Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3r5b_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A NE2 SER 2.A O no hydrogen 3.497 N/A GLN 1.A NE2 ALA 93.A O no hydrogen 2.799 N/A PHE 4.A N LEU 92.A O no hydrogen 2.724 N/A SER 5.A N LEU 92.A O no hydrogen 3.150 N/A SER 5.A OG LEU 28.A O no hydrogen 2.944 N/A LEU 6.A N LEU 28.A O no hydrogen 3.118 N/A ALA 7.A N THR 90.A O no hydrogen 3.188 N/A GLY 9.A N VAL 88.A O no hydrogen 2.712 N/A VAL 10.A N PHE 23.A O no hydrogen 3.040 N/A GLY 11.A N PRO 86.A O no hydrogen 3.122 N/A THR 12.A N GLU 21.A O no hydrogen 3.006 N/A ASN 14.A N ALA 18.A O no hydrogen 3.119 N/A ASN 14.A ND2 ASP 142.A OD2 no hydrogen 3.016 N/A ARG 15.A N GLU 145.A OE2 no hydrogen 3.266 N/A GLU 17.A N ASN 14.A O no hydrogen 3.197 N/A ALA 18.A N ASN 14.A OD1 no hydrogen 2.827 N/A LEU 20.A N THR 12.A O no hydrogen 3.091 N/A PHE 23.A N VAL 10.A O no hydrogen 2.786 N/A TYR 24.A N HIS 109.A NE2 no hydrogen 3.399 N/A TYR 24.A OH ALA 102.A O no hydrogen 2.770 N/A LEU 28.A N LEU 6.A O no hydrogen 3.040 N/A LYS 30.A N PHE 4.A O no hydrogen 2.635 N/A SER 33.A OG GLU 34.A OE2 no hydrogen 3.473 N/A GLU 34.A N GLU 34.A OE2 no hydrogen 2.775 N/A VAL 36.A N SER 32.A O no hydrogen 3.335 N/A ALA 37.A N SER 33.A O no hydrogen 2.946 N/A ALA 38.A N GLU 34.A O no hydrogen 3.278 N/A VAL 39.A N VAL 36.A O no hydrogen 3.115 N/A ALA 40.A N VAL 36.A O no hydrogen 2.915 N/A LEU 43.A N VAL 39.A O no hydrogen 3.265 N/A GLY 44.A N ALA 40.A O no hydrogen 2.923 N/A TYR 45.A N ALA 40.A O no hydrogen 2.993 N/A TYR 45.A OH GLY 48.A O no hydrogen 2.834 N/A ASN 49.A ND2 GLU 94.A O no hydrogen 3.168 N/A GLN 50.A N LEU 91.A O no hydrogen 3.024 N/A LEU 52.A N ALA 89.A O no hydrogen 2.861 N/A SER 56.A OG ALA 81.A O no hydrogen 2.658 N/A ALA 59.A N THR 55.A O no hydrogen 3.127 N/A TYR 60.A N SER 56.A O no hydrogen 3.438 N/A GLN 61.A N GLN 57.A O no hydrogen 3.141 N/A LEU 62.A N GLN 58.A O no hydrogen 2.714 N/A ALA 63.A N ALA 59.A O no hydrogen 2.739 N/A ASP 64.A N TYR 60.A O no hydrogen 2.942 N/A ALA 65.A N GLN 61.A O no hydrogen 2.989 N/A LEU 66.A N LEU 62.A O no hydrogen 3.237 N/A LYS 67.A N ASP 64.A O no hydrogen 3.303 N/A ILE 69.A N LEU 66.A O no hydrogen 3.007 N/A ASP 70.A N LEU 66.A O no hydrogen 2.862 N/A GLN 73.A N ASP 70.A OD1 no hydrogen 3.298 N/A GLN 73.A NE2 LEU 26.A O no hydrogen 3.283 N/A SER 74.A N ASP 70.A O no hydrogen 3.238 N/A SER 74.A OG ALA 63.A O no hydrogen 2.570 N/A ALA 75.A N ALA 71.A O no hydrogen 2.894 N/A LEU 76.A N ALA 72.A O no hydrogen 3.152 N/A LEU 77.A N GLN 73.A O no hydrogen 3.104 N/A SER 78.A N SER 74.A O no hydrogen 3.216 N/A SER 78.A OG SER 74.A O no hydrogen 3.498 N/A ARG 79.A N ALA 75.A O no hydrogen 3.369 N/A LEU 80.A N LEU 76.A O no hydrogen 2.967 N/A ALA 81.A N LEU 77.A O no hydrogen 2.889 N/A GLU 82.A N ARG 79.A O no hydrogen 3.121 N/A SER 83.A N LEU 80.A O no hydrogen 3.193 N/A SER 83.A OG LYS 85.A O no hydrogen 