Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5r1k_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 2.A N ILE 36.A O no hydrogen 3.042 N/A VAL 4.A N ILE 33.A O no hydrogen 2.785 N/A PHE 6.A N HIS 31.A O no hydrogen 2.911 N/A THR 7.A N ILE 69.A O no hydrogen 2.808 N/A ILE 11.A N TYR 78.A OH no hydrogen 3.459 N/A VAL 13.A N VAL 24.A O no hydrogen 3.028 N/A THR 14.A N GLN 47.A O no hydrogen 2.825 N/A THR 14.A OG1 ASN 23.A OD1 no hydrogen 2.924 N/A ILE 15.A N PHE 22.A O no hydrogen 2.799 N/A GLY 16.A N HIS 45.A O no hydrogen 2.676 N/A ILE 17.A N TYR 20.A O no hydrogen 2.718 N/A ASP 18.A N VAL 43.A O no hydrogen 2.876 N/A GLN 19.A N GLN 19.A OE1 no hydrogen 2.461 N/A TYR 20.A N ILE 17.A O no hydrogen 2.917 N/A PHE 22.A N ILE 15.A O no hydrogen 2.796 N/A VAL 24.A N VAL 13.A O no hydrogen 2.961 N/A LYS 25.A N GLN 28.A OE1 no hydrogen 3.070 N/A ASN 27.A N ALA 9.A O no hydrogen 2.863 N/A GLN 28.A N LYS 25.A O no hydrogen 2.751 N/A HIS 31.A N MET 101.A O no hydrogen 2.957 N/A HIS 31.A ND1 PHE 6.A O no hydrogen 3.022 N/A ILE 33.A N VAL 4.A O no hydrogen 3.163 N/A LYS 34.A N VAL 103.A O no hydrogen 2.869 N/A ILE 36.A N ASN 2.A O no hydrogen 2.829 N/A HIS 42.A N PHE 60.A O no hydrogen 2.682 N/A HIS 42.A ND1 ASP 18.A OD2 no hydrogen 2.527 N/A HIS 42.A NE2 PRO 37.A O no hydrogen 2.524 N/A VAL 43.A N ASP 18.A OD1 no hydrogen 3.075 N/A ILE 44.A N.A TYR 58.A O no hydrogen 2.964 N/A ILE 44.A N.B TYR 58.A O no hydrogen 2.958 N/A HIS 45.A N GLY 16.A O no hydrogen 3.006 N/A HIS 45.A NE2 ASP 18.A O no hydrogen 3.135 N/A PHE 46.A N TYR 56.A O no hydrogen 2.763 N/A GLN 47.A N THR 14.A O no hydrogen 3.063 N/A HIS 48.A NE2 TYR 56.A OH no hydrogen 2.710 N/A ALA 49.A N GLU 12.A O no hydrogen 2.988 N/A ASN 51.A ND2 SER 53.A O no hydrogen 2.955 N/A ARG 55.A NH2 PHE 216.A O no hydrogen 2.943 N/A TYR 56.A N PHE 46.A O no hydrogen 3.121 N/A TYR 56.A OH HIS 48.A NE2 no hydrogen 2.710 N/A GLY 57.A N VAL 140.A O no hydrogen 2.856 N/A TYR 58.A N ILE 44.A O.A no hydrogen 2.750 N/A TYR 58.A N ILE 44.A O.B no hydrogen 2.716 N/A TYR 58.A OH TYR 78.A O no hydrogen 2.546 N/A TRP 59.A N SER 138.A O no hydrogen 2.933 N/A TRP 59.A NE1 ASN 213.A OD1.A no hydrogen 2.957 N/A PHE 60.A N HIS 42.A O no hydrogen 2.741 N/A ARG 63.A N ASP 61.A OD1 no hydrogen 2.760 N/A ARG 63.A NE ASP 61.A OD1 no hydrogen 3.227 N/A ARG 63.A NE ASP 61.A OD2 no hydrogen 3.323 N/A ARG 63.A NH2 ASP 61.A OD2 no hydrogen 2.963 N/A MET 64.A N.A ASP 61.A O no hydrogen 2.837 N/A MET 64.A N.B ASP 61.A O no hydrogen 2.840 N/A GLY 65.A N CYS 62.A O no hydrogen 3.293 N/A TYR 68.A N MET 81.A O no hydrogen 2.851 N/A ILE 69.A N PRO 5.A O no hydrogen 2.897 N/A GLN 70.A N LYS 79.A O no hydrogen 2.946 N/A GLN 70.A NE2 THR 7.A OG1 no hydrogen 3.028 N/A ASP 72.A N LEU 77.A O no hydrogen 2.997 N/A