Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1nml_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N ASP 1.A O no hydrogen 2.985 N/A ARG 6.A N ASN 2.A O no hydrogen 2.700 N/A ARG 6.A NH1 ASP 194.A OD1 no hydrogen 3.459 N/A ARG 6.A NH2 ASP 194.A OD1 no hydrogen 2.726 N/A ALA 7.A N LEU 3.A O no hydrogen 2.852 N/A ASN 8.A N MET 4.A O no hydrogen 2.976 N/A ASN 8.A ND2 MET 4.A O no hydrogen 3.165 N/A ASN 8.A ND2 LEU 174.A O no hydrogen 2.860 N/A SER 9.A N ARG 6.A O no hydrogen 2.715 N/A SER 9.A OG ARG 6.A O no hydrogen 2.631 N/A MET 10.A N ARG 6.A O no hydrogen 3.154 N/A MET 10.A N ALA 7.A O no hydrogen 3.220 N/A PHE 11.A N ALA 7.A O no hydrogen 2.846 N/A ILE 14.A N ASP 171.A OD2 no hydrogen 2.821 N/A ASN 24.A N ILE 21.A O no hydrogen 2.875 N/A ASN 24.A ND2 VAL 154.A O no hydrogen 2.932 N/A LYS 30.A N THR 27.A OG1 no hydrogen 3.126 N/A LYS 30.A NZ ASN 24.A OD1 no hydrogen 2.680 N/A LYS 30.A NZ GLU 25.A O no hydrogen 2.783 N/A VAL 31.A N THR 27.A O no hydrogen 2.999 N/A GLU 32.A N GLN 28.A O no hydrogen 2.949 N/A LEU 33.A N ALA 29.A O no hydrogen 3.113 N/A GLY 34.A N LYS 30.A O no hydrogen 2.821 N/A LYS 35.A N VAL 31.A O no hydrogen 2.851 N/A LYS 35.A NZ THR 297.A O no hydrogen 2.743 N/A MET 36.A N GLU 32.A O no hydrogen 3.043 N/A GLU 37.A N LEU 33.A O no hydrogen 3.042 N/A PHE 38.A N GLY 34.A O no hydrogen 2.838 N/A PHE 39.A N LYS 35.A O no hydrogen 3.201 N/A PHE 39.A N MET 36.A O no hydrogen 3.276 N/A GLU 40.A N GLU 37.A O no hydrogen 3.053 N/A ARG 42.A N GLU 40.A OE2 no hydrogen 2.787 N/A ARG 42.A NE GLU 40.A OE2 no hydrogen 2.710 N/A ARG 42.A NH1 PRO 302.A O no hydrogen 2.767 N/A ARG 42.A NH1 SER 304.A OG no hydrogen 3.055 N/A ARG 42.A NH2 GLU 40.A OE1 no hydrogen 2.828 N/A ARG 42.A NH2 PRO 302.A O no hydrogen 2.747 N/A SER 44.A N PRO 41.A O no hydrogen 3.329 N/A SER 44.A OG PRO 41.A O no hydrogen 2.710 N/A SER 44.A OG ILE 49.A O no hydrogen 3.162 N/A HIS 47.A N SER 44.A O no hydrogen 3.087 N/A LEU 48.A N SER 46.A OG no hydrogen 3.347 N/A ILE 49.A N SER 44.A OG no hydrogen 3.182 N/A SER 50.A N THR 53.A OG1 no hydrogen 2.947 N/A ASN 52.A N PHE 38.A O no hydrogen 3.288 N/A ASN 52.A ND2 HIS 55.A O no hydrogen 3.364 N/A THR 53.A N SER 50.A O no hydrogen 3.049 N/A THR 53.A OG1 SER 50.A O no hydrogen 3.196 N/A CYS 54.A N CYS 51.A O no hydrogen 3.023 N/A HIS 55.A N CYS 51.A O no hydrogen 2.871 N/A HIS 