Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1dth_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A N GLN 1.A OE1 no hydrogen 2.636 N/A ARG 6.A N ASN 48.A O no hydrogen 3.019 N/A TYR 7.A N ILE 198.A O no hydrogen 2.851 N/A ILE 8.A N HIS 50.A O no hydrogen 3.097 N/A GLU 9.A N ASP 93.A OD2 no hydrogen 2.748 N/A LEU 10.A N SER 52.A O no hydrogen 2.944 N/A VAL 11.A N ASN 94.A O no hydrogen 3.017 N/A VAL 12.A N ASP 55.A O no hydrogen 3.299 N/A VAL 13.A N GLN 96.A O no hydrogen 2.903 N/A ALA 14.A N GLU 57.A O no hydrogen 2.808 N/A ASP 15.A N LEU 98.A O no hydrogen 3.214 N/A HIS 16.A N ASP 63.A OD1 no hydrogen 3.003 N/A VAL 18.A N ASP 15.A O no hydrogen 2.780 N/A VAL 18.A N ASP 15.A OD1 no hydrogen 2.995 N/A PHE 19.A N ASP 15.A O no hydrogen 3.029 N/A MET 20.A N HIS 16.A O no hydrogen 2.794 N/A LYS 21.A N VAL 18.A O no hydrogen 3.104 N/A TYR 22.A N VAL 18.A O no hydrogen 3.267 N/A SER 24.A N PHE 19.A O no hydrogen 3.009 N/A ASP 25.A N TYR 22.A O no hydrogen 3.180 N/A THR 28.A OG1 ASP 25.A OD2 no hydrogen 2.672 N/A ARG 30.A N LEU 26.A O no hydrogen 2.836 N/A THR 31.A N ASN 27.A O no hydrogen 2.923 N/A THR 31.A OG1 ASN 27.A O no hydrogen 2.891 N/A ARG 32.A N THR 28.A O no hydrogen 2.968 N/A ARG 32.A NE ASN 133.A OD1 no hydrogen 2.938 N/A VAL 33.A N ILE 29.A O no hydrogen 3.140 N/A HIS 34.A N ARG 30.A O no hydrogen 3.096 N/A ILE 36.A N ARG 32.A O no hydrogen 3.161 N/A VAL 37.A N VAL 33.A O no hydrogen 3.062 N/A ASN 38.A N HIS 34.A O no hydrogen 3.393 N/A PHE 39.A N GLU 35.A O no hydrogen 3.154 N/A ILE 40.A N ILE 36.A O no hydrogen 3.002 N/A ASN 41.A N VAL 37.A O no hydrogen 2.850 N/A ASN 41.A ND2 VAL 51.A O no hydrogen 3.059 N/A GLY 42.A N ASN 38.A O no hydrogen 3.213 N/A PHE 43.A N PHE 39.A O no hydrogen 3.176 N/A TYR 44.A N ILE 40.A O no hydrogen 2.950 N/A LEU 47.A N TYR 44.A O no hydrogen 3.125 N/A ASN 48.A N ARG 45.A O no hydrogen 3.331 N/A ILE 49.A N TYR 44.A O no hydrogen 3.421 N/A HIS 50.A N ARG 6.A O no hydrogen 3.144 N/A VAL 51.A N ASN 41.A OD1 no hydrogen 2.731 N/A SER 52.A N ILE 8.A O no hydrogen 3.074 N/A THR 54.A N LEU 10.A O no hydrogen 2.858 N/A GLU 57.A N VAL 12.A O no hydrogen 2.950 N/A TRP 59.A N ALA 14.A O no hydrogen 2.972 N/A SER 60.A N ILE 58.A O no hydrogen 2.861 N/A SER 60.A OG ILE 58.A O no hydrogen 3.450 N/A GLN 68.A N THR 74.A OG1 no hydrogen 3.116 N/A GLN 68.A NE2 ASN 66.A O no hydrogen 2.805 N/A SER 71.A N ASP 104.A OD2 no hydrogen 3.308 N/A SER 71.A OG ASP 104.A OD1 no hydrogen 3.386 N/A SER 71.A OG ASP 104.A OD2 no hydrogen 3.299 N/A THR 74.A N ALA 70.A O no hydrogen 3.285 N/A THR 74.A OG1 GLN 68.A O no hydrogen 2.688 N/A THR 74.A OG1 ALA 70.A O no