Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3f9g_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N LEU 278.A O no hydrogen 2.901 N/A LYS 4.A NZ GLU 284.A OE2 no hydrogen 3.150 N/A LYS 4.A NZ GLU 286.A OE1 no hydrogen 2.911 N/A MET 5.A N ARG 3.A O no hydrogen 2.994 N/A PHE 7.A N SER 112.A OG no hydrogen 2.820 N/A SER 9.A OG GLU 13.A OE1 no hydrogen 2.624 N/A VAL 12.A N SER 9.A O no hydrogen 3.155 N/A GLU 13.A N SER 9.A O no hydrogen 2.782 N/A CYS 15.A N VAL 12.A O no hydrogen 2.909 N/A CYS 15.A SG LYS 11.A O no hydrogen 3.340 N/A MET 16.A N GLU 13.A O no hydrogen 3.247 N/A VAL 17.A N GLY 28.A O no hydrogen 2.975 N/A GLN 18.A N GLN 68.A O no hydrogen 3.137 N/A VAL 19.A N LEU 26.A O no hydrogen 2.779 N/A THR 20.A N LEU 66.A O no hydrogen 2.974 N/A CYS 21.A N THR 24.A O no hydrogen 3.068 N/A CYS 21.A SG SER 64.A O no hydrogen 3.992 N/A THR 24.A OG1 CYS 43.A O no hydrogen 2.864 N/A THR 25.A OG1 THR 23.A O no hydrogen 3.476 N/A LEU 26.A N VAL 19.A O no hydrogen 3.023 N/A ASN 27.A N CYS 141.A O no hydrogen 2.871 N/A ASN 27.A ND2 CYS 116.A O no hydrogen 2.810 N/A ASN 27.A ND2 CYS 141.A O no hydrogen 2.799 N/A GLY 28.A N VAL 17.A O no hydrogen 2.681 N/A LEU 29.A N TYR 36.A O no hydrogen 2.665 N/A TRP 30.A N CYS 15.A O no hydrogen 2.759 N/A LEU 31.A N THR 34.A O no hydrogen 3.067 N/A ASP 32.A N THR 97.A OG1 no hydrogen 3.178 N/A THR 34.A N LEU 31.A O no hydrogen 3.138 N/A VAL 35.A N LEU 88.A O no hydrogen 2.739 N/A TYR 36.A N LEU 29.A O no hydrogen 2.857 N/A CYS 37.A N LEU 86.A O no hydrogen 3.121 N/A CYS 37.A SG PRO 38.A O no hydrogen 3.553 N/A ARG 39.A N CYS 84.A O no hydrogen 3.115 N/A ARG 39.A NE ASP 183.A OD1 no hydrogen 2.693 N/A ARG 39.A NH2 ASP 183.A OD2 no hydrogen 3.196 N/A HIS 40.A NE2 HIS 160.A O no hydrogen 3.039 N/A VAL 41.A N PRO 38.A O no hydrogen 3.455 N/A ILE 42.A N ARG 39.A O no hydrogen 3.338 N/A CYS 43.A N HIS 40.A O no hydrogen 3.398 N/A THR 44.A N ASP 47.A OD2 no hydrogen 2.777 N/A THR 44.A OG1 ASP 47.A OD2 no hydrogen 2.890 N/A LEU 49.A N GLU 46.A O no hydrogen 3.408 N/A TYR 53.A OH ASP 183.A O no hydrogen 2.571 N/A ASP 55.A N ASN 52.A OD1 no hydrogen 3.041 N/A LEU 56.A N ASN 52.A O no hydrogen 3.042 N/A LEU 56.A N TYR 53.A O no hydrogen 3.298 N/A LEU 57.A N TYR 53.A O no hydrogen 2.912 N/A ILE 58.A N GLU 54.A O no hydrogen 3.498 N/A LYS 60.A N LEU 57.A O no hydrogen 2.809 N/A SER 61.A N SER 64.A OG no hydrogen 3.273 N/A SER 64.A N SER 61.A O no hydrogen 3.300 N/A SER 64.A OG SER 61.A O no hydrogen 2.680 N/A PHE 65.A N ASN 62.A O no hydrogen 2.936 N/A LEU 66.A N THR 20.A O no hydrogen 3.150 N/A GLN 68.A N GLN 18.A O no hydrogen 3.118 N/A ALA 69.A N VAL 72.A O no hydrogen 2.648 N/A LEU 74.A N VAL 67.A O no hydrogen 2.685 N/A ARG 75.A N ASP 91.A OD2 no hydrogen 3.171 N/A ILE 77.A N LYS 89.A O no