Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5v1j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A OG1 GLY 1.A O no hydrogen 3.131 N/A ASP 5.A N GLY 1.A O no hydrogen 2.718 N/A MET 6.A N GLY 2.A O no hydrogen 2.869 N/A LEU 7.A N ILE 3.A O no hydrogen 2.848 N/A THR 8.A N THR 4.A O no hydrogen 2.994 N/A THR 8.A OG1 THR 4.A O no hydrogen 2.827 N/A GLU 9.A N ASP 5.A O no hydrogen 2.848 N/A LEU 10.A N MET 6.A O no hydrogen 2.823 N/A ALA 11.A N LEU 7.A O no hydrogen 2.875 N/A ASN 12.A N THR 8.A O no hydrogen 2.952 N/A PHE 13.A N GLU 9.A O no hydrogen 3.042 N/A GLU 14.A N LEU 10.A O no hydrogen 2.973 N/A LYS 15.A N ALA 11.A O no hydrogen 2.849 N/A ASN 16.A N ASN 12.A O no hydrogen 2.687 N/A ASN 16.A ND2 ASN 86.A OD1 no hydrogen 2.364 N/A VAL 17.A N PHE 13.A O no hydrogen 2.806 N/A SER 18.A N PHE 13.A O no hydrogen 3.019 N/A SER 18.A OG GLU 14.A OE1 no hydrogen 2.751 N/A ALA 20.A N GLU 14.A O no hydrogen 2.684 N/A TYR 24.A N ALA 20.A O no hydrogen 2.965 N/A ASN 25.A N ILE 21.A O no hydrogen 3.011 N/A ALA 26.A N HIS 22.A O no hydrogen 3.115 N/A ALA 26.A N LYS 23.A O no hydrogen 3.248 N/A TYR 27.A N LYS 23.A O no hydrogen 3.106 N/A ARG 28.A N TYR 24.A O no hydrogen 2.990 N/A LYS 29.A N ASN 25.A O no hydrogen 2.853 N/A ALA 30.A N ALA 26.A O no hydrogen 2.767 N/A ALA 31.A N TYR 27.A O no hydrogen 2.795 N/A SER 32.A N ARG 28.A O no hydrogen 2.860 N/A SER 32.A OG LYS 29.A O no hydrogen 2.790 N/A VAL 33.A N LYS 29.A O no hydrogen 3.109 N/A ILE 34.A N ALA 30.A O no hydrogen 3.257 N/A ALA 35.A N ALA 31.A O no hydrogen 2.742 N/A LYS 36.A N VAL 33.A O no hydrogen 3.123 N/A TYR 37.A N ILE 34.A O no hydrogen 3.043 N/A TYR 37.A OH GLU 46.A OE2 no hydrogen 2.603 N/A LYS 42.A N GLU 46.A OE1 no hydrogen 2.554 N/A SER 43.A N GLU 46.A OE1 no hydrogen 3.445 N/A GLY 44.A N ASP 62.A OD1 no hydrogen 2.408 N/A GLU 46.A N SER 43.A O no hydrogen 3.179 N/A GLU 46.A N SER 43.A OG no hydrogen 2.925 N/A LYS 48.A N GLY 44.A O no hydrogen 3.057 N/A LYS 49.A N GLU 46.A O no hydrogen 3.236 N/A LEU 50.A N ALA 47.A O no hydrogen 2.493 N/A VAL 53.A N LEU 50.A O no hydrogen 3.193 N/A ALA 58.A N GLY 54.A O no hydrogen 3.184 N/A GLU 59.A N THR 55.A O no hydrogen 3.201 N/A LYS 60.A N LYS 56.A O no hydrogen 3.183 N/A ILE 61.A N ILE 57.A O no hydrogen 2.721 N/A ASP 62.A N ALA 58.A O no hydrogen 2.839 N/A GLU 63.A N GLU 59.A O no hydrogen 3.072 N/A PHE 64.A N LYS 60.A O no hydrogen 2.860 N/A LEU 65.A N ILE 61.A O no hydrogen 2.809 N/A ALA 66.A N ASP 62.A