Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4kip_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 5.A N VAL 16.A O no hydrogen 2.909 N/A TYR 5.A OH TYR 20.A O no hydrogen 2.900 N/A GLN 7.A N TRP 14.A O no hydrogen 2.867 N/A LEU 9.A N THR 12.A O no hydrogen 3.008 N/A THR 12.A N LEU 9.A O no hydrogen 3.190 N/A THR 12.A OG1 LEU 9.A O no hydrogen 2.735 N/A THR 12.A OG1 ASN 10.A O no hydrogen 3.374 N/A TRP 14.A N GLN 7.A O no hydrogen 2.779 N/A GLU 15.A N TYR 99.A OH no hydrogen 3.168 N/A VAL 16.A N TYR 5.A O no hydrogen 3.170 N/A GLU 18.A N THR 3.A O no hydrogen 2.815 N/A ARG 19.A NE ASP 39.A OD1 no hydrogen 2.815 N/A ARG 19.A NH2 ASP 39.A OD1 no hydrogen 3.033 N/A ARG 19.A NH2 ASP 39.A OD2 no hydrogen 3.326 N/A TYR 20.A OH ASP 84.A OD2 no hydrogen 3.134 N/A GLN 21.A N PHE 38.A O no hydrogen 2.806 N/A SER 24.A N ALA 36.A O no hydrogen 2.866 N/A VAL 26.A N VAL 34.A O no hydrogen 3.370 N/A ALA 30.A N ASP 164.A OD1 no hydrogen 3.131 N/A SER 33.A N LYS 50.A O no hydrogen 3.044 N/A CYS 35.A N VAL 48.A O no hydrogen 2.764 N/A ALA 36.A N SER 24.A O no hydrogen 2.768 N/A ALA 37.A N VAL 46.A O no hydrogen 3.031 N/A PHE 38.A N GLN 21.A O no hydrogen 2.759 N/A ASP 39.A N LEU 44.A O no hydrogen 2.855 N/A THR 40.A N ARG 19.A O no hydrogen 2.688 N/A THR 40.A OG1 ARG 19.A O no hydrogen 3.412 N/A THR 42.A N ASP 39.A OD2 no hydrogen 3.163 N/A THR 42.A OG1 ASP 39.A OD2 no hydrogen 2.689 N/A GLY 43.A N ASP 39.A O no hydrogen 3.087 N/A VAL 46.A N ALA 37.A O no hydrogen 2.784 N/A ALA 47.A N THR 102.A O no hydrogen 2.812 N/A VAL 48.A N CYS 35.A O no hydrogen 2.763 N/A LYS 49.A N LEU 100.A O no hydrogen 2.731 N/A LYS 49.A NZ ALA 30.A O no hydrogen 2.795 N/A LYS 49.A NZ GLU 67.A OE2 no hydrogen 2.823 N/A LYS 50.A N SER 33.A O no hydrogen 2.970 N/A LYS 50.A NZ ILE 13.A O no hydrogen 2.881 N/A LEU 51.A N VAL 98.A O no hydrogen 3.108 N/A SER 52.A N TYR 31.A O no hydrogen 3.092 N/A ARG 53.A NH2 GLN 56.A OE1 no hydrogen 3.157 N/A HIS 60.A N SER 57.A OG no hydrogen 3.034 N/A HIS 60.A ND1 ARG 53.A O no hydrogen 2.741 N/A ALA 61.A N SER 57.A O no hydrogen 2.966 N/A LYS 62.A N ILE 58.A O no hydrogen 3.290 N/A LYS 62.A NZ GLU 313.A O no hydrogen 3.117 N/A ARG 63.A N ILE 59.A O no hydrogen 3.086 N/A THR 64.A N HIS 60.A O no hydrogen 2.814 N/A THR 64.A OG1 PRO 54.A O no hydrogen 3.160 N/A THR 64.A OG1 HIS 60.A O no hydrogen 2.723 N/A TYR 65.A N ALA 61.A O no hydrogen 3.361 N/A ARG 66.A N LYS 62.A O no hydrogen 3.012 N/A ARG 