Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8x5l_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A N GLU 2.A OE1 no hydrogen 3.509 N/A ALA 5.A N LYS 1.A O no hydrogen 3.225 N/A LYS 6.A NZ GLU 2.A O no hydrogen 3.259 N/A LYS 8.A N LEU 4.A O no hydrogen 3.128 N/A ASP 10.A N LYS 6.A O no hydrogen 2.778 N/A LEU 12.A N LYS 8.A O no hydrogen 3.404 N/A LYS 13.A N GLU 9.A O no hydrogen 3.058 N/A LYS 14.A N ASP 10.A O no hydrogen 3.002 N/A TRP 15.A N PHE 11.A O no hydrogen 2.591 N/A GLU 16.A N LEU 12.A O no hydrogen 3.025 N/A SER 17.A N LYS 13.A O no hydrogen 2.925 N/A SER 17.A OG LYS 13.A O no hydrogen 2.567 N/A ASN 21.A ND2 GLU 92.A O no hydrogen 3.419 N/A THR 22.A OG1 GLN 20.A O no hydrogen 3.184 N/A HIS 24.A N GLN 27.A OE1 no hydrogen 2.742 N/A GLN 27.A N HIS 24.A O no hydrogen 3.014 N/A GLN 27.A NE2 GLU 49.A OE2 no hydrogen 2.985 N/A PHE 28.A N LEU 25.A O no hydrogen 3.170 N/A GLU 29.A N LYS 46.A O no hydrogen 2.831 N/A ILE 31.A N LEU 44.A O no hydrogen 3.018 N/A THR 33.A N GLU 313.A OE2 no hydrogen 3.379 N/A THR 33.A OG1 GLU 313.A OE1 no hydrogen 2.776 N/A LEU 34.A N VAL 42.A O no hydrogen 2.652 N/A GLY 37.A N GLY 40.A O no hydrogen 2.803 N/A ARG 41.A N ILE 58.A O no hydrogen 3.094 N/A ARG 41.A NH1 THR 33.A OG1 no hydrogen 2.729 N/A ARG 41.A NH1 GLU 312.A O no hydrogen 2.916 N/A ARG 41.A NH2 GLU 312.A O no hydrogen 3.567 N/A VAL 42.A N GLY 35.A O no hydrogen 2.910 N/A MET 43.A N MET 56.A O no hydrogen 2.762 N/A LEU 44.A N ARG 32.A O no hydrogen 2.725 N/A VAL 45.A N TYR 54.A O no hydrogen 2.782 N/A LYS 46.A N GLU 29.A O no hydrogen 2.955 N/A LYS 46.A NZ GLY 51.A O no hydrogen 3.097 N/A HIS 47.A N ASN 52.A O no hydrogen 2.702 N/A LYS 48.A N GLN 27.A O no hydrogen 2.894 N/A LYS 48.A NZ ASP 26.A O no hydrogen 2.838 N/A GLU 49.A N HIS 47.A ND1 no hydrogen 3.242 N/A GLY 51.A N HIS 47.A O no hydrogen 2.895 N/A ASN 52.A N THR 50.A OG1 no hydrogen 3.105 N/A TYR 54.A N VAL 45.A O no hydrogen 2.910 N/A ALA 55.A N LEU 105.A O no hydrogen 3.073 N/A MET 56.A N MET 43.A O no hydrogen 2.624 N/A LYS 57.A N MET 103.A O no hydrogen 2.818 N/A ILE 58.A N ARG 41.A O no hydrogen 2.731 N/A LEU 59.A N LEU 101.A O no hydrogen 2.965 N/A ASP 60.A N PHE 39.A O no hydrogen 2.922 N/A LYS 61.A N SER 99.A O no hydrogen 2.946 N/A LYS 61.A NZ ASP 97.A O no hydrogen 2.721 N/A LYS 61.A NZ LYS 322.A O no hydrogen 2.908 N/A GLN 62.A N ASP 60.A OD1 no hydrogen 2.799 N/A LYS 63.A N ASP 60.A OD1 no hydrogen 3.181 