55.A ND1 GLY 61.A O no hydrogen 3.198 N/A ASN 56.A N ASP 62.A O no hydrogen 3.385 N/A GLY 58.A N ASN 56.A OD1 no hydrogen 2.872 N/A LEU 59.A N ASN 56.A O no hydrogen 2.930 N/A GLY 61.A N ASN 56.A O no hydrogen 2.741 N/A ASP 63.A N SER 80.A OG no hydrogen 2.757 N/A LEU 65.A N ASP 63.A OD2 no hydrogen 3.383 N/A THR 67.A N ARG 78.A O no hydrogen 2.971 N/A ILE 69.A N THR 67.A OG1 no hydrogen 3.147 N/A HIS 71.A ND1 GLU 114.A O no hydrogen 2.723 N/A GLY 72.A N SER 116.A OG no hydrogen 2.746 N/A TRP 73.A N GLY 70.A O no hydrogen 3.088 N/A TRP 73.A NE1 GLY 76.A O no hydrogen 2.712 N/A ARG 78.A N THR 67.A O no hydrogen 2.853 N/A ARG 78.A NE THR 67.A O no hydrogen 3.051 N/A ARG 78.A NH2 THR 67.A O no hydrogen 3.106 N/A ARG 78.A NH2 ILE 69.A O no hydrogen 2.458 N/A ASN 79.A N HIS 251.A O no hydrogen 2.772 N/A THR 82.A OG1 GLY 60.A O no hydrogen 2.745 N/A VAL 83.A N GLY 61.A O no hydrogen 3.066 N/A PHE 84.A N THR 82.A OG1 no hydrogen 2.946 N/A ASN 85.A N LEU 163.A O no hydrogen 2.751 N/A ASN 85.A ND2 THR 165.A OG1 no hydrogen 3.045 N/A ALA 86.A N VAL 83.A O no hydrogen 3.122 N/A PHE 88.A N ASN 85.A O no hydrogen 3.034 N/A ASN 89.A N ALA 86.A O no hydrogen 2.964 N/A ALA 90.A N GLN 209.A OE1 no hydrogen 2.994 N/A ALA 91.A N GLY 208.A O no hydrogen 3.124 N/A GLN 92.A N TYR 211.A OH no hydrogen 3.040 N/A GLN 92.A NE2 LYS 106.A O no hydrogen 3.196 N/A TRP 94.A NE1 ARG 97.A O no hydrogen 3.141 N/A ARG 97.A NH1 GLU 232.A OE2 no hydrogen 2.400 N/A ARG 97.A NH2 GLU 232.A OE2 no hydrogen 2.838 N/A ALA 98.A N GLU 232.A O no hydrogen 3.012 N/A ASP 100.A N ARG 97.A O no hydrogen 3.025 N/A LEU 101.A N ALA 98.A O no hydrogen 3.204 N/A GLN 104.A N ASP 100.A O no hydrogen 2.957 N/A ALA 105.A N LEU 101.A O no hydrogen 2.878 N/A ALA 111.A N GLY 107.A O no hydrogen 2.772 N/A GLY 112.A N PRO 108.A O no hydrogen 2.818 N/A VAL 113.A N GLN 110.A O no hydrogen 3.094 N/A GLU 114.A N ALA 111.A O no hydrogen 3.152 N/A SER 117.A OG LEU 43.A O no hydrogen 2.627 N/A ARG 121.A N THR 118.A OG1 no hydrogen 3.280 N/A ARG 121.A NH2 SER 45.A O no hydrogen 3.440 N/A VAL 122.A N THR 118.A O no hydrogen 3.203 N/A VAL 123.A N PRO 119.A O no hydrogen 2.956 N/A ALA 124.A N ASP 120.A O no hydrogen 2.982 N/A THR 125.A N ARG 121.A O no hydrogen 2.943 N/A THR 125.A OG1 ARG 121.A O no hydrogen 2.860 N/A LEU 126.A N VAL 122.A O no hydrogen 2.903 N/A LYS 127.A N VAL 