Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7jus_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 4.A N GLU 7.A OE1 no hydrogen 2.586 N/A GLN 6.A N GLN 6.A OE1 no hydrogen 2.690 N/A GLU 7.A N PHE 4.A O no hydrogen 3.329 N/A GLU 16.A N ARG 33.A O no hydrogen 3.028 N/A GLY 18.A N HIS 31.A O no hydrogen 2.542 N/A ILE 21.A N VAL 29.A O no hydrogen 3.075 N/A GLN 28.A N LEU 41.A O no hydrogen 2.868 N/A TYR 30.A N ILE 39.A O no hydrogen 2.679 N/A HIS 31.A N GLU 19.A O no hydrogen 2.771 N/A GLY 32.A N VAL 37.A O no hydrogen 2.880 N/A ARG 33.A N GLU 16.A O no hydrogen 2.945 N/A TRP 34.A N GLY 35.A O no hydrogen 2.697 N/A TRP 34.A NE1 PRO 11.A O no hydrogen 3.108 N/A VAL 37.A N GLY 32.A O no hydrogen 2.981 N/A ALA 38.A N THR 87.A O no hydrogen 2.854 N/A ILE 39.A N TYR 30.A O no hydrogen 2.898 N/A ARG 40.A N ILE 85.A O no hydrogen 2.895 N/A ARG 40.A NH1 PHE 26.A O no hydrogen 2.974 N/A ARG 40.A NH2 ASP 151.A OD2 no hydrogen 2.932 N/A LEU 41.A N GLN 28.A O no hydrogen 2.692 N/A ILE 42.A N LEU 83.A O no hydrogen 2.996 N/A ILE 44.A N PRO 81.A O no hydrogen 2.858 N/A ASN 48.A ND2 GLU 45.A OE2 no hydrogen 2.412 N/A GLN 51.A N ASN 48.A OD1 no hydrogen 3.435 N/A LEU 52.A N ASN 48.A O no hydrogen 2.889 N/A LYS 53.A N GLU 49.A O no hydrogen 3.258 N/A ALA 54.A N ASP 50.A O no hydrogen 3.140 N/A PHE 55.A N GLN 51.A O no hydrogen 2.925 N/A LYS 56.A N LEU 52.A O no hydrogen 3.096 N/A LYS 56.A NZ SER 2.A O no hydrogen 2.883 N/A LYS 56.A NZ GLU 7.A OE2 no hydrogen 3.554 N/A ARG 57.A N LYS 53.A O no hydrogen 2.958 N/A VAL 59.A N PHE 55.A O no hydrogen 3.240 N/A MET 60.A N LYS 56.A O no hydrogen 3.330 N/A TYR 62.A N GLU 58.A O no hydrogen 3.231 N/A ARG 63.A N VAL 59.A O no hydrogen 3.274 N/A ARG 63.A N MET 60.A O no hydrogen 3.044 N/A ARG 63.A NH2 GLU 7.A O no hydrogen 2.682 N/A GLN 64.A N ALA 61.A O no hydrogen 3.003 N/A THR 65.A N TYR 62.A O no hydrogen 3.014 N/A THR 65.A OG1 TYR 62.A O no hydrogen 2.625 N/A ARG 66.A N TYR 124.A OH no hydrogen 2.935 N/A ASN 69.A N HIS 67.A ND1 no hydrogen 2.880 N/A ASN 69.A ND2 GLU 117.A OE1 no hydrogen 3.002 N/A ASN 69.A ND2 VAL 147.A O no hydrogen 3.027 N/A VAL 70.A N HIS 67.A O no hydrogen 2.935 N/A VAL 71.A N ILE 149.A O no hydrogen 2.930 N/A MET 74.A N ILE 86.A O no hydrogen 2.875 N/A GLY 75.A N ILE 86.A O no hydrogen 3.148 N/A CYS 77.A N ALA 84.A O no hydrogen 3.265 N/A MET 78.A N ILE 3.A O no hydrogen 2.449 N/A SER 79.A N HIS 82.A O no hydrogen 2.996 N/A HIS 82.A N SER 79.A O no hydrogen 2.654 N/A LEU 83.A N ILE 42.A O no hydrogen 3.038 N/A ALA 84.A N CYS 77.A O no hydrogen 3.126 N/A ILE 85.A N ARG 40.A O no hydrogen 2.944 N/A ILE 86.A N GLY 75.A