Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4a2u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N MET 1.A O no hydrogen 3.069 N/A LEU 5.A N MET 1.A O no hydrogen 3.210 N/A ARG 7.A N ILE 4.A O no hydrogen 3.370 N/A GLN 12.A NE2 ALA 6.A O no hydrogen 2.543 N/A VAL 14.A N PHE 11.A O no hydrogen 3.173 N/A ALA 18.A N GLU 15.A O no hydrogen 2.928 N/A ILE 19.A N GLU 15.A O no hydrogen 3.185 N/A LEU 22.A N ALA 18.A O no hydrogen 2.938 N/A THR 23.A N ALA 20.A O no hydrogen 2.955 N/A THR 23.A OG1 ASP 2.A OD1 no hydrogen 3.313 N/A THR 23.A OG1 ILE 19.A O no hydrogen 2.291 N/A LYS 24.A N ALA 20.A O no hydrogen 3.159 N/A LEU 26.A N THR 23.A O no hydrogen 3.226 N/A GLN 27.A N SER 103.A O no hydrogen 3.380 N/A VAL 29.A N ALA 101.A O no hydrogen 2.877 N/A HIS 35.A N THR 95.A OG1 no hydrogen 3.019 N/A VAL 37.A N ALA 93.A O no hydrogen 2.806 N/A ALA 39.A N GLU 42.A OE1 no hydrogen 2.539 N/A GLY 41.A N ARG 89.A O no hydrogen 3.152 N/A GLU 42.A N ALA 39.A O no hydrogen 2.913 N/A ARG 46.A NH1 SER 103.A OG no hydrogen 2.340 N/A LEU 47.A N MET 104.A O no hydrogen 2.858 N/A TYR 48.A N PHE 78.A O no hydrogen 2.785 N/A ILE 49.A N VAL 102.A O no hydrogen 2.618 N/A ILE 50.A N ASP 76.A O no hydrogen 3.100 N/A SER 52.A N ARG 100.A O no hydrogen 2.930 N/A LYS 54.A N THR 97.A OG1 no hydrogen 3.243 N/A LYS 54.A NZ ASP 174.A OD2 no hydrogen 3.156 N/A VAL 55.A N MET 72.A O no hydrogen 2.700 N/A LYS 56.A N THR 94.A O no hydrogen 2.753 N/A LYS 56.A NZ GLU 179.A OE2 no hydrogen 3.216 N/A ILE 57.A N THR 70.A O no hydrogen 3.040 N/A GLY 58.A N SER 92.A O no hydrogen 2.872 N/A ARG 59.A N ASN 67.A O no hydrogen 2.970 N/A ARG 59.A NE THR 90.A O no hydrogen 3.260 N/A ARG 60.A N GLU 40.A OE1 no hydrogen 3.341 N/A ARG 60.A NH1 GLU 66.A OE1 no hydrogen 3.442 N/A ALA 61.A N ARG 65.A O no hydrogen 2.289 N/A GLY 64.A N ALA 61.A O no hydrogen 2.754 N/A ASN 67.A N ARG 59.A O no hydrogen 2.751 N/A LEU 68.A N GLN 182.A O no hydrogen 3.303 N/A LEU 69.A N ILE 57.A O no hydrogen 2.773 N/A MET 72.A N VAL 55.A O no hydrogen 2.722 N/A GLY 73.A N ASP 76.A OD2 no hydrogen 2.650 N/A SER 75.A N ILE 50.A O no hydrogen 2.724 N/A SER 75.A OG ILE 4.A O no hydrogen 2.543 N/A SER 75.A OG ARG 7.A O no hydrogen 3.259 N/A ASP 76.A N GLY 73.A O no hydrogen 3.021 N/A PHE 78.A N TYR 48.A O no hydrogen 2.777 N/A GLU 80.A N GLU 80.A OE1 no hydrogen 2.432 N/A SER 82.A OG PRO 88.A O no hydrogen 3.051 N/A ILE 83.A N GLU 80.A O no hydrogen 3.172 N/A PHE 84.A N GLU 80.A O no hydrogen 3.375 N/A ARG 89.A N GLU 42.A O no hydrogen 3.022 N/A ARG 89.A NH1 ARG 46.A O no hydrogen 3.157 N/A ARG 89.A NH1 GLY 79.A O no hydrogen 2.663 N/A ARG 89.A NH2 ARG 46.A O no hydrogen 2.474 N/A THR 90.A OG1 SER 91.A OG no hydrogen 3.053 N/A SER 91.A OG THR 90.A OG1 