Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1w87_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 5.A N PRO 127.A O no hydrogen 2.921 N/A TYR 7.A OH GLY 42.A O no hydrogen 2.295 N/A ALA 11.A N ARG 8.A O no hydrogen 2.976 N/A PHE 13.A N ILE 124.A O no hydrogen 2.810 N/A GLY 15.A N VAL 122.A O no hydrogen 3.170 N/A VAL 17.A N SER 120.A O no hydrogen 2.698 N/A ILE 18.A N LYS 36.A O no hydrogen 2.651 N/A SER 19.A N LYS 36.A O no hydrogen 3.394 N/A LEU 23.A N VAL 32.A O no hydrogen 2.814 N/A LYS 25.A N PRO 189.A O no hydrogen 3.053 N/A LYS 25.A NZ GLU 195.A OE2 no hydrogen 3.528 N/A GLY 27.A N GLU 26.A OE1 no hydrogen 2.656 N/A GLY 28.A N LYS 25.A O no hydrogen 3.105 N/A ILE 29.A N ASN 190.A OD1 no hydrogen 2.655 N/A GLN 33.A N VAL 91.A O no hydrogen 2.853 N/A GLN 33.A NE2 ASN 20.A O no hydrogen 3.127 N/A HIS 34.A N GLU 21.A O no hydrogen 2.542 N/A HIS 34.A ND1 TYR 193.A OH no hydrogen 2.492 N/A HIS 34.A NE2 ASP 80.A OD2 no hydrogen 3.058 N/A ILE 35.A N LEU 89.A O no hydrogen 3.078 N/A LYS 36.A N SER 19.A O no hydrogen 3.027 N/A LYS 36.A NZ ASP 81.A OD1 no hydrogen 3.040 N/A PHE 37.A N ILE 87.A O no hydrogen 2.708 N/A ASP 38.A N LYS 16.A O no hydrogen 2.994 N/A LEU 39.A N LYS 85.A O no hydrogen 2.743 N/A THR 40.A N ASP 38.A OD1 no hydrogen 3.446 N/A THR 40.A OG1 ASP 38.A OD1 no hydrogen 3.193 N/A THR 40.A OG1 ASP 38.A OD2 no hydrogen 2.519 N/A GLY 42.A N LEU 39.A O no hydrogen 2.826 N/A TYR 46.A OH SER 75.A OG no hydrogen 3.140 N/A TYR 46.A OH THR 76.A O no hydrogen 2.568 N/A TYR 46.A OH THR 86.A O no hydrogen 2.948 N/A ILE 47.A N GLN 50.A OE1 no hydrogen 2.951 N/A GLN 50.A N ILE 47.A O no hydrogen 3.057 N/A GLN 50.A NE2 PRO 3.A O no hydrogen 3.069 N/A GLN 50.A NE2 GLY 129.A O no hydrogen 3.422 N/A SER 51.A N VAL 128.A O no hydrogen 3.177 N/A ILE 52.A N TYR 71.A O no hydrogen 2.986 N/A GLY 53.A N THR 125.A O no hydrogen 2.705 N/A ILE 54.A N ARG 69.A O no hydrogen 2.989 N/A ILE 55.A N LYS 123.A O no hydrogen 3.165 N/A ASP 60.A N LYS 64.A O no hydrogen 2.784 N/A GLY 63.A N ASP 60.A O no hydrogen 2.866 N/A LYS 64.A N ASP 60.A OD1 no hydrogen 3.000 N/A GLU 66.A N GLY 58.A O no hydrogen 3.219 N/A ARG 69.A N ILE 54.A O no hydrogen 2.972 N/A ARG 69.A NH1 GLU 66.A OE1 no hydrogen 2.871 N/A ARG 69.A NH1 LYS 67.A O no hydrogen 2.445 N/A ARG 69.A NH2 GLU 66.A OE1 no hydrogen 3.212 N/A TYR 71.A N ILE 52.A O no