66.A NE GLU 313.A OE1 no hydrogen 3.318 N/A ARG 66.A NE GLU 313.A OE2 no hydrogen 3.083 N/A ARG 66.A NH2 GLU 313.A OE1 no hydrogen 3.447 N/A GLU 67.A N ARG 63.A O no hydrogen 2.908 N/A LEU 68.A N THR 64.A O no hydrogen 3.222 N/A ARG 69.A N TYR 65.A O no hydrogen 3.100 N/A ARG 69.A NH1 TYR 65.A OH no hydrogen 2.810 N/A ARG 69.A NH2 ASP 309.A O no hydrogen 2.774 N/A LEU 70.A N ARG 66.A O no hydrogen 3.089 N/A LEU 71.A N GLU 67.A O no hydrogen 3.143 N/A LYS 72.A N LEU 68.A O no hydrogen 3.252 N/A LYS 72.A NZ GLU 329.A O no hydrogen 3.052 N/A LYS 72.A NZ GLU 329.A OE1 no hydrogen 3.221 N/A HIS 73.A N LEU 70.A O no hydrogen 3.075 N/A HIS 73.A NE2 ASP 306.A O no hydrogen 2.809 N/A MET 74.A N LEU 70.A O no hydrogen 3.108 N/A LYS 75.A N TYR 136.A OH no hydrogen 2.793 N/A ASN 78.A N HIS 76.A ND1 no hydrogen 3.066 N/A ASN 78.A ND2 GLN 129.A OE1 no hydrogen 3.462 N/A ASN 78.A ND2 LEU 160.A O no hydrogen 3.275 N/A ILE 80.A N ILE 162.A O no hydrogen 3.236 N/A LEU 83.A N VAL 101.A O no hydrogen 3.035 N/A ASP 84.A N VAL 101.A O no hydrogen 3.443 N/A PHE 86.A N TYR 99.A O no hydrogen 3.191 N/A THR 87.A OG1 ASP 97.A O no hydrogen 2.806 N/A ALA 89.A N THR 87.A OG1 no hydrogen 3.383 N/A ARG 90.A N GLU 94.A OE2 no hydrogen 2.843 N/A SER 91.A OG GLU 93.A OE1 no hydrogen 3.521 N/A PHE 95.A N LEU 92.A O no hydrogen 3.201 N/A TYR 99.A N PHE 86.A O no hydrogen 3.022 N/A LEU 100.A N LYS 49.A O no hydrogen 2.846 N/A VAL 101.A N ASP 84.A O no hydrogen 2.847 N/A THR 102.A N ALA 47.A O no hydrogen 2.896 N/A THR 102.A OG1 HIS 103.A O no hydrogen 3.364 N/A LEU 104.A N ARG 45.A O no hydrogen 3.249 N/A ALA 107.A N VAL 154.A O no hydrogen 2.889 N/A LEU 109.A N LEU 152.A O no hydrogen 3.163 N/A ASN 111.A N ASP 108.A O no hydrogen 3.173 N/A CYS 115.A N GLN 116.A OE1 no hydrogen 3.220 N/A GLN 116.A N VAL 113.A O no hydrogen 3.322 N/A HIS 122.A N THR 119.A O no hydrogen 3.139 N/A VAL 123.A N THR 119.A O no hydrogen 3.185 N/A GLN 124.A N ASP 120.A O no hydrogen 3.095 N/A GLN 124.A NE2 ASP 120.A OD2 no hydrogen 3.467 N/A PHE 125.A N ASP 121.A O no hydrogen 3.113 N/A LEU 126.A N HIS 122.A O no hydrogen 2.995 N/A ILE 127.A N VAL 123.A O no hydrogen 2.864 N/A TYR 128.A N GLN 124.A O no hydrogen 3.015 N/A TYR 128.A OH GLU 302.A OE2 no hydrogen 2.712 N/A GLN 129.A N PHE 125.A O no hydrogen 3.224 N/A GLN 129.A NE2 PHE 125.A O no hydrogen 3.005 N/A GLN 129.A NE2 CYS 158.A O no hydrogen 2.960 N/A ILE 130.A N LEU 126.A O no hydrogen 2.995 N/A LEU 