Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4di4_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A N LEU 34.A O no hydrogen 3.252 N/A LEU 4.A N SER 36.A O no hydrogen 2.955 N/A LYS 5.A N ASP 58.A OD2 no hydrogen 3.208 N/A LYS 5.A NZ PRO 56.A O no hydrogen 3.547 N/A ILE 6.A N LYS 38.A O no hydrogen 3.141 N/A SER 8.A N TYR 40.A O no hydrogen 2.410 N/A ALA 10.A N SER 8.A OG no hydrogen 3.026 N/A SER 14.A N PRO 11.A O no hydrogen 3.325 N/A SER 14.A OG PRO 11.A O no hydrogen 2.368 N/A TRP 16.A NE1 ASN 118.A O no hydrogen 3.062 N/A THR 18.A N SER 14.A O no hydrogen 3.196 N/A GLU 19.A N ILE 15.A O no hydrogen 2.700 N/A LEU 20.A N TRP 16.A O no hydrogen 2.840 N/A LYS 21.A N THR 18.A O no hydrogen 3.213 N/A LYS 22.A N THR 18.A O no hydrogen 3.102 N/A LYS 22.A NZ GLU 26.A OE1 no hydrogen 2.870 N/A LEU 23.A N GLU 19.A O no hydrogen 3.038 N/A SER 24.A N LEU 20.A O no hydrogen 3.184 N/A SER 24.A OG MET 37.A O no hydrogen 3.230 N/A ALA 25.A N LYS 21.A O no hydrogen 2.725 N/A GLU 26.A N LYS 22.A O no hydrogen 2.965 N/A TRP 27.A N LEU 23.A O no hydrogen 2.664 N/A TRP 27.A NE1 MET 225.A O no hydrogen 2.810 N/A SER 28.A N SER 24.A O no hydrogen 3.030 N/A GLU 29.A N ALA 25.A O no hydrogen 3.260 N/A ILE 30.A N GLU 26.A O no hydrogen 3.335 N/A THR 31.A N TRP 27.A O no hydrogen 2.825 N/A THR 31.A OG1 SER 28.A O no hydrogen 2.979 N/A THR 31.A OG1 VAL 35.A O no hydrogen 3.506 N/A GLY 32.A N GLU 29.A O no hydrogen 2.950 N/A GLY 33.A N SER 28.A O no hydrogen 2.686 N/A VAL 35.A N THR 31.A OG1 no hydrogen 2.795 N/A SER 36.A N VAL 2.A O no hydrogen 3.258 N/A MET 37.A N SER 24.A OG no hydrogen 3.172 N/A LYS 38.A N LEU 4.A O no hydrogen 2.835 N/A TYR 40.A N ILE 6.A O no hydrogen 2.911 N/A MET 42.A N SER 8.A O no hydrogen 3.207 N/A SER 44.A N ASP 41.A OD1 no hydrogen 3.284 N/A SER 44.A OG ASP 41.A OD1 no hydrogen 3.386 N/A LEU 45.A N ASP 41.A O no hydrogen 3.369 N/A GLY 46.A N SER 43.A O no hydrogen 3.154 N/A GLY 47.A N MET 42.A O no hydrogen 2.626 N/A GLY 51.A N GLY 47.A O no hydrogen 3.161 N/A ILE 52.A N ARG 49.A O no hydrogen 2.894 N/A ARG 53.A NH2 GLU 50.A OE1 no hydrogen 3.413 N/A LYS 54.A N GLY 51.A O no hydrogen 3.042 N/A LEU 55.A N ILE 52.A O no hydrogen 2.975 N/A LEU 57.A N LYS 54.A O no hydrogen 3.215 N/A ALA 60.A N LEU 208.A O no hydrogen 2.477 N/A VAL 61.A N ALA 7.A O no hydrogen 2.943 N/A PHE 62.A N GLY 206.A O no hydrogen 2.739 N/A SER 63.A N GLU 48.A OE2 no hydrogen 2.491 N/A SER 63.A OG GLU 48.A OE1 no hydrogen 2.782 N/A SER 63.A OG GLU 48.A OE2 no hydrogen 