hydrogen 3.023 N/A LEU 75.A N SER 71.A O no hydrogen 2.951 N/A ASN 76.A N SER 72.A O no hydrogen 3.181 N/A ALA 77.A N ASP 73.A O no hydrogen 3.165 N/A PHE 78.A N THR 74.A O no hydrogen 2.980 N/A ALA 79.A N LEU 75.A O no hydrogen 2.927 N/A ARG 82.A N PHE 78.A O no hydrogen 3.016 N/A ARG 82.A NE HIS 92.A NE2 no hydrogen 3.078 N/A GLU 83.A N ALA 79.A O no hydrogen 3.334 N/A THR 84.A N GLU 80.A O no hydrogen 3.317 N/A THR 84.A OG1 GLU 80.A O no hydrogen 2.831 N/A ASP 85.A N TRP 81.A O no hydrogen 2.821 N/A LEU 87.A N ARG 82.A O no hydrogen 2.885 N/A ASN 88.A N ASP 85.A O no hydrogen 3.188 N/A ARG 89.A N LEU 86.A O no hydrogen 3.010 N/A LYS 90.A N LEU 86.A O no hydrogen 2.780 N/A HIS 92.A ND1 LYS 90.A O no hydrogen 2.737 N/A ASP 93.A N GLU 9.A O no hydrogen 2.882 N/A ASN 94.A N GLU 9.A O no hydrogen 3.064 N/A ASN 94.A ND2 ASN 147.A OD1 no hydrogen 2.780 N/A ALA 95.A N SER 122.A O no hydrogen 3.296 N/A GLN 96.A N VAL 11.A O no hydrogen 2.869 N/A GLN 96.A NE2 ASN 94.A OD1 no hydrogen 2.847 N/A GLN 96.A NE2 ASN 147.A OD1 no hydrogen 3.332 N/A LEU 97.A N GLY 124.A O no hydrogen 2.996 N/A LEU 98.A N VAL 13.A O no hydrogen 2.725 N/A THR 99.A N VAL 126.A O no hydrogen 2.899 N/A THR 99.A OG1 ASP 15.A OD2 no hydrogen 2.824 N/A ILE 101.A N THR 99.A OG1 no hydrogen 3.325 N/A ASP 104.A N SER 69.A O no hydrogen 3.047 N/A GLU 106.A N LEU 103.A O no hydrogen 3.156 N/A THR 107.A N LEU 103.A O no hydrogen 3.423 N/A THR 107.A OG1 ASP 104.A OD1 no hydrogen 2.785 N/A LEU 110.A N ILE 125.A O no hydrogen 3.121 N/A GLY 114.A N HIS 146.A O no hydrogen 2.946 N/A THR 115.A N ASN 147.A O no hydrogen 3.093 N/A THR 115.A OG1 PRO 112.A O no hydrogen 3.356 N/A THR 115.A OG1 LEU 121.A O no hydrogen 2.690 N/A MET 116.A N ASN 147.A O no hydrogen 3.027 N/A CYS 117.A N SER 122.A OG no hydrogen 3.051 N/A ASP 118.A N THR 115.A O no hydrogen 3.133 N/A LYS 120.A N ASP 118.A OD1 no hydrogen 3.042 N/A LEU 121.A N ASP 118.A OD1 no hydrogen 2.988 N/A SER 122.A OG ASP 93.A O no hydrogen 2.826 N/A GLY 124.A N ALA 95.A O no hydrogen 3.267 N/A ILE 125.A N LEU 110.A O no hydrogen 2.620 N/A VAL 126.A N LEU 97.A O no hydrogen 2.883 N/A GLN 127.A N LEU 108.A O no hydrogen 2.994 N/A ASP 128.A N THR 99.A O no hydrogen 2.848 N/A HIS 129.A NE2 THR 139.A OG1 no hydrogen 2.872 N/A ILE 132.A N SER 130.A OG no hydrogen 3.347 N/A MET 136.A N ILE 132.A O no hydrogen 3.312 N/A GLY 137.A N ASN 133.A O no hydrogen 2.823 N/A GLY 137.A N LEU 134.A O no hydrogen 2.908 N/A VAL 138.A N LEU 134.A O no hydrogen 2.999 N/A THR 139.A N LEU 135.A O no hydrogen 3.051 N/A THR 139.A OG1 HIS 129.A NE2 no hydrogen 2.872 N/A THR 139.A OG1 LEU 135.A O no hydrogen 2.907 N/A MET 