LYS 74.A N ASP 72.A OD1 no hydrogen 2.943 N/A GLY 76.A N PRO 73.A O no hydrogen 3.345 N/A LEU 77.A N ASP 72.A O no hydrogen 3.298 N/A TYR 78.A N TYR 56.A OH no hydrogen 2.899 N/A TYR 78.A OH ILE 11.A O no hydrogen 3.039 N/A LYS 79.A N GLN 70.A O no hydrogen 2.910 N/A LYS 79.A NZ ASP 72.A OD2 no hydrogen 2.610 N/A MET 81.A N TYR 68.A O no hydrogen 2.828 N/A GLU 83.A N ASN 66.A O no hydrogen 3.085 N/A ASP 85.A N GLU 83.A OE2 no hydrogen 3.240 N/A LYS 88.A N ASP 85.A OD1 no hydrogen 2.944 N/A PHE 89.A N ASP 85.A O no hydrogen 3.076 N/A PHE 89.A N GLY 86.A O no hydrogen 2.998 N/A GLU 90.A N GLY 86.A O no hydrogen 3.159 N/A ASN 91.A N ALA 87.A O no hydrogen 2.997 N/A ILE 92.A N LYS 88.A O no hydrogen 3.309 N/A VAL 93.A N PHE 89.A O no hydrogen 2.961 N/A HIS 94.A N GLU 90.A O no hydrogen 2.964 N/A ASN 95.A N ASN 91.A O no hydrogen 3.292 N/A PHE 96.A N ILE 92.A O no hydrogen 3.118 N/A LYS 97.A N VAL 93.A O no hydrogen 3.203 N/A GLU 98.A N HIS 94.A O no hydrogen 3.068 N/A ARG 99.A N ASN 95.A O no hydrogen 2.910 N/A GLN 100.A N LYS 97.A O no hydrogen 2.400 N/A MET 101.A N PHE 96.A O no hydrogen 3.041 N/A VAL 103.A N GLY 32.A O no hydrogen 2.967 N/A SER 104.A OG ASP 35.A OD2 no hydrogen 2.628 N/A TYR 105.A N LYS 34.A O no hydrogen 2.736 N/A TYR 105.A OH ASP 18.A OD2 no hydrogen 2.510 N/A LYS 107.A N TYR 105.A O no hydrogen 2.938 N/A ASP 111.A N ILE 108.A O no hydrogen 2.773 N/A THR 113.A N ASP 111.A OD2 no hydrogen 3.125 N/A THR 113.A OG1 ASP 111.A OD1 no hydrogen 2.550 N/A TRP 114.A NE1 VAL 41.A O.A no hydrogen 2.816 N/A TRP 114.A NE1 VAL 41.A O.B no hydrogen 2.759 N/A ASN 116.A N ASP 112.A O no hydrogen 2.725 N/A LEU 117.A N THR 113.A O no hydrogen 2.746 N/A THR 118.A N TYR 115.A O no hydrogen 3.190 N/A THR 118.A OG1 TRP 114.A O no hydrogen 2.573 N/A PHE 120.A N GLN 208.A OE1 no hydrogen 2.808 N/A VAL 121.A N THR 118.A O no hydrogen 2.803 N/A LYS 125.A NZ GLN 122.A OE1.B no hydrogen 2.959 N/A LYS 125.A NZ ASP 124.A OD2 no hydrogen 3.547 N/A LYS 125.A NZ ASN 202.A OD1 no hydrogen 3.235 N/A ILE 126.A N GLN 122.A O.A no hydrogen 3.242 N/A ILE 126.A N GLN 122.A O.B no hydrogen 3.234 N/A ARG 127.A N MET 123.A O no hydrogen 3.090 N/A ARG 127.A NH1 ASP 133.A O no hydrogen 3.425 N/A ARG 127.A NH1 ASN 135.A O no hydrogen 2.410 N/A LYS 128.A N LYS 125.A O no hydrogen 3.195 N/A ILE 129.A N ILE 126.A O no hydrogen 2.967 N/A VAL 130.A N ILE 126.A O no hydrogen 2.716 N/A ARG 131.A NE ASN 160.A OD1.B no hydrogen 3.112 N/A ARG 131.A NH2 ASN 160.A OD1.B no hydrogen 2.633 N/A GLU 134.A N GLU 134.A OE1 no hydrogen 2.635 N/A ASN 135.A N LYS 132.A O no hydrogen 3.104 N/A SER 138.A N TRP 59.A O no hydrogen 2.884 N/A TYR 139.A OH ASP 141.A OD2 no hydrogen 2.812 N/A VAL 140.A N GLY 57.A O no hydrogen 2.924 N/A SER 142.A N ARG 55.A O no hydrogen 