131.A N ILE 127.A O no hydrogen 2.944 N/A ARG 132.A N TYR 128.A O no hydrogen 2.923 N/A ARG 132.A NE ASP 301.A O no hydrogen 2.767 N/A ARG 132.A NH1 ASN 78.A OD1 no hydrogen 2.797 N/A ARG 132.A NH2 GLU 77.A OE1 no hydrogen 3.562 N/A ARG 132.A NH2 GLU 77.A OE2 no hydrogen 3.433 N/A ARG 132.A NH2 ASP 301.A O no hydrogen 2.821 N/A ARG 132.A NH2 ASP 301.A OD1 no hydrogen 3.121 N/A GLY 133.A N GLN 129.A O no hydrogen 2.959 N/A LEU 134.A N ILE 130.A O no hydrogen 2.798 N/A LYS 135.A N LEU 131.A O no hydrogen 2.851 N/A LYS 135.A NZ GLU 302.A O no hydrogen 3.040 N/A TYR 136.A N ARG 132.A O no hydrogen 3.397 N/A TYR 136.A OH HIS 73.A O no hydrogen 3.315 N/A ILE 137.A N GLY 133.A O no hydrogen 3.188 N/A HIS 138.A N LEU 134.A O no hydrogen 2.858 N/A HIS 138.A ND1 ILE 142.A O no hydrogen 2.924 N/A SER 139.A N LYS 135.A O no hydrogen 3.070 N/A SER 139.A OG LYS 135.A O no hydrogen 3.545 N/A SER 139.A OG TYR 136.A O no hydrogen 2.800 N/A ALA 140.A N ILE 137.A O no hydrogen 3.388 N/A ASP 141.A N HIS 138.A O no hydrogen 3.172 N/A ILE 142.A N ILE 137.A O no hydrogen 3.163 N/A HIS 144.A N ASP 190.A OD2 no hydrogen 2.881 N/A HIS 144.A NE2 LEU 163.A O no hydrogen 2.746 N/A ARG 145.A N ASP 190.A OD1 no hydrogen 3.025 N/A ASP 146.A N HIS 144.A ND1 no hydrogen 3.244 N/A LYS 148.A N ASN 151.A OD1 no hydrogen 3.028 N/A LYS 148.A NZ ASP 146.A OD2 no hydrogen 2.838 N/A ASN 151.A N LYS 148.A O no hydrogen 3.023 N/A ASN 151.A ND2 ASP 146.A O no hydrogen 2.815 N/A LEU 152.A N PRO 149.A O no hydrogen 3.434 N/A ALA 153.A N LYS 161.A O no hydrogen 2.789 N/A VAL 154.A N ALA 107.A O no hydrogen 2.766 N/A CYS 158.A SG HIS 122.A NE2 no hydrogen 3.715 N/A GLU 159.A N ASN 155.A OD1 no hydrogen 2.937 N/A LEU 160.A N GLN 129.A OE1 no hydrogen 2.926 N/A LYS 161.A N ALA 153.A O no hydrogen 2.758 N/A LYS 161.A NZ GLU 77.A O no hydrogen 2.779 N/A ILE 162.A N ASN 78.A O no hydrogen 2.909 N/A LEU 163.A N ASN 151.A O no hydrogen 2.802 N/A TRP 172.A NE1 GLY 210.A O no hydrogen 2.818 N/A TYR 173.A OH GLU 200.A OE1 no hydrogen 3.413 N/A TYR 173.A OH GLU 200.A OE2 no hydrogen 2.691 N/A ARG 174.A N ARG 171.A O no hydrogen 3.240 N/A GLU 177.A N GLU 177.A OE1 no hydrogen 2.796 N/A LEU 180.A N PRO 176.A O no hydrogen 2.832 N/A ASN 181.A ND2 MET 179.A O no hydrogen 3.391 N/A TRP 182.A N GLU 177.A O no hydrogen 3.046 N/A ASN 186.A ND2 SER 278.A O no hydrogen 2.947 N/A GLN 187.A NE2 HIS 138.A O no hydrogen 2.876 N/A THR 188.A OG1 ASN 186.A OD1 no hydrogen 