N/A VAL 64.A N ASP 60.A O no hydrogen 3.100 N/A VAL 65.A N LYS 61.A O no hydrogen 3.211 N/A LYS 66.A N GLN 62.A O no hydrogen 2.750 N/A LEU 67.A N LYS 63.A O no hydrogen 3.226 N/A LYS 68.A N VAL 65.A O no hydrogen 2.893 N/A GLN 69.A N VAL 64.A O no hydrogen 2.736 N/A GLN 69.A NE2 LEU 67.A O no hydrogen 3.417 N/A THR 73.A N GLN 69.A O no hydrogen 2.861 N/A THR 73.A OG1 GLN 69.A O no hydrogen 2.715 N/A LEU 74.A N ILE 70.A O no hydrogen 2.828 N/A ASN 75.A N GLU 71.A O no hydrogen 2.910 N/A ASN 75.A ND2 GLU 71.A O no hydrogen 2.995 N/A GLU 76.A N HIS 72.A O no hydrogen 2.738 N/A LYS 77.A N THR 73.A O no hydrogen 2.995 N/A LYS 77.A NZ PHE 330.A OXT no hydrogen 2.477 N/A ARG 78.A N LEU 74.A O no hydrogen 3.145 N/A ILE 79.A N ASN 75.A O no hydrogen 2.930 N/A GLN 80.A N GLU 76.A O no hydrogen 2.978 N/A GLN 80.A NE2 VAL 89.A O no hydrogen 2.706 N/A GLN 81.A N LYS 77.A O no hydrogen 2.994 N/A ALA 82.A N ARG 78.A O no hydrogen 3.213 N/A ALA 82.A N ILE 79.A O no hydrogen 3.112 N/A VAL 83.A N ILE 79.A O no hydrogen 2.933 N/A LEU 88.A N PHE 85.A O no hydrogen 3.164 N/A VAL 89.A N VAL 167.A O no hydrogen 3.119 N/A LYS 90.A NZ ASN 84.A OD1 no hydrogen 2.650 N/A GLU 92.A N VAL 104.A O no hydrogen 2.719 N/A PHE 93.A N VAL 104.A O no hydrogen 3.352 N/A PHE 95.A N TYR 102.A O no hydrogen 2.913 N/A LYS 96.A NZ PHE 327.A O no hydrogen 2.552 N/A LYS 96.A NZ SER 328.A O no hydrogen 3.242 N/A LYS 96.A NZ PHE 330.A O no hydrogen 3.086 N/A ASP 97.A N ASN 100.A O no hydrogen 3.048 N/A SER 99.A N ASP 97.A OD1 no hydrogen 3.194 N/A ASN 100.A N ASP 97.A OD1 no hydrogen 2.783 N/A ASN 100.A ND2 TYR 102.A OH no hydrogen 3.008 N/A LEU 101.A N LEU 59.A O no hydrogen 2.839 N/A TYR 102.A N PHE 95.A O no hydrogen 2.842 N/A TYR 102.A OH ASP 97.A OD2 no hydrogen 2.702 N/A MET 103.A N LYS 57.A O no hydrogen 2.901 N/A VAL 104.A N PHE 93.A O no hydrogen 2.884 N/A LEU 105.A N ALA 55.A O no hydrogen 2.804 N/A GLU 106.A N LYS 90.A O no hydrogen 2.983 N/A TYR 107.A OH ASP 304.A O no hydrogen 2.767 N/A GLY 110.A N ILE 159.A O no hydrogen 2.782 N/A GLY 111.A N ALA 108.A O no hydrogen 3.313 N/A MET 113.A N LEU 157.A O no hydrogen 2.806 N/A SER 115.A N GLU 112.A O no hydrogen 3.178 N/A SER 115.A OG GLU 112.A O no hydrogen 2.797 N/A LEU 117.A N MET 113.A O no hydrogen 3.108 N/A ARG 118.A N PHE 114.A O no hydrogen 3.168 N/A ARG 118.A NH1 GLU 211.A OE2 no hydrogen 2.771 N/A ARG 118.A NH2 GLU 211.A OE2 no hydrogen 3.115 N/A ARG 119.A N SER 