Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4nd3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A NH1 ASP 30.A OD1 no hydrogen 3.077 N/A ARG 4.A NH1 THR 58.A O no hydrogen 2.739 N/A LYS 6.A N ASP 74.A OD2 no hydrogen 2.890 N/A LYS 6.A NZ ASP 69.A O no hydrogen 2.782 N/A LYS 6.A NZ SER 71.A O no hydrogen 2.682 N/A ILE 7.A N ASP 30.A O no hydrogen 2.791 N/A ALA 8.A N VAL 75.A O no hydrogen 2.835 N/A VAL 9.A N VAL 32.A O no hydrogen 2.809 N/A ILE 10.A N ILE 77.A O no hydrogen 2.838 N/A GLY 11.A N PHE 34.A O no hydrogen 2.734 N/A SER 12.A N ASP 35.A OD2 no hydrogen 2.784 N/A SER 12.A OG PHE 34.A O no hydrogen 3.049 N/A GLY 17.A N GLY 13.A O no hydrogen 3.066 N/A ILE 19.A N ILE 15.A O no hydrogen 2.948 N/A ALA 20.A N GLY 16.A O no hydrogen 3.152 N/A TYR 21.A N GLY 17.A O no hydrogen 3.005 N/A ILE 22.A N ASN 18.A O no hydrogen 2.927 N/A VAL 23.A N ILE 19.A O no hydrogen 2.822 N/A GLY 24.A N ALA 20.A O no hydrogen 2.875 N/A LYS 25.A N TYR 21.A O no hydrogen 2.880 N/A ASP 26.A N ILE 22.A O no hydrogen 2.882 N/A ASN 27.A N GLY 24.A O no hydrogen 3.057 N/A LEU 28.A N VAL 23.A O no hydrogen 3.142 N/A ASP 30.A N ARG 5.A O no hydrogen 2.737 N/A VAL 31.A N LYS 60.A O no hydrogen 2.880 N/A VAL 32.A N ILE 7.A O no hydrogen 2.908 N/A LEU 33.A N ILE 62.A O no hydrogen 2.739 N/A PHE 34.A N VAL 9.A O no hydrogen 2.810 N/A ASP 35.A N THR 64.A O no hydrogen 3.066 N/A ALA 37.A N ASP 35.A OD1 no hydrogen 2.945 N/A GLN 42.A N GLN 42.A OE1 no hydrogen 2.911 N/A GLY 43.A N GLY 39.A O no hydrogen 2.877 N/A LYS 44.A N ILE 40.A O no hydrogen 3.086 N/A LYS 44.A NZ SER 12.A O no hydrogen 2.748 N/A LYS 44.A NZ GLY 13.A O no hydrogen 2.886 N/A ALA 45.A N PRO 41.A O no hydrogen 2.807 N/A LEU 46.A N GLN 42.A O no hydrogen 3.024 N/A ASP 47.A N GLY 43.A O no hydrogen 3.039 N/A ILE 48.A N LYS 44.A O no hydrogen 2.852 N/A THR 49.A N ALA 45.A O no hydrogen 2.799 N/A THR 49.A OG1 ALA 45.A O no hydrogen 2.699 N/A HIS 50.A N LEU 46.A O no hydrogen 3.127 N/A SER 51.A N ILE 48.A O no hydrogen 3.008 N/A SER 51.A OG ILE 48.A O no hydrogen 2.617 N/A MET 52.A N THR 49.A O no hydrogen 3.065 N/A SER 57.A N MET 52.A O no hydrogen 3.013 N/A SER 57.A OG GLY 24.A O no hydrogen 2.645 N/A SER 59.A N SER 57.A OG no hydrogen 3.062 N/A SER 59.A OG ASN 27.A OD1 no hydrogen 3.012 N/A SER 59.A OG ALA 29.A O no hydrogen 2.729 N/A LYS 60.A N ASP 30.A