3.394 N/A LYS 85.A N SER 83.A OG no hydrogen 3.017 N/A LYS 85.A NZ GLY 11.A O no hydrogen 3.125 N/A VAL 88.A N GLY 9.A O no hydrogen 2.938 N/A ALA 89.A N LEU 52.A O no hydrogen 2.913 N/A THR 90.A N ALA 7.A O no hydrogen 3.098 N/A LEU 91.A N GLN 50.A O no hydrogen 3.046 N/A LEU 92.A N SER 5.A O no hydrogen 2.876 N/A ALA 93.A N ASN 49.A OD1 no hydrogen 2.805 N/A GLU 94.A N ASN 49.A OD1 no hydrogen 3.218 N/A SER 99.A N GLU 103.A OE2 no hydrogen 3.308 N/A SER 99.A OG GLU 103.A OE2 no hydrogen 3.558 N/A THR 101.A OG1 LEU 129.A O no hydrogen 3.071 N/A GLU 103.A N SER 100.A OG no hydrogen 3.066 N/A ALA 104.A N SER 100.A O no hydrogen 2.968 N/A TYR 105.A N THR 101.A O no hydrogen 2.950 N/A TYR 105.A OH LEU 20.A O no hydrogen 3.292 N/A LEU 106.A N ALA 102.A O no hydrogen 3.203 N/A LYS 107.A N GLU 103.A O no hydrogen 3.101 N/A LYS 107.A NZ ASP 95.A OD1 no hydrogen 2.780 N/A LYS 107.A NZ ALA 96.A O no hydrogen 2.574 N/A LYS 107.A NZ ASN 122.A O no hydrogen 2.880 N/A LEU 108.A N ALA 104.A O no hydrogen 3.309 N/A HIS 109.A N TYR 105.A O no hydrogen 2.935 N/A HIS 109.A ND1 TYR 105.A O no hydrogen 2.595 N/A LEU 110.A N LEU 106.A O no hydrogen 3.054 N/A LEU 111.A N LYS 107.A O no hydrogen 3.287 N/A SER 112.A N LEU 108.A O no hydrogen 3.047 N/A SER 112.A OG ALA 192.A O no hydrogen 2.613 N/A HIS 113.A N HIS 109.A O no hydrogen 2.682 N/A HIS 113.A ND1 HIS 109.A O no hydrogen 3.164 N/A ARG 114.A N LEU 111.A O no hydrogen 2.781 N/A ARG 114.A NE ILE 194.A O no hydrogen 2.810 N/A ARG 114.A NH2 ALA 178.A O no hydrogen 2.680 N/A ARG 114.A NH2 ILE 194.A O no hydrogen 3.387 N/A LEU 115.A N LEU 110.A O no hydrogen 2.838 N/A VAL 116.A N LEU 110.A O no hydrogen 3.328 N/A HIS 119.A N ASN 209.A OD1 no hydrogen 3.131 N/A HIS 119.A NE2 GLY 225.A O no hydrogen 2.709 N/A ALA 120.A N LYS 117.A O no hydrogen 3.095 N/A ASN 122.A N ASP 95.A OD1 no hydrogen 3.074 N/A SER 124.A N ASN 122.A OD1 no hydrogen 3.011 N/A SER 124.A OG ASN 122.A OD1 no hydrogen 3.011 N/A LEU 129.A N ILE 126.A O no hydrogen 3.158 N/A LEU 130.A N PHE 127.A O no hydrogen 2.966 N/A VAL 133.A N ASP 166.A O no hydrogen 3.321 N/A ALA 134.A N VAL 141.A O no hydrogen 3.011 N/A TRP 135.A N SER 164.A O no hydrogen 2.740 N/A TRP 135.A NE1 ASP 166.A O no hydrogen 2.964 N/A THR 136.A N GLY 139.A O no hydrogen 3.033 N/A THR 136.A OG1 GLY 139.A O no hydrogen 2.679 N/A ASN 137.A N GLU 161.A O no hydrogen 3.202 N/A ILE 138.A N THR 136.A OG1 no hydrogen 3.347 N/A GLY 139.A N THR 136.A O no hydrogen 2.919 N/A VAL 141.A N ALA 134.A O no hydrogen 2.992 N/A ALA 144.A N ASP 142.A OD1 no hydrogen 3.170 N/A GLU 145.A N ASP 142.A O no hydrogen 2.987 N/A LEU 146.A N LEU 143.A O no hydrogen 3.345 N/A LEU 149.A N GLU 145.A O no hydrogen 3.455 N/A GLN 150.A N LEU 146.A O no hydrogen 2.881 N/A LEU 151.A N ALA 147.A O no hydrogen 2.814 N/A GLU 152.A N GLU 148.A O no hydrogen 3.122 N/A ALA 153.A N LEU 149.A O no hydrogen 3.200 N/A ARG 154.A