Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3sdi_F.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 6.A ND2 HIS 117.A O no hydrogen 2.646 N/A ASN 6.A ND2 TYR 120.A O no hydrogen 3.029 N/A ASN 6.A ND2 VAL 123.A O no hydrogen 3.122 N/A SER 10.A N ARG 14.A O no hydrogen 2.709 N/A SER 10.A OG ASP 12.A OD2 no hydrogen 2.714 N/A ASP 12.A N SER 10.A OG no hydrogen 3.364 N/A ASP 12.A N ASP 12.A OD2 no hydrogen 2.465 N/A GLY 13.A N SER 10.A O no hydrogen 2.830 N/A ARG 14.A N SER 10.A OG no hydrogen 3.124 N/A ARG 14.A NE GLU 19.A OE2 no hydrogen 2.777 N/A ARG 14.A NH1 ASP 12.A OD1 no hydrogen 3.008 N/A ARG 14.A NH2 GLU 19.A OE1 no hydrogen 2.860 N/A ARG 14.A NH2 GLU 19.A OE2 no hydrogen 3.334 N/A ASN 15.A ND2 ASN 6.A O no hydrogen 2.730 N/A ASN 15.A ND2 ASN 6.A OD1 no hydrogen 3.438 N/A VAL 18.A N ASN 15.A OD1 no hydrogen 3.120 N/A GLU 19.A N ASN 15.A O no hydrogen 3.197 N/A TYR 20.A N PHE 16.A O no hydrogen 2.809 N/A TYR 20.A OH ASP 3.A OD2 no hydrogen 2.829 N/A ALA 21.A N GLN 17.A O no hydrogen 2.912 N/A VAL 22.A N VAL 18.A O no hydrogen 3.010 N/A LYS 23.A N TYR 20.A O no hydrogen 3.106 N/A ALA 24.A N ALA 21.A O no hydrogen 3.078 N/A VAL 25.A N ALA 21.A O no hydrogen 3.426 N/A GLU 26.A N VAL 22.A O no hydrogen 2.889 N/A ASN 27.A N LYS 23.A O no hydrogen 2.989 N/A GLY 28.A N VAL 25.A O no hydrogen 2.660 N/A THR 30.A N GLU 45.A OE2 no hydrogen 3.154 N/A THR 30.A OG1 THR 159.A O no hydrogen 3.512 N/A SER 31.A N THR 159.A O no hydrogen 3.034 N/A SER 31.A OG SER 73.A OG no hydrogen 2.576 N/A ILE 32.A N ALA 43.A O no hydrogen 2.835 N/A GLY 33.A N ALA 157.A O no hydrogen 2.968 N/A ILE 34.A N VAL 41.A O no hydrogen 2.776 N/A LYS 35.A N LYS 155.A O no hydrogen 3.108 N/A CYS 36.A N GLY 39.A O no hydrogen 2.935 N/A ASN 37.A N LEU 181.A O no hydrogen 2.858 N/A VAL 40.A N CYS 213.A O no hydrogen 3.009 N/A VAL 41.A N ILE 34.A O no hydrogen 2.816 N/A PHE 42.A N SER 211.A O no hydrogen 2.890 N/A ALA 43.A N ILE 32.A O no hydrogen 3.006 N/A VAL 44.A N GLU 209.A O no hydrogen 3.012 N/A GLU 45.A N THR 30.A O no hydrogen 3.120 N/A LYS 46.A N GLU 207.A O no hydrogen 2.905 N/A LYS 46.A NZ GLU 207.A OE2 no hydrogen 3.123 N/A LYS 46.A NZ GLU 209.A OE2 no hydrogen 3.262 N/A ILE 48.A N ASP 205.A O no hydrogen 2.779 N/A LEU 52.A N SER 50.A OG no hydrogen 3.097 N/A LEU 53.A N SER 50.A O no hydrogen 3.198 N/A GLN 56.A N GLU 207.A OE1 no hydrogen 3.302 N/A GLN 56.A N GLU 207.A OE2 no hydrogen 2.802 N/A LYS 60.A N GLU 209.A OE1 no hydrogen 2.733 N/A ILE 61.A N GLU 209.A OE1 no hydrogen 3.040 N/A GLN 62.A N CYS 70.A O no hydrogen 2.880 