OD1 no hydrogen 2.871 N/A ILE 62.A N VAL 31.A O no hydrogen 3.094 N/A THR 64.A N LEU 33.A O no hydrogen 2.821 N/A THR 64.A OG1 ASP 66.A O no hydrogen 3.547 N/A THR 64.A OG1 ASP 69.A OD2 no hydrogen 2.547 N/A ASP 66.A N THR 64.A OG1 no hydrogen 2.941 N/A ALA 68.A N ASP 66.A OD2 no hydrogen 3.069 N/A ASP 69.A N ASP 66.A O no hydrogen 2.999 N/A ILE 70.A N TYR 67.A O no hydrogen 3.059 N/A SER 71.A N ALA 68.A O no hydrogen 3.223 N/A SER 71.A OG ALA 68.A O no hydrogen 3.238 N/A SER 73.A N ILE 70.A O no hydrogen 3.172 N/A SER 73.A OG ILE 70.A O no hydrogen 2.621 N/A ASP 74.A N LYS 6.A O no hydrogen 2.829 N/A VAL 75.A N LYS 6.A O no hydrogen 3.259 N/A VAL 76.A N PHE 116.A O no hydrogen 2.918 N/A ILE 77.A N ALA 8.A O no hydrogen 2.800 N/A ILE 78.A N ILE 118.A O no hydrogen 3.006 N/A THR 79.A N ILE 10.A O no hydrogen 2.819 N/A THR 79.A OG1 ILE 10.A O no hydrogen 3.342 N/A THR 79.A OG1 GLY 11.A O no hydrogen 2.685 N/A SER 81.A OG ILE 82.A O no hydrogen 3.032 N/A SER 81.A OG ASN 97.A OD1 no hydrogen 3.434 N/A ILE 82.A N ASN 97.A OD1 no hydrogen 2.861 N/A ARG 85.A NE PRO 86.A O no hydrogen 2.784 N/A ARG 85.A NH1 ASP 225.A OD1 no hydrogen 2.958 N/A ARG 85.A NH2 PRO 86.A O no hydrogen 3.041 N/A LYS 87.A N GLU 92.A OE2 no hydrogen 2.811 N/A ASP 88.A N GLU 92.A OE1 no hydrogen 2.764 N/A ASP 89.A N GLU 92.A OE1 no hydrogen 2.890 N/A SER 91.A N ASP 89.A OD1 no hydrogen 2.869 N/A SER 91.A OG ASP 89.A OD1 no hydrogen 2.692 N/A GLU 92.A N ASP 89.A O no hydrogen 3.132 N/A LEU 93.A N ARG 90.A O no hydrogen 3.307 N/A LEU 94.A N SER 91.A O no hydrogen 2.965 N/A ASN 97.A N LEU 93.A O no hydrogen 3.062 N/A ASN 97.A ND2 SER 81.A OG no hydrogen 3.132 N/A ASN 97.A ND2 ASN 122.A O no hydrogen 2.841 N/A ALA 98.A N LEU 94.A O no hydrogen 3.073 N/A ILE 100.A N GLY 96.A O no hydrogen 3.202 N/A LEU 101.A N ASN 97.A O no hydrogen 2.970 N/A ASP 102.A N ALA 98.A O no hydrogen 3.101 N/A SER 103.A N ARG 99.A O no hydrogen 3.429 N/A VAL 104.A N ILE 100.A O no hydrogen 2.981 N/A ALA 105.A N LEU 101.A O no hydrogen 2.805 N/A GLU 106.A N ASP 102.A O no hydrogen 3.304 N/A GLY 107.A N SER 103.A O no hydrogen 3.239 N/A VAL 108.A N VAL 104.A O no hydrogen 2.974 N/A LYS 109.A N ALA 105.A O no hydrogen 2.902 N/A LYS 110.A N GLU 106.A O no hydrogen 3.130 N/A LYS 110.A NZ TYR 111.A OH no hydrogen 3.389 N/A TYR 111.A N GLY 107.A O no hydrogen 3.045 N/A CYS 