Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1d1u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A OG1 ASP 5.A OD2 no hydrogen 3.372 N/A SER 4.A OG THR 1.A O no hydrogen 2.724 N/A ASP 5.A N THR 1.A O no hydrogen 3.217 N/A PHE 6.A N LEU 3.A O no hydrogen 3.368 N/A ALA 9.A N PHE 6.A O no hydrogen 3.291 N/A TRP 10.A NE1 TRP 2.A O no hydrogen 3.153 N/A ALA 11.A N ALA 231.A O no hydrogen 2.792 N/A GLU 12.A N GLU 12.A OE1 no hydrogen 2.685 N/A THR 13.A N TRP 10.A O no hydrogen 3.141 N/A THR 13.A OG1 PRO 7.A O no hydrogen 2.442 N/A GLY 14.A N TRP 10.A O no hydrogen 2.715 N/A LEU 18.A N GLY 228.A O no hydrogen 2.657 N/A ALA 19.A N CYS 134.A O no hydrogen 2.761 N/A GLN 22.A N ALA 19.A O no hydrogen 3.056 N/A GLN 22.A NE2 ASP 183.A OD1 no hydrogen 2.849 N/A GLN 22.A NE2 ASP 183.A OD2 no hydrogen 3.329 N/A LEU 25.A N ARG 136.A O no hydrogen 2.817 N/A ILE 27.A N SER 141.A OG no hydrogen 2.609 N/A LYS 30.A N ARG 98.A O no hydrogen 2.947 N/A LYS 30.A NZ LYS 97.A O no hydrogen 3.024 N/A SER 33.A N LYS 30.A O no hydrogen 3.357 N/A SER 33.A OG ARG 98.A O no hydrogen 2.605 N/A ILE 38.A N ASN 72.A O no hydrogen 2.784 N/A LYS 39.A NZ GLU 148.A OE1 no hydrogen 3.361 N/A GLN 40.A NE2 TYR 41.A O.A no hydrogen 2.763 N/A GLN 40.A NE2 TYR 41.A O.B no hydrogen 2.910 N/A GLN 40.A NE2 LEU 75.A O no hydrogen 3.082 N/A ALA 47.A N SER 44.A OG no hydrogen 3.281 N/A ARG 48.A N SER 44.A O no hydrogen 2.950 N/A LEU 49.A N GLN 45.A O no hydrogen 2.750 N/A LEU 49.A N GLU 46.A O no hydrogen 3.116 N/A GLY 50.A N GLU 46.A O no hydrogen 2.997 N/A ILE 51.A N ALA 47.A O no hydrogen 3.045 N/A LYS 52.A N ARG 48.A O no hydrogen 2.966 N/A LYS 52.A NZ ASP 151.A OD1 no hydrogen 3.239 N/A HIS 54.A ND1 GLY 50.A O no hydrogen 3.092 N/A ILE 55.A N ILE 51.A O no hydrogen 3.102 N/A GLN 56.A N LYS 52.A O no hydrogen 2.877 N/A ARG 57.A N PRO 53.A O no hydrogen 2.954 N/A LEU 58.A N HIS 54.A O no hydrogen 3.014 N/A LEU 59.A N ILE 55.A O no hydrogen 3.060 N/A ASP 60.A N GLN 56.A O no hydrogen 2.945 N/A GLN 61.A N ARG 57.A O no hydrogen 2.971 N/A GLY 62.A N LEU 59.A O no hydrogen 3.053 N/A ILE 63.A N LEU 58.A O no hydrogen 2.873 N/A LEU 64.A N LEU 58.A O no hydrogen 3.236 N/A VAL 65.A N THR 161.A O no hydrogen 2.994 N/A CYS 67.A N GLN 159.A O no hydrogen 3.141 N/A SER 69.A N GLN 159.A OE1 no hydrogen 2.838 N/A SER 69.A OG TRP 71.A O no hydrogen 3.566 N/A SER 69.A OG PRO 143.A O no hydrogen 2.905 N/A TRP 71.A N SER 69.A OG no hydrogen 2.986 N/A ASN 72.A N VAL 36.A O no hydrogen 