3.062 N/A CYS 64.A SG VAL 204.A O no hydrogen 3.788 N/A LEU 65.A N SER 63.A OG no hydrogen 3.277 N/A LEU 67.A N SER 63.A O no hydrogen 2.864 N/A SER 68.A N CYS 64.A O no hydrogen 3.210 N/A SER 68.A OG CYS 64.A O no hydrogen 2.673 N/A GLU 69.A N GLY 66.A O no hydrogen 2.885 N/A LEU 70.A N GLY 66.A O no hydrogen 3.247 N/A SER 74.A N ALA 71.A O no hydrogen 2.229 N/A SER 74.A OG ALA 71.A O no hydrogen 2.535 N/A THR 78.A N GLY 75.A O no hydrogen 2.963 N/A THR 78.A OG1 GLY 75.A O no hydrogen 2.839 N/A LEU 79.A N ILE 76.A O no hydrogen 2.570 N/A SER 80.A N TYR 77.A O no hydrogen 3.344 N/A SER 80.A OG TYR 77.A O no hydrogen 3.122 N/A VAL 81.A N THR 78.A O no hydrogen 3.213 N/A PHE 83.A N ILE 200.A O no hydrogen 2.716 N/A LEU 84.A N VAL 81.A O no hydrogen 3.068 N/A ASP 90.A N ASN 87.A OD1 no hydrogen 2.926 N/A LEU 91.A N ASN 87.A O no hydrogen 3.089 N/A GLU 92.A N GLU 88.A O no hydrogen 3.217 N/A ARG 93.A N LYS 89.A O no hydrogen 3.123 N/A VAL 94.A N ASP 90.A O no hydrogen 3.155 N/A LEU 95.A N LEU 91.A O no hydrogen 2.993 N/A LEU 95.A N GLU 92.A O no hydrogen 2.971 N/A HIS 96.A N GLU 92.A O no hydrogen 2.949 N/A GLU 97.A N ARG 93.A O no hydrogen 2.965 N/A ARG 99.A N HIS 96.A O no hydrogen 3.353 N/A ARG 99.A NE ASP 103.A OD1 no hydrogen 3.137 N/A ARG 99.A NH2 VAL 113.A O no hydrogen 2.911 N/A ASP 101.A N LEU 98.A O no hydrogen 3.267 N/A LEU 102.A N LEU 98.A O no hydrogen 3.430 N/A ASP 103.A N ARG 99.A O no hydrogen 2.777 N/A ARG 104.A N GLU 100.A O no hydrogen 2.908 N/A PHE 106.A N ASP 103.A O no hydrogen 2.702 N/A ARG 107.A N ARG 104.A O no hydrogen 2.893 N/A ALA 108.A N ARG 104.A O no hydrogen 3.226 N/A PHE 111.A N PHE 106.A O no hydrogen 2.614 N/A ARG 112.A N ILE 209.A O no hydrogen 3.105 N/A ILE 114.A N MET 207.A O no hydrogen 3.074 N/A THR 115.A OG1 TRP 116.A O no hydrogen 3.373 N/A THR 115.A OG1 ALA 229.A O no hydrogen 3.063 N/A TRP 116.A NE1 ASP 103.A OD1 no hydrogen 3.291 N/A THR 117.A N ILE 205.A O no hydrogen 2.389 N/A ALA 119.A N ALA 203.A O no hydrogen 2.631 N/A GLY 120.A N ASN 118.A OD1 no hydrogen 2.972 N/A LEU 122.A N CYS 201.A O no hydrogen 3.260 N/A SER 123.A N SER 178.A O no hydrogen 2.719 N/A SER 123.A OG TRP 121.A O no hydrogen 3.508 N/A SER 123.A OG LEU 196.A O no hydrogen 3.130 N/A TYR 125.A N PHE 176.A O no hydrogen 2.941 N/A TYR 125.A OH HIS 180.A ND1 no hydrogen 2.171 N/A THR 126.A N TYR 194.A O no hydrogen 2.725 N/A THR 126.A OG1 ALA 128.A O no hydrogen 2.645 N/A THR 126.A OG1 GLN 139.A OE1 no hydrogen 2.590 N/A THR 126.A OG1 ASP 174.A