hydrogen 3.044 N/A ILE 73.A N GLN 50.A O no hydrogen 3.133 N/A ALA 74.A N SER 88.A O no hydrogen 2.734 N/A SER 75.A OG TYR 46.A OH no hydrogen 3.140 N/A THR 76.A OG1 GLU 166.A OE2 no hydrogen 2.611 N/A ARG 77.A N GLU 48.A OE2 no hydrogen 2.869 N/A ARG 77.A NE GLU 48.A OE1 no hydrogen 3.249 N/A ARG 77.A NE GLU 48.A OE2 no hydrogen 2.976 N/A ARG 77.A NH2 GLU 48.A OE1 no hydrogen 2.994 N/A HIS 78.A ND1 ASP 84.A OD2 no hydrogen 2.920 N/A HIS 78.A NE2 ASN 170.A OD1 no hydrogen 2.853 N/A GLY 79.A N THR 76.A O no hydrogen 2.947 N/A VAL 82.A N GLY 79.A O no hydrogen 2.924 N/A ASP 84.A N HIS 78.A O no hydrogen 2.835 N/A LYS 85.A N ASP 83.A OD1 no hydrogen 3.083 N/A SER 88.A N SER 75.A OG no hydrogen 2.736 N/A SER 88.A OG ASP 80.A OD2 no hydrogen 2.518 N/A LEU 89.A N ILE 35.A O no hydrogen 2.728 N/A CYS 90.A SG TYR 193.A OH no hydrogen 3.631 N/A VAL 91.A N GLN 33.A O no hydrogen 3.065 N/A ARG 92.A NH1 ILE 29.A O no hydrogen 3.025 N/A GLN 93.A N ILE 31.A O no hydrogen 3.040 N/A LEU 94.A N SER 110.A OG no hydrogen 3.079 N/A TYR 96.A N VAL 105.A O no hydrogen 2.829 N/A HIS 98.A N GLU 103.A O no hydrogen 2.931 N/A SER 101.A OG GLU 103.A OE2 no hydrogen 2.557 N/A GLU 103.A N SER 101.A O no hydrogen 2.563 N/A VAL 105.A N TYR 96.A O no hydrogen 2.606 N/A GLY 107.A N LEU 94.A O no hydrogen 2.737 N/A CYS 109.A SG ILE 54.A O no hydrogen 3.692 N/A CYS 109.A SG TYR 71.A OH no hydrogen 3.410 N/A THR 111.A N GLY 107.A O no hydrogen 3.377 N/A THR 111.A OG1 GLY 107.A O no hydrogen 2.262 N/A TYR 112.A N VAL 108.A O no hydrogen 2.990 N/A LEU 113.A N CYS 109.A O no hydrogen 3.057 N/A THR 114.A N SER 110.A O no hydrogen 2.894 N/A THR 114.A OG1 SER 110.A O no hydrogen 2.596 N/A THR 114.A OG1 THR 111.A O no hydrogen 3.104 N/A THR 114.A OG1 HIS 115.A ND1 no hydrogen 3.207 N/A HIS 115.A N THR 111.A O no hydrogen 2.979 N/A HIS 115.A ND1 THR 114.A OG1 no hydrogen 3.207 N/A ILE 116.A N LEU 113.A O no hydrogen 2.821 N/A GLY 119.A N VAL 17.A O no hydrogen 2.978 N/A SER 120.A N GLU 117.A O no hydrogen 2.890 N/A SER 120.A OG GLU 117.A O no hydrogen 2.550 N/A VAL 122.A N GLY 15.A O no hydrogen 2.604 N/A ILE 124.A N PHE 13.A O no hydrogen 2.728 N/A THR 125.A N GLY 53.A O no hydrogen 2.600 N/A GLY 126.A N TYR 7.A O no hydrogen 3.139 N/A VAL 128.A N SER 51.A O no hydrogen 2.887 N/A LYS 130.A NZ VAL 2.A O no hydrogen 2.942 N/A GLU 139.A N ASP 137.A OD1 no