O no hydrogen 2.812 N/A THR 67.A N GLU 63.A O no hydrogen 2.939 N/A THR 67.A N PHE 64.A O no hydrogen 3.232 N/A THR 67.A OG1 GLU 63.A O no hydrogen 2.841 N/A GLY 68.A N PHE 64.A O no hydrogen 2.452 N/A LYS 69.A N THR 67.A OG1 no hydrogen 3.294 N/A ARG 71.A N GLU 63.A OE2 no hydrogen 2.894 N/A GLU 74.A N LEU 70.A O no hydrogen 3.069 N/A LYS 75.A N ARG 71.A O no hydrogen 3.034 N/A ILE 76.A N LYS 72.A O no hydrogen 3.072 N/A ARG 77.A N LEU 73.A O no hydrogen 2.743 N/A ARG 77.A NH2 GLU 9.A OE1 no hydrogen 2.993 N/A GLN 78.A N GLU 74.A O no hydrogen 2.895 N/A SER 82.A N ASP 79.A OD2 no hydrogen 3.362 N/A SER 82.A OG ASP 79.A OD2 no hydrogen 2.425 N/A SER 83.A OG ASP 80.A O no hydrogen 3.378 N/A SER 84.A N ASP 80.A O no hydrogen 2.944 N/A SER 84.A OG ASP 80.A O no hydrogen 2.714 N/A ILE 85.A N THR 81.A O no hydrogen 2.874 N/A ASN 86.A N SER 82.A O no hydrogen 2.950 N/A PHE 87.A N SER 83.A O no hydrogen 2.768 N/A LEU 88.A N SER 84.A O no hydrogen 3.012 N/A THR 89.A N ILE 85.A O no hydrogen 3.151 N/A THR 89.A N ASN 86.A O no hydrogen 3.309 N/A THR 89.A OG1 ASN 86.A O no hydrogen 2.903 N/A ARG 90.A N PHE 87.A O no hydrogen 2.856 N/A ARG 90.A NE GLU 135.A OE2 no hydrogen 2.852 N/A ARG 90.A NH2 GLU 135.A OE1 no hydrogen 2.505 N/A ARG 90.A NH2 GLU 135.A OE2 no hydrogen 3.298 N/A VAL 91.A N LEU 88.A O no hydrogen 2.996 N/A SER 92.A OG HIS 123.A NE2 no hydrogen 2.627 N/A ILE 94.A N VAL 91.A O no hydrogen 2.666 N/A ALA 99.A N GLY 95.A O no hydrogen 2.912 N/A ARG 100.A N PRO 96.A O no hydrogen 3.093 N/A ARG 100.A NH1 VAL 17.A O no hydrogen 3.006 N/A LYS 101.A N SER 97.A O no hydrogen 2.994 N/A PHE 102.A N ALA 98.A O no hydrogen 2.830 N/A VAL 103.A N ALA 99.A O no hydrogen 2.989 N/A ASP 104.A N ARG 100.A O no hydrogen 3.018 N/A GLU 105.A N LYS 101.A O no hydrogen 3.292 N/A GLU 105.A N PHE 102.A O no hydrogen 3.085 N/A GLY 106.A N VAL 103.A O no hydrogen 3.175 N/A ILE 107.A N PHE 102.A O no hydrogen 2.766 N/A LYS 108.A N ASP 112.A OD2 no hydrogen 2.977 N/A LYS 108.A NZ ASP 80.A OD2 no hydrogen 2.610 N/A THR 109.A N ASP 112.A OD2 no hydrogen 3.017 N/A ASP 112.A N THR 109.A OG1 no hydrogen 3.001 N/A LEU 113.A N THR 109.A O no hydrogen 3.114 N/A ARG 114.A N LEU 110.A O no hydrogen 3.043 N/A LYS 115.A N GLU 111.A O no hydrogen 2.957 N/A ASN 116.A N LEU 113.A O no hydrogen 2.869 N/A ASN 116.A ND2 ASP 112.A O no hydrogen 2.585 N/A GLU 117.A N ARG 114.A O no hydrogen 3.334 N/A LYS 119.A N ASN 116.A O no hydrogen 2.572 N/A LEU 120.A N GLU 