3.008 N/A SER 142.A OG ARG 55.A O no hydrogen 3.080 N/A SER 142.A OG PHE 217.A O no hydrogen 3.175 N/A SER 143.A N ASP 141.A OD1 no hydrogen 3.012 N/A SER 143.A OG ASP 141.A OD1 no hydrogen 3.350 N/A MET 144.A N ASP 141.A O no hydrogen 3.436 N/A THR 145.A OG1 ASN 150.A OD1 no hydrogen 3.135 N/A THR 146.A N GLU 149.A OE2 no hydrogen 2.651 N/A VAL 147.A N LEU 159.A O no hydrogen 2.926 N/A GLN 148.A NE2 ILE 164.A O no hydrogen 2.896 N/A GLU 149.A N THR 146.A OG1 no hydrogen 3.170 N/A ASN 150.A N THR 146.A O no hydrogen 3.018 N/A GLU 151.A N VAL 147.A O no hydrogen 3.043 N/A LEU 152.A N GLN 148.A O no hydrogen 3.335 N/A SER 158.A OG ASP 154.A O no hydrogen 3.549 N/A SER 158.A OG PRO 155.A O no hydrogen 3.157 N/A LEU 159.A N THR 145.A O no hydrogen 2.924 N/A ASN 160.A N.A ILE 129.A O no hydrogen 3.030 N/A ASN 160.A N.B ILE 129.A O no hydrogen 3.013 N/A ASN 160.A ND2.A ILE 129.A O no hydrogen 3.209 N/A TYR 161.A OH SER 222.A OG no hydrogen 2.804 N/A THR 162.A N GLU 206.A OE2 no hydrogen 2.723 N/A THR 162.A OG1 GLU 206.A OE1 no hydrogen 2.783 N/A THR 162.A OG1 GLU 206.A OE2 no hydrogen 3.445 N/A ASN 165.A N TYR 187.A OH no hydrogen 2.934 N/A LYS 167.A N ASN 165.A OD1 no hydrogen 3.197 N/A SER 168.A OG ASN 165.A O no hydrogen 3.218 N/A SER 168.A OG GLU 170.A OE1 no hydrogen 3.403 N/A ARG 169.A NH1 ILE 172.A O no hydrogen 2.930 N/A ALA 171.A N SER 168.A O no hydrogen 3.096 N/A ILE 172.A N ARG 169.A O no hydrogen 3.341 N/A ARG 173.A N ASP 180.A OD2 no hydrogen 3.167 N/A ARG 173.A NE ASP 180.A OD2 no hydrogen 2.855 N/A ARG 173.A NH2 ASP 180.A OD1 no hydrogen 2.774 N/A ARG 173.A NH2 ASP 180.A OD2 no hydrogen 3.538 N/A GLY 175.A N GLU 177.A OE2 no hydrogen 3.025 N/A HIS 176.A N ARG 173.A O no hydrogen 2.924 N/A HIS 176.A ND1 GLU 179.A OE1 no hydrogen 2.324 N/A GLU 177.A N GLU 177.A OE1 no hydrogen 2.606 N/A ASP 180.A N HIS 176.A O no hydrogen 2.808 N/A PHE 181.A N GLU 177.A O no hydrogen 3.260 N/A LEU 182.A N MET 178.A O no hydrogen 3.026 N/A ASP 183.A N GLU 179.A O no hydrogen 2.811 N/A LYS 184.A N SER 235.A O no hydrogen 3.053 N/A LYS 184.A NZ PHE 181.A O no hydrogen 2.624 N/A SER 185.A N ASP 183.A OD1 no hydrogen 3.171 N/A SER 185.A OG ASP 183.A OD1 no hydrogen 2.841 N/A SER 185.A OG THR 238.A O no hydrogen 3.426 N/A LEU 188.A N LYS 184.A O no hydrogen 3.041 N/A ASN 189.A N SER 185.A O no hydrogen 2.769 N/A ASN 189.A ND2 THR 238.A O no hydrogen 2.807 N/A THR 190.A N TYR 186.A O.A no hydrogen 3.149 N/A THR 190.A N TYR 186.A O.B no hydrogen 2.972 N/A VAL 191.A N TYR 186.A O.A no hydrogen 3.147 N/A VAL 191.A N TYR 186.A O.B no hydrogen 3.272 N/A MET 192.A N TYR 187.A O no hydrogen 2.627 N/A LEU 193.A N LEU 188.A O no hydrogen 2.596 N/A GLN 194.A N.A ASN 189.A O no hydrogen 2.869 N/A GLN 194.A N.B ASN 189.A O no hydrogen 2.863 