N GLN 150.A O no hydrogen 3.236 N/A LEU 155.A N LEU 151.A O no hydrogen 2.998 N/A LYS 156.A N GLU 152.A O no hydrogen 3.259 N/A LYS 156.A N ALA 153.A O no hydrogen 3.263 N/A GLY 157.A N ARG 154.A O no hydrogen 3.043 N/A LYS 158.A N ALA 153.A O no hydrogen 2.877 N/A GLU 161.A N ASN 137.A OD1 no hydrogen 3.318 N/A PHE 163.A N TRP 135.A O no hydrogen 3.034 N/A ASP 166.A N VAL 133.A O no hydrogen 3.118 N/A LYS 167.A N ASP 166.A OD1 no hydrogen 2.649 N/A LYS 167.A NZ PHE 127.A O no hydrogen 3.022 N/A LYS 167.A NZ LEU 130.A O no hydrogen 2.738 N/A LYS 170.A NZ ASP 173.A OD1 no hydrogen 2.706 N/A LYS 170.A NZ ASP 173.A OD2 no hydrogen 3.465 N/A MET 171.A N VAL 188.A O no hydrogen 2.828 N/A ASP 173.A N LYS 170.A O no hydrogen 3.290 N/A TYR 174.A N MET 171.A O no hydrogen 2.757 N/A TYR 174.A OH GLU 21.A OE2 no hydrogen 2.586 N/A VAL 175.A N MET 171.A O no hydrogen 3.052 N/A ARG 181.A N THR 198.A O no hydrogen 2.995 N/A ARG 181.A NE THR 199.A OG1 no hydrogen 3.402 N/A ALA 183.A N VAL 200.A O no hydrogen 2.934 N/A VAL 188.A N THR 185.A O no hydrogen 3.449 N/A ARG 189.A N VAL 206.A O no hydrogen 3.117 N/A ARG 189.A NH1 ASN 207.A OD1 no hydrogen 3.006 N/A ARG 189.A NH2 ASP 166.A OD2 no hydrogen 2.659 N/A LEU 190.A N PRO 169.A O no hydrogen 3.134 N/A GLY 191.A N SER 112.A OG no hydrogen 2.990 N/A ALA 192.A N ARG 189.A O no hydrogen 3.079 N/A TYR 193.A N ALA 210.A O no hydrogen 2.779 N/A GLY 195.A N THR 212.A OG1 no hydrogen 3.111 N/A GLY 197.A N GLY 179.A O no hydrogen 2.755 N/A THR 198.A N GLY 195.A O no hydrogen 3.145 N/A THR 198.A OG1 GLY 195.A O no hydrogen 2.683 N/A THR 198.A OG1 THR 212.A OG1 no hydrogen 2.910 N/A THR 199.A N GLY 216.A O no hydrogen 2.724 N/A VAL 200.A N ARG 181.A O no hydrogen 2.829 N/A MET 201.A N ILE 218.A O no hydrogen 2.820 N/A GLY 204.A N MET 201.A O no hydrogen 2.720 N/A PHE 205.A N GLY 220.A O no hydrogen 3.025 N/A VAL 206.A N ARG 187.A O no hydrogen 2.956 N/A ASN 207.A N VAL 222.A O no hydrogen 3.227 N/A PHE 208.A N ASN 207.A OD1 no hydrogen 2.686 N/A GLY 211.A N VAL 226.A O no hydrogen 3.052 N/A THR 212.A N TYR 193.A O no hydrogen 2.915 N/A THR 212.A OG1 THR 198.A OG1 no hydrogen 2.910 N/A GLU 213.A N VAL 228.A O no hydrogen 2.924 N/A GLY 216.A N GLY 197.A O no hydrogen 3.341 N/A ILE 218.A N THR 199.A O no hydrogen 2.760 N/A GLU 219.A N LEU 234.A O no hydrogen 2.836 N/A ARG 221.A N CYS 238.A O no hydrogen 2.984 N/A VAL 222.A N PHE 205.A O no hydrogen 2.878 N/A SER 223.A N THR 240.A OG1 no hydrogen 3.064 N/A SER 223.A OG THR 240.A O no hydrogen 2.611 N/A GLY 225.A N ASN 209.A O no hydrogen 3.208 N/A VAL 226.A N SER 223.A O no hydrogen 3.025 N/A VAL 228.A N GLY 211.A O no hydrogen 2.870 N/A GLY 229.A N VAL 250.A O no hydrogen 2.686 N/A LYS 230.A N GLU 213.A OE1 no hydrogen 3.295 N/A GLY 231.A N PRO 215.A O no hydrogen 2.831 N/A SER 232.A OG GLY 229.A O no hydrogen 3.478 N/A SER 232.A OG GLY 251.A O no hydrogen 2.640 N/A