Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3scz_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 4.A N ASP 2.A OD1 no hydrogen 3.203 N/A GLU 5.A N ASP 2.A OD2 no hydrogen 3.259 N/A LEU 6.A N ASP 2.A O no hydrogen 3.076 N/A ALA 7.A N PRO 3.A O no hydrogen 2.989 N/A ARG 8.A N ASP 4.A O no hydrogen 2.970 N/A ARG 8.A NE GLU 5.A OE1 no hydrogen 3.021 N/A ARG 8.A NH1 GLU 5.A OE1 no hydrogen 2.801 N/A ARG 9.A N GLU 5.A O no hydrogen 3.083 N/A ARG 9.A NH1 GLU 5.A OE2 no hydrogen 2.957 N/A ALA 10.A N LEU 6.A O no hydrogen 2.806 N/A ALA 11.A N ALA 7.A O no hydrogen 3.020 N/A GLN 12.A N ARG 8.A O no hydrogen 3.008 N/A VAL 13.A N ARG 9.A O no hydrogen 3.051 N/A ILE 14.A N ALA 10.A O no hydrogen 2.822 N/A ALA 15.A N ALA 11.A O no hydrogen 2.955 N/A ASP 16.A N GLN 12.A O no hydrogen 2.865 N/A ARG 17.A N VAL 13.A O no hydrogen 2.820 N/A THR 18.A N ILE 14.A O no hydrogen 2.908 N/A THR 18.A OG1 ILE 14.A O no hydrogen 2.684 N/A GLY 19.A N ALA 15.A O no hydrogen 2.953 N/A ILE 20.A N THR 18.A OG1 no hydrogen 3.008 N/A HIS 23.A N ALA 105.A O no hydrogen 2.889 N/A HIS 23.A NE2 SER 69.A OG no hydrogen 2.779 N/A ALA 26.A N ILE 109.A O no hydrogen 2.944 N/A VAL 27.A N LEU 78.A O no hydrogen 2.778 N/A VAL 28.A N VAL 111.A O no hydrogen 2.873 N/A LEU 29.A N LEU 80.A O no hydrogen 3.330 N/A GLY 30.A N THR 113.A OG1 no hydrogen 2.820 N/A TRP 33.A N GLY 30.A O no hydrogen 3.045 N/A TRP 33.A NE1 ASN 114.A O no hydrogen 2.844 N/A ALA 36.A N TRP 33.A O no hydrogen 2.857 N/A VAL 37.A N LEU 34.A O no hydrogen 3.096 N/A LEU 40.A N VAL 37.A O no hydrogen 2.891 N/A GLY 41.A N ALA 38.A O no hydrogen 3.392 N/A THR 44.A N SER 69.A O no hydrogen 2.777 N/A THR 44.A OG1 SER 69.A O no hydrogen 3.290 N/A LEU 47.A N LEU 67.A O no hydrogen 2.825 N/A GLN 49.A N GLY 65.A O no hydrogen 2.942 N/A GLN 49.A NE2 GLU 66.A O no hydrogen 3.048 N/A GLN 49.A NE2 GLY 82.A O no hydrogen 2.779 N/A GLU 51.A N PRO 48.A O no hydrogen 2.949 N/A LEU 52.A N GLN 49.A O no hydrogen 3.072 N/A GLU 66.A N ALA 81.A O no hydrogen 2.809 N/A LEU 67.A N LEU 47.A O no hydrogen 2.706 N/A LEU 68.A N VAL 79.A O no hydrogen 2.804 N/A SER 69.A N THR 45.A O no hydrogen 3.006 N/A SER 69.A OG HIS 23.A NE2 no hydrogen 2.779 N/A VAL 70.A N VAL 77.A O no hydrogen 2.930 N/A ILE 72.A N HIS 75.A O no hydrogen 3.073 N/A HIS 75.A N ILE 72.A O no hydrogen 3.103 N/A HIS 75.A ND1 ASP 24.A OD2 no hydrogen 2.590 N/A HIS 75.A NE2 PHE 263.A OXT no hydrogen 2.701 N/A VAL 77.A N VAL 70.A O no hydrogen 2.829 N/A LEU 78.A N VAL 25.A O no hydrogen 2.995 N/A VAL 79.A N LEU 68.A O no hydrogen 