Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1equ_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N ASP 85.A OD2 no hydrogen 3.139 N/A VAL 5.A N LYS 31.A O no hydrogen 2.898 N/A LEU 6.A N VAL 86.A O no hydrogen 2.916 N/A ILE 7.A N TYR 33.A O no hydrogen 3.166 N/A THR 8.A N VAL 88.A O no hydrogen 2.986 N/A THR 8.A OG1 VAL 88.A O no hydrogen 3.199 N/A CYS 10.A N THR 35.A O no hydrogen 2.930 N/A CYS 10.A SG ILE 7.A O no hydrogen 3.478 N/A CYS 10.A SG GLY 15.A O no hydrogen 2.962 N/A LEU 16.A N GLY 13.A O no hydrogen 3.025 N/A HIS 17.A N GLY 13.A O no hydrogen 3.193 N/A LEU 18.A N ILE 14.A O no hydrogen 3.038 N/A ALA 19.A N GLY 15.A O no hydrogen 3.476 N/A VAL 20.A N LEU 16.A O no hydrogen 2.955 N/A ARG 21.A N HIS 17.A O no hydrogen 2.761 N/A LEU 22.A N LEU 18.A O no hydrogen 2.878 N/A ALA 23.A N ALA 19.A O no hydrogen 2.921 N/A SER 24.A N VAL 20.A O no hydrogen 2.804 N/A SER 24.A OG VAL 20.A O no hydrogen 2.723 N/A ASP 25.A N LEU 22.A O no hydrogen 3.179 N/A SER 27.A OG ASP 25.A OD1 no hydrogen 2.793 N/A SER 27.A OG SER 29.A OG no hydrogen 3.328 N/A GLN 28.A N ASP 25.A O no hydrogen 3.059 N/A SER 29.A OG SER 27.A O no hydrogen 3.535 N/A SER 29.A OG SER 27.A OG no hydrogen 3.328 N/A LYS 31.A N THR 3.A O no hydrogen 3.006 N/A LYS 31.A NZ TYR 33.A OH no hydrogen 2.713 N/A LYS 31.A NZ GLU 81.A OE1 no hydrogen 2.804 N/A LYS 31.A NZ GLU 81.A OE2 no hydrogen 3.098 N/A VAL 32.A N SER 58.A O no hydrogen 2.649 N/A TYR 33.A N VAL 5.A O no hydrogen 2.813 N/A TYR 33.A OH THR 80.A OG1 no hydrogen 2.869 N/A TYR 33.A OH GLU 81.A OE1 no hydrogen 2.570 N/A THR 35.A N ILE 7.A O no hydrogen 3.050 N/A THR 35.A OG1 ILE 7.A O no hydrogen 2.414 N/A LEU 36.A N LEU 62.A O no hydrogen 2.680 N/A LEU 39.A N GLN 63.A OE1 no hydrogen 2.734 N/A THR 41.A N ASP 38.A O no hydrogen 3.164 N/A THR 41.A OG1 ASP 38.A O no hydrogen 2.352 N/A GLN 42.A N LEU 39.A O no hydrogen 2.713 N/A TRP 46.A N GLN 42.A O no hydrogen 3.284 N/A TRP 46.A NE1 GLN 42.A OE1 no hydrogen 2.633 N/A GLU 47.A N GLY 43.A O no hydrogen 2.846 N/A ALA 48.A N ARG 44.A O no hydrogen 3.133 N/A ALA 49.A N LEU 45.A O no hydrogen 2.929 N/A ARG 50.A N TRP 46.A O no hydrogen 2.892 N/A ALA 51.A N GLU 47.A O no hydrogen 2.840 N/A LEU 52.A N ALA 48.A O no hydrogen 3.007 N/A LEU 52.A N ALA 49.A O no hydrogen 3.228 N/A ALA 53.A N ARG 50.A O no hydrogen 2.624 N/A CYS 54.A N ALA 49.A O no hydrogen 2.942 N/A CYS 54.A SG SER 58.A OG no hydrogen 3.407 N/A SER 58.A N PRO 55.A O no hydrogen 3.516 N/A SER 58.A OG ALA 23.A O no hydrogen 3.481 N/A SER 58.A OG PRO 55.A O no hydrogen 2.844 N/A GLU 60.A N VAL 32.A O no hydrogen 2.958 N/A THR 61.A OG1 GLN 42.A OE1 no hydrogen 2.654 N/A LEU 62.A N ALA 34.A O no hydrogen 2.725 N/A LEU 64.A N LEU 36.A O no hydrogen 2.518 N/A ASP 65.A N SER 71.A OG no hydrogen 2.821 N/A ARG 67.A N ASP 65.A OD2 no hydrogen 3.492 N/A ARG 67.A NH1 SER 109.A OG no