O no hydrogen 2.716 N/A THR 87.A N ALA 38.A O no hydrogen 2.896 N/A THR 87.A OG1 SER 88.A O no hydrogen 3.094 N/A SER 88.A N LEU 72.A O no hydrogen 2.832 N/A ARG 93.A N TYR 142.A O no hydrogen 3.381 N/A ARG 93.A NH1 ASP 101.A OD1 no hydrogen 3.405 N/A ARG 93.A NH2 ASP 101.A OD1 no hydrogen 2.985 N/A THR 94.A OG1 SER 97.A OG no hydrogen 3.290 N/A LEU 95.A N VAL 140.A O no hydrogen 2.763 N/A TYR 96.A N SER 137.A O no hydrogen 2.952 N/A SER 97.A N THR 94.A OG1 no hydrogen 3.250 N/A SER 97.A OG THR 94.A OG1 no hydrogen 3.290 N/A VAL 98.A N THR 94.A O no hydrogen 3.176 N/A VAL 99.A N LEU 95.A O no hydrogen 3.052 N/A ARG 100.A N TYR 96.A O no hydrogen 3.407 N/A ARG 100.A NH1 TYR 96.A O no hydrogen 3.314 N/A ARG 100.A NH1 GLU 210.A OE2 no hydrogen 2.625 N/A ARG 100.A NH2 GLU 210.A OE2 no hydrogen 3.050 N/A ARG 100.A NH2 GLU 215.A OE2 no hydrogen 3.424 N/A ASP 101.A N VAL 98.A O no hydrogen 3.134 N/A LYS 103.A N ASP 101.A OD2 no hydrogen 3.012 N/A ILE 104.A N ASP 101.A O no hydrogen 3.181 N/A LYS 110.A N ASP 107.A OD2 no hydrogen 2.968 N/A LYS 110.A NZ VAL 105.A O no hydrogen 3.192 N/A THR 111.A N ASP 107.A O no hydrogen 2.924 N/A THR 111.A OG1 ASP 107.A O no hydrogen 3.469 N/A THR 111.A OG1 VAL 108.A O no hydrogen 2.930 N/A ARG 112.A N VAL 108.A O no hydrogen 3.110 N/A GLN 113.A N ASN 109.A O no hydrogen 3.003 N/A ILE 114.A N LYS 110.A O no hydrogen 2.810 N/A ALA 115.A N THR 111.A O no hydrogen 3.007 N/A GLN 116.A N ARG 112.A O no hydrogen 2.959 N/A GLN 116.A NE2 ARG 112.A O no hydrogen 3.665 N/A GLU 117.A N GLN 113.A O no hydrogen 3.146 N/A ILE 118.A N ILE 114.A O no hydrogen 3.164 N/A VAL 119.A N ALA 115.A O no hydrogen 3.084 N/A LYS 120.A N GLN 116.A O no hydrogen 3.080 N/A LYS 120.A NZ GLU 117.A OE2 no hydrogen 2.582 N/A GLY 121.A N GLU 117.A O no hydrogen 3.169 N/A MET 122.A N ILE 118.A O no hydrogen 2.974 N/A GLY 123.A N VAL 119.A O no hydrogen 2.740 N/A TYR 124.A N LYS 120.A O no hydrogen 3.046 N/A LEU 125.A N GLY 121.A O no hydrogen 3.028 N/A HIS 126.A N MET 122.A O no hydrogen 2.860 N/A ALA 127.A N GLY 123.A O no hydrogen 2.700 N/A LYS 128.A N TYR 124.A O no hydrogen 3.031 N/A GLY 129.A N HIS 126.A O no hydrogen 2.675 N/A ILE 130.A N LEU 125.A O no hydrogen 2.749 N/A HIS 132.A N ASP 200.A OD1 no hydrogen 2.841 N/A HIS 132.A NE2 THR 150.A O no hydrogen 2.808 N/A LYS 133.A N ASP 200.A OD2 no hydrogen 3.231 N/A LYS 133.A NZ SER 156.A OG no hydrogen 2.523 N/A ASP 134.A N HIS 132.A ND1 no hydrogen 3.064 N/A LYS 136.A NZ ASP 134.A OD1 no hydrogen 3.396 N/A LYS 136.A NZ ASP 134.A OD2 no hydrogen 2.918 N/A SER 137.A OG GLU 210.A OE1 no hydrogen 3.063 N/A SER 137.A OG GLU 210.A OE2 