3.125 N/A ASN 72.A ND2 ILE 38.A O no hydrogen 2.651 N/A THR 73.A N ALA 146.A O no hydrogen 3.088 N/A LEU 75.A N GLN 40.A OE1 no hydrogen 2.764 N/A LEU 76.A N VAL 89.A O no hydrogen 2.721 N/A LYS 79.A NZ PRO 77.A O no hydrogen 2.532 N/A TYR 86.A OH GLU 46.A OE2 no hydrogen 2.820 N/A VAL 89.A N LEU 76.A O no hydrogen 2.961 N/A GLN 90.A NE2 THR 73.A OG1 no hydrogen 2.872 N/A GLN 90.A NE2 PHE 145.A O no hydrogen 2.990 N/A ASP 91.A N PRO 74.A O no hydrogen 2.969 N/A ARG 93.A N ASP 91.A OD1 no hydrogen 3.243 N/A ARG 93.A NE ASP 91.A OD1 no hydrogen 2.781 N/A ARG 93.A NH2 ASP 91.A OD2 no hydrogen 2.754 N/A VAL 95.A N LEU 92.A O no hydrogen 3.116 N/A ASN 96.A N LEU 92.A O no hydrogen 2.762 N/A ASN 96.A ND2 GLY 168.A O no hydrogen 3.007 N/A LYS 97.A N ARG 93.A O no hydrogen 3.128 N/A LYS 97.A NZ GLU 94.A OE2 no hydrogen 2.822 N/A ARG 98.A N VAL 95.A O no hydrogen 2.799 N/A ARG 98.A NE THR 34.A O no hydrogen 3.385 N/A ARG 98.A NH1 GLU 94.A O no hydrogen 2.836 N/A ARG 98.A NH1 GLU 94.A OE1 no hydrogen 3.068 N/A VAL 99.A N ASN 96.A O no hydrogen 3.323 N/A GLU 100.A N PRO 28.A O no hydrogen 3.002 N/A THR 105.A OG1 GLU 178.A OE2 no hydrogen 2.907 N/A ASN 111.A N ASN 108.A OD1 no hydrogen 2.723 N/A LEU 112.A N ASN 108.A O no hydrogen 2.973 N/A LEU 113.A N PRO 109.A O no hydrogen 2.944 N/A SER 114.A N TYR 110.A O no hydrogen 3.305 N/A SER 114.A OG ASN 111.A O no hydrogen 2.682 N/A GLY 115.A N LEU 112.A O no hydrogen 3.255 N/A LEU 116.A N LEU 113.A O no hydrogen 2.949 N/A SER 119.A OG HIS 120.A ND1 no hydrogen 2.837 N/A HIS 120.A N PRO 117.A O no hydrogen 3.231 N/A HIS 120.A ND1 SER 119.A OG no hydrogen 2.837 N/A HIS 120.A NE2 ASP 193.A O no hydrogen 2.903 N/A TRP 122.A N ALA 207.A O no hydrogen 3.111 N/A TYR 123.A N GLN 240.A O no hydrogen 2.690 N/A TYR 123.A OH HIS 120.A O no hydrogen 3.398 N/A THR 124.A N LEU 205.A O no hydrogen 2.991 N/A THR 124.A OG1 THR 217.A OG1 no hydrogen 2.723 N/A VAL 125.A N GLN 237.A O no hydrogen 2.714 N/A LEU 126.A N LEU 203.A O no hydrogen 2.964 N/A LEU 128.A N ASP 201.A O no hydrogen 2.875 N/A LYS 129.A N ARG 230.A O no hydrogen 2.732 N/A CYS 134.A N ALA 131.A O no hydrogen 2.842 N/A CYS 134.A SG ASP 130.A O no hydrogen 3.553 N/A CYS 134.A SG GLY 228.A O no hydrogen 3.916 N/A LEU 135.A N PHE 132.A O no hydrogen 2.990 N/A ARG 136.A NH2 GLN 22.A O no hydrogen 2.637 N/A LEU 137.A N THR 163.A O no hydrogen 2.675 N/A HIS 138.A N LEU 25.A O no hydrogen 2.736 N/A SER 141.A N HIS 138.A O no hydrogen 2.794 N/A GLN 142.A