hydrogen 2.876 N/A ALA 140.A N ASP 137.A O no hydrogen 3.329 N/A ASN 141.A N LYS 247.A O no hydrogen 2.563 N/A VAL 142.A N PHE 178.A O no hydrogen 2.823 N/A ILE 143.A N HIS 249.A O no hydrogen 2.796 N/A MET 144.A N TRP 180.A O no hydrogen 2.753 N/A LEU 145.A N TYR 251.A O no hydrogen 2.666 N/A ALA 146.A N VAL 182.A O no hydrogen 3.224 N/A THR 147.A N CYS 253.A O no hydrogen 3.070 N/A GLY 148.A N GLY 184.A O no hydrogen 2.776 N/A GLY 150.A N THR 147.A O no hydrogen 2.995 N/A ILE 151.A N GLY 148.A O no hydrogen 2.834 N/A ALA 152.A N THR 149.A O no hydrogen 3.035 N/A ARG 155.A N ILE 151.A O no hydrogen 2.855 N/A ARG 155.A N ALA 152.A O no hydrogen 3.047 N/A ARG 155.A NH1 ALA 74.A O no hydrogen 2.931 N/A ARG 155.A NH1 ASP 80.A OD1 no hydrogen 2.868 N/A ARG 155.A NH2 ASP 80.A OD1 no hydrogen 3.359 N/A THR 156.A N ALA 152.A O no hydrogen 3.326 N/A THR 156.A OG1 PRO 153.A O no hydrogen 2.522 N/A TYR 157.A N PRO 153.A O no hydrogen 2.953 N/A TYR 157.A N MET 154.A O no hydrogen 3.249 N/A TYR 157.A OH MET 132.A O no hydrogen 2.498 N/A LEU 158.A N MET 154.A O no hydrogen 2.889 N/A TRP 159.A N ARG 155.A O no hydrogen 2.693 N/A ARG 160.A N THR 156.A O no hydrogen 3.475 N/A MET 161.A N TYR 157.A O no hydrogen 2.870 N/A MET 161.A N LEU 158.A O no hydrogen 2.902 N/A PHE 162.A N LEU 158.A O no hydrogen 2.707 N/A LYS 163.A N TRP 159.A O no hydrogen 2.984 N/A LYS 163.A NZ GLU 199.A OE1 no hydrogen 3.139 N/A ARG 167.A N LYS 163.A O no hydrogen 3.176 N/A ARG 167.A NE TYR 204.A OH no hydrogen 2.815 N/A ALA 168.A N ASP 164.A O no hydrogen 2.955 N/A ALA 169.A N ALA 165.A O no hydrogen 2.801 N/A ASN 170.A N GLU 166.A O no hydrogen 2.575 N/A ASN 170.A ND2 GLU 166.A OE1 no hydrogen 2.880 N/A GLU 172.A N GLU 172.A OE1 no hydrogen 2.479 N/A TYR 173.A N ASN 170.A O no hydrogen 3.015 N/A LYS 176.A N PRO 138.A O no hydrogen 3.087 N/A GLY 177.A N PRO 138.A O no hydrogen 3.048 N/A SER 179.A N ASN 207.A O no hydrogen 2.761 N/A SER 179.A OG VAL 142.A O no hydrogen 3.474 N/A TRP 180.A N VAL 142.A O no hydrogen 2.727 N/A TRP 180.A NE1 THR 211.A OG1 no hydrogen 2.677 N/A LEU 181.A N ARG 209.A O no hydrogen 2.706 N/A VAL 182.A N MET 144.A O no hydrogen 2.778 N/A PHE 183.A N THR 211.A O no hydrogen 2.747 N/A GLY 184.A N ALA 146.A O no hydrogen 2.835 N/A VAL 185.A N ALA 213.A O no hydrogen 3.156 N/A THR 187.A OG1 ASN 190.A OD1 no hydrogen 2.975 N/A THR 