115.A O no hydrogen 3.227 N/A ILE 120.A N HIS 116.A O no hydrogen 3.186 N/A ARG 122.A N ILE 120.A O no hydrogen 3.126 N/A PHE 123.A N MET 212.A O no hydrogen 2.734 N/A ALA 128.A N SER 124.A O no hydrogen 2.826 N/A ARG 129.A N GLU 125.A O no hydrogen 2.764 N/A ARG 129.A NE TRP 277.A O no hydrogen 2.485 N/A PHE 130.A N PRO 126.A O no hydrogen 2.837 N/A TYR 131.A N HIS 127.A O no hydrogen 3.424 N/A ALA 132.A N ALA 128.A O no hydrogen 2.878 N/A ALA 133.A N ARG 129.A O no hydrogen 2.994 N/A GLN 134.A NE2 PHE 130.A O no hydrogen 3.240 N/A ILE 135.A N TYR 131.A O no hydrogen 3.142 N/A VAL 136.A N ALA 132.A O no hydrogen 2.789 N/A LEU 137.A N ALA 133.A O no hydrogen 3.002 N/A THR 138.A N GLN 134.A O no hydrogen 2.821 N/A THR 138.A OG1 GLN 134.A O no hydrogen 2.666 N/A PHE 139.A N ILE 135.A O no hydrogen 2.728 N/A GLU 140.A N VAL 136.A O no hydrogen 2.771 N/A TYR 141.A N LEU 137.A O no hydrogen 2.797 N/A LEU 142.A N THR 138.A O no hydrogen 2.887 N/A HIS 143.A N PHE 139.A O no hydrogen 2.917 N/A HIS 143.A NE2 ASP 201.A OD2 no hydrogen 2.568 N/A SER 144.A N GLU 140.A O no hydrogen 3.141 N/A SER 144.A N TYR 141.A O no hydrogen 3.088 N/A SER 144.A OG TYR 141.A O no hydrogen 2.643 N/A LEU 145.A N LEU 142.A O no hydrogen 3.148 N/A ASP 146.A N HIS 143.A O no hydrogen 2.879 N/A LEU 147.A N LEU 142.A O no hydrogen 2.909 N/A ILE 148.A N PHE 172.A O no hydrogen 2.876 N/A TYR 149.A N ASP 201.A OD2 no hydrogen 2.977 N/A ARG 150.A N ASP 201.A OD1 no hydrogen 2.777 N/A ARG 150.A NH1 ASP 151.A OD2 no hydrogen 2.575 N/A ASN 156.A N LYS 153.A O no hydrogen 2.678 N/A ASN 156.A ND2 ASP 169.A OD2 no hydrogen 2.487 N/A LEU 157.A N PRO 154.A O no hydrogen 3.438 N/A LEU 158.A N LYS 166.A O no hydrogen 2.748 N/A ILE 159.A N GLY 111.A O no hydrogen 2.785 N/A ASP 160.A N TYR 164.A O no hydrogen 2.927 N/A GLN 162.A N ASP 160.A OD1 no hydrogen 2.940 N/A GLY 163.A N ASP 160.A O no hydrogen 2.723 N/A TYR 164.A N ASP 160.A OD1 no hydrogen 2.955 N/A TYR 164.A OH VAL 291.A O no hydrogen 2.537 N/A ILE 165.A N GLN 134.A OE1 no hydrogen 2.691 N/A LYS 166.A N LEU 158.A O no hydrogen 2.907 N/A LYS 166.A NZ PRO 86.A O no hydrogen 2.837 N/A VAL 167.A N PHE 87.A O no hydrogen 2.859 N/A ALA 168.A N ASN 156.A O no hydrogen 3.144 N/A PHE 172.A N ILE 148.A O no hydrogen 2.670 N/A THR 178.A OG1 ARG 175.A O no hydrogen 3.087 N/A CYS 180.A N THR 176.A O no hydrogen 3.049 N/A CYS 180.A SG THR 176.A O no hydrogen 3.093 N/A GLY 181.A N TRP 