2.708 N/A THR 188.A OG1 SER 278.A O no hydrogen 3.440 N/A ASP 190.A N GLN 187.A O no hydrogen 3.245 N/A ILE 191.A N THR 188.A O no hydrogen 3.224 N/A TRP 192.A N THR 188.A O no hydrogen 3.346 N/A SER 193.A OG TYR 173.A O no hydrogen 3.024 N/A SER 193.A OG VAL 189.A O no hydrogen 3.332 N/A VAL 194.A N ASP 190.A O no hydrogen 2.954 N/A GLY 195.A N ILE 191.A O no hydrogen 2.856 N/A CYS 196.A N TRP 192.A O no hydrogen 2.966 N/A CYS 196.A SG TRP 192.A O no hydrogen 3.262 N/A ILE 197.A N SER 193.A O no hydrogen 2.914 N/A MET 198.A N VAL 194.A O no hydrogen 2.806 N/A ALA 199.A N GLY 195.A O no hydrogen 3.148 N/A GLU 200.A N CYS 196.A O no hydrogen 3.258 N/A LEU 201.A N ILE 197.A O no hydrogen 3.047 N/A LEU 202.A N MET 198.A O no hydrogen 3.247 N/A THR 203.A N ALA 199.A O no hydrogen 2.983 N/A THR 203.A OG1 ALA 199.A O no hydrogen 2.733 N/A THR 203.A OG1 ARG 205.A O no hydrogen 2.730 N/A GLY 204.A N GLU 200.A O no hydrogen 2.832 N/A ARG 205.A N THR 203.A OG1 no hydrogen 3.240 N/A THR 206.A OG1 GLU 200.A OE2 no hydrogen 3.457 N/A GLY 210.A N GLN 216.A OE1 no hydrogen 3.213 N/A ASP 215.A N ASP 212.A OD1 no hydrogen 3.063 N/A GLN 216.A N ASP 212.A O no hydrogen 3.057 N/A GLN 216.A NE2 PHE 208.A O no hydrogen 2.929 N/A LYS 218.A N ILE 214.A O no hydrogen 3.256 N/A LEU 219.A N ASP 215.A O no hydrogen 3.078 N/A ILE 220.A N GLN 216.A O no hydrogen 3.219 N/A LEU 221.A N LEU 217.A O no hydrogen 3.328 N/A THR 226.A N MET 250.A O no hydrogen 2.843 N/A THR 226.A OG1 GLN 249.A OE1 no hydrogen 2.713 N/A THR 226.A OG1 MET 250.A O no hydrogen 3.079 N/A LEU 231.A N GLY 228.A O no hydrogen 3.471 N/A ARG 241.A NE ILE 235.A O no hydrogen 3.344 N/A ARG 241.A NH2 ILE 235.A O no hydrogen 2.778 N/A ASN 242.A N SER 239.A O no hydrogen 3.340 N/A TYR 243.A N ALA 240.A O no hydrogen 3.131 N/A ILE 244.A N ALA 240.A O no hydrogen 3.345 N/A GLN 245.A N ARG 241.A O no hydrogen 3.417 N/A LEU 247.A N TYR 243.A O no hydrogen 3.010 N/A MET 253.A N LEU 223.A O no hydrogen 3.191 N/A ASN 254.A ND2 ASN 257.A OD1 no hydrogen 2.804 N/A PHE 255.A N GLU 271.A OE2 no hydrogen 3.473 N/A ASN 257.A N ASN 254.A O no hydrogen 3.368 N/A PHE 259.A N PHE 255.A O no hydrogen 2.865 N/A LEU 265.A N ASN 263.A OD1 no hydrogen 3.146 N/A ALA 266.A N ASN 263.A O no hydrogen 3.034 N/A VAL 267.A N ASN 263.A O no hydrogen 3.165 N/A ASP 268.A N PRO 264.A O no hydrogen 3.105 N/A LEU 269.A N LEU 265.A O no hydrogen 3.022 N/A LEU 270.A N ALA 266.A O no hydrogen 3.185 N/A GLU 