hydrogen 3.177 N/A ARG 67.A NH2 SER 109.A OG no hydrogen 3.322 N/A ARG 67.A NH2 ASP 112.A OD1 no hydrogen 2.863 N/A LYS 70.A N ASP 68.A OD1 no hydrogen 2.916 N/A SER 71.A N ASP 68.A OD1 no hydrogen 3.224 N/A VAL 72.A N ASP 68.A O no hydrogen 2.907 N/A ALA 73.A N SER 69.A O no hydrogen 3.112 N/A ALA 74.A N LYS 70.A O no hydrogen 3.329 N/A ALA 75.A N SER 71.A O no hydrogen 3.401 N/A ARG 76.A N ALA 73.A O no hydrogen 3.130 N/A GLU 77.A N ALA 73.A O no hydrogen 3.122 N/A ARG 78.A N ALA 74.A O no hydrogen 3.131 N/A VAL 79.A N ARG 76.A O no hydrogen 3.161 N/A THR 80.A N ARG 78.A O no hydrogen 3.079 N/A THR 80.A OG1 TYR 33.A OH no hydrogen 2.869 N/A GLU 81.A N GLU 81.A OE1 no hydrogen 3.090 N/A GLY 82.A N VAL 79.A O no hydrogen 2.647 N/A ARG 83.A NE ASP 85.A OD1 no hydrogen 2.852 N/A ARG 83.A NH2 ASP 85.A OD1 no hydrogen 2.884 N/A ASP 85.A N VAL 4.A O no hydrogen 2.796 N/A VAL 86.A N VAL 4.A O no hydrogen 3.071 N/A LEU 87.A N ARG 136.A O no hydrogen 2.928 N/A VAL 88.A N LEU 6.A O no hydrogen 2.872 N/A CYS 89.A N LEU 138.A O no hydrogen 2.710 N/A ASN 90.A N THR 8.A OG1 no hydrogen 2.838 N/A ASN 90.A ND2 THR 8.A O no hydrogen 2.963 N/A ALA 91.A N THR 8.A OG1 no hydrogen 3.396 N/A LEU 93.A N ASN 114.A OD1 no hydrogen 2.768 N/A GLY 97.A N PHE 151.A O no hydrogen 3.211 N/A GLU 100.A N GLU 100.A OE2 no hydrogen 2.774 N/A ALA 101.A N PRO 98.A O no hydrogen 2.633 N/A LEU 102.A N LEU 99.A O no hydrogen 3.048 N/A VAL 107.A N GLY 103.A O no hydrogen 2.878 N/A ALA 108.A N GLU 104.A O no hydrogen 2.806 N/A SER 109.A N ASP 105.A O no hydrogen 2.946 N/A SER 109.A OG ASP 105.A O no hydrogen 3.455 N/A VAL 110.A N ALA 106.A O no hydrogen 3.303 N/A LEU 111.A N VAL 107.A O no hydrogen 3.258 N/A ASP 112.A N ALA 108.A O no hydrogen 2.600 N/A VAL 113.A N SER 109.A O no hydrogen 2.736 N/A ASN 114.A N VAL 110.A O no hydrogen 2.828 N/A ASN 114.A ND2 LEU 93.A O no hydrogen 2.842 N/A ASN 114.A ND2 SER 158.A OG no hydrogen 2.974 N/A VAL 115.A N LEU 111.A O no hydrogen 3.184 N/A VAL 116.A N LEU 111.A O no hydrogen 3.212 N/A GLY 117.A N ASP 112.A O no hydrogen 3.027 N/A THR 118.A OG1 ASN 114.A O no hydrogen 2.840 N/A VAL 119.A N VAL 115.A O no hydrogen 3.012 N/A ARG 120.A N VAL 116.A O no hydrogen 2.803 N/A ARG 120.A NE VAL 66.A O no hydrogen 3.062 N/A ARG 120.A NH1 SER 69.A OG no hydrogen 3.428 N/A MET 121.A N GLY 117.A O no hydrogen 2.783 N/A LEU 122.A N THR 118.A O no hydrogen 3.064 N/A GLN 123.A N VAL 119.A O no hydrogen 2.668 N/A ALA 124.A N ARG 120.A O no hydrogen 3.080 N/A PHE 125.A N MET 121.A O no hydrogen 3.294 N/A PHE 125.A N LEU 122.A O no hydrogen 2.993 N/A LEU 126.A N LEU 122.A O no hydrogen 2.853 N/A MET 129.A N PHE 125.A O no hydrogen 2.983 N/A LYS 130.A N LEU 126.A O no hydrogen 2.767 N/A LYS 130.A N PRO 127.A O no hydrogen 2.919 N/A ARG 131.A N PRO 127.A O no hydrogen 3.226 N/A ARG 132.A N ASP 128.A O no hydrogen 3.456 N/A GLY 133.A