N/A VAL 64.A N ILE 68.A O no hydrogen 2.837 N/A ARG 66.A N ASP 65.A OD2 no hydrogen 2.653 N/A HIS 67.A NE2 ILE 101.A O no hydrogen 2.749 N/A ILE 68.A N VAL 64.A O no hydrogen 3.208 N/A GLY 69.A N GLY 133.A O no hydrogen 3.043 N/A CYS 70.A N GLN 62.A O no hydrogen 2.718 N/A VAL 71.A N ILE 131.A O no hydrogen 2.684 N/A TYR 72.A OH GLN 62.A OE1 no hydrogen 2.720 N/A SER 73.A N SER 129.A O no hydrogen 3.041 N/A SER 73.A OG THR 29.A O no hydrogen 2.699 N/A SER 73.A OG SER 31.A OG no hydrogen 2.576 N/A SER 73.A OG THR 159.A O no hydrogen 3.551 N/A LEU 75.A N GLY 127.A O no hydrogen 2.822 N/A GLY 79.A N LEU 75.A O no hydrogen 3.325 N/A ARG 80.A N ILE 76.A O no hydrogen 3.030 N/A HIS 81.A N PRO 77.A O no hydrogen 2.821 N/A HIS 81.A NE2 TYR 113.A OH no hydrogen 2.840 N/A LEU 82.A N ASP 78.A O no hydrogen 3.057 N/A VAL 83.A N GLY 79.A O no hydrogen 2.872 N/A ASN 84.A N ARG 80.A O no hydrogen 2.844 N/A ARG 85.A N HIS 81.A O no hydrogen 3.223 N/A ARG 85.A NE GLU 89.A OE2 no hydrogen 2.870 N/A ARG 85.A NH2 GLU 89.A OE2 no hydrogen 3.211 N/A GLY 86.A N LEU 82.A O no hydrogen 2.858 N/A ARG 87.A N VAL 83.A O no hydrogen 2.757 N/A ARG 87.A NE VAL 63.A O no hydrogen 2.883 N/A ARG 87.A NH2 VAL 63.A O no hydrogen 2.601 N/A GLU 88.A N ASN 84.A O no hydrogen 3.089 N/A GLU 89.A N ARG 85.A O no hydrogen 2.820 N/A ALA 90.A N GLY 86.A O no hydrogen 2.831 N/A ALA 91.A N ARG 87.A O no hydrogen 3.027 N/A SER 92.A N GLU 88.A O no hydrogen 2.975 N/A PHE 93.A N GLU 89.A O no hydrogen 3.340 N/A LYS 94.A N ALA 90.A O no hydrogen 3.080 N/A LYS 94.A NZ ASP 65.A OD1 no hydrogen 3.430 N/A LYS 94.A NZ ASP 65.A OD2 no hydrogen 3.540 N/A LYS 95.A N ALA 91.A O no hydrogen 2.807 N/A LEU 96.A N SER 92.A O no hydrogen 3.353 N/A LEU 96.A N PHE 93.A O no hydrogen 3.217 N/A TYR 97.A N PHE 93.A O no hydrogen 2.890 N/A LYS 98.A N LYS 94.A O no hydrogen 2.761 N/A THR 99.A N TYR 97.A O no hydrogen 2.796 N/A THR 99.A OG1 PRO 100.A O no hydrogen 3.099 N/A ILE 103.A N ASP 136.A OD1 no hydrogen 3.157 N/A PHE 106.A N PRO 102.A O no hydrogen 2.849 N/A ALA 107.A N ILE 103.A O no hydrogen 2.794 N/A ASP 108.A N PRO 104.A O no hydrogen 3.044 N/A ARG 109.A N ALA 105.A O no hydrogen 3.175 N/A LEU 110.A N PHE 106.A O no hydrogen 3.145 N/A GLY 111.A N ALA 107.A O no hydrogen 2.807 N/A GLN 112.A N ASP 108.A O no hydrogen 2.766 N/A GLN 112.A NE2 ASP 108.A OD1 no hydrogen 3.154 N/A TYR 113.A N ARG 109.A O no hydrogen 3.278 N/A TYR 113.A OH HIS 81.A NE2 no hydrogen 2.840 N/A VAL 114.A N LEU 110.A O no hydrogen 2.924 N/A GLN 115.A N GLY 111.A O no hydrogen 2.972 N/A ALA 116.A N GLN 