117.A O no hydrogen 2.960 N/A ASN 121.A N GLN 124.A OE1 no hydrogen 3.098 N/A HIS 122.A NE2 THR 215.A O no hydrogen 2.734 N/A HIS 123.A NE2 SER 92.A OG no hydrogen 2.627 N/A GLN 124.A N ASN 121.A OD1 no hydrogen 2.906 N/A GLN 124.A NE2 GLY 93.A O no hydrogen 2.727 N/A ARG 125.A N ASN 121.A O no hydrogen 2.893 N/A ARG 125.A NE GLU 117.A O no hydrogen 3.480 N/A ILE 126.A N HIS 122.A O no hydrogen 3.055 N/A GLY 127.A N HIS 123.A O no hydrogen 2.852 N/A LEU 128.A N GLN 124.A O no hydrogen 2.808 N/A LYS 129.A N ARG 125.A O no hydrogen 2.673 N/A LYS 129.A NZ TYR 130.A OH no hydrogen 3.043 N/A TYR 130.A N ILE 126.A O no hydrogen 2.955 N/A TYR 130.A OH ASP 214.A OD1 no hydrogen 2.634 N/A PHE 131.A N LEU 128.A O no hydrogen 3.184 N/A PHE 134.A N TYR 130.A O no hydrogen 2.825 N/A ILE 138.A N SER 176.A O no hydrogen 2.673 N/A GLU 142.A N PRO 139.A O no hydrogen 2.993 N/A MET 143.A N PRO 139.A O no hydrogen 3.242 N/A LEU 144.A N ARG 140.A O no hydrogen 2.967 N/A GLN 145.A N GLU 141.A O no hydrogen 3.259 N/A MET 146.A N GLU 142.A O no hydrogen 2.660 N/A GLN 147.A N MET 143.A O no hydrogen 2.310 N/A ASP 148.A N LEU 144.A O no hydrogen 2.683 N/A ILE 149.A N GLN 145.A O no hydrogen 3.314 N/A ILE 149.A N MET 146.A O no hydrogen 3.327 N/A VAL 150.A N MET 146.A O no hydrogen 3.227 N/A LEU 151.A N GLN 147.A O no hydrogen 3.057 N/A ASN 152.A N ASP 148.A O no hydrogen 3.302 N/A GLU 153.A N ILE 149.A O no hydrogen 2.515 N/A VAL 154.A N VAL 150.A O no hydrogen 2.679 N/A LYS 155.A N LEU 151.A O no hydrogen 2.930 N/A LYS 156.A N ASN 152.A O no hydrogen 3.269 N/A LYS 156.A NZ GLU 153.A OE1 no hydrogen 3.441 N/A LYS 156.A NZ GLU 153.A OE2 no hydrogen 2.965 N/A GLU 160.A N ASP 158.A OD1 no hydrogen 3.133 N/A TYR 161.A N ASP 158.A O no hydrogen 2.796 N/A TYR 161.A OH LEU 198.A O no hydrogen 2.533 N/A ILE 162.A N THR 184.A O no hydrogen 2.732 N/A THR 164.A N LEU 182.A O no hydrogen 3.088 N/A THR 164.A OG1 TYR 249.A OH no hydrogen 2.800 N/A CYS 166.A N ASP 180.A O no hydrogen 2.815 N/A CYS 166.A SG THR 164.A O no hydrogen 3.779 N/A GLY 167.A N PHE 256.A O no hydrogen 2.967 N/A SER 168.A OG SER 175.A O no hydrogen 3.459 N/A ARG 170.A NH1 GLU 300.A OE2 no hydrogen 2.053 N/A ARG 171.A N GLY 167.A O no hydrogen 3.417 N/A GLY 172.A N PHE 169.A O no hydrogen 2.929 N/A ALA 173.A N SER 168.A O no hydrogen 3.176 N/A SER 175.A OG GLU 174.A OE1 no hydrogen 3.522 N/A SER 176.A N ILE 138.A O no hydrogen 2.630 N/A VAL 181.A N ASP 240.A O no hydrogen 2.995 N/A