N HIS 138.A O no hydrogen 3.132 N/A GLN 142.A NE2 LEU 137.A O no hydrogen 2.966 N/A PHE 145.A N GLN 142.A O no hydrogen 3.209 N/A ALA 146.A N PRO 143.A O no hydrogen 3.209 N/A PHE 147.A N LEU 160.A O no hydrogen 2.869 N/A TRP 149.A N GLY 158.A O no hydrogen 2.540 N/A GLN 159.A NE2 SER 69.A O no hydrogen 3.106 N/A GLN 159.A NE2 TRP 71.A O no hydrogen 2.821 N/A GLN 159.A NE2 ASN 72.A OD1 no hydrogen 3.311 N/A LEU 160.A N PHE 147.A O no hydrogen 2.858 N/A THR 161.A N VAL 65.A O no hydrogen 2.949 N/A THR 161.A OG1 GLN 142.A O no hydrogen 2.798 N/A TRP 162.A NE1 GLN 90.A OE1 no hydrogen 2.928 N/A THR 163.A N ILE 63.A O no hydrogen 3.105 N/A THR 163.A OG1 GLY 62.A O no hydrogen 2.900 N/A THR 163.A OG1 ILE 63.A O no hydrogen 3.332 N/A ARG 164.A NH1 GLY 17.A O no hydrogen 3.539 N/A ARG 164.A NH1 PHE 133.A O no hydrogen 2.536 N/A LEU 165.A N LEU 135.A O no hydrogen 2.939 N/A LYS 170.A N ASN 96.A OD1 no hydrogen 2.875 N/A LYS 170.A NZ ASN 96.A O no hydrogen 2.971 N/A LYS 170.A NZ VAL 99.A O no hydrogen 2.919 N/A LYS 170.A NZ ASP 101.A OD1 no hydrogen 2.622 N/A ASN 171.A ND2 GLU 100.A O no hydrogen 3.599 N/A SER 172.A N PHE 169.A O no hydrogen 2.974 N/A SER 172.A OG PRO 166.A O no hydrogen 2.845 N/A SER 172.A OG PHE 169.A O no hydrogen 3.446 N/A LEU 175.A N ASN 171.A O no hydrogen 3.010 N/A PHE 176.A N SER 172.A O no hydrogen 2.878 N/A ASP 177.A N PRO 173.A O no hydrogen 2.944 N/A GLU 178.A N THR 174.A O no hydrogen 2.982 N/A ALA 179.A N LEU 175.A O no hydrogen 3.086 N/A LEU 180.A N PHE 176.A O no hydrogen 2.855 N/A HIS 181.A N ASP 177.A O no hydrogen 2.907 N/A ARG 182.A N GLU 178.A O no hydrogen 3.021 N/A ARG 182.A NE GLN 22.A OE1 no hydrogen 3.304 N/A ARG 182.A NH2 GLN 22.A OE1 no hydrogen 2.898 N/A ASP 183.A N ALA 179.A O no hydrogen 3.041 N/A LEU 184.A N LEU 180.A O no hydrogen 2.897 N/A ALA 185.A N ARG 182.A O no hydrogen 3.469 N/A ARG 188.A N LEU 184.A O no hydrogen 3.066 N/A ARG 188.A NH1 LEU 196.A O no hydrogen 2.781 N/A ARG 188.A NH2 LEU 196.A O no hydrogen 2.916 N/A ARG 188.A NH2 GLN 198.A OE1 no hydrogen 3.038 N/A ILE 189.A N ALA 185.A O no hydrogen 3.223 N/A GLN 190.A N ASP 186.A O no hydrogen 2.934 N/A ASP 193.A N ASP 193.A OD2 no hydrogen 2.405 N/A LEU 194.A N HIS 191.A O no hydrogen 3.065 N/A ILE 195.A N ALA 206.A O no hydrogen 2.999 N/A LEU 197.A N LEU 204.A O no hydrogen 2.887 N/A TYR 199.A N ASP 202.A O no hydrogen 3.014 N/A VAL 200.A N ASP 177.A OD1 no hydrogen 2.970 N/A ASP 202.A N TYR 199.A O no hydrogen 2.878 N/A