no hydrogen 3.053 N/A SER 92.A N GLY 58.A O no hydrogen 2.748 N/A SER 92.A OG GLY 58.A O no hydrogen 3.029 N/A ALA 93.A N PHE 38.A O no hydrogen 3.431 N/A THR 94.A N LYS 56.A O no hydrogen 2.959 N/A THR 95.A N HIS 35.A O no hydrogen 2.981 N/A THR 95.A OG1 PRO 32.A O no hydrogen 2.720 N/A THR 95.A OG1 THR 97.A O no hydrogen 3.185 N/A ILE 96.A N LYS 54.A O no hydrogen 3.262 N/A THR 97.A OG1 GLU 98.A O no hydrogen 2.312 N/A VAL 99.A N PHE 31.A O no hydrogen 2.606 N/A ARG 100.A N SER 52.A O no hydrogen 2.999 N/A ARG 100.A NH1 ASP 30.A OD2 no hydrogen 3.379 N/A ALA 101.A N VAL 29.A O no hydrogen 2.757 N/A VAL 102.A N ILE 49.A O no hydrogen 2.780 N/A SER 103.A N GLN 27.A O no hydrogen 3.207 N/A MET 104.A N LEU 47.A O no hydrogen 3.080 N/A ARG 106.A N ASP 45.A O no hydrogen 2.931 N/A ALA 108.A N ASP 105.A OD1 no hydrogen 3.157 N/A LEU 109.A N ASP 105.A O no hydrogen 2.619 N/A ARG 110.A N ARG 106.A O no hydrogen 2.868 N/A SER 111.A N ASP 107.A O no hydrogen 2.940 N/A SER 111.A OG ASP 107.A O no hydrogen 3.247 N/A TRP 112.A N ALA 108.A O no hydrogen 3.133 N/A ILE 113.A N LEU 109.A O no hydrogen 3.118 N/A ALA 114.A N ARG 110.A O no hydrogen 3.204 N/A ALA 114.A N SER 111.A O no hydrogen 3.176 N/A ASP 115.A N SER 111.A O no hydrogen 2.947 N/A ARG 116.A N TRP 112.A O no hydrogen 2.748 N/A ILE 119.A N ARG 116.A O no hydrogen 2.977 N/A SER 120.A N PRO 117.A O no hydrogen 2.977 N/A GLN 122.A N GLU 118.A O no hydrogen 2.934 N/A LEU 123.A N ILE 119.A O no hydrogen 3.041 N/A LEU 124.A N SER 120.A O no hydrogen 3.089 N/A ARG 125.A N GLU 121.A O no hydrogen 3.401 N/A VAL 126.A N GLN 122.A O no hydrogen 3.031 N/A LEU 127.A N LEU 123.A O no hydrogen 2.830 N/A ALA 128.A N LEU 124.A O no hydrogen 2.781 N/A ARG 129.A N ARG 125.A O no hydrogen 2.854 N/A ARG 130.A N VAL 126.A O no hydrogen 2.892 N/A ARG 130.A NH1 MET 77.A O no hydrogen 3.075 N/A ARG 130.A NH1 GLU 80.A OE2 no hydrogen 2.618 N/A ARG 130.A NH2 MET 77.A O no hydrogen 2.488 N/A LEU 131.A N LEU 127.A O no hydrogen 2.793 N/A ARG 132.A N ALA 128.A O no hydrogen 2.823 N/A ARG 133.A N ARG 129.A O no hydrogen 2.949 N/A THR 134.A N ARG 130.A O no hydrogen 3.167 N/A THR 134.A OG1 ARG 130.A O no hydrogen 2.420 N/A ASN 135.A N LEU 131.A O no hydrogen 3.116 N/A ASN 136.A N ARG 132.A O no hydrogen 3.315 N/A ASN 137.A N ARG 133.A O no hydrogen 2.949 N/A LEU 138.A N THR 134.A O no hydrogen 2.744 N/A ALA 139.A N ASN 135.A O no hydrogen 3.086 N/A ASP 140.A N ASN 136.A O no hydrogen 2.862 N/A LEU 141.A N ASN 137.A O no hydrogen 3.139 N/A LEU 141.A N LEU 138.A O no hydrogen 2.959 N/A ILE 142.A N ALA 139.A O no hydrogen 3.196 N/A PHE 143.A N ALA 139.A O no hydrogen 2.825 N/A THR 144.A N ASP 140.A O no hydrogen 2.858 N/A THR 144.A OG1 ASP 140.A OD1 no hydrogen 