N MET 129.A O no hydrogen 3.033 N/A ARG 136.A N ASP 85.A O no hydrogen 2.724 N/A ARG 136.A NH1 ALA 246.A O no hydrogen 2.530 N/A ARG 136.A NH2 ALA 246.A O no hydrogen 2.745 N/A VAL 137.A N HIS 179.A O no hydrogen 2.719 N/A LEU 138.A N LEU 87.A O no hydrogen 2.769 N/A VAL 139.A N SER 181.A O no hydrogen 2.906 N/A THR 140.A N CYS 89.A O no hydrogen 3.076 N/A THR 140.A OG1 ASN 90.A OD1 no hydrogen 2.829 N/A SER 142.A N GLU 184.A OE1 no hydrogen 2.691 N/A SER 142.A OG TYR 155.A OH no hydrogen 2.822 N/A GLY 145.A N SER 142.A O no hydrogen 3.150 N/A LEU 146.A N VAL 143.A O no hydrogen 2.769 N/A MET 147.A N VAL 143.A O no hydrogen 2.915 N/A ASN 152.A N LEU 149.A O no hydrogen 3.186 N/A ASN 152.A ND2 PRO 150.A O no hydrogen 3.360 N/A TYR 155.A OH SER 142.A OG no hydrogen 2.822 N/A CYS 156.A N ASN 152.A O no hydrogen 2.670 N/A ALA 157.A N ASP 153.A O no hydrogen 2.667 N/A SER 158.A N VAL 154.A O no hydrogen 2.992 N/A SER 158.A OG TYR 155.A O no hydrogen 2.685 N/A LYS 159.A N TYR 155.A O no hydrogen 2.850 N/A LYS 159.A NZ THR 140.A O no hydrogen 3.560 N/A PHE 160.A N CYS 156.A O no hydrogen 2.974 N/A PHE 160.A N ALA 157.A O no hydrogen 3.102 N/A ALA 161.A N ALA 157.A O no hydrogen 2.908 N/A LEU 162.A N SER 158.A O no hydrogen 3.447 N/A GLY 164.A N PHE 160.A O no hydrogen 3.138 N/A LEU 165.A N ALA 161.A O no hydrogen 2.690 N/A CYS 166.A N LEU 162.A O no hydrogen 2.995 N/A CYS 166.A SG LEU 162.A O no hydrogen 3.330 N/A GLU 167.A N GLU 163.A O no hydrogen 3.070 N/A SER 168.A N GLY 164.A O no hydrogen 3.236 N/A SER 168.A OG GLY 164.A O no hydrogen 2.926 N/A ALA 170.A N CYS 166.A O no hydrogen 2.790 N/A VAL 171.A N GLU 167.A O no hydrogen 3.393 N/A LEU 173.A N LEU 169.A O no hydrogen 2.957 N/A LEU 174.A N VAL 171.A O no hydrogen 3.126 N/A PHE 176.A N LEU 173.A O no hydrogen 2.773 N/A GLY 177.A N LEU 174.A O no hydrogen 3.429 N/A HIS 179.A N GLY 135.A O no hydrogen 2.832 N/A SER 181.A N VAL 137.A O no hydrogen 3.336 N/A SER 181.A OG THR 250.A O no hydrogen 2.506 N/A LEU 182.A N LEU 251.A O no hydrogen 2.818 N/A ILE 183.A N VAL 139.A O no hydrogen 2.717 N/A GLU 184.A N TYR 253.A O no hydrogen 2.689 N/A CYS 185.A SG ILE 183.A O no hydrogen 3.572 N/A HIS 189.A N GLN 231.A O no hydrogen 2.993 N/A THR 190.A OG1 VAL 188.A O no hydrogen 3.501 N/A PHE 192.A N THR 190.A OG1 no hydrogen 3.118 N/A GLY 198.A N LYS 195.A O no hydrogen 2.725 N/A GLU 202.A N SER 199.A O no hydrogen 3.266 N/A ASP 205.A N GLU 202.A O no hydrogen 3.019 N/A ARG 206.A N VAL 203.A O no hydrogen 2.790 N/A ARG 206.A NE ALA 101.A O no hydrogen 2.951 N/A THR 207.A OG1 VAL 203.A O no hydrogen 2.859 N/A THR 211.A N ASP 208.A O no hydrogen 3.097 N/A THR 211.A N ASP 208.A OD1 no hydrogen 2.832 N/A THR 211.A OG1 ASP 208.A OD1 no hydrogen 3.156 N/A THR 211.A OG1 ASP 208.A OD2 no hydrogen 2.469 N/A PHE 212.A N ASP 208.A O no hydrogen 3.240 N/A HIS 213.A N ILE 209.A O no