LEU 182.A N THR 164.A O no hydrogen 2.929 N/A THR 184.A N ILE 162.A O no hydrogen 2.964 N/A THR 184.A OG1 ILE 244.A O no hydrogen 3.061 N/A HIS 185.A NE2 ASP 158.A OD2 no hydrogen 3.279 N/A SER 187.A N HIS 185.A ND1 no hydrogen 3.126 N/A PHE 188.A N HIS 185.A O no hydrogen 3.408 N/A SER 190.A N ASP 247.A OD2 no hydrogen 3.176 N/A SER 192.A N THR 189.A O no hydrogen 2.993 N/A THR 193.A N SER 192.A OG no hydrogen 2.168 N/A GLN 201.A N.A LYS 197.A O no hydrogen 2.947 N/A GLN 201.A N.B LYS 197.A O no hydrogen 2.951 N/A VAL 202.A N LEU 199.A O no hydrogen 3.189 N/A VAL 203.A N LEU 199.A O no hydrogen 3.272 N/A GLU 204.A N HIS 200.A O no hydrogen 2.802 N/A GLN 205.A NE2 GLU 153.A OE1 no hydrogen 2.296 N/A LEU 206.A N VAL 202.A O no hydrogen 2.828 N/A GLN 207.A N VAL 203.A O no hydrogen 2.820 N/A LYS 208.A N GLU 204.A O no hydrogen 3.138 N/A LYS 208.A N GLN 205.A O no hydrogen 2.936 N/A VAL 209.A N GLN 205.A O no hydrogen 3.299 N/A HIS 210.A N GLN 207.A O no hydrogen 2.801 N/A PHE 211.A N LEU 206.A O no hydrogen 2.965 N/A ILE 212.A N LEU 206.A O no hydrogen 3.006 N/A THR 213.A N VAL 226.A O no hydrogen 3.116 N/A THR 213.A OG1 ASP 214.A OD1 no hydrogen 3.012 N/A LEU 216.A N MET 224.A O no hydrogen 2.697 N/A SER 217.A N MET 224.A O no hydrogen 3.355 N/A LYS 218.A NZ HIS 200.A ND1 no hydrogen 2.911 N/A GLY 219.A N LYS 222.A O no hydrogen 3.106 N/A PHE 223.A N ILE 241.A O no hydrogen 2.902 N/A MET 224.A N SER 217.A O no hydrogen 2.818 N/A GLY 225.A N ILE 239.A O no hydrogen 2.882 N/A VAL 226.A N ASP 214.A O no hydrogen 2.956 N/A CYS 227.A N ARG 237.A O no hydrogen 2.825 N/A CYS 227.A SG ARG 237.A O no hydrogen 3.725 N/A HIS 236.A N ASP 133.A OD2 no hydrogen 3.061 N/A ARG 237.A N CYS 227.A O no hydrogen 2.940 N/A ARG 237.A NH2 GLU 142.A OE2 no hydrogen 3.531 N/A ARG 238.A NH1 GLY 225.A O no hydrogen 2.920 N/A ARG 238.A NH1 ILE 239.A O no hydrogen 2.693 N/A ARG 238.A NH1 ASP 240.A OD1 no hydrogen 2.752 N/A ARG 238.A NH2 ASP 240.A OD1 no hydrogen 2.518 N/A ARG 238.A NH2 ASP 240.A OD2 no hydrogen 3.504 N/A ILE 239.A N GLY 225.A O no hydrogen 2.858 N/A ASP 240.A N MET 179.A O no hydrogen 2.814 N/A ILE 241.A N PHE 223.A O no hydrogen 3.127 N/A ARG 242.A N VAL 181.A O no hydrogen 2.860 N/A ARG 242.A NH2 ASP 180.A OD2 no hydrogen 3.001 N/A LEU 243.A N THR 221.A O no hydrogen 2.787 N/A ILE 244.A N LEU 183.A O no hydrogen 2.917 N/A LYS 246.A N PHE 188.A O no hydrogen 3.090 N/A GLN 248.A N PRO 245.A O no hydrogen 3.090 N/A TYR 249.A N LYS 