ASP 233.A N CYS 254.A O no hydrogen 2.927 N/A LEU 234.A N MET 217.A O no hydrogen 2.907 N/A GLY 235.A N ILE 256.A O no hydrogen 2.814 N/A GLY 237.A N GLU 219.A O no hydrogen 3.090 N/A CYS 238.A N GLY 235.A O no hydrogen 3.076 N/A CYS 238.A SG GLY 235.A O no hydrogen 3.162 N/A SER 239.A N ALA 260.A O no hydrogen 2.973 N/A SER 239.A OG THR 240.A O no hydrogen 3.493 N/A THR 240.A OG1 ARG 221.A O no hydrogen 2.830 N/A ILE 246.A N ASN 245.A OD1 no hydrogen 2.674 N/A VAL 250.A N PHE 227.A O no hydrogen 3.158 N/A GLU 252.A N ASP 268.A OD1 no hydrogen 3.191 N/A GLY 253.A N LYS 230.A O no hydrogen 2.981 N/A CYS 254.A N SER 232.A OG no hydrogen 3.093 N/A CYS 254.A SG GLU 252.A O no hydrogen 3.810 N/A CYS 254.A SG GLY 267.A O no hydrogen 3.086 N/A LEU 255.A N ASN 270.A O no hydrogen 2.955 N/A ILE 256.A N ASP 233.A O no hydrogen 2.887 N/A GLY 257.A N VAL 272.A O no hydrogen 2.885 N/A ASN 259.A N GLY 236.A O no hydrogen 2.829 N/A ALA 260.A N GLY 257.A O no hydrogen 3.149 N/A GLY 261.A N LEU 276.A O no hydrogen 2.929 N/A ILE 262.A N SER 239.A O no hydrogen 2.959 N/A GLY 263.A N ILE 278.A O no hydrogen 2.779 N/A LEU 266.A N SER 249.A O no hydrogen 2.972 N/A ARG 269.A N GLU 252.A O no hydrogen 2.617 N/A ARG 269.A NE ASP 305.A OD1 no hydrogen 3.287 N/A ARG 269.A NE ASP 305.A OD2 no hydrogen 3.562 N/A ARG 269.A NH2 ASP 305.A OD2 no hydrogen 3.407 N/A ASN 270.A ND2 GLN 303.A O no hydrogen 3.397 N/A VAL 272.A N LEU 255.A O no hydrogen 3.016 N/A GLU 273.A N PHE 308.A O no hydrogen 2.884 N/A GLY 275.A N ALA 258.A O no hydrogen 3.032 N/A LEU 276.A N GLU 273.A O no hydrogen 3.340 N/A ILE 278.A N GLY 261.A O no hydrogen 2.921 N/A THR 279.A N THR 282.A OG1 no hydrogen 3.023 N/A THR 279.A OG1 THR 282.A OG1 no hydrogen 2.657 N/A THR 282.A N THR 279.A O no hydrogen 3.393 N/A THR 282.A OG1 THR 279.A O no hydrogen 3.451 N/A THR 282.A OG1 THR 279.A OG1 no hydrogen 2.657 N/A VAL 284.A N VAL 295.A O no hydrogen 2.773 N/A ALA 285.A N VAL 317.A O no hydrogen 2.703 N/A LEU 286.A N LYS 293.A O no hydrogen 2.928 N/A LEU 287.A N CYS 319.A O no hydrogen 3.008 N/A ASP 288.A N ALA 290.A O no hydrogen 3.137 N/A ALA 290.A N ASP 288.A OD1 no hydrogen 3.229 N/A VAL 292.A N LEU 286.A O no hydrogen 2.907 N/A VAL 295.A N VAL 284.A O no hydrogen 3.047 N/A ALA 297.A N THR 282.A O no hydrogen 3.006 N/A ARG 298.A N ALA 280.A O no hydrogen 3.195 N/A ASP 299.A N LYS 296.A O no hydrogen 2.628 N/A LEU 300.A N ALA 297.A O no hydrogen 2.568 N/A GLY 302.A N PRO 265.A O no hydrogen 2.988 N/A ASP 305.A N ASP 268.A O no hydrogen 3.163 N/A PHE 308.A N ILE 271.A O no hydrogen 2.877 N/A ARG 310.A N GLU 273.A OE1 no hydrogen 2.951 N/A ASN 311.A N ALA 316.A O no hydrogen 2.981 N/A ASN 311.A ND2 GLN 313.A OE1 no hydrogen 3.455 N/A GLY 315.A N ASN 311.A O no hydrogen 2.860 N/A GLU 318.A N ARG 309.A O no hydrogen 3.367 N/A CYS 319.A N ALA 285.A O no hydrogen 2.821 N/A LYS 320.A N LEU 307.A O no hydrogen 3.048 N/A