271.A N VAL 267.A O no hydrogen 2.920 N/A LYS 272.A N ASP 268.A O no hydrogen 2.937 N/A LYS 272.A NZ ASP 268.A OD1 no hydrogen 2.814 N/A MET 273.A N LEU 269.A O no hydrogen 2.817 N/A MET 273.A N LEU 270.A O no hydrogen 3.173 N/A LEU 274.A N LEU 270.A O no hydrogen 2.791 N/A VAL 275.A N MET 273.A O no hydrogen 2.824 N/A SER 278.A OG GLU 177.A OE2 no hydrogen 2.913 N/A LYS 280.A N ASP 277.A O no hydrogen 3.208 N/A ARG 281.A NE VAL 275.A O no hydrogen 2.831 N/A ARG 281.A NH1 GLU 177.A OE1 no hydrogen 3.462 N/A ARG 281.A NH1 GLU 177.A OE2 no hydrogen 2.815 N/A ARG 281.A NH1 THR 188.A O no hydrogen 2.871 N/A ARG 281.A NH2 GLU 177.A OE1 no hydrogen 2.947 N/A ARG 281.A NH2 VAL 275.A O no hydrogen 3.049 N/A THR 283.A N GLN 286.A OE1 no hydrogen 3.211 N/A GLN 286.A N THR 283.A OG1 no hydrogen 3.384 N/A ALA 287.A N THR 283.A O no hydrogen 2.843 N/A LEU 288.A N ALA 284.A O no hydrogen 3.149 N/A HIS 290.A NE2 ASP 268.A OD2 no hydrogen 2.815 N/A TYR 292.A N HIS 290.A ND1 no hydrogen 3.093 N/A TYR 292.A OH ASP 120.A OD1 no hydrogen 3.426 N/A PHE 293.A N HIS 290.A O no hydrogen 3.076 N/A ALA 294.A N ALA 291.A O no hydrogen 3.169 N/A TYR 296.A N PHE 293.A O no hydrogen 3.228 N/A TYR 296.A OH ASP 121.A OD1 no hydrogen 3.281 N/A TYR 296.A OH ASP 121.A OD2 no hydrogen 2.736 N/A HIS 297.A N PHE 293.A O no hydrogen 2.782 N/A ASP 298.A N GLU 302.A OE2 no hydrogen 2.846 N/A ASP 301.A N ASP 298.A O no hydrogen 2.959 N/A ALA 305.A N SER 139.A OG no hydrogen 2.768 N/A SER 311.A OG ASP 309.A OD1 no hydrogen 2.720 N/A GLU 313.A N GLN 310.A O no hydrogen 2.943 N/A SER 314.A N SER 311.A O no hydrogen 3.304 N/A SER 314.A OG SER 311.A O no hydrogen 2.915 N/A ARG 315.A N PHE 312.A O no hydrogen 3.103 N/A LEU 318.A N GLU 321.A OE1 no hydrogen 3.199 N/A GLU 321.A N LEU 318.A O no hydrogen 3.126 N/A TRP 322.A N LEU 318.A O no hydrogen 3.112 N/A LYS 323.A N ILE 319.A O no hydrogen 2.799 N/A SER 324.A N ASP 320.A O no hydrogen 3.233 N/A SER 324.A N GLU 321.A O no hydrogen 3.278 N/A LEU 325.A N GLU 321.A O no hydrogen 3.289 N/A THR 326.A N TRP 322.A O no hydrogen 3.124 N/A THR 326.A OG1 TRP 322.A O no hydrogen 2.732 N/A TYR 327.A N LYS 323.A O no hydrogen 3.203 N/A ASP 328.A N SER 324.A O no hydrogen 3.275 N/A GLU 329.A N LEU 325.A O no hydrogen 3.342 N/A VAL 330.A N THR 326.A O no hydrogen 3.004 N/A ILE 331.A N TYR 327.A O no hydrogen 3.207 N/A SER 332.A N ASP 328.A O no hydrogen 2.805 N/A SER 332.A OG ASP 328.A O no hydrogen 2.775 N/A