3.266 N/A GLY 148.A N ASP 145.A OD2 no hydrogen 2.843 N/A ARG 149.A N ASP 145.A O no hydrogen 2.948 N/A ARG 149.A NE VAL 184.A O no hydrogen 3.177 N/A ARG 149.A NH1 THR 144.A O no hydrogen 3.315 N/A ARG 149.A NH2 VAL 184.A O no hydrogen 3.316 N/A ALA 151.A N PRO 147.A O no hydrogen 3.111 N/A GLN 153.A N ARG 149.A O no hydrogen 3.159 N/A LEU 154.A N VAL 150.A O no hydrogen 3.321 N/A LEU 154.A N ALA 151.A O no hydrogen 2.944 N/A LEU 155.A N ALA 151.A O no hydrogen 3.211 N/A GLN 156.A N LYS 152.A O no hydrogen 3.040 N/A LEU 157.A N GLN 153.A O no hydrogen 3.044 N/A ALA 158.A N LEU 154.A O no hydrogen 2.854 N/A GLN 159.A N LEU 155.A O no hydrogen 2.655 N/A ARG 160.A N GLN 156.A O no hydrogen 3.221 N/A ARG 160.A NE ARG 160.A O no hydrogen 3.214 N/A ARG 160.A NH1 ASP 76.A OD1 no hydrogen 2.725 N/A ARG 160.A NH2 PRO 74.A O no hydrogen 2.899 N/A PHE 161.A N LEU 157.A O no hydrogen 2.638 N/A GLY 162.A N ALA 158.A O no hydrogen 2.429 N/A THR 163.A N ARG 170.A O no hydrogen 2.770 N/A GLU 165.A N ALA 168.A O no hydrogen 3.139 N/A LEU 169.A N ILE 213.A O no hydrogen 2.546 N/A ARG 170.A N THR 163.A O no hydrogen 2.335 N/A ARG 170.A NH2 GLU 207.A OE1 no hydrogen 3.505 N/A VAL 171.A N VAL 211.A O no hydrogen 3.161 N/A LEU 175.A N HIS 173.A ND1 no hydrogen 2.918 N/A THR 176.A N GLU 179.A OE1 no hydrogen 2.774 N/A GLU 179.A N THR 176.A OG1 no hydrogen 3.317 N/A ILE 180.A N THR 176.A O no hydrogen 3.418 N/A ALA 181.A N GLN 177.A O no hydrogen 3.404 N/A GLN 182.A N GLU 178.A O no hydrogen 2.914 N/A LEU 183.A N GLU 179.A O no hydrogen 3.294 N/A VAL 184.A N ILE 180.A O no hydrogen 3.368 N/A GLY 185.A N GLN 182.A O no hydrogen 2.979 N/A SER 187.A OG GLU 189.A OE1 no hydrogen 3.105 N/A THR 190.A N SER 187.A O no hydrogen 2.881 N/A VAL 191.A N SER 187.A O no hydrogen 3.126 N/A ASN 192.A N ARG 188.A O no hydrogen 2.591 N/A ALA 194.A N VAL 191.A O no hydrogen 2.890 N/A LEU 195.A N VAL 191.A O no hydrogen 3.047 N/A ALA 196.A N ASN 192.A O no hydrogen 3.259 N/A ASP 197.A N LYS 193.A O no hydrogen 3.309 N/A ALA 199.A N ALA 196.A O no hydrogen 3.185 N/A HIS 200.A N ALA 196.A O no hydrogen 3.014 N/A ARG 201.A NE ASP 197.A OD1 no hydrogen 2.804 N/A ARG 201.A NH2 ASP 197.A OD1 no hydrogen 3.109 N/A ARG 201.A NH2 ASP 197.A OD2 no hydrogen 3.369 N/A TRP 203.A N PHE 198.A O no hydrogen 3.467 N/A SER 210.A OG VAL 171.A O no hydrogen 3.274 N/A VAL 211.A N VAL 171.A O no hydrogen 2.770 N/A ILE 213.A N LEU 169.A O no hydrogen 2.747 N/A SER 214.A N TRP 203.A O no hydrogen 2.749 N/A SER 216.A N ASP 215.A OD1 no hydrogen 2.826 N/A ALA 220.A N SER 216.A O no hydrogen 3.132 N/A ARG 221.A N GLU 217.A O no hydrogen 2.935 N/A ARG 222.A NH2 ASP 145.A OD2 no hydrogen 2.966 N/A ALA 223.A N LEU 219.A O no hydrogen 2.462 N/A