2.753 N/A LEU 80.A N VAL 27.A O no hydrogen 2.754 N/A ALA 81.A N GLU 66.A O no hydrogen 2.975 N/A ARG 83.A NH1 LEU 29.A O no hydrogen 3.247 N/A ARG 83.A NH1 THR 113.A O no hydrogen 2.931 N/A ARG 83.A NH2 GLU 207.A OE1 no hydrogen 2.700 N/A HIS 85.A N GLU 88.A OE2 no hydrogen 2.803 N/A GLU 88.A N HIS 85.A O no hydrogen 3.071 N/A GLY 89.A N ALA 86.A O no hydrogen 2.987 N/A ARG 93.A N ASP 91.A OD2 no hydrogen 2.808 N/A TYR 94.A N ASP 91.A O no hydrogen 2.983 N/A VAL 96.A N LEU 92.A O no hydrogen 2.968 N/A ARG 100.A N VAL 96.A O no hydrogen 3.198 N/A ARG 100.A NH2 PRO 142.A O no hydrogen 2.954 N/A ALA 101.A N HIS 97.A O no hydrogen 2.692 N/A ALA 102.A N PRO 98.A O no hydrogen 2.823 N/A ARG 103.A N VAL 99.A O no hydrogen 2.850 N/A ARG 103.A NE ALA 214.A O no hydrogen 2.980 N/A ARG 103.A NH1 ALA 107.A O no hydrogen 2.998 N/A ARG 103.A NH2 GLN 108.A OE1 no hydrogen 3.057 N/A ALA 104.A N ARG 100.A O no hydrogen 2.952 N/A ALA 105.A N ALA 101.A O no hydrogen 2.881 N/A GLY 106.A N ARG 103.A O no hydrogen 2.912 N/A ALA 107.A N ALA 102.A O no hydrogen 2.882 N/A GLN 108.A N ASP 24.A O no hydrogen 2.883 N/A ILE 109.A N ASP 24.A O no hydrogen 3.404 N/A MET 110.A N GLU 217.A O no hydrogen 2.847 N/A VAL 111.A N ALA 26.A O no hydrogen 2.750 N/A LEU 112.A N LEU 219.A O no hydrogen 2.812 N/A THR 113.A N VAL 28.A O no hydrogen 3.017 N/A THR 113.A OG1 VAL 28.A O no hydrogen 2.750 N/A ASN 114.A N VAL 221.A O no hydrogen 3.040 N/A ASN 114.A ND2 SER 222.A OG no hydrogen 2.676 N/A ALA 116.A N LEU 223.A O no hydrogen 2.950 N/A GLY 117.A N VAL 200.A O no hydrogen 2.785 N/A GLY 118.A N ASN 226.A O no hydrogen 2.960 N/A LEU 119.A N ASP 198.A O no hydrogen 2.739 N/A ARG 120.A NH1 ASP 122.A OD2 no hydrogen 3.199 N/A ARG 120.A NH2 GLU 172.A O no hydrogen 2.890 N/A LEU 123.A N ARG 120.A O no hydrogen 3.082 N/A GLN 124.A N GLN 127.A OE1 no hydrogen 2.962 N/A GLY 126.A N VAL 224.A O no hydrogen 2.752 N/A GLN 127.A N GLN 124.A O no hydrogen 3.065 N/A VAL 129.A N SER 222.A O no hydrogen 2.786 N/A LEU 130.A N ALA 171.A O no hydrogen 2.960 N/A ILE 131.A N GLY 220.A O no hydrogen 2.822 N/A SER 132.A N GLY 173.A O no hydrogen 2.900 N/A HIS 134.A N ASP 133.A OD1 no hydrogen 2.745 N/A HIS 134.A ND1 TYR 155.A OH no hydrogen 2.755 N/A LEU 135.A N TYR 175.A O no hydrogen 2.810 N/A ASN 136.A ND2 ARG 140.A O no hydrogen 3.099 N/A LEU 137.A N GLY 177.A O no hydrogen 2.943 N/A THR 138.A N ASN 136.A OD1 no hydrogen 3.021 N/A THR 138.A OG1 ASN 136.A OD1 no hydrogen 2.657 N/A THR 138.A OG1 HIS 206.A NE2 no hydrogen 3.171 N/A ARG 140.A N THR 138.A