O no hydrogen 3.525 N/A ARG 127.A N ASP 174.A O no hydrogen 2.633 N/A ALA 128.A N THR 126.A OG1 no hydrogen 3.316 N/A ALA 131.A N GLN 135.A OE1 no hydrogen 2.852 N/A GLN 135.A N SER 132.A OG no hydrogen 3.192 N/A LEU 136.A N SER 132.A O no hydrogen 3.103 N/A LYS 137.A N LEU 133.A O no hydrogen 2.798 N/A LYS 137.A NZ CYS 152.A O no hydrogen 2.485 N/A LYS 137.A NZ GLU 272.A OE1 no hydrogen 3.345 N/A LYS 137.A NZ ASP 276.A OD2 no hydrogen 3.141 N/A LYS 138.A N GLY 134.A O no hydrogen 3.131 N/A LYS 138.A N GLN 135.A O no hydrogen 2.955 N/A GLN 139.A N LEU 136.A O no hydrogen 2.936 N/A GLN 139.A NE2 ALA 128.A O no hydrogen 3.514 N/A THR 140.A N ASP 174.A OD2 no hydrogen 2.945 N/A THR 140.A OG1 ASP 155.A OD1 no hydrogen 2.833 N/A ILE 141.A N ASP 155.A O no hydrogen 3.234 N/A ALA 142.A N GLY 175.A O no hydrogen 2.954 N/A LEU 143.A N LYS 157.A O no hydrogen 3.189 N/A THR 147.A OG1 VAL 144.A O no hydrogen 2.743 N/A ARG 150.A N GLY 146.A O no hydrogen 3.165 N/A ILE 151.A N CYS 148.A O no hydrogen 2.927 N/A CYS 152.A SG CYS 148.A O no hydrogen 3.928 N/A GLY 153.A N ARG 150.A O no hydrogen 3.103 N/A PHE 154.A N PHE 149.A O no hydrogen 3.179 N/A ASP 155.A N LYS 137.A O no hydrogen 3.170 N/A LYS 157.A N ILE 141.A O no hydrogen 3.113 N/A LEU 167.A N ARG 163.A O no hydrogen 2.839 N/A LEU 168.A N LEU 164.A O no hydrogen 2.823 N/A LYS 169.A N ALA 165.A O no hydrogen 2.881 N/A ALA 170.A N LEU 167.A O no hydrogen 3.318 N/A GLY 171.A N LEU 168.A O no hydrogen 2.820 N/A SER 172.A N LEU 167.A O no hydrogen 2.909 N/A ASP 174.A N THR 140.A O no hydrogen 2.827 N/A PHE 176.A N TYR 125.A O no hydrogen 2.816 N/A LEU 177.A N ALA 142.A O no hydrogen 2.900 N/A SER 178.A N SER 123.A O no hydrogen 3.069 N/A HIS 180.A ND1 TYR 125.A OH no hydrogen 2.171 N/A HIS 180.A NE2 ASP 197.A OD1 no hydrogen 2.982 N/A THR 183.A N VAL 179.A O no hydrogen 3.234 N/A THR 183.A OG1 HIS 180.A O no hydrogen 3.303 N/A TRP 184.A N HIS 180.A O no hydrogen 2.947 N/A ALA 185.A N LEU 181.A O no hydrogen 2.832 N/A THR 186.A N PHE 182.A O no hydrogen 2.969 N/A THR 186.A OG1 PHE 182.A O no hydrogen 2.904 N/A GLY 187.A N TRP 184.A O no hydrogen 2.812 N/A PHE 188.A N THR 186.A OG1 no hydrogen 3.033 N/A TYR 189.A N THR 183.A O no hydrogen 3.096 N/A ARG 190.A N GLY 187.A O no hydrogen 2.979 N/A TYR 191.A N PHE 188.A O no hydrogen 3.017 N/A ILE 192.A N TYR 189.A O no hydrogen 3.091 N/A SER 193.A OG ARG 127.A O no hydrogen 3.354 N/A TYR 194.A N THR 126.A O no hydrogen 2.804 N/A ALA 195.A N SER 257.A O no hydrogen 3.106 N/A