112.A N VAL 108.A O no hydrogen 2.843 N/A CYS 112.A SG ILE 70.A O no hydrogen 3.613 N/A ALA 115.A N CYS 112.A O no hydrogen 3.292 N/A PHE 116.A N ASP 74.A O no hydrogen 2.994 N/A VAL 117.A N LYS 141.A O no hydrogen 2.762 N/A ILE 118.A N VAL 76.A O no hydrogen 2.814 N/A CYS 119.A N CYS 143.A O no hydrogen 2.790 N/A CYS 119.A SG THR 121.A O no hydrogen 4.026 N/A ILE 120.A N ILE 78.A O no hydrogen 2.892 N/A THR 121.A N ILE 78.A O no hydrogen 3.226 N/A THR 121.A OG1 ILE 78.A O no hydrogen 3.310 N/A THR 121.A OG1 ALA 80.A O no hydrogen 2.765 N/A LEU 124.A N ASN 122.A OD1 no hydrogen 3.068 N/A MET 127.A N PRO 123.A O no hydrogen 3.013 N/A VAL 128.A N LEU 124.A O no hydrogen 2.929 N/A SER 129.A N ASP 125.A O no hydrogen 3.265 N/A HIS 130.A N VAL 126.A O no hydrogen 2.860 N/A HIS 130.A NE2 ALA 98.A O no hydrogen 2.956 N/A PHE 131.A N MET 127.A O no hydrogen 2.764 N/A GLN 132.A N VAL 128.A O no hydrogen 3.004 N/A GLN 132.A NE2 LEU 137.A O no hydrogen 2.788 N/A LYS 133.A N SER 129.A O no hydrogen 3.088 N/A VAL 134.A N HIS 130.A O no hydrogen 3.045 N/A SER 135.A N PHE 131.A O no hydrogen 2.845 N/A SER 135.A OG PHE 131.A O no hydrogen 2.696 N/A SER 135.A OG GLN 132.A O no hydrogen 3.442 N/A GLY 136.A N GLN 132.A O no hydrogen 2.988 N/A LEU 137.A N SER 135.A OG no hydrogen 3.275 N/A ASN 140.A ND2 ASN 281.A O no hydrogen 2.890 N/A LYS 141.A N PRO 138.A O no hydrogen 3.006 N/A LYS 141.A NZ ASN 114B.A O no hydrogen 2.855 N/A VAL 142.A N HIS 139.A O no hydrogen 3.300 N/A CYS 143.A N VAL 117.A O no hydrogen 2.989 N/A CYS 143.A SG VAL 117.A O no hydrogen 3.961 N/A GLY 144.A N SER 258.A O no hydrogen 2.896 N/A MET 145.A N CYS 119.A O no hydrogen 2.798 N/A ASP 150.A N ALA 146.A O no hydrogen 2.869 N/A SER 151.A N GLY 147.A O no hydrogen 2.653 N/A SER 151.A OG GLY 147.A O no hydrogen 2.706 N/A SER 152.A N VAL 148.A O no hydrogen 2.896 N/A SER 152.A OG VAL 148.A O no hydrogen 2.572 N/A ARG 153.A N LEU 149.A O no hydrogen 3.036 N/A PHE 154.A N ASP 150.A O no hydrogen 2.984 N/A ARG 155.A N SER 151.A O no hydrogen 2.740 N/A ARG 155.A NE VAL 169.A O no hydrogen 2.726 N/A ARG 155.A NH2 ALA 166.A O no hydrogen 3.443 N/A ARG 155.A NH2 SER 167.A O no hydrogen 3.352 N/A ARG 155.A NH2 VAL 169.A O no hydrogen 3.200 N/A THR 156.A N SER 152.A O no hydrogen 2.864 N/A THR 156.A OG1 SER 152.A O no hydrogen 2.545 N/A PHE 157.A N ARG 153.A