112.A O no hydrogen 3.086 N/A HIS 117.A N VAL 114.A O no hydrogen 2.914 N/A HIS 117.A ND1 TYR 113.A O no hydrogen 2.926 N/A THR 118.A N GLN 115.A O no hydrogen 2.915 N/A THR 118.A OG1 GLN 115.A O no hydrogen 2.981 N/A LEU 119.A N ALA 116.A O no hydrogen 3.083 N/A VAL 123.A N TYR 120.A O no hydrogen 3.380 N/A ARG 124.A NH1 ASP 78.A OD1 no hydrogen 2.647 N/A ARG 124.A NH1 PRO 125.A O no hydrogen 3.062 N/A ARG 124.A NH2 ASP 78.A OD1 no hydrogen 3.285 N/A ARG 124.A NH2 ASP 78.A OD2 no hydrogen 2.864 N/A GLY 127.A N ASP 78.A OD1 no hydrogen 2.828 N/A SER 129.A N SER 73.A O no hydrogen 3.084 N/A SER 129.A OG LEU 145.A O no hydrogen 3.202 N/A SER 129.A OG GLU 146.A OE1 no hydrogen 2.479 N/A THR 130.A N LEU 145.A O no hydrogen 3.090 N/A ILE 131.A N VAL 71.A O no hydrogen 2.570 N/A PHE 132.A N TYR 143.A O no hydrogen 3.034 N/A GLY 133.A N GLY 69.A O no hydrogen 3.137 N/A GLY 134.A N HIS 141.A O no hydrogen 3.225 N/A ASP 136.A N GLY 139.A O no hydrogen 2.978 N/A ASN 138.A N ASP 136.A OD2 no hydrogen 3.096 N/A GLY 139.A N ASP 136.A O no hydrogen 3.261 N/A HIS 141.A N GLY 134.A O no hydrogen 3.001 N/A TYR 143.A N PHE 132.A O no hydrogen 2.741 N/A MET 144.A N TRP 152.A O no hydrogen 3.435 N/A LEU 145.A N THR 130.A O no hydrogen 2.961 N/A GLU 146.A N SER 150.A O no hydrogen 2.856 N/A GLY 149.A N GLU 146.A O no hydrogen 2.803 N/A SER 150.A N SER 148.A OG no hydrogen 3.355 N/A TYR 151.A OH ASP 108.A OD2 no hydrogen 2.601 N/A TYR 154.A N LEU 142.A O no hydrogen 2.877 N/A ALA 157.A N GLY 33.A O no hydrogen 2.941 N/A THR 159.A N SER 31.A O no hydrogen 2.966 N/A LYS 161.A N GLY 28.A O no hydrogen 2.842 N/A ARG 163.A N GLY 160.A O no hydrogen 3.162 N/A ARG 163.A NE GLY 160.A O no hydrogen 3.086 N/A ALA 166.A N GLY 162.A O no hydrogen 3.171 N/A LYS 167.A N ARG 163.A O no hydrogen 2.865 N/A ALA 168.A N GLN 164.A O no hydrogen 3.130 N/A GLU 169.A N SER 165.A O no hydrogen 2.923 N/A LEU 170.A N ALA 166.A O no hydrogen 2.674 N/A GLU 171.A N LYS 167.A O no hydrogen 2.795 N/A LYS 172.A N ALA 168.A O no hydrogen 3.314 N/A LEU 173.A N GLU 169.A O no hydrogen 3.306 N/A VAL 174.A N LEU 170.A O no hydrogen 3.236 N/A ARG 184.A NE GLU 217A.A OE1 no hydrogen 3.186 N/A ARG 184.A NE GLU 217A.A OE2 no hydrogen 3.308 N/A GLU 185.A N SER 182.A OG no hydrogen 3.216 N/A ALA 186.A N SER 182.A O no hydrogen 2.971 N/A VAL 187.A N ALA 183.A O no hydrogen 3.231 N/A LYS 188.A N ARG 184.A O no hydrogen 3.273 N/A GLN 189.A N GLU 185.A O no hydrogen 2.834 N/A ALA 190.A N ALA 186.A O no hydrogen 3.022 N/A ALA 191.A N VAL 187.A O no hydrogen 3.126 N/A LYS 192.A N