no hydrogen 2.745 N/A ASN 139.A N LYS 136.A O no hydrogen 2.744 N/A ASN 139.A ND2 ASP 134.A O no hydrogen 3.086 N/A VAL 140.A N SER 137.A O no hydrogen 3.492 N/A PHE 141.A N VAL 148.A O no hydrogen 2.941 N/A TYR 142.A N ARG 93.A O no hydrogen 2.831 N/A ASP 143.A N LYS 146.A O no hydrogen 3.027 N/A LYS 146.A N ASP 143.A O no hydrogen 3.108 N/A LYS 146.A NZ LYS 91.A O no hydrogen 3.532 N/A VAL 148.A N PHE 141.A O no hydrogen 2.986 N/A ILE 149.A N ASN 69.A O no hydrogen 2.928 N/A THR 150.A N ASN 139.A O no hydrogen 3.012 N/A GLY 153.A N HIS 132.A O no hydrogen 3.072 N/A SER 156.A N GLY 153.A O no hydrogen 3.385 N/A ILE 157.A N LEU 154.A O no hydrogen 2.918 N/A SER 158.A N PHE 155.A O no hydrogen 3.103 N/A LEU 161.A N GLU 190.A OE2 no hydrogen 3.084 N/A GLN 162.A N GLU 190.A OE2 no hydrogen 3.345 N/A TRP 172.A N GLN 169.A O no hydrogen 3.080 N/A CYS 174.A SG GLY 171.A O no hydrogen 3.282 N/A CYS 174.A SG HIS 175.A ND1 no hydrogen 3.505 N/A HIS 175.A N TRP 172.A O no hydrogen 2.867 N/A HIS 175.A ND1 GLY 171.A O no hydrogen 2.571 N/A LEU 176.A N LEU 173.A O no hydrogen 3.029 N/A GLU 179.A N GLU 179.A OE2 no hydrogen 2.706 N/A ILE 180.A N ALA 177.A O no hydrogen 2.944 N/A ILE 181.A N ALA 177.A O no hydrogen 2.997 N/A ARG 182.A N PRO 178.A O no hydrogen 2.915 N/A ARG 182.A NH2 GLY 231.A O no hydrogen 2.513 N/A GLN 183.A N ILE 180.A O no hydrogen 2.814 N/A GLN 183.A NE2 GLU 179.A O no hydrogen 3.602 N/A LEU 184.A N ILE 181.A O no hydrogen 3.435 N/A ASP 187.A N SER 185.A OG no hydrogen 2.740 N/A THR 188.A N SER 185.A O no hydrogen 3.104 N/A GLU 190.A N GLU 190.A OE1 no hydrogen 2.305 N/A LYS 192.A N GLU 189.A O no hydrogen 2.893 N/A LYS 192.A NZ GLU 189.A OE2 no hydrogen 2.836 N/A LYS 192.A NZ ASP 191.A OD1 no hydrogen 2.986 N/A LYS 192.A NZ ASP 191.A OD2 no hydrogen 3.091 N/A PHE 195.A N LEU 193.A O no hydrogen 2.659 N/A SER 196.A N SER 199.A OG no hydrogen 3.323 N/A LYS 197.A NZ HIS 126.A O no hydrogen 3.335 N/A SER 199.A N SER 196.A OG no hydrogen 3.034 N/A SER 199.A OG SER 196.A O no hydrogen 2.986 N/A ASP 200.A N SER 196.A O no hydrogen 3.262 N/A VAL 201.A N LYS 197.A O no hydrogen 3.134 N/A PHE 202.A N HIS 198.A O no hydrogen 3.071 N/A ALA 203.A N SER 199.A O no hydrogen 3.071 N/A LEU 204.A N ASP 200.A O no hydrogen 3.067 N/A GLY 205.A N VAL 201.A O no hydrogen 3.041 N/A THR 206.A N PHE 202.A O no hydrogen 3.218 N/A THR 206.A OG1 CYS 174.A O no hydrogen 2.455 N/A ILE 207.A N ALA 203.A O no hydrogen 3.297 N/A TRP 208.A N LEU 204.A O no hydrogen 2.924 N/A TRP 208.A NE1 ILE 247.A O no hydrogen 2.880 N/A TYR 209.A N GLY 205.A O no hydrogen 3.049 N/A GLU 210.A N THR 206.A O no hydrogen 