N/A GLY 195.A N THR 190.A O no hydrogen 2.679 N/A ILE 196.A N VAL 191.A O no hydrogen 3.157 N/A ILE 196.A N MET 192.A O no hydrogen 3.135 N/A PHE 197.A N MET 192.A O no hydrogen 2.707 N/A LYS 198.A NZ GLY 195.A O no hydrogen 2.504 N/A ASN 202.A N ASN 199.A OD1 no hydrogen 2.746 N/A ASN 202.A ND2 PHE 197.A O no hydrogen 2.637 N/A TYR 203.A OH MET 229.A O no hydrogen 3.017 N/A PHE 204.A N SER 200.A O no hydrogen 2.932 N/A GLY 205.A N SER 201.A O no hydrogen 2.802 N/A GLU 206.A N ASN 202.A O no hydrogen 2.995 N/A LEU 207.A N TYR 203.A O no hydrogen 2.806 N/A GLN 208.A N PHE 204.A O no hydrogen 2.834 N/A PHE 209.A N GLY 205.A O no hydrogen 2.817 N/A ALA 210.A N GLU 206.A O no hydrogen 2.958 N/A PHE 211.A N LEU 207.A O no hydrogen 3.141 N/A LEU 212.A N GLN 208.A O no hydrogen 3.233 N/A ASN 213.A N PHE 209.A O no hydrogen 2.982 N/A ASN 213.A ND2.A TYR 161.A OH no hydrogen 3.007 N/A ASN 213.A ND2.B TYR 161.A OH no hydrogen 3.117 N/A ALA 214.A N ALA 210.A O no hydrogen 3.080 N/A MET 215.A N PHE 211.A O no hydrogen 2.946 N/A PHE 216.A N LEU 212.A O no hydrogen 2.753 N/A PHE 217.A N ASN 213.A O no hydrogen 3.010 N/A ASN 219.A N ASN 213.A O no hydrogen 3.498 N/A ASN 219.A ND2 ASP 141.A O no hydrogen 2.911 N/A ASN 219.A ND2 MET 144.A O no hydrogen 2.943 N/A SER 222.A N ASN 219.A O no hydrogen 3.211 N/A SER 222.A N ASN 219.A OD1 no hydrogen 3.172 N/A SER 222.A OG TYR 161.A OH no hydrogen 2.804 N/A SER 222.A OG ASN 219.A OD1 no hydrogen 2.932 N/A SER 223.A N ASN 219.A O no hydrogen 3.254 N/A LEU 224.A N TYR 220.A O no hydrogen 3.068 N/A GLN 225.A N GLY 221.A O no hydrogen 2.885 N/A GLN 225.A NE2 THR 162.A O no hydrogen 2.788 N/A TRP 226.A N SER 222.A O no hydrogen 2.877 N/A TRP 226.A NE1 GLN 254.A OE1 no hydrogen 2.911 N/A HIS 227.A N SER 223.A O no hydrogen 3.067 N/A HIS 227.A ND1 SER 223.A O no hydrogen 2.964 N/A ALA 228.A N LEU 224.A O no hydrogen 3.115 N/A MET 229.A N GLN 225.A O no hydrogen 3.002 N/A ILE 230.A N TRP 226.A O no hydrogen 3.056 N/A GLU 231.A N HIS 227.A O no hydrogen 2.632 N/A LEU 232.A N ALA 228.A O no hydrogen 2.867 N/A ILE 233.A N MET 229.A O no hydrogen 3.507 N/A CYS 234.A N ILE 230.A O no hydrogen 2.974 N/A CYS 234.A SG ILE 230.A O no hydrogen 3.671 N/A SER 235.A N GLU 231.A O no hydrogen 2.779 N/A SER 235.A OG GLU 231.A O no hydrogen 2.951 N/A SER 236.A N ILE 233.A O no hydrogen 2.926 N/A SER 236.A OG LEU 232.A O no hydrogen 2.947 N/A ALA 237.A N ASP 183.A OD1 no hydrogen 2.875 N/A THR 238.A N SER 185.A OG no hydrogen 2.776 N/A LEU 244.A N PRO 240.A O no hydrogen 3.226 N/A ASP 245.A N LYS 241.A O no hydrogen 3.058 N/A LYS 246.A N HIS 242.A O no hydrogen 2.812 N/A LYS 246.A NZ GLU 119.A OE2 no hydrogen 2.703 N/A LEU 247.A N MET 243.A O no hydrogen 2.575 N/A ASP 248.A N LEU 244.A O no hydrogen 3.000 N/A GLU 