188.A N GLU 217.A OE2 no hydrogen 2.967 N/A THR 188.A OG1 GLU 217.A OE1 no hydrogen 2.479 N/A ASN 190.A N THR 187.A O no hydrogen 3.072 N/A ASN 190.A ND2 ILE 29.A O no hydrogen 3.085 N/A ILE 191.A N THR 188.A O no hydrogen 2.849 N/A TYR 193.A OH HIS 34.A ND1 no hydrogen 2.492 N/A LYS 194.A N ILE 191.A O no hydrogen 2.998 N/A LYS 194.A NZ GLU 198.A OE1 no hydrogen 2.744 N/A LEU 197.A N TYR 193.A O no hydrogen 2.723 N/A GLU 198.A N LYS 194.A O no hydrogen 2.920 N/A GLU 199.A N GLU 195.A O no hydrogen 2.999 N/A ILE 200.A N GLU 196.A O no hydrogen 2.824 N/A GLN 201.A N LEU 197.A O no hydrogen 3.346 N/A GLN 202.A N GLU 199.A O no hydrogen 2.765 N/A LYS 203.A N GLU 199.A O no hydrogen 3.240 N/A LYS 203.A NZ GLU 199.A OE1 no hydrogen 3.374 N/A TYR 204.A N ILE 200.A O no hydrogen 3.000 N/A TYR 204.A OH ASP 164.A OD1 no hydrogen 3.371 N/A ASN 207.A N TYR 204.A O no hydrogen 3.221 N/A ASN 207.A ND2 GLY 177.A O no hydrogen 3.090 N/A PHE 208.A N TYR 204.A O no hydrogen 2.844 N/A ARG 209.A N SER 179.A O no hydrogen 3.085 N/A LEU 210.A N GLN 201.A OE1 no hydrogen 2.493 N/A THR 211.A N LEU 181.A O no hydrogen 2.862 N/A ALA 213.A N PHE 183.A O no hydrogen 3.033 N/A SER 215.A N VAL 185.A O no hydrogen 2.910 N/A SER 215.A N ALA 213.A O no hydrogen 3.064 N/A SER 215.A OG VAL 185.A O no hydrogen 3.281 N/A ARG 216.A N PRO 186.A O no hydrogen 2.919 N/A GLU 217.A N ILE 214.A O no hydrogen 2.782 N/A GLN 218.A NE2 TYR 212.A O no hydrogen 3.557 N/A LYS 219.A NZ GLY 223.A O no hydrogen 3.184 N/A ASN 220.A N GLY 224.A O no hydrogen 2.775 N/A GLY 223.A N ASN 220.A O no hydrogen 2.732 N/A MET 226.A N GLN 218.A O no hydrogen 2.901 N/A TYR 227.A N ASP 230.A OD2 no hydrogen 3.222 N/A GLN 229.A N GLN 229.A OE1 no hydrogen 2.572 N/A ASP 230.A N TYR 227.A O no hydrogen 3.005 N/A ARG 231.A N TYR 227.A O no hydrogen 3.345 N/A ARG 231.A NE TYR 212.A O no hydrogen 2.894 N/A ARG 231.A NH2 TYR 212.A O no hydrogen 3.364 N/A VAL 232.A N ILE 228.A O no hydrogen 2.900 N/A ALA 233.A N GLN 229.A O no hydrogen 2.990 N/A ALA 233.A N ASP 230.A O no hydrogen 2.833 N/A GLU 234.A N ASP 230.A O no hydrogen 2.750 N/A HIS 235.A N ARG 231.A O no hydrogen 3.034 N/A ALA 236.A N ALA 233.A O no hydrogen 2.955 N/A LEU 239.A N HIS 235.A O no hydrogen 2.947 N/A TRP 240.A N ALA 236.A O no hydrogen 2.784 N/A GLN 241.A N ASP 237.A O no hydrogen 2.819 N/A GLN 241.A NE2 GLU 