hydrogen 2.601 N/A HIS 79.A ND1 ASN 62.A OD1 no hydrogen 3.031 N/A SER 80.A N ARG 87.A O no hydrogen 2.988 N/A GLN 82.A N LEU 85.A O no hydrogen 2.892 N/A ASN 83.A ND2 GLU 174.A O no hydrogen 2.713 N/A CYS 84.A N GLY 175.A O no hydrogen 3.260 N/A CYS 84.A SG ASP 183.A OD1 no hydrogen 3.461 N/A LEU 85.A N GLN 82.A O no hydrogen 2.839 N/A LEU 86.A N CYS 37.A O no hydrogen 2.790 N/A ARG 87.A N SER 80.A O no hydrogen 2.802 N/A ARG 87.A NH1 GLN 82.A OE1 no hydrogen 3.109 N/A LEU 88.A N VAL 35.A O no hydrogen 2.945 N/A LYS 89.A N GLY 78.A O no hydrogen 2.745 N/A LYS 89.A NZ ASP 33.A OD1 no hydrogen 2.771 N/A LYS 89.A NZ ASP 33.A OD2 no hydrogen 3.393 N/A VAL 90.A N ASP 33.A O no hydrogen 3.021 N/A ASP 91.A N ARG 75.A O no hydrogen 3.254 N/A THR 92.A OG1 SER 93.A O no hydrogen 3.559 N/A ASN 94.A N ASP 32.A O no hydrogen 2.872 N/A ASN 94.A ND2 GLY 14.A O no hydrogen 2.968 N/A ASN 94.A ND2 TRP 30.A O no hydrogen 2.832 N/A LYS 96.A N ASN 94.A OD1 no hydrogen 2.842 N/A THR 97.A N ASN 94.A O no hydrogen 3.382 N/A THR 97.A OG1 ASN 94.A O no hydrogen 2.654 N/A TYR 100.A OH ASP 32.A OD2 no hydrogen 3.191 N/A LYS 101.A N VAL 153.A O no hydrogen 3.035 N/A VAL 103.A N PHE 155.A O no hydrogen 2.964 N/A ARG 104.A NH1 ASP 172.A OD2 no hydrogen 2.800 N/A ARG 104.A NH1 LYS 176.A O no hydrogen 3.098 N/A ARG 104.A NH1 PHE 177.A O no hydrogen 3.330 N/A ARG 104.A NH2 PHE 177.A O no hydrogen 2.708 N/A GLN 106.A N GLN 109.A OE1 no hydrogen 2.827 N/A GLY 108.A N MET 129.A O no hydrogen 2.559 N/A GLN 109.A N GLN 106.A O no hydrogen 3.185 N/A THR 110.A OG1 ASP 291.A OD1 no hydrogen 3.416 N/A THR 110.A OG1 ASP 291.A OD2 no hydrogen 2.551 N/A PHE 111.A N CYS 127.A O no hydrogen 2.852 N/A SER 112.A N PHE 146.A O no hydrogen 2.847 N/A SER 112.A OG GLN 126.A OE1 no hydrogen 2.802 N/A VAL 113.A N TYR 125.A O no hydrogen 2.743 N/A LEU 114.A N VAL 144.A O no hydrogen 3.416 N/A CYS 116.A N SER 143.A OG no hydrogen 3.158 N/A CYS 116.A SG LEU 114.A O no hydrogen 3.276 N/A TYR 117.A N SER 120.A O no hydrogen 2.837 N/A GLY 119.A N ASN 27.A OD1 no hydrogen 2.766 N/A SER 120.A N TYR 117.A O no hydrogen 2.889 N/A SER 122.A N ALA 115.A O no hydrogen 3.054 N/A SER 122.A OG ALA 115.A O no hydrogen 3.557 N/A GLY 123.A N ALA 115.A O no hydrogen 3.474 N/A TYR 125.A N VAL 113.A O no hydrogen 2.912 N/A CYS 127.A N PHE 111.A O no hydrogen 2.967 N/A CYS 127.A SG PHE 111.A O no hydrogen 3.926 N/A CYS 127.A SG ALA 128.A O no hydrogen 4.049 N/A MET 129.A N GLN 109.A O no hydrogen 2.807 N/A ARG 130.A N THR 134.A O no hydrogen 3.245 N/A ARG 130.A NH1 ASP 285.A OD1 no hydrogen 3.016 N/A ARG 130.A NH1 ASP 285.A OD2 no hydrogen 3.062 N/A ARG 130.A NH2 ASP 285.A OD1 no hydrogen 2.829 N/A ASN 132.A ND2 GLY 191.A O no hydrogen 3.633 N/A HIS 133.A N ARG 130.A O no hydrogen 2.729 N/A THR 