123.A O no hydrogen 2.762 N/A LYS 127.A NZ ASN 145.A OD1 no hydrogen 3.062 N/A SER 128.A N ALA 124.A O no hydrogen 3.032 N/A SER 128.A N THR 125.A O no hydrogen 3.152 N/A SER 128.A OG THR 125.A O no hydrogen 2.518 N/A SER 128.A OG THR 308.A OG1 no hydrogen 2.784 N/A MET 129.A N LEU 126.A O no hydrogen 3.345 N/A TYR 132.A N MET 129.A O no hydrogen 2.906 N/A TYR 132.A OH GLU 40.A OE1 no hydrogen 2.654 N/A ILE 133.A N MET 129.A O no hydrogen 3.314 N/A GLU 134.A N PRO 130.A O no hydrogen 3.049 N/A ARG 135.A N GLU 131.A O no hydrogen 2.951 N/A ARG 135.A NE GLU 131.A OE2 no hydrogen 2.929 N/A ARG 135.A NH2 GLU 131.A OE2 no hydrogen 3.303 N/A PHE 136.A N TYR 132.A O no hydrogen 2.868 N/A GLU 137.A N ILE 133.A O no hydrogen 2.897 N/A ASP 138.A N GLU 134.A O no hydrogen 2.881 N/A ALA 139.A N ARG 135.A O no hydrogen 2.997 N/A PHE 140.A N PHE 136.A O no hydrogen 2.804 N/A GLN 143.A N PHE 140.A O no hydrogen 3.322 N/A ASN 151.A N THR 148.A OG1 no hydrogen 3.083 N/A MET 152.A N THR 148.A O no hydrogen 2.946 N/A ALA 153.A N PHE 149.A O no hydrogen 2.937 N/A VAL 154.A N ASP 150.A O no hydrogen 2.899 N/A ALA 155.A N ASN 151.A O no hydrogen 2.953 N/A ILE 156.A N MET 152.A O no hydrogen 2.993 N/A GLU 157.A N ALA 153.A O no hydrogen 2.966 N/A ALA 158.A N VAL 154.A O no hydrogen 2.948 N/A TYR 159.A N ALA 155.A O no hydrogen 3.074 N/A GLU 160.A N ILE 156.A O no hydrogen 2.774 N/A ALA 161.A N GLU 157.A O no hydrogen 3.039 N/A THR 162.A N TYR 159.A O no hydrogen 2.924 N/A THR 162.A OG1 TYR 159.A O no hydrogen 2.658 N/A LEU 163.A N GLU 160.A O no hydrogen 3.104 N/A ILE 164.A N THR 162.A O no hydrogen 2.874 N/A THR 165.A N ASN 85.A OD1 no hydrogen 2.926 N/A THR 165.A OG1 THR 165.A O no hydrogen 2.508 N/A PHE 170.A N THR 288.A O no hydrogen 3.078 N/A LYS 172.A N ALA 168.A O no hydrogen 3.083 N/A LYS 172.A NZ GLU 167.A OE2 no hydrogen 2.802 N/A TYR 173.A N PRO 169.A O no hydrogen 2.948 N/A LEU 174.A N PHE 170.A O no hydrogen 2.869 N/A ARG 175.A N ASP 171.A O no hydrogen 2.910 N/A ARG 175.A NH2 ILE 14.A O no hydrogen 3.065 N/A GLY 176.A N TYR 173.A O no hydrogen 2.764 N/A ASP 177.A N LYS 172.A O no hydrogen 2.953 N/A THR 178.A OG1 ASP 1.A OD2 no hydrogen 3.151 N/A SER 179.A N ASP 177.A OD2 no hydrogen 3.213 N/A SER 179.A OG ASP 177.A OD2 no hydrogen 2.601 N/A ALA 180.A N ASP 177.A O no hydrogen 2.816 N/A ASN 182.A N GLU 185.A OE1 no