246.A O no hydrogen 3.130 N/A TYR 249.A OH THR 164.A OG1 no hydrogen 2.800 N/A TYR 249.A OH LEU 182.A O no hydrogen 3.134 N/A GLY 252.A N GLN 248.A O no hydrogen 2.791 N/A VAL 253.A N TYR 249.A O no hydrogen 2.618 N/A LEU 254.A N TYR 250.A O no hydrogen 2.731 N/A TYR 255.A N CYS 251.A O no hydrogen 2.955 N/A PHE 256.A N GLY 252.A O no hydrogen 2.811 N/A THR 257.A OG1 VAL 253.A O no hydrogen 2.629 N/A SER 259.A N ARG 317.A O no hydrogen 2.768 N/A SER 259.A OG ARG 317.A O no hydrogen 3.299 N/A SER 259.A OG SER 318.A O no hydrogen 2.817 N/A ASN 263.A N SER 259.A O no hydrogen 2.901 N/A ASN 263.A ND2 TYR 255.A O no hydrogen 3.078 N/A LYS 264.A N ASP 260.A O no hydrogen 2.887 N/A ASN 265.A N ILE 261.A O no hydrogen 3.269 N/A MET 266.A N PHE 262.A O no hydrogen 3.007 N/A ARG 267.A N ASN 263.A O no hydrogen 2.813 N/A ALA 268.A N LYS 264.A O no hydrogen 3.086 N/A HIS 269.A N ASN 265.A O no hydrogen 2.719 N/A ALA 270.A N MET 266.A O no hydrogen 2.777 N/A LEU 271.A N ARG 267.A O no hydrogen 3.158 N/A GLU 272.A N ALA 268.A O no hydrogen 3.276 N/A LYS 273.A N HIS 269.A O no hydrogen 3.146 N/A GLY 274.A N LEU 271.A O no hydrogen 3.229 N/A PHE 275.A N ALA 270.A O no hydrogen 2.736 N/A THR 276.A N ARG 283.A O no hydrogen 3.085 N/A ASN 278.A N THR 281.A O no hydrogen 3.211 N/A TYR 280.A N ASN 278.A OD1 no hydrogen 2.933 N/A THR 281.A N ASN 278.A OD1 no hydrogen 2.564 N/A THR 281.A OG1 ASN 278.A OD1 no hydrogen 3.552 N/A ARG 283.A N THR 276.A O no hydrogen 3.237 N/A LEU 285.A N GLY 274.A O no hydrogen 2.994 N/A GLY 286.A N VAL 290.A O no hydrogen 2.782 N/A GLY 289.A N GLY 286.A O no hydrogen 2.635 N/A GLY 292.A N PRO 284.A O no hydrogen 2.488 N/A LEU 295.A N ILE 282.A O no hydrogen 2.873 N/A ASP 298.A N ASP 302.A OD2 no hydrogen 2.837 N/A SER 299.A N ASP 302.A OD2 no hydrogen 3.329 N/A ILE 303.A N GLU 300.A O no hydrogen 3.254 N/A ASP 305.A N LYS 301.A O no hydrogen 2.631 N/A ASP 305.A N ASP 302.A O no hydrogen 3.075 N/A TYR 306.A N ASP 302.A O no hydrogen 3.155 N/A TYR 306.A OH PRO 296.A O no hydrogen 2.547 N/A GLN 308.A N ASP 305.A O no hydrogen 2.903 N/A TRP 309.A N PHE 304.A O no hydrogen 2.748 N/A ARG 312.A NH2 ASP 316.A O no hydrogen 3.403 N/A ASP 316.A N GLU 313.A O no hydrogen 3.049 N/A ARG 317.A N PRO 314.A O no hydrogen 2.901 N/A ARG 317.A NE ARG 312.A O no hydrogen 2.778 N/A ARG 317.A NH1 GLU 300.A OE1 no hydrogen 2.514 N/A ARG 317.A NH2 GLU 300.A OE1 no hydrogen 2.569 N/A ARG 317.A NH2 ARG 312.A O no hydrogen 3.140 N/A