134.A N ASN 132.A OD1 no hydrogen 3.306 N/A THR 134.A OG1 ASN 132.A OD1 no hydrogen 2.580 N/A ILE 135.A N HIS 168.A O no hydrogen 3.006 N/A CYS 141.A SG HIS 160.A O no hydrogen 3.469 N/A GLY 142.A N HIS 159.A O no hydrogen 3.130 N/A SER 143.A N SER 140.A O no hydrogen 3.422 N/A SER 143.A OG SER 140.A O no hydrogen 2.692 N/A GLY 145.A N TYR 157.A O no hydrogen 2.782 N/A PHE 146.A N SER 112.A O no hydrogen 2.886 N/A ASN 147.A N SER 154.A O no hydrogen 3.040 N/A ASP 149.A N CYS 152.A O no hydrogen 2.698 N/A CYS 152.A N ASP 149.A O no hydrogen 3.045 N/A CYS 152.A SG LYS 99.A O no hydrogen 3.618 N/A VAL 153.A N LYS 99.A O no hydrogen 2.679 N/A SER 154.A N ASN 147.A O no hydrogen 2.967 N/A PHE 155.A N LYS 101.A O no hydrogen 3.016 N/A CYS 156.A N GLY 145.A O no hydrogen 2.903 N/A TYR 157.A N GLY 145.A O no hydrogen 3.369 N/A TYR 157.A OH HIS 159.A ND1.B no hydrogen 2.549 N/A MET 158.A N THR 171.A O no hydrogen 2.817 N/A HIS 159.A N SER 143.A O no hydrogen 2.937 N/A HIS 160.A N ALA 169.A O no hydrogen 3.033 N/A MET 161.A N ALA 169.A O no hydrogen 2.920 N/A LEU 163.A N VAL 167.A O no hydrogen 2.776 N/A GLY 166.A N LEU 163.A O no hydrogen 3.092 N/A HIS 168.A N ILE 135.A O no hydrogen 2.532 N/A ALA 169.A N MET 161.A O no hydrogen 2.831 N/A THR 171.A N MET 158.A O no hydrogen 3.068 N/A THR 171.A OG1 HIS 160.A NE2 no hydrogen 2.950 N/A THR 171.A OG1 ASP 172.A O no hydrogen 2.834 N/A ASP 172.A N LYS 176.A O no hydrogen 2.998 N/A GLU 174.A N ASP 172.A OD1 no hydrogen 3.049 N/A LYS 176.A N ASP 172.A OD1 no hydrogen 2.888 N/A TYR 178.A N GLY 170.A O no hydrogen 2.975 N/A TYR 178.A OH CYS 156.A O no hydrogen 2.631 N/A ARG 184.A N VAL 182.A O no hydrogen 2.935 N/A GLN 185.A N MET 48.A O no hydrogen 2.768 N/A THR 195.A N ASN 234.A O no hydrogen 3.244 N/A ILE 196.A N ASP 285.A OD1 no hydrogen 2.976 N/A THR 197.A OG1 GLU 236.A O no hydrogen 2.623 N/A ASN 199.A ND2 GLY 108.A O no hydrogen 3.056 N/A ASN 199.A ND2 ASP 285.A O no hydrogen 2.872 N/A VAL 200.A N ILE 196.A O no hydrogen 3.184 N/A LEU 201.A N THR 197.A O no hydrogen 2.936 N/A ALA 202.A N LEU 198.A O no hydrogen 3.193 N/A TRP 203.A N ASN 199.A O no hydrogen 3.113 N/A LEU 204.A N VAL 200.A O no hydrogen 2.891 N/A TYR 205.A N LEU 201.A O no hydrogen 3.064 N/A TYR 205.A OH ILE 255.A O no hydrogen 2.823 N/A ALA 206.A N ALA 202.A O no hydrogen 2.881 N/A ALA 207.A N TRP 203.A O no hydrogen 2.985 N/A VAL 208.A N LEU 204.A O no hydrogen 3.109 N/A ILE 209.A N TYR 205.A O no hydrogen 3.009 N/A ASN 210.A N ALA 206.A O no hydrogen 3.361 N/A ASN 210.A ND2 ALA 206.A O no hydrogen 2.763 N/A GLY 211.A N ALA 207.A O no hydrogen 3.180 N/A GLY 211.A N VAL 208.A O no hydrogen 2.816 N/A TRP 214.A NE1 THR 276.A O no hydrogen 2.965 N/A LEU 216.A N ARG 213.A O no hydrogen 3.394 N/A ASN 217.A ND2 ALA 262.A O no