O no hydrogen 2.978 N/A ILE 158.A N PHE 154.A O no hydrogen 3.142 N/A ALA 159.A N ARG 155.A O no hydrogen 2.840 N/A GLN 160.A N THR 156.A O no hydrogen 2.774 N/A HIS 161.A N PHE 157.A O no hydrogen 3.168 N/A HIS 161.A NE2 LEU 203.A O no hydrogen 2.765 N/A PHE 162.A N ILE 158.A O no hydrogen 3.179 N/A VAL 164.A N ALA 159.A O no hydrogen 3.168 N/A SER 167.A N ASN 165.A OD1 no hydrogen 2.984 N/A SER 167.A OG ASN 165.A OD1 no hydrogen 3.410 N/A ASP 168.A N ASN 165.A O no hydrogen 2.874 N/A VAL 169.A N ALA 166.A O no hydrogen 3.006 N/A SER 170.A N SER 189.A O no hydrogen 2.864 N/A VAL 173.A N SER 151.A OG no hydrogen 2.957 N/A ILE 174.A N VAL 182.A O no hydrogen 2.886 N/A GLY 175.A N GLY 273.A O no hydrogen 2.781 N/A GLY 176.A N SER 302.A OG no hydrogen 2.872 N/A HIS 177.A N ASP 125.A OD2 no hydrogen 2.606 N/A HIS 177.A ND1 ASP 150.A OD2 no hydrogen 2.641 N/A GLY 178.A N GLY 176.A O no hydrogen 2.922 N/A GLY 180.A N GLU 305.A OE1 no hydrogen 3.222 N/A MET 181.A N GLY 178.A O no hydrogen 3.116 N/A VAL 182.A N ILE 174.A O no hydrogen 2.794 N/A ALA 184.A N ASN 172.A O no hydrogen 2.970 N/A SER 186.A N GLU 295.A OE2 no hydrogen 2.970 N/A SER 186.A OG ASP 290.A O no hydrogen 3.146 N/A SER 186.A OG GLU 295.A OE1 no hydrogen 2.677 N/A SER 186.A OG GLU 295.A OE2 no hydrogen 3.368 N/A SER 187.A N ALA 184.A O no hydrogen 3.340 N/A SER 187.A OG ALA 184.A O no hydrogen 3.428 N/A VAL 188.A N THR 185.A O no hydrogen 3.181 N/A SER 189.A N SER 170.A O no hydrogen 2.973 N/A VAL 190.A N VAL 193A.A O no hydrogen 2.860 N/A SER 197.A N PRO 194B.A O no hydrogen 3.145 N/A PHE 198.A N PRO 194B.A O no hydrogen 3.464 N/A ILE 199.A N LEU 195.A O no hydrogen 2.983 N/A LYS 200.A N SER 196.A O no hydrogen 3.204 N/A LEU 203.A N PHE 198.A O no hydrogen 2.836 N/A ILE 204.A N PHE 198.A O no hydrogen 3.346 N/A THR 205.A N GLN 208.A OE1 no hydrogen 2.813 N/A GLN 206.A NE2 ASP 210.A OD1 no hydrogen 3.003 N/A GLN 208.A N THR 205.A OG1 no hydrogen 3.106 N/A ILE 209.A N THR 205.A O no hydrogen 2.974 N/A ASP 210.A N GLN 206.A O no hydrogen 2.794 N/A GLU 211.A N GLU 207.A O no hydrogen 2.900 N/A ILE 212.A N GLN 208.A O no hydrogen 3.068 N/A VAL 213.A N ILE 209.A O no hydrogen 2.984 N/A CYS 214.A N ASP 210.A O no hydrogen 2.988 N/A HIS 215.A N GLU 211.A O no hydrogen 2.764 N/A HIS 215.A NE2 GLU 222.A OE2 no hydrogen 2.639 N/A THR 216.A N ILE 212.A