140.A N MET 136.A O no hydrogen 3.223 N/A ALA 141.A N GLY 137.A O no hydrogen 2.965 N/A HIS 142.A N VAL 138.A O no hydrogen 2.726 N/A HIS 142.A ND1 ILE 165.A O no hydrogen 2.821 N/A HIS 142.A NE2 HIS 152.A NE2 no hydrogen 3.169 N/A GLU 143.A N THR 139.A O no hydrogen 3.342 N/A LEU 144.A N MET 140.A O no hydrogen 3.120 N/A GLY 145.A N ALA 141.A O no hydrogen 3.012 N/A HIS 146.A N HIS 142.A O no hydrogen 3.112 N/A HIS 146.A ND1 MET 150.A O no hydrogen 2.908 N/A HIS 146.A NE2 HIS 142.A NE2 no hydrogen 3.028 N/A HIS 146.A NE2 HIS 152.A NE2 no hydrogen 3.071 N/A ASN 147.A N GLU 143.A O no hydrogen 3.270 N/A ASN 147.A ND2 PRO 112.A O no hydrogen 2.981 N/A ASN 147.A ND2 ILE 123.A O no hydrogen 2.959 N/A LEU 148.A N LEU 144.A O no hydrogen 3.068 N/A LEU 148.A N GLY 145.A O no hydrogen 3.028 N/A GLY 149.A N HIS 146.A O no hydrogen 2.964 N/A MET 150.A N GLY 145.A O no hydrogen 2.899 N/A HIS 152.A NE2 HIS 142.A NE2 no hydrogen 3.169 N/A HIS 152.A NE2 HIS 146.A NE2 no hydrogen 3.071 N/A ASP 153.A N MET 166.A O no hydrogen 2.831 N/A CYS 157.A SG ASP 153.A OD2 no hydrogen 3.291 N/A ARG 159.A N SER 162.A O no hydrogen 2.974 N/A SER 162.A N ARG 159.A O no hydrogen 3.365 N/A SER 162.A OG SER 175.A OG no hydrogen 3.017 N/A SER 162.A OG GLU 177.A OE2 no hydrogen 3.356 N/A LEU 163.A N SER 175.A O no hydrogen 3.455 N/A CYS 164.A N CYS 157.A O no hydrogen 3.289 N/A ILE 165.A N GLU 177.A O no hydrogen 2.877 N/A ARG 167.A NE CYS 157.A O no hydrogen 3.026 N/A SER 175.A OG SER 162.A OG no hydrogen 3.017 N/A GLU 177.A N LEU 163.A O no hydrogen 3.193 N/A SER 179.A OG ASP 153.A OD1 no hydrogen 3.088 N/A SER 179.A OG ASP 153.A OD2 no hydrogen 2.705 N/A SER 179.A OG SER 182.A OG no hydrogen 3.121 N/A SER 182.A OG ASP 153.A OD1 no hydrogen 3.448 N/A SER 182.A OG SER 179.A OG no hydrogen 3.121 N/A MET 183.A N SER 179.A O no hydrogen 3.150 N/A HIS 184.A N ASP 180.A O no hydrogen 2.908 N/A HIS 184.A ND1 ASP 180.A O no hydrogen 2.776 N/A TYR 185.A N ASP 181.A O no hydrogen 2.836 N/A TYR 186.A N SER 182.A O no hydrogen 3.268 N/A GLU 187.A N MET 183.A O no hydrogen 3.262 N/A ARG 188.A N HIS 184.A O no hydrogen 3.125 N/A PHE 189.A N TYR 185.A O no hydrogen 3.089 N/A LEU 190.A N TYR 186.A O no hydrogen 3.052 N/A LYS 191.A N GLU 187.A O no hydrogen 3.169 N/A GLN 192.A N ARG 188.A O no hydrogen 2.886 N/A TYR 193.A N PHE 189.A O no hydrogen 3.050 N/A LYS 194.A N LEU 190.A O no hydrogen 3.079 N/A LYS 194.A NZ LYS 191.A O no hydrogen 2.771 N/A LYS 194.A NZ GLN 192.A O no hydrogen 3.429 N/A CYS 197.A SG ASP 93.A OD1 no hydrogen 3.263 N/A LEU 199.A N GLN 196.A O no hydrogen 3.284 N/A ASN 200.A ND2 GLU 9.A OE1 no hydrogen 2.942 N/A