LEU 203.A N LEU 126.A O no hydrogen 2.860 N/A LEU 204.A N LEU 197.A O no hydrogen 3.176 N/A LEU 205.A N THR 124.A O no hydrogen 2.796 N/A ALA 206.A N ILE 195.A O no hydrogen 2.636 N/A ALA 207.A N TRP 122.A O no hydrogen 2.856 N/A SER 209.A N ASP 212.A OD2 no hydrogen 2.998 N/A SER 209.A OG ASP 212.A OD2 no hydrogen 2.662 N/A CYS 213.A SG TRP 122.A O no hydrogen 3.412 N/A CYS 213.A SG THR 124.A OG1 no hydrogen 3.662 N/A GLN 214.A N GLU 210.A O no hydrogen 3.163 N/A GLN 214.A N LEU 211.A O no hydrogen 2.691 N/A GLN 214.A NE2 GLU 210.A O no hydrogen 3.492 N/A GLN 215.A N LEU 211.A O no hydrogen 2.826 N/A GLY 216.A N ASP 212.A O no hydrogen 3.087 N/A THR 217.A N CYS 213.A O no hydrogen 2.939 N/A THR 217.A OG1 THR 124.A OG1 no hydrogen 2.723 N/A THR 217.A OG1 CYS 213.A O no hydrogen 2.510 N/A ARG 218.A N GLN 214.A O no hydrogen 3.015 N/A ALA 219.A N GLN 215.A O no hydrogen 3.099 N/A LEU 220.A N GLY 216.A O no hydrogen 2.782 N/A LEU 221.A N THR 217.A O no hydrogen 2.905 N/A GLN 222.A N ARG 218.A O no hydrogen 2.885 N/A THR 223.A N ALA 219.A O no hydrogen 2.854 N/A THR 223.A OG1 ALA 219.A O no hydrogen 3.096 N/A LEU 224.A N LEU 220.A O no hydrogen 2.722 N/A GLY 225.A N LEU 221.A O no hydrogen 2.955 N/A ASN 226.A N GLN 222.A O no hydrogen 2.970 N/A LEU 227.A N THR 223.A O no hydrogen 2.929 N/A GLY 228.A N GLY 225.A O no hydrogen 3.291 N/A TYR 229.A N LEU 224.A O no hydrogen 3.014 N/A TYR 229.A OH ASP 183.A OD2 no hydrogen 2.461 N/A ARG 230.A NE GLY 14.A O no hydrogen 3.156 N/A ARG 230.A NE GLY 15.A O no hydrogen 3.090 N/A ARG 230.A NH1 GLY 225.A O no hydrogen 3.416 N/A ARG 230.A NH1 TYR 229.A O no hydrogen 2.797 N/A ARG 230.A NH2 GLY 14.A O no hydrogen 3.129 N/A ALA 231.A N ALA 9.A O no hydrogen 2.841 N/A SER 232.A N ASP 127.A O no hydrogen 3.012 N/A ALA 233.A N GLU 12.A OE1 no hydrogen 2.800 N/A LYS 234.A N GLU 12.A OE2 no hydrogen 2.924 N/A ALA 236.A N SER 232.A O no hydrogen 3.120 N/A GLN 237.A N VAL 125.A O no hydrogen 3.042 N/A GLN 237.A NE2 LYS 244.A O no hydrogen 2.750 N/A CYS 239.A N THR 124.A OG1 no hydrogen 2.996 N/A GLN 240.A N TYR 123.A O no hydrogen 2.704 N/A GLN 240.A NE2 ILE 238.A O no hydrogen 2.985 N/A VAL 243.A N LEU 250.A O no hydrogen 3.259 N/A LYS 244.A N GLN 237.A OE1 no hydrogen 2.748 N/A TYR 245.A N TYR 248.A O no hydrogen 2.917 N/A TYR 245.A OH ASP 202.A O no hydrogen 2.842 N/A TYR 248.A N TYR 245.A O no hydrogen 2.958 N/A LEU 250.A N VAL 243.A O no hydrogen 2.876 N/A GLN 254.A N LYS 251.A O no hydrogen 2.773 N/A