen 2.829 N/A ARG 137.A NH1 GLU 165.A OE1 no hydrogen 2.769 N/A ARG 137.A NH1 ASP 180.A OD2 no hydrogen 2.972 N/A ARG 137.A NH2 ASN 141.A O no hydrogen 3.473 N/A ARG 137.A NH2 ASP 180.A OD2 no hydrogen 3.540 N/A ASN 141.A N GLY 138.A O no hydrogen 3.100 N/A ASN 141.A ND2 GLN 118.A OE1 no hydrogen 2.864 N/A ASN 141.A ND2 GLU 145.A OE1 no hydrogen 3.036 N/A THR 142.A N GLU 145.A OE1 no hydrogen 3.124 N/A GLN 144.A NE2 TYR 3.A OH no hydrogen 2.918 N/A GLU 145.A N THR 142.A OG1 no hydrogen 2.881 N/A LEU 146.A N THR 142.A O no hydrogen 3.019 N/A LEU 147.A N ILE 143.A O no hydrogen 3.103 N/A TYR 148.A N GLN 144.A O no hydrogen 2.995 N/A SER 149.A N GLU 145.A O no hydrogen 3.000 N/A SER 149.A OG SER 117.A O no hydrogen 2.614 N/A SER 149.A OG GLU 145.A O no hydrogen 3.452 N/A ALA 150.A N LEU 146.A O no hydrogen 2.983 N/A GLU 151.A N LEU 147.A O no hydrogen 2.846 N/A TYR 152.A N TYR 148.A O no hydrogen 3.020 N/A ILE 153.A N SER 149.A O no hydrogen 3.356 N/A MET 154.A N ALA 150.A O no hydrogen 2.926 N/A ALA 155.A N GLU 151.A O no hydrogen 2.850 N/A GLN 156.A N ILE 153.A O no hydrogen 3.133 N/A GLY 157.A N MET 154.A O no hydrogen 3.010 N/A ASN 158.A N GLY 127.A O no hydrogen 3.207 N/A ASN 158.A ND2 VAL 126.A O no hydrogen 3.133 N/A ASN 158.A ND2 ASN 131.A O no hydrogen 2.801 N/A ASN 160.A N ASN 158.A OD1 no hydrogen 3.146 N/A ILE 162.A N VAL 133.A O no hydrogen 2.893 N/A LEU 163.A N PRO 194.A O no hydrogen 2.872 N/A CYS 164.A N LEU 135.A O no hydrogen 2.768 N/A CYS 164.A SG GLU 165.A O no hydrogen 3.861 N/A CYS 164.A SG ILE 196.A O no hydrogen 3.815 N/A GLU 165.A N ILE 196.A O no hydrogen 2.973 N/A ARG 166.A NH1 GLY 167.A O no hydrogen 3.007 N/A GLY 167.A N GLU 165.A OE2 no hydrogen 2.709 N/A ILE 168.A N THR 178.A O no hydrogen 2.861 N/A ARG 169.A N MET 139.A O no hydrogen 2.848 N/A THR 170.A OG1 THR 178.A OG1 no hydrogen 2.718 N/A GLU 172.A N THR 170.A OG1 no hydrogen 3.084 N/A ALA 174.A N GLU 172.A OE2 no hydrogen 3.055 N/A THR 175.A OG1 PHE 177.A O no hydrogen 2.777 N/A ARG 176.A NH1 ASP 238.A OD1 no hydrogen 3.551 N/A ARG 176.A NH2 ASP 238.A OD1 no hydrogen 2.841 N/A PHE 177.A N PRO 202.A O no hydrogen 3.128 N/A THR 178.A N ILE 168.A O no hydrogen 2.904 N/A THR 178.A OG1 THR 170.A OG1 no hydrogen 2.718 N/A ASP 180.A N GLU 165.A OE2 no hydrogen 2.884 N/A SER 182.A OG ASP 180.A OD1 no hydrogen 2.784 N/A ALA 183.A N ASP 180.A O no hydrogen 3.059 N/A VAL 184.A N ILE 181.A O no hydrogen 3.226 N/A VAL 186.A N SER 182.A O no hydrogen 2.891 N/A VAL 187.A N ALA 183.A O no hydrogen 2.842 N/A LYS 188.A N VAL 184.A O no hydrogen 3.034 N/A LYS 188.A NZ ASP 222.A OD1 no hydrogen 3.230 N/A GLU 189.A N PRO 185.A O no hydrogen 3.073 N/A LEU 190.A N VAL 186.A O no hydrogen 3.131 N/A LEU 190.A N VAL 187.A O no hydrogen 3.033 N/A SER 191.A N VAL 187.A O no hydrogen 2.789 N/A SER 191.A OG TYR 3.A O no hydrogen 2.652 N/A HIS 192.A ND1 THR 11.A OG1 no hydrogen 2.471 N/A HIS 192.A NE2 LYS 2.A O no