273.A OE1 no hydrogen 3.553 N/A LEU 242.A N GLN 238.A O no hydrogen 2.784 N/A ILE 243.A N LEU 239.A O no hydrogen 2.649 N/A ILE 243.A N TRP 240.A O no hydrogen 2.895 N/A LYS 244.A N TRP 240.A O no hydrogen 2.978 N/A LYS 244.A N GLN 241.A O no hydrogen 3.287 N/A LYS 244.A NZ GLU 273.A OE1 no hydrogen 2.837 N/A LYS 247.A N ASN 245.A OD1 no hydrogen 2.671 N/A THR 248.A N ASN 245.A O no hydrogen 3.247 N/A THR 248.A OG1 ASN 141.A OD1 no hydrogen 3.025 N/A THR 248.A OG1 LEU 242.A O no hydrogen 2.608 N/A HIS 249.A N ASN 141.A O no hydrogen 2.673 N/A THR 250.A N ARG 289.A O no hydrogen 3.175 N/A TYR 251.A N ILE 143.A O no hydrogen 2.800 N/A TYR 251.A OH LEU 133.A O no hydrogen 2.789 N/A ILE 252.A N HIS 291.A O no hydrogen 2.815 N/A CYS 253.A N LEU 145.A O no hydrogen 2.911 N/A CYS 253.A SG GLU 293.A O no hydrogen 3.579 N/A GLY 254.A N GLU 293.A O no hydrogen 3.294 N/A MET 258.A N LEU 255.A O no hydrogen 2.928 N/A ILE 262.A N MET 258.A O no hydrogen 2.861 N/A ASP 263.A N GLU 259.A O no hydrogen 2.880 N/A ALA 264.A N GLU 260.A O no hydrogen 2.917 N/A ALA 265.A N GLY 261.A O no hydrogen 2.931 N/A LEU 266.A N ILE 262.A O no hydrogen 2.996 N/A SER 267.A N ASP 263.A O no hydrogen 2.734 N/A ALA 268.A N ALA 264.A O no hydrogen 3.153 N/A ALA 269.A N ALA 265.A O no hydrogen 2.999 N/A ALA 270.A N LEU 266.A O no hydrogen 2.945 N/A ALA 271.A N ALA 268.A O no hydrogen 2.699 N/A LYS 272.A N ALA 268.A O no hydrogen 3.465 N/A LYS 272.A NZ ASP 237.A OD1 no hydrogen 2.955 N/A LYS 272.A NZ ASP 237.A OD2 no hydrogen 2.898 N/A GLY 274.A N ALA 271.A O no hydrogen 2.420 N/A VAL 275.A N ALA 270.A O no hydrogen 2.705 N/A ASP 279.A N THR 276.A O no hydrogen 2.669 N/A TYR 280.A N THR 276.A O no hydrogen 3.005 N/A GLN 281.A N TRP 277.A O no hydrogen 2.632 N/A GLN 281.A NE2 ASP 263.A OD1 no hydrogen 2.910 N/A ASP 283.A N ASP 279.A O no hydrogen 3.332 N/A ASP 283.A N TYR 280.A O no hydrogen 2.932 N/A LEU 284.A N TYR 280.A O no hydrogen 3.142 N/A LYS 285.A N GLN 281.A O no hydrogen 2.842 N/A LYS 286.A N LYS 282.A O no hydrogen 2.999 N/A ALA 287.A N ASP 283.A O no hydrogen 2.576 N/A GLY 288.A N LEU 284.A O no hydrogen 2.735 N/A GLY 288.A N LYS 285.A O no hydrogen 2.786 N/A ARG 289.A N LEU 284.A O no hydrogen 2.951 N/A HIS 291.A N THR 250.A O no hydrogen 2.977 N/A GLU 293.A N ILE 252.A O no hydrogen 2.850 N/A TRP 295.A N GLY 254.A O no hydrogen 2.910 N/A