2.897 N/A LEU 211.A N ILE 207.A O no hydrogen 2.675 N/A HIS 212.A N TRP 208.A O no hydrogen 3.204 N/A HIS 212.A N TYR 209.A O no hydrogen 3.017 N/A ALA 213.A N TYR 209.A O no hydrogen 2.760 N/A ARG 214.A N GLU 210.A O no hydrogen 2.760 N/A ARG 214.A NE VAL 99.A O no hydrogen 2.580 N/A ARG 214.A NH1 VAL 98.A O no hydrogen 3.100 N/A ARG 214.A NH1 VAL 99.A O no hydrogen 2.928 N/A ARG 214.A NH1 ILE 104.A O no hydrogen 3.064 N/A ARG 214.A NH2 ILE 104.A O no hydrogen 2.808 N/A TRP 216.A N GLU 215.A OE2 no hydrogen 3.093 N/A GLN 221.A N PHE 218.A O no hydrogen 3.241 N/A ILE 226.A N PRO 222.A O no hydrogen 3.007 N/A ILE 227.A N ALA 223.A O no hydrogen 2.854 N/A TRP 228.A N GLU 224.A O no hydrogen 3.110 N/A GLN 229.A N ALA 225.A O no hydrogen 2.979 N/A GLN 229.A NE2 ALA 225.A O no hydrogen 3.263 N/A MET 230.A N ILE 226.A O no hydrogen 2.865 N/A GLY 231.A N ILE 227.A O no hydrogen 2.809 N/A THR 232.A N TRP 228.A O no hydrogen 3.089 N/A GLY 233.A N GLN 229.A O no hydrogen 3.117 N/A GLY 233.A N MET 230.A O no hydrogen 3.152 N/A MET 234.A N GLN 229.A O no hydrogen 2.924 N/A LYS 235.A NZ GLY 233.A O no hydrogen 3.410 N/A SER 239.A N ASN 237.A OD1 no hydrogen 2.526 N/A SER 239.A OG ASN 237.A OD1 no hydrogen 2.483 N/A GLN 240.A NE2 ASN 237.A O no hydrogen 2.750 N/A ILE 241.A N LEU 238.A O no hydrogen 3.392 N/A GLY 242.A N SER 239.A O no hydrogen 3.002 N/A MET 243.A N LEU 238.A O no hydrogen 3.267 N/A LYS 245.A NZ ASP 249.A OD2 no hydrogen 3.558 N/A GLU 246.A N GLU 246.A OE1 no hydrogen 2.319 N/A SER 248.A N GLY 244.A O no hydrogen 3.211 N/A ASP 249.A N LYS 245.A O no hydrogen 2.720 N/A ASP 249.A N GLU 246.A O no hydrogen 3.139 N/A LEU 252.A N SER 248.A O no hydrogen 3.267 N/A PHE 253.A N ASP 249.A O no hydrogen 3.021 N/A CYS 254.A N ILE 250.A O no hydrogen 2.713 N/A CYS 254.A SG ILE 250.A O no hydrogen 3.565 N/A TRP 255.A N LEU 251.A O no hydrogen 2.786 N/A ALA 256.A N PHE 253.A O no hydrogen 3.171 N/A GLU 260.A N GLU 258.A OE1 no hydrogen 3.250 N/A GLU 261.A N GLU 258.A O no hydrogen 3.140 N/A ARG 262.A N GLN 259.A O no hydrogen 2.705 N/A ARG 262.A NH1 ALA 256.A O no hydrogen 2.611 N/A ARG 262.A NH2 GLU 179.A OE2 no hydrogen 3.008 N/A LYS 267.A N THR 264.A OG1 no hydrogen 3.425 N/A LEU 268.A N THR 264.A O no hydrogen 3.040 N/A MET 269.A N PHE 265.A O no hydrogen 3.031 N/A ASP 270.A N THR 266.A O no hydrogen 3.408 N/A MET 271.A N LYS 267.A O no hydrogen 3.036 N/A LEU 272.A N LEU 268.A O no hydrogen 2.959 N/A GLU 273.A N MET 269.A O no hydrogen 3.124 N/A LYS 274.A N MET 271.A O no hydrogen 3.344 N/A LYS 274.A NZ ASP 270.A OD2 no hydrogen 2.777 N/A LEU 275.A N LEU 272.A O no hydrogen 3.481 N/A