O no hydrogen 2.977 N/A THR 216.A OG1 ILE 212.A O no hydrogen 2.729 N/A ARG 217.A N VAL 213.A O no hydrogen 3.079 N/A ARG 217.A NH1 MET 181.A O no hydrogen 2.936 N/A ILE 218.A N CYS 214.A O no hydrogen 3.049 N/A LYS 221.A N ILE 218.A O no hydrogen 3.205 N/A LYS 221.A NZ ASP 88.A O no hydrogen 3.171 N/A VAL 223.A N ALA 219.A O no hydrogen 3.257 N/A ALA 224.A N TRP 220.A O no hydrogen 2.912 N/A ASP 225.A N LYS 221.A O no hydrogen 2.823 N/A ASN 226.A N VAL 223.A O no hydrogen 3.037 N/A ASN 226.A ND2 GLU 222.A O no hydrogen 2.636 N/A LEU 227.A N VAL 223.A O no hydrogen 2.970 N/A ALA 237.A N TYR 233.A O no hydrogen 3.285 N/A ALA 238.A N PHE 234.A O no hydrogen 3.183 N/A ALA 239.A N ALA 235.A O no hydrogen 2.825 N/A ALA 240.A N PRO 236.A O no hydrogen 3.053 N/A VAL 241.A N ALA 237.A O no hydrogen 3.093 N/A LYS 242.A N ALA 238.A O no hydrogen 3.086 N/A LYS 242.A NZ GLU 245.A OE1 no hydrogen 3.084 N/A MET 243.A N ALA 239.A O no hydrogen 3.148 N/A ALA 244.A N ALA 240.A O no hydrogen 2.915 N/A GLU 245.A N VAL 241.A O no hydrogen 2.762 N/A ALA 246.A N LYS 242.A O no hydrogen 3.113 N/A TYR 247.A N MET 243.A O no hydrogen 3.344 N/A LEU 248.A N ALA 244.A O no hydrogen 2.924 N/A LYS 249.A N GLU 245.A O no hydrogen 2.865 N/A ASP 250.A N TYR 247.A O no hydrogen 3.233 N/A LYS 251.A N ALA 246.A O no hydrogen 2.982 N/A LYS 251.A NZ GLU 245.A OE1 no hydrogen 2.787 N/A LYS 252.A NZ ASP 250.A OD1 no hydrogen 2.661 N/A LYS 252.A NZ GLU 284.A OE1 no hydrogen 3.238 N/A LYS 252.A NZ GLU 284.A OE2 no hydrogen 2.858 N/A ALA 253.A N ILE 278.A O no hydrogen 3.110 N/A VAL 255.A N THR 276.A O no hydrogen 2.732 N/A CYS 257.A N VAL 274.A O no hydrogen 3.016 N/A CYS 257.A SG VAL 255.A O no hydrogen 4.016 N/A CYS 257.A SG THR 276.A OG1 no hydrogen 3.560 N/A SER 258.A N GLY 144.A O no hydrogen 2.946 N/A SER 258.A OG ASP 125.A OD1 no hydrogen 2.778 N/A ALA 259.A N MET 272.A O no hydrogen 3.204 N/A CYS 261.A N ILE 270.A O no hydrogen 2.822 N/A CYS 261.A SG HIS 264.A O no hydrogen 3.417 N/A HIS 264.A ND1 GLU 288.A OE2 no hydrogen 3.180 N/A TYR 265.A N GLU 288.A OE1 no hydrogen 3.351 N/A TYR 265.A OH LEU 287.A O no hydrogen 2.643 N/A VAL 267.A N HIS 264.A O no hydrogen 3.227 N/A GLY 269.A N CYS 261.A O no hydrogen 3.255 N/A ILE 270.A N CYS 261.A O no hydrogen 3.179 N/A TYR 271.A OH HIS 139.A O no hydrogen 3.045 N/A TYR 271.A OH VAL 142.A O