LEU 196.A N PHE 124.A O no hydrogen 2.984 N/A ASP 197.A N VAL 259.A O no hydrogen 2.830 N/A LYS 199.A NZ GLU 88.A OE1 no hydrogen 2.369 N/A LYS 199.A NZ GLU 241.A OE2 no hydrogen 3.531 N/A CYS 201.A SG SER 80.A O no hydrogen 3.333 N/A ALA 203.A N ASN 118.A OD1 no hydrogen 3.029 N/A ALA 203.A N GLY 120.A O no hydrogen 2.987 N/A ILE 205.A N THR 117.A O no hydrogen 2.581 N/A MET 207.A N THR 115.A O no hydrogen 3.349 N/A LEU 208.A N ALA 60.A O no hydrogen 2.585 N/A ILE 209.A N ARG 112.A O no hydrogen 3.105 N/A SER 210.A OG SER 213.A OG no hydrogen 2.675 N/A SER 213.A N SER 210.A OG no hydrogen 3.076 N/A SER 213.A OG SER 210.A OG no hydrogen 2.675 N/A TRP 214.A N SER 210.A O no hydrogen 2.881 N/A ALA 215.A N GLY 212.A O no hydrogen 2.647 N/A ARG 216.A N SER 213.A O no hydrogen 3.230 N/A TYR 221.A N PRO 218.A O no hydrogen 3.004 N/A HIS 222.A N SER 219.A O no hydrogen 3.297 N/A HIS 222.A NE2 ILE 217.A O no hydrogen 2.760 N/A MET 225.A N TYR 221.A O no hydrogen 3.172 N/A LEU 226.A N HIS 222.A O no hydrogen 2.856 N/A GLN 227.A N ASP 223.A O no hydrogen 2.852 N/A GLN 227.A NE2 ASP 223.A OD1 no hydrogen 3.565 N/A ALA 228.A N MET 225.A O no hydrogen 2.815 N/A ALA 229.A N MET 225.A O no hydrogen 3.271 N/A THR 230.A OG1 LEU 226.A O no hydrogen 3.555 N/A THR 230.A OG1 GLN 227.A O no hydrogen 2.994 N/A ARG 231.A N GLN 227.A O no hydrogen 3.194 N/A ARG 231.A NE GLU 26.A OE1 no hydrogen 3.138 N/A VAL 232.A N ALA 228.A O no hydrogen 3.130 N/A ARG 233.A N ALA 229.A O no hydrogen 3.188 N/A ARG 233.A NE GLU 92.A OE1 no hydrogen 3.081 N/A ARG 233.A NH2 GLU 92.A OE1 no hydrogen 3.525 N/A GLN 234.A N THR 230.A O no hydrogen 3.281 N/A GLN 234.A N ARG 231.A O no hydrogen 3.113 N/A GLN 234.A NE2 GLU 92.A OE2 no hydrogen 2.808 N/A ARG 235.A N ARG 231.A O no hydrogen 3.073 N/A ARG 235.A NH2 GLU 26.A OE2 no hydrogen 3.472 N/A LEU 236.A N VAL 232.A O no hydrogen 3.066 N/A ALA 237.A N ARG 233.A O no hydrogen 3.289 N/A ASN 238.A N GLN 234.A O no hydrogen 3.247 N/A ASN 238.A N ARG 235.A O no hydrogen 3.135 N/A ASN 239.A N ARG 235.A O no hydrogen 2.903 N/A LEU 240.A N LEU 236.A O no hydrogen 2.560 N/A GLU 241.A N ASN 238.A O no hydrogen 2.745 N/A THR 242.A N ASN 238.A O no hydrogen 3.227 N/A THR 242.A OG1 ASN 238.A O no hydrogen 3.553 N/A LEU 243.A N ASN 239.A O no hydrogen 2.864 N/A ASP 244.A N LEU 240.A O no hydrogen 2.967 N/A ARG 245.A N GLU 241.A O no hydrogen 3.011 N/A GLU 246.A N THR 242.A O no hydrogen 2.935 N/A CYS 247.A N LEU 243.A O no hydrogen 2.924 N/A CYS 247.A SG LEU 243.A