177.A O no hydrogen 3.105 N/A THR 182.A N THR 178.A O no hydrogen 2.977 N/A THR 182.A OG1 THR 178.A O no hydrogen 2.964 N/A GLU 184.A N GLU 184.A OE1 no hydrogen 2.833 N/A TYR 185.A OH GLU 211.A OE1 no hydrogen 2.442 N/A LEU 186.A N PRO 183.A O no hydrogen 3.288 N/A GLU 189.A N GLU 189.A OE1 no hydrogen 2.863 N/A ILE 190.A N ALA 187.A O no hydrogen 3.063 N/A ILE 191.A N ALA 187.A O no hydrogen 3.240 N/A LEU 192.A N PRO 188.A O no hydrogen 2.990 N/A SER 193.A N ILE 190.A O no hydrogen 3.384 N/A LYS 194.A N GLU 189.A O no hydrogen 3.017 N/A ASN 197.A ND2 ASN 264.A OD1 no hydrogen 3.542 N/A ALA 199.A N ASN 197.A OD1 no hydrogen 3.147 N/A VAL 200.A N ASN 197.A O no hydrogen 3.273 N/A ASP 201.A N LYS 198.A O no hydrogen 3.274 N/A TRP 202.A N ALA 199.A O no hydrogen 3.102 N/A TRP 203.A N ALA 199.A O no hydrogen 3.250 N/A ALA 204.A N VAL 200.A O no hydrogen 2.933 N/A LEU 205.A N ASP 201.A O no hydrogen 2.856 N/A GLY 206.A N TRP 202.A O no hydrogen 3.199 N/A VAL 207.A N TRP 203.A O no hydrogen 2.989 N/A LEU 208.A N ALA 204.A O no hydrogen 2.896 N/A ILE 209.A N LEU 205.A O no hydrogen 2.926 N/A TYR 210.A N GLY 206.A O no hydrogen 2.977 N/A TYR 210.A OH ARG 237.A O no hydrogen 2.518 N/A GLU 211.A N VAL 207.A O no hydrogen 2.877 N/A MET 212.A N LEU 208.A O no hydrogen 2.907 N/A ALA 213.A N ILE 209.A O no hydrogen 2.916 N/A ALA 214.A N TYR 210.A O no hydrogen 2.759 N/A GLY 215.A N GLU 211.A O no hydrogen 2.667 N/A GLN 226.A N GLN 223.A O no hydrogen 3.098 N/A TYR 228.A N PRO 224.A O no hydrogen 3.206 N/A TYR 228.A OH LEU 179.A O no hydrogen 2.363 N/A GLU 229.A N ILE 225.A O no hydrogen 3.292 N/A LYS 230.A N GLN 226.A O no hydrogen 3.144 N/A LYS 230.A NZ PHE 220.A O no hydrogen 2.722 N/A ILE 231.A N ILE 227.A O no hydrogen 2.923 N/A VAL 232.A N TYR 228.A O no hydrogen 3.160 N/A SER 233.A N GLU 229.A O no hydrogen 3.263 N/A SER 233.A N LYS 230.A O no hydrogen 3.182 N/A SER 233.A OG LYS 230.A O no hydrogen 2.482 N/A GLY 234.A N ILE 231.A O no hydrogen 3.487 N/A PHE 242.A N PRO 239.A O no hydrogen 3.327 N/A SER 243.A N GLU 125.A OE2 no hydrogen 2.895 N/A SER 243.A OG GLU 125.A OE1 no hydrogen 2.787 N/A LEU 246.A N SER 243.A OG no hydrogen 2.962 N/A LYS 247.A N SER 243.A O no hydrogen 3.014 N/A ASP 248.A N SER 244.A O no hydrogen 2.884 N/A LEU 249.A N ASP 245.A O no hydrogen 3.067 N/A LEU 250.A N LEU 246.A O no hydrogen 2.944 N/A ARG 251.A N LYS 247.A O no hydrogen 3.006 N/A ASN 252.A N ASP 248.A O no