hydrogen 2.933 N/A GLU 185.A N ASN 182.A O no hydrogen 3.042 N/A GLU 185.A N ASN 182.A OD1 no hydrogen 2.845 N/A LYS 186.A N ASN 182.A O no hydrogen 2.979 N/A LYS 186.A NZ THR 178.A O no hydrogen 2.755 N/A GLU 187.A N GLU 183.A O no hydrogen 2.952 N/A GLY 188.A N SER 184.A O no hydrogen 3.254 N/A LEU 189.A N GLU 185.A O no hydrogen 2.986 N/A ALA 190.A N LYS 186.A O no hydrogen 3.013 N/A LEU 191.A N GLU 187.A O no hydrogen 3.002 N/A PHE 192.A N GLY 188.A O no hydrogen 2.882 N/A MET 193.A N LEU 189.A O no hydrogen 3.161 N/A ASP 194.A N ALA 190.A O no hydrogen 2.739 N/A ARG 195.A N LEU 191.A O no hydrogen 2.745 N/A ARG 195.A NH2 GLU 278.A OE2 no hydrogen 2.734 N/A CYS 197.A N PHE 192.A O no hydrogen 3.211 N/A ALA 199.A N GLY 196.A O no hydrogen 3.061 N/A CYS 200.A N CYS 197.A O no hydrogen 3.153 N/A HIS 201.A N CYS 197.A O no hydrogen 2.973 N/A HIS 201.A ND1 SER 238.A O no hydrogen 2.891 N/A GLY 203.A N MET 10.A O no hydrogen 2.836 N/A ASN 205.A ND2 ASN 85.A O no hydrogen 2.878 N/A ASN 205.A ND2 ASN 89.A OD1 no hydrogen 3.049 N/A LEU 206.A N GLY 203.A O no hydrogen 3.439 N/A GLY 207.A N SER 202.A O no hydrogen 3.160 N/A GLY 208.A N ALA 237.A O no hydrogen 2.545 N/A GLN 209.A NE2 PHE 88.A O no hydrogen 3.198 N/A TYR 212.A N PHE 235.A O no hydrogen 2.673 N/A GLY 215.A N THR 226.A O no hydrogen 3.131 N/A VAL 217.A N SER 224.A O no hydrogen 2.698 N/A LYS 219.A N ARG 222.A O no hydrogen 3.029 N/A LYS 219.A NZ GLY 221.A O no hydrogen 2.783 N/A LYS 220.A NZ ASN 276.A OD1 no hydrogen 3.215 N/A PHE 223.A N LYS 220.A O no hydrogen 2.925 N/A SER 224.A N VAL 217.A O no hydrogen 3.037 N/A THR 226.A N GLY 215.A O no hydrogen 3.144 N/A THR 228.A N PRO 213.A O no hydrogen 2.825 N/A THR 228.A OG1 TYR 233.A O no hydrogen 2.676 N/A ASP 231.A N THR 228.A O no hydrogen 2.869 N/A GLU 232.A N ALA 229.A O no hydrogen 3.139 N/A VAL 234.A N GLY 96.A O no hydrogen 3.047 N/A PHE 235.A N TYR 212.A O no hydrogen 2.767 N/A ARG 236.A NE ALA 91.A O no hydrogen 3.247 N/A ARG 236.A NH2 ALA 91.A O no hydrogen 2.803 N/A ALA 237.A N ASN 210.A O no hydrogen 2.977 N/A LEU 240.A N LEU 206.A O no hydrogen 2.989 N/A ARG 241.A N ASN 205.A O no hydrogen 3.404 N/A ARG 241.A NE VAL 204.A O no hydrogen 2.737 N/A ARG 241.A NH1 ASP 171.A OD1 no hydrogen 2.849 N/A ARG 241.A NH2 ASP 171.A OD1 no hydrogen 3.019 N/A ARG 241.A NH2 VAL 204.A O no hydrogen 2.892 N/A