hydrogen 3.612 N/A THR 220.A OG1 THR 221.A O no hydrogen 3.515 N/A THR 220.A OG1 ASP 259.A OD2 no hydrogen 3.542 N/A THR 221.A OG1 THR 222.A O no hydrogen 3.287 N/A THR 222.A OG1 ASP 225.A OD1 no hydrogen 2.903 N/A PHE 226.A N THR 222.A O no hydrogen 3.008 N/A ASN 227.A N LEU 223.A O no hydrogen 3.064 N/A ASN 227.A ND2 LEU 238.A O no hydrogen 2.912 N/A LEU 228.A N ASN 224.A O no hydrogen 3.060 N/A ALA 230.A N PHE 226.A O no hydrogen 2.844 N/A MET 231.A N ASN 227.A O no hydrogen 3.130 N/A TYR 233.A N VAL 229.A O no hydrogen 3.190 N/A ASN 234.A N MET 231.A O no hydrogen 3.112 N/A ASN 234.A ND2 ASP 193.A O no hydrogen 2.798 N/A TYR 235.A N ALA 230.A O no hydrogen 2.760 N/A GLU 236.A N THR 195.A O no hydrogen 2.942 N/A LEU 238.A N ASN 227.A OD1 no hydrogen 2.656 N/A GLN 240.A NE2 GLN 240.A O no hydrogen 2.974 N/A GLN 240.A NE2 ASP 244.A OD2 no hydrogen 3.199 N/A VAL 243.A N THR 239.A O no hydrogen 3.241 N/A ASP 244.A N GLN 240.A O no hydrogen 2.980 N/A ILE 245.A N ASP 241.A O no hydrogen 3.011 N/A LEU 246.A N HIS 242.A O no hydrogen 2.984 N/A GLY 247.A N ASP 244.A O no hydrogen 3.003 N/A SER 250.A N LEU 246.A O no hydrogen 3.079 N/A SER 250.A OG ILE 255.A O no hydrogen 2.819 N/A ALA 251.A N GLY 247.A O no hydrogen 2.860 N/A GLN 252.A N PRO 248.A O no hydrogen 3.010 N/A THR 253.A N LEU 249.A O no hydrogen 3.441 N/A THR 253.A OG1 LEU 249.A O no hydrogen 2.850 N/A GLY 254.A N SER 250.A O no hydrogen 3.043 N/A ILE 255.A N SER 250.A O no hydrogen 3.210 N/A MET 260.A N ALA 256.A O no hydrogen 3.198 N/A CYS 261.A N VAL 257.A O no hydrogen 3.070 N/A CYS 261.A SG VAL 257.A O no hydrogen 3.219 N/A ALA 262.A N LEU 258.A O no hydrogen 3.082 N/A ALA 263.A N ASP 259.A O no hydrogen 2.934 N/A LEU 264.A N MET 260.A O no hydrogen 2.898 N/A LYS 265.A N CYS 261.A O no hydrogen 2.892 N/A GLU 266.A N ALA 262.A O no hydrogen 3.350 N/A LEU 267.A N ALA 263.A O no hydrogen 3.153 N/A LEU 268.A N LEU 264.A O no hydrogen 2.819 N/A GLN 269.A N LYS 265.A O no hydrogen 2.959 N/A ASN 270.A N GLU 266.A O no hydrogen 2.742 N/A GLY 271.A N LEU 267.A O no hydrogen 2.949 N/A ASN 273.A ND2 ASN 270.A O no hydrogen 3.348 N/A ILE 277.A N SER 280.A O no hydrogen 2.970 N/A SER 280.A N ILE 277.A O no hydrogen 3.035 N/A SER 280.A OG ILE 282.A O no hydrogen 2.677 N/A ILE 282.A N SER 280.A OG no hydrogen 2.919 N/A THR 288.A N ASP 291.A OD2 no hydrogen 3.102 N/A ASP 291.A N THR 288.A OG1 no hydrogen 3.203 N/A VAL 292.A N THR 288.A O no hydrogen 3.121 N/A VAL 293.A N PRO 289.A O no hydrogen 3.284 N/A ARG 294.A N PHE 290.A O no hydrogen 3.068 N/A GLN 295.A N ASP 291.A O no hydrogen 3.063 N/A GLN 295.A NE2 ARG 3.A O no hydrogen 3.271 N/A CYS 296.A N VAL 292.A O no hydrogen 2.789 N/A CYS 296.A SG VAL 292.A O no hydrogen 3.249 N/A SER 297.A OG CYS 296.A O no hydrogen 2.959 N/A