hydrogen 3.194 N/A LEU 253.A N LEU 249.A O no hydrogen 2.778 N/A LEU 254.A N LEU 250.A O no hydrogen 2.688 N/A ASP 257.A N GLN 255.A OE1 no hydrogen 3.279 N/A THR 259.A OG1 ASP 257.A OD1 no hydrogen 2.737 N/A LYS 260.A N ASP 257.A O no hydrogen 2.930 N/A ARG 261.A N LEU 258.A O no hydrogen 3.149 N/A ARG 261.A NE GLN 255.A O no hydrogen 2.841 N/A ARG 261.A NH1 GLU 189.A OE1 no hydrogen 3.409 N/A ARG 261.A NH1 GLU 189.A OE2 no hydrogen 2.527 N/A ARG 261.A NH1 ALA 199.A O no hydrogen 2.989 N/A ARG 261.A NH2 GLU 189.A OE1 no hydrogen 2.726 N/A ARG 261.A NH2 GLN 255.A O no hydrogen 3.015 N/A PHE 262.A N ASN 252.A O no hydrogen 2.894 N/A ASN 264.A N ARG 261.A O no hydrogen 3.114 N/A ASN 264.A ND2 LEU 258.A O no hydrogen 2.775 N/A GLY 268.A N LEU 265.A O no hydrogen 2.966 N/A ASN 270.A N ASN 267.A O no hydrogen 3.252 N/A ASN 270.A ND2 ASN 267.A O no hydrogen 3.319 N/A ILE 272.A N VAL 269.A O no hydrogen 3.071 N/A LYS 273.A N VAL 269.A O no hydrogen 3.090 N/A LYS 273.A NZ GLU 140.A OE1 no hydrogen 2.679 N/A ASN 274.A N ASN 270.A O no hydrogen 3.044 N/A HIS 275.A N ILE 272.A O no hydrogen 3.263 N/A HIS 275.A NE2 ASP 248.A OD2 no hydrogen 2.969 N/A TRP 277.A N HIS 275.A ND1 no hydrogen 3.067 N/A TRP 277.A NE1 GLU 125.A OE1 no hydrogen 3.067 N/A PHE 278.A N HIS 275.A O no hydrogen 2.853 N/A ALA 279.A N LYS 276.A O no hydrogen 3.217 N/A THR 281.A N PHE 278.A O no hydrogen 2.973 N/A ALA 285.A N ASP 282.A OD1 no hydrogen 3.502 N/A ILE 286.A N ASP 282.A O no hydrogen 2.910 N/A TYR 287.A N TRP 283.A O no hydrogen 3.051 N/A GLN 288.A N ILE 284.A O no hydrogen 2.890 N/A ARG 289.A N ILE 286.A O no hydrogen 2.992 N/A ARG 289.A NE GLN 162.A OE1 no hydrogen 3.372 N/A ARG 289.A NH2 ASP 160.A OD2 no hydrogen 2.754 N/A ARG 289.A NH2 GLN 162.A OE1 no hydrogen 2.980 N/A LYS 290.A N ALA 285.A O no hydrogen 2.759 N/A LYS 300.A N ASP 304.A OD2 no hydrogen 3.271 N/A LYS 300.A NZ SER 306.A OG no hydrogen 3.398 N/A SER 306.A OG ASP 304.A OD2 no hydrogen 3.502 N/A ASN 307.A ND2 PRO 109.A O no hydrogen 2.987 N/A PHE 308.A N THR 305.A O no hydrogen 3.036 N/A ARG 317.A N GLU 315.A O no hydrogen 2.947 N/A LYS 322.A N ASN 98.A O no hydrogen 3.003 N/A GLU 326.A N GLU 326.A OE1 no hydrogen 2.768 N/A PHE 327.A N CYS 323.A O no hydrogen 3.366 N/A PHE 327.A N GLY 324.A O no hydrogen 3.284 N/A SER 328.A N LYS 325.A O no hydrogen 3.430 N/A SER 328.A OG LYS 325.A O no hydrogen 3.251 N/A PHE 330.A N PHE 327.A O no hydrogen 3.105 N/A