hydrogen 3.163 N/A PHE 215.A N THR 211.A O no hydrogen 2.568 N/A PHE 215.A N PHE 212.A O no hydrogen 2.985 N/A TYR 216.A N PHE 212.A O no hydrogen 3.041 N/A TYR 216.A OH GLU 201.A OE2 no hydrogen 2.611 N/A GLN 217.A N HIS 213.A O no hydrogen 2.806 N/A TYR 218.A N ARG 214.A O no hydrogen 2.966 N/A LEU 219.A N PHE 215.A O no hydrogen 2.951 N/A ALA 220.A N TYR 216.A O no hydrogen 2.792 N/A SER 222.A N TYR 218.A O no hydrogen 2.674 N/A LYS 223.A N LEU 219.A O no hydrogen 2.736 N/A LYS 223.A NZ SER 222.A OG no hydrogen 2.736 N/A GLN 224.A N HIS 221.A O no hydrogen 3.238 N/A GLN 224.A NE2 GLU 228.A OE2 no hydrogen 2.905 N/A VAL 225.A N HIS 221.A O no hydrogen 2.887 N/A PHE 226.A N SER 222.A O no hydrogen 2.777 N/A ARG 227.A N LYS 223.A O no hydrogen 3.268 N/A ALA 229.A N PHE 226.A O no hydrogen 3.243 N/A ALA 230.A N PHE 226.A O no hydrogen 2.875 N/A GLN 231.A N PRO 187.A O no hydrogen 3.034 N/A GLN 231.A NE2 THR 255.A OG1 no hydrogen 3.242 N/A GLU 234.A N ASN 232.A OD1 no hydrogen 2.859 N/A VAL 236.A N ASN 232.A O no hydrogen 3.061 N/A ALA 237.A N PRO 233.A O no hydrogen 2.980 N/A GLU 238.A N GLU 234.A O no hydrogen 3.153 N/A VAL 239.A N VAL 236.A O no hydrogen 2.994 N/A LEU 241.A N ALA 237.A O no hydrogen 3.058 N/A THR 242.A N GLU 238.A O no hydrogen 3.050 N/A ALA 243.A N VAL 239.A O no hydrogen 2.992 N/A LEU 244.A N PHE 240.A O no hydrogen 3.115 N/A ARG 245.A N LEU 241.A O no hydrogen 2.940 N/A ALA 246.A N THR 242.A O no hydrogen 3.134 N/A ALA 246.A N ALA 243.A O no hydrogen 2.829 N/A THR 250.A N TYR 253.A OH no hydrogen 2.912 N/A THR 250.A OG1 ARG 252.A O no hydrogen 2.795 N/A ARG 252.A NE GLU 163.A OE2 no hydrogen 3.402 N/A ARG 252.A NH1 GLU 163.A OE2 no hydrogen 3.021 N/A TYR 253.A N LEU 182.A O no hydrogen 3.107 N/A THR 255.A N GLU 184.A O no hydrogen 3.002 N/A THR 255.A OG1 GLU 184.A O no hydrogen 3.296 N/A LEU 263.A N PHE 259.A O no hydrogen 3.270 N/A ARG 264.A N LEU 260.A O no hydrogen 3.259 N/A MET 265.A N PRO 261.A O no hydrogen 2.934 N/A ARG 266.A N LEU 262.A O no hydrogen 3.012 N/A LEU 267.A N LEU 263.A O no hydrogen 2.840 N/A LEU 267.A N ARG 264.A O no hydrogen 3.022 N/A ASP 268.A N ARG 264.A O no hydrogen 3.299 N/A ASP 268.A N MET 265.A O no hydrogen 2.886 N/A ASP 269.A N ARG 266.A O no hydrogen 3.198 N/A SER 271.A OG ASP 269.A OD1 no hydrogen 2.951 N/A GLY 272.A N ASP 269.A O no hydrogen 3.100 N/A ASN 274.A N ASP 269.A OD2 no hydrogen 2.760 N/A TYR 275.A OH GLY 148.A O no hydrogen 2.703 N/A VAL 276.A N GLY 272.A O no hydrogen 3.504 N/A THR 277.A N SER 273.A O no hydrogen 3.176 N/A THR 277.A OG1 SER 273.A O no hydrogen 3.449 N/A ALA 278.A N ASN 274.A O no hydrogen 3.026 N/A MET 279.A N TYR 275.A O no hydrogen 2.782 N/A HIS 280.A N VAL 276.A O no hydrogen 2.998 N/A ARG 281.A N THR 277.A O no hydrogen 2.824 N/A VAL 283.A N MET 279.A O no hydrogen 2.910 N/A PHE 284.A N HIS 280.A O no hydrogen 3.069 N/A