249.A N ASP 245.A O no hydrogen 3.450 N/A ILE 250.A N LYS 246.A O no hydrogen 2.912 N/A LEU 251.A N LEU 247.A O no hydrogen 2.946 N/A TYR 252.A N ASP 248.A O no hydrogen 3.186 N/A TYR 253.A N GLU 249.A O no hydrogen 3.385 N/A GLN 254.A N ILE 250.A O no hydrogen 3.088 N/A ILE 255.A N LEU 251.A O no hydrogen 2.809 N/A LYS 256.A N TYR 252.A O no hydrogen 2.683 N/A THR 257.A N TYR 253.A O no hydrogen 2.982 N/A THR 257.A OG1 TYR 253.A O no hydrogen 2.626 N/A LEU 258.A N GLN 254.A O no hydrogen 3.140 N/A GLU 260.A N GLU 260.A OE1 no hydrogen 2.441 N/A TYR 262.A N PRO 259.A O no hydrogen 3.222 N/A SER 263.A OG GLU 260.A O no hydrogen 3.251 N/A ASP 264.A N ASP 264.A OD1 no hydrogen 2.515 N/A LEU 266.A N TYR 262.A O no hydrogen 3.283 N/A ASN 268.A N HIS 227.A NE2 no hydrogen 2.854 N/A ARG 270.A NH1 GLU 231.A OE2 no hydrogen 2.620 N/A ARG 270.A NH2 GLU 231.A OE1 no hydrogen 2.988 N/A VAL 271.A N ASN 268.A OD1 no hydrogen 3.397 N/A TRP 272.A N ASN 268.A O no hydrogen 3.125 N/A ASN 273.A N GLU 269.A O no hydrogen 3.010 N/A ASN 273.A ND2 GLU 269.A O no hydrogen 2.899 N/A ASN 273.A ND2 LEU 299.A O no hydrogen 3.654 N/A ILE 274.A N ARG 270.A O no hydrogen 2.999 N/A CYS 275.A N VAL 271.A O no hydrogen 2.707 N/A LEU 276.A N TRP 272.A O no hydrogen 2.921 N/A TYR 277.A N ASN 273.A O no hydrogen 3.053 N/A TYR 277.A OH GLU 293.A OE1 no hydrogen 3.016 N/A SER 278.A N ASN 273.A O no hydrogen 3.259 N/A SER 278.A N ILE 274.A O no hydrogen 3.218 N/A SER 279.A N ILE 274.A O no hydrogen 2.458 N/A SER 279.A OG CYS 234.A O no hydrogen 3.082 N/A SER 279.A OG CYS 275.A O no hydrogen 3.047 N/A GLN 281.A N SER 279.A OG no hydrogen 2.933 N/A GLN 281.A NE2 SER 236.A O no hydrogen 3.106 N/A LYS 282.A N SER 279.A O no hydrogen 3.356 N/A SER 284.A N GLN 281.A O no hydrogen 2.642 N/A SER 284.A OG GLN 281.A OE1 no hydrogen 2.686 N/A ASN 287.A N ASP 248.A OD2 no hydrogen 2.823 N/A ASN 287.A ND2 GLU 249.A OE2 no hydrogen 3.074 N/A THR 288.A N ASP 248.A OD1 no hydrogen 2.549 N/A THR 288.A OG1 ASP 248.A O no hydrogen 2.867 N/A THR 288.A OG1 ASP 248.A OD1 no hydrogen 2.704 N/A GLU 289.A N LEU 285.A O no hydrogen 2.780 N/A LYS 290.A N HIS 286.A O no hydrogen 3.107 N/A ILE 291.A N ASN 287.A O no hydrogen 2.946 N/A MET 292.A N THR 288.A O no hydrogen 2.986 N/A GLU 293.A N GLU 289.A O no hydrogen 3.062 N/A ASN 294.A N LYS 290.A O no hydrogen 3.273 N/A ASN 294.A ND2 LYS 290.A O no hydrogen 3.232 N/A LYS 295.A N ILE 291.A O no hydrogen 3.060 N/A LYS 295.A N MET 292.A O no hydrogen 3.324 N/A LYS 295.A NZ ILE 255.A O no hydrogen 3.000 N/A LYS 295.A NZ LYS 256.A O no hydrogen 3.245 N/A LYS 295.A NZ LEU 258.A O no hydrogen 3.099 N/A LYS 295.A NZ TYR 296.A OH no hydrogen 3.247 N/A TYR 296.A N MET 292.A O no hydrogen 2.582 N/A LEU 300.A N PRO 297.A O no hydrogen 3.225 N/A