ASN 242.A N LEU 289.A O no hydrogen 3.146 N/A ASN 242.A ND2 THR 165.A OG1 no hydrogen 2.880 N/A ILE 243.A N LEU 240.A O no hydrogen 2.987 N/A LEU 245.A N ASN 242.A O no hydrogen 2.903 N/A THR 246.A N ILE 243.A O no hydrogen 3.137 N/A THR 246.A OG1 ILE 243.A O no hydrogen 3.556 N/A TYR 249.A N VAL 255.A O no hydrogen 2.706 N/A TYR 249.A OH ILE 243.A O no hydrogen 2.637 N/A GLY 253.A N PHE 250.A O no hydrogen 2.942 N/A GLU 260.A N SER 257.A OG no hydrogen 3.190 N/A ALA 261.A N SER 257.A O no hydrogen 3.028 N/A VAL 262.A N LEU 258.A O no hydrogen 2.996 N/A ALA 263.A N GLU 259.A O no hydrogen 2.957 N/A VAL 264.A N GLU 260.A O no hydrogen 3.000 N/A MET 265.A N VAL 262.A O no hydrogen 3.198 N/A GLY 266.A N ALA 263.A O no hydrogen 3.041 N/A THR 267.A N THR 272.A OG1 no hydrogen 2.809 N/A LEU 270.A N THR 267.A OG1 no hydrogen 3.111 N/A GLY 271.A N ALA 268.A O no hydrogen 2.818 N/A THR 272.A N THR 267.A O no hydrogen 2.842 N/A THR 272.A OG1 MET 265.A O no hydrogen 2.651 N/A THR 272.A OG1 THR 267.A O no hydrogen 3.368 N/A ASN 275.A N GLU 278.A OE1 no hydrogen 3.118 N/A GLU 278.A N ASN 275.A OD1 no hydrogen 2.855 N/A VAL 279.A N ASN 275.A O no hydrogen 3.141 N/A LYS 280.A N ASN 276.A O no hydrogen 3.227 N/A SER 281.A N ASP 277.A O no hydrogen 2.986 N/A SER 281.A OG ASP 277.A O no hydrogen 3.178 N/A ILE 282.A N GLU 278.A O no hydrogen 2.942 N/A VAL 283.A N VAL 279.A O no hydrogen 2.993 N/A ALA 284.A N LYS 280.A O no hydrogen 3.112 N/A PHE 285.A N SER 281.A O no hydrogen 3.053 N/A LEU 286.A N ILE 282.A O no hydrogen 2.810 N/A LYS 287.A N VAL 283.A O no hydrogen 3.057 N/A THR 288.A N PHE 285.A O no hydrogen 2.830 N/A THR 288.A OG1 PHE 285.A O no hydrogen 2.511 N/A LEU 289.A N LEU 286.A O no hydrogen 3.142 N/A THR 290.A OG1 GLU 244.A OE1 no hydrogen 2.866 N/A GLY 291.A N ASN 242.A OD1 no hydrogen 2.750 N/A ASN 292.A N PRO 166.A O no hydrogen 2.886 N/A GLU 295.A N GLU 295.A OE1 no hydrogen 2.444 N/A THR 305.A N THR 308.A OG1 no hydrogen 2.717 N/A THR 305.A OG1 SER 128.A O no hydrogen 2.691 N/A THR 305.A OG1 THR 308.A OG1 no hydrogen 3.348 N/A ASN 307.A N THR 305.A OG1 no hydrogen 3.295 N/A THR 308.A N THR 305.A O no hydrogen 2.924 N/A THR 308.A OG1 SER 128.A OG no hydrogen 2.784 N/A THR 308.A OG1 THR 305.A O no hydrogen 3.367 N/A THR 308.A OG1 THR 305.A OG1 no hydrogen 3.348 N/A VAL 312.A N SER 45.A O no hydrogen 2.887 N/A