LYS 188.A O no hydrogen 3.177 N/A ILE 193.A N GLN 189.A O no hydrogen 2.887 N/A ILE 194.A N ALA 190.A O no hydrogen 3.130 N/A TYR 195.A N ALA 191.A O no hydrogen 3.175 N/A LEU 196.A N LYS 192.A O no hydrogen 2.920 N/A ALA 197.A N ILE 193.A O no hydrogen 3.042 N/A HIS 198.A N TYR 195.A O no hydrogen 3.254 N/A HIS 198.A ND1 GLU 45.A OE1 no hydrogen 2.660 N/A HIS 198.A NE2 LYS 204C.A O no hydrogen 2.926 N/A ASN 201.A N HIS 198.A O no hydrogen 2.736 N/A ASN 201.A ND2 ASN 201.A O no hydrogen 3.005 N/A LYS 202.A N GLU 199.A O no hydrogen 3.180 N/A PHE 206.A N ASP 205.A OD2 no hydrogen 2.688 N/A GLU 207.A N LYS 46.A O no hydrogen 2.827 N/A GLU 209.A N VAL 44.A O no hydrogen 3.267 N/A SER 211.A N PHE 42.A O no hydrogen 2.905 N/A SER 211.A OG HIS 222.A NE2 no hydrogen 2.823 N/A TRP 212.A N LYS 223.A O no hydrogen 2.940 N/A CYS 213.A N VAL 40.A O no hydrogen 3.026 N/A CYS 213.A SG HIS 67.A O no hydrogen 3.396 N/A SER 214.A N THR 218B.A OG1 no hydrogen 2.860 N/A SER 214.A OG ASP 38.A OD1 no hydrogen 3.022 N/A SER 214.A OG ASP 38.A OD2 no hydrogen 2.823 N/A LEU 215.A N ASP 38.A O no hydrogen 2.961 N/A SER 216.A N ASP 38.A OD1 no hydrogen 3.003 N/A SER 216.A OG ASP 38.A OD1 no hydrogen 2.748 N/A GLY 220.A N SER 214.A O no hydrogen 2.911 N/A LEU 221.A N THR 218B.A O no hydrogen 3.410 N/A HIS 222.A N ARG 66.A O no hydrogen 2.865 N/A HIS 222.A NE2 SER 211.A OG no hydrogen 2.823 N/A LYS 223.A N TRP 212.A O no hydrogen 2.932 N/A VAL 225.A N ILE 210.A O no hydrogen 2.976 N/A GLN 231.A N GLY 227.A O no hydrogen 2.974 N/A GLN 231.A NE2 GLN 231.A O no hydrogen 3.239 N/A GLN 231.A NE2 ASP 235.A OD1 no hydrogen 3.195 N/A GLU 232.A N ASP 228.A O no hydrogen 2.949 N/A ALA 233.A N LEU 229.A O no hydrogen 3.193 N/A ILE 234.A N LEU 230.A O no hydrogen 2.925 N/A ASP 235.A N GLN 231.A O no hydrogen 2.841 N/A PHE 236.A N GLU 232.A O no hydrogen 3.173 N/A ALA 237.A N ALA 233.A O no hydrogen 3.121 N/A GLN 238.A N ILE 234.A O no hydrogen 2.775 N/A LYS 239.A N ASP 235.A O no hydrogen 2.947 N/A GLU 240.A N PHE 236.A O no hydrogen 2.860 N/A ILE 241.A N GLN 238.A O no hydrogen 3.142 N/A ASN 242.A N LYS 239.A O no hydrogen 3.454 N/A ASN 242.A ND2 GLN 238.A O no hydrogen 3.391 N/A ASP 175A.A N GLU 171.A O no hydrogen 3.309 N/A ASP 175A.A N LYS 172.A O no hydrogen 2.787 N/A HIS 176B.A N LYS 172.A O no hydrogen 2.876 N/A THR 218B.A N SER 214.A O no hydrogen 2.947 N/A THR 218B.A OG1 SER 214.A O no hydrogen 2.791 N/A THR 218B.A OG1 LEU 221.A O no hydrogen 2.685 N/A HIS 177C.A N LEU 173.A O no hydrogen 3.030 N/A LYS 204C.A N ASN 201.A O no hydrogen 3.512 N/A