no hydrogen 2.994 N/A MET 272.A N ALA 259.A O no hydrogen 3.265 N/A GLY 273.A N GLY 175.A O no hydrogen 2.882 N/A VAL 274.A N CYS 257.A O no hydrogen 2.941 N/A THR 276.A N VAL 255.A O no hydrogen 2.885 N/A THR 276.A OG1 VAL 255.A O no hydrogen 2.596 N/A ILE 277.A N ASP 285.A O no hydrogen 2.918 N/A ILE 278.A N ALA 253.A O no hydrogen 2.956 N/A GLY 279.A N GLY 282.A O no hydrogen 2.998 N/A LYS 280.A N ASP 250.A OD1 no hydrogen 2.849 N/A ASN 281.A N GLU 284.A OE1 no hydrogen 2.910 N/A GLY 282.A N GLY 279.A O no hydrogen 2.881 N/A VAL 283.A N ASN 140.A O no hydrogen 2.837 N/A GLU 284.A N ILE 277.A O no hydrogen 2.811 N/A ILE 286.A N ASP 285.A OD1 no hydrogen 2.902 N/A LEU 287.A N PRO 275.A O no hydrogen 2.822 N/A LEU 289.A N TYR 265.A OH no hydrogen 2.975 N/A THR 292.A N GLU 295.A OE1 no hydrogen 3.164 N/A GLU 295.A N THR 292.A OG1 no hydrogen 3.113 N/A GLN 296.A N THR 292.A O no hydrogen 2.845 N/A LYS 297.A N PRO 293.A O no hydrogen 3.093 N/A LEU 298.A N LEU 294.A O no hydrogen 3.021 N/A LEU 299.A N GLU 295.A O no hydrogen 2.865 N/A GLY 300.A N GLN 296.A O no hydrogen 3.008 N/A GLU 301.A N LYS 297.A O no hydrogen 2.896 N/A SER 302.A N LEU 298.A O no hydrogen 2.951 N/A SER 302.A OG GLY 180.A O no hydrogen 3.220 N/A ILE 303.A N LEU 299.A O no hydrogen 2.917 N/A ASN 304.A N GLY 300.A O no hydrogen 3.072 N/A GLU 305.A N GLU 301.A O no hydrogen 3.241 N/A VAL 306.A N SER 302.A O no hydrogen 3.117 N/A ASN 307.A N ILE 303.A O no hydrogen 2.965 N/A THR 308.A N ASN 304.A O no hydrogen 2.851 N/A THR 308.A OG1 ASN 304.A O no hydrogen 2.743 N/A ILE 309.A N GLU 305.A O no hydrogen 3.057 N/A SER 310.A N VAL 306.A O no hydrogen 2.965 N/A LYS 311.A N ASN 307.A O no hydrogen 2.921 N/A VAL 312.A N THR 308.A O no hydrogen 3.101 N/A LEU 313.A N ILE 309.A O no hydrogen 3.054 N/A ASP 314.A N SER 310.A O no hydrogen 3.065 N/A ASN 315.A N LYS 311.A O no hydrogen 3.102 N/A ASN 315.A N VAL 312.A O no hydrogen 3.195 N/A PHE 55A.A N SER 51.A O no hydrogen 3.149 N/A GLY 191A.A N ASP 168.A O no hydrogen 3.130 N/A VAL 193A.A N VAL 190.A O no hydrogen 3.230 N/A GLN 201A.A N SER 197.A O no hydrogen 2.846 N/A LYS 228A.A N ALA 224.A O no hydrogen 2.890 N/A LYS 228A.A NZ ASP 225.A O no hydrogen 3.443 N/A GLY 56B.A N VAL 53.A O no hydrogen 3.332 N/A GLY 202B.A N ILE 199.A O no hydrogen 3.026 N/A THR 229B.A N LEU 227.A O no hydrogen 2.761 N/A