OG1 no hydrogen 3.140 N/A LEU 143.A N SER 141.A OG no hydrogen 3.122 N/A THR 152.A N ASP 150.A OD1 no hydrogen 3.044 N/A THR 152.A OG1 ASP 150.A OD1 no hydrogen 2.735 N/A ALA 154.A N LEU 151.A O no hydrogen 3.239 N/A TYR 155.A OH HIS 134.A ND1 no hydrogen 2.755 N/A TYR 155.A OH THR 208.A OG1 no hydrogen 2.796 N/A SER 156.A N VAL 218.A O no hydrogen 3.143 N/A SER 156.A OG GLU 217.A OE1 no hydrogen 2.642 N/A ARG 158.A NE GLU 217.A OE1 no hydrogen 2.711 N/A ARG 158.A NH2 GLU 217.A OE2 no hydrogen 2.536 N/A LEU 159.A N SER 156.A OG no hydrogen 3.421 N/A ARG 160.A N SER 156.A O no hydrogen 3.156 N/A ARG 160.A NE GLU 172.A OE2 no hydrogen 3.062 N/A ARG 160.A NH1 TYR 155.A O no hydrogen 3.113 N/A ARG 160.A NH2 GLU 172.A OE1 no hydrogen 2.567 N/A GLU 161.A N PRO 157.A O no hydrogen 3.068 N/A LEU 162.A N ARG 158.A O no hydrogen 3.063 N/A ALA 163.A N LEU 159.A O no hydrogen 2.919 N/A ARG 164.A N ARG 160.A O no hydrogen 2.976 N/A ARG 164.A NH1 GLU 172.A OE2 no hydrogen 2.722 N/A ARG 164.A NH2 GLU 172.A OE2 no hydrogen 2.894 N/A GLN 165.A N GLU 161.A O no hydrogen 2.975 N/A GLN 165.A N LEU 162.A O no hydrogen 2.741 N/A SER 166.A OG ASP 258.A OD2 no hydrogen 2.557 N/A ASP 167.A N ALA 163.A O no hydrogen 3.002 N/A GLN 169.A N ASP 167.A OD1 no hydrogen 2.868 N/A LEU 170.A N ASP 167.A O no hydrogen 3.037 N/A GLY 173.A N LEU 130.A O no hydrogen 2.890 N/A VAL 174.A N ASP 198.A OD2 no hydrogen 2.864 N/A TYR 175.A N ASP 133.A O no hydrogen 3.025 N/A TYR 175.A OH SER 203.A O no hydrogen 3.109 N/A ALA 176.A N LEU 199.A O no hydrogen 2.958 N/A GLY 177.A N LEU 135.A O no hydrogen 2.903 N/A LEU 178.A N GLY 201.A O no hydrogen 2.809 N/A THR 185.A N GLU 188.A OE1 no hydrogen 2.937 N/A GLU 188.A N THR 185.A OG1 no hydrogen 2.998 N/A ILE 189.A N THR 185.A O no hydrogen 2.991 N/A ARG 190.A N PRO 186.A O no hydrogen 3.054 N/A MET 191.A N ALA 187.A O no hydrogen 3.010 N/A LEU 192.A N GLU 188.A O no hydrogen 2.908 N/A GLN 193.A N ILE 189.A O no hydrogen 2.906 N/A THR 194.A N ARG 190.A O no hydrogen 3.041 N/A THR 194.A OG1 ARG 190.A O no hydrogen 3.209 N/A LEU 195.A N MET 191.A O no hydrogen 2.913 N/A GLY 196.A N GLN 193.A O no hydrogen 3.029 N/A ALA 197.A N LEU 192.A O no hydrogen 2.979 N/A ASP 198.A N VAL 174.A O no hydrogen 2.661 N/A LEU 199.A N VAL 174.A O no hydrogen 3.071 N/A VAL 200.A N GLY 117.A O no hydrogen 2.790 N/A GLY 201.A N ALA 176.A O no hydrogen 3.004 N/A SER 203.A N TYR 175.A OH no hydrogen 3.118 N/A SER 203.A OG THR 204.A OG1 no hydrogen 3.030 N/A THR 204.A OG1 ASN 114.A OD1 no hydrogen 2.703 N/A THR 204.A OG1 