O no hydrogen 3.221 N/A SER 248.A N ASP 244.A O no hydrogen 2.903 N/A SER 248.A OG ASP 197.A OD1 no hydrogen 3.151 N/A ASN 249.A N ARG 245.A O no hydrogen 2.866 N/A ASN 250.A N GLU 246.A O no hydrogen 2.948 N/A ILE 251.A N CYS 247.A O no hydrogen 2.999 N/A GLN 252.A N SER 248.A O no hydrogen 2.785 N/A LYS 253.A N ASN 249.A O no hydrogen 2.647 N/A ALA 254.A N ASN 250.A O no hydrogen 3.219 N/A ALA 254.A N ILE 251.A O no hydrogen 3.270 N/A GLY 255.A N GLN 252.A O no hydrogen 2.810 N/A VAL 256.A N ILE 251.A O no hydrogen 3.342 N/A SER 257.A N SER 193.A O no hydrogen 3.085 N/A SER 257.A OG SER 193.A O no hydrogen 3.317 N/A VAL 259.A N ALA 195.A O no hydrogen 2.793 N/A HIS 260.A NE2 ASP 197.A OD2 no hydrogen 3.136 N/A LEU 261.A N THR 198.A OG1 no hydrogen 2.879 N/A THR 262.A N GLU 265.A OE1 no hydrogen 2.673 N/A THR 262.A OG1 GLN 264.A OE1 no hydrogen 2.843 N/A THR 262.A OG1 GLU 265.A OE1 no hydrogen 3.106 N/A GLU 265.A N THR 262.A OG1 no hydrogen 3.379 N/A ILE 266.A N THR 262.A O no hydrogen 2.789 N/A GLN 267.A N PRO 263.A O no hydrogen 2.956 N/A GLU 268.A N GLN 264.A O no hydrogen 3.125 N/A TRP 269.A N GLU 265.A O no hydrogen 2.882 N/A ARG 270.A N ILE 266.A O no hydrogen 2.959 N/A THR 271.A N GLN 267.A O no hydrogen 3.073 N/A THR 271.A OG1 GLN 267.A O no hydrogen 3.506 N/A GLU 272.A N GLU 268.A O no hydrogen 3.333 N/A PHE 273.A N TRP 269.A O no hydrogen 2.896 N/A ALA 274.A N ARG 270.A O no hydrogen 2.759 N/A ALA 275.A N THR 271.A O no hydrogen 3.172 N/A VAL 277.A N PHE 273.A O no hydrogen 3.195 N/A ARG 279.A NH1 ASP 276.A OD1 no hydrogen 2.861 N/A ILE 280.A N ASP 276.A O no hydrogen 2.911 N/A GLN 281.A N VAL 277.A O no hydrogen 3.166 N/A GLN 281.A NE2 VAL 277.A O no hydrogen 3.251 N/A ALA 282.A N ARG 279.A O no hydrogen 3.154 N/A ARG 283.A N ARG 279.A O no hydrogen 3.048 N/A LEU 284.A N ILE 280.A O no hydrogen 2.561 N/A LEU 288.A N PRO 285.A O no hydrogen 3.334 N/A ASN 289.A N THR 78.A OG1 no hydrogen 2.713 N/A THR 291.A N ASN 289.A OD1 no hydrogen 3.178 N/A LEU 292.A N ASN 289.A OD1 no hydrogen 3.123 N/A TYR 293.A N ASN 289.A O no hydrogen 2.554 N/A GLU 294.A N MET 290.A O no hydrogen 3.062 N/A LYS 295.A N THR 291.A O no hydrogen 2.950 N/A ILE 296.A N LEU 292.A O no hydrogen 3.105 N/A ILE 296.A N TYR 293.A O no hydrogen 3.080 N/A LYS 297.A N TYR 293.A O no hydrogen 3.302 N/A LYS 297.A NZ GLU 294.A OE1 no hydrogen 3.388 N/A HIS 298.A N GLU 294.A O no hydrogen 2.900 N/A LEU 299.A N LYS 295.A O no hydrogen 3.069 N/A LEU 300.A N ILE 296.A O no hydrogen 3.123 N/A