hydrogen 2.786 N/A LEU 193.A N SER 191.A OG no hydrogen 2.944 N/A ILE 195.A N ASP 222.A OD2 no hydrogen 2.803 N/A ILE 196.A N LEU 163.A O no hydrogen 2.878 N/A VAL 197.A N GLY 223.A O no hydrogen 2.918 N/A ASP 198.A N GLU 165.A O no hydrogen 2.885 N/A SER 200.A N ASP 198.A OD1 no hydrogen 2.605 N/A HIS 201.A N ASP 198.A OD1 no hydrogen 3.122 N/A HIS 201.A ND1 ASP 198.A OD2 no hydrogen 2.860 N/A GLY 204.A N SER 200.A O no hydrogen 3.171 N/A ARG 205.A NH2 ALA 174.A O no hydrogen 2.888 N/A ARG 206.A N GLN 240.A O no hydrogen 3.097 N/A ARG 206.A NE GLN 242.A O no hydrogen 2.991 N/A ARG 206.A NH2 SER 239.A O no hydrogen 2.805 N/A ARG 206.A NH2 GLN 242.A O no hydrogen 3.076 N/A LEU 208.A N ARG 205.A O no hydrogen 3.150 N/A VAL 209.A N ARG 206.A O no hydrogen 3.078 N/A LEU 212.A N LEU 208.A O no hydrogen 3.118 N/A ALA 213.A N VAL 209.A O no hydrogen 2.916 N/A LYS 214.A N ILE 210.A O no hydrogen 2.898 N/A LYS 214.A NZ GLU 254.A OE1 no hydrogen 2.976 N/A ALA 215.A N PRO 211.A O no hydrogen 3.091 N/A ALA 216.A N LEU 212.A O no hydrogen 3.090 N/A TYR 217.A N ALA 213.A O no hydrogen 2.965 N/A ALA 218.A N LYS 214.A O no hydrogen 3.005 N/A ILE 219.A N ALA 215.A O no hydrogen 2.928 N/A GLY 220.A N TYR 217.A O no hydrogen 3.020 N/A ALA 221.A N ALA 216.A O no hydrogen 3.100 N/A ASP 222.A N ILE 195.A O no hydrogen 2.898 N/A ILE 224.A N THR 25.A O no hydrogen 3.299 N/A MET 225.A N VAL 197.A O no hydrogen 2.904 N/A VAL 226.A N ILE 27.A O no hydrogen 2.861 N/A GLU 227.A N SER 200.A OG no hydrogen 3.000 N/A VAL 228.A N GLY 29.A O no hydrogen 2.928 N/A HIS 229.A N LEU 243.A O no hydrogen 2.963 N/A HIS 229.A NE2 GLU 34.A OE1 no hydrogen 2.835 N/A GLU 231.A N HIS 229.A ND1 no hydrogen 3.026 N/A LYS 234.A N GLU 231.A O no hydrogen 2.962 N/A ALA 235.A N PRO 232.A O no hydrogen 3.099 N/A LEU 236.A N GLU 34.A OE2 no hydrogen 2.674 N/A SER 237.A OG SER 32.A OG no hydrogen 3.187 N/A SER 239.A OG PRO 232.A O no hydrogen 2.762 N/A GLN 241.A NE2 GLU 227.A OE1 no hydrogen 2.630 N/A GLN 242.A NE2 SER 237.A O no hydrogen 2.897 N/A GLN 242.A NE2 ASP 238.A O no hydrogen 3.435 N/A LEU 243.A N GLU 227.A O no hydrogen 3.087 N/A THR 244.A N ASP 247.A OD2 no hydrogen 2.939 N/A THR 244.A OG1 ASP 247.A OD2 no hydrogen 2.769 N/A ASP 247.A N THR 244.A OG1 no hydrogen 3.074 N/A PHE 248.A N THR 244.A O no hydrogen 2.994 N/A LEU 249.A N PHE 245.A O no hydrogen 2.912 N/A GLN 250.A N ASP 246.A O no hydrogen 3.047 N/A GLN 250.A NE2 GLU 254.A OE2 no hydrogen 2.802 N/A LEU 251.A N ASP 247.A O no hydrogen 2.812 N/A LEU 252.A N PHE 248.A O no hydrogen 3.163 N/A LYS 253.A N LEU 249.A O no hydrogen 3.119 N/A GLU 254.A N GLN 250.A O no hydrogen 3.014 N/A LEU 255.A N LEU 251.A O no hydrogen 2.953 N/A GLU 256.A N LEU 252.A O no hydrogen 3.051 N/A ALA 257.A N LYS 253.A O no hydrogen 3.058 N/A LEU 258.A N LEU 255.A O no hydrogen 3.068 N/A GLY 259.A N GLU 256.A O no hydrogen 2.767 N/A TRP 260.A N LEU 255.A O no hydrogen 3.119 N/A