SER 203.A OG no hydrogen 3.030 N/A VAL 205.A N SER 203.A O no hydrogen 2.885 N/A GLU 207.A N GLU 207.A OE2 no hydrogen 2.619 N/A THR 208.A N THR 204.A O no hydrogen 2.873 N/A THR 208.A OG1 TYR 155.A OH no hydrogen 2.796 N/A THR 208.A OG1 THR 204.A O no hydrogen 3.220 N/A ILE 209.A N VAL 205.A O no hydrogen 3.049 N/A ALA 210.A N HIS 206.A O no hydrogen 2.851 N/A ALA 211.A N GLU 207.A O no hydrogen 2.817 N/A ARG 212.A N THR 208.A O no hydrogen 2.978 N/A ARG 212.A NE ALA 216.A O no hydrogen 3.461 N/A ARG 212.A NH2 ALA 216.A O no hydrogen 2.956 N/A ALA 213.A N ILE 209.A O no hydrogen 2.884 N/A ALA 214.A N ALA 210.A O no hydrogen 2.947 N/A GLY 215.A N ARG 212.A O no hydrogen 2.988 N/A ALA 216.A N ALA 211.A O no hydrogen 2.960 N/A GLU 217.A N GLN 108.A O no hydrogen 2.884 N/A LEU 219.A N MET 110.A O no hydrogen 2.888 N/A VAL 221.A N LEU 112.A O no hydrogen 2.972 N/A SER 222.A N VAL 129.A O no hydrogen 2.812 N/A LEU 223.A N ASN 114.A O no hydrogen 2.760 N/A VAL 224.A N GLN 127.A O no hydrogen 2.881 N/A THR 225.A N ALA 116.A O no hydrogen 3.020 N/A THR 225.A OG1 ASN 226.A OD1 no hydrogen 2.852 N/A ASN 226.A ND2 LEU 227.A O no hydrogen 3.085 N/A ALA 228.A N GLY 118.A O no hydrogen 2.855 N/A ILE 231.A N ALA 228.A O no hydrogen 3.177 N/A GLU 234.A N THR 232.A OG1 no hydrogen 3.182 N/A SER 237.A N GLU 240.A OE1 no hydrogen 3.046 N/A GLU 240.A N SER 237.A OG no hydrogen 3.074 N/A VAL 241.A N SER 237.A O no hydrogen 2.872 N/A LEU 242.A N HIS 238.A O no hydrogen 2.811 N/A ALA 243.A N ALA 239.A O no hydrogen 2.876 N/A ALA 244.A N GLU 240.A O no hydrogen 2.979 N/A GLY 245.A N VAL 241.A O no hydrogen 2.957 N/A ALA 246.A N LEU 242.A O no hydrogen 2.800 N/A ALA 247.A N ALA 243.A O no hydrogen 2.950 N/A SER 248.A N ALA 244.A O no hydrogen 3.010 N/A SER 248.A N GLY 245.A O no hydrogen 3.235 N/A SER 248.A OG ALA 244.A O no hydrogen 3.258 N/A ALA 249.A N ALA 246.A O no hydrogen 3.259 N/A MET 252.A N SER 248.A O no hydrogen 2.827 N/A GLY 253.A N ALA 249.A O no hydrogen 2.873 N/A ALA 254.A N THR 250.A O no hydrogen 3.043 N/A LEU 255.A N ARG 251.A O no hydrogen 2.871 N/A LEU 256.A N MET 252.A O no hydrogen 2.910 N/A ALA 257.A N GLY 253.A O no hydrogen 2.990 N/A ASP 258.A N ALA 254.A O no hydrogen 3.155 N/A VAL 259.A N LEU 255.A O no hydrogen 2.934 N/A ILE 260.A N LEU 256.A O no hydrogen 2.829 N/A ALA 261.A N ALA 257.A O no hydrogen 2.999 N/A ARG 262.A N ASP 258.A O no hydrogen 3.148 N/A ARG 262.A NH2 ASP 258.A OD2 no hydrogen 3.076 N/A PHE 263.A N VAL 259.A O no hydrogen 3.187 N/A PHE 263.A N ILE 260.A O no hydrogen 3.047 N/A