Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2vss_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 1.A OH ASP 48.A OD2 no hydrogen 3.097 N/A ARG 4.A N TYR 1.A O no hydrogen 3.312 N/A TRP 5.A NE1 ASP 40.A OD2 no hydrogen 2.758 N/A LYS 6.A N GLU 37.A OE2 no hydrogen 2.799 N/A THR 7.A N GLU 37.A OE1 no hydrogen 2.673 N/A THR 7.A OG1 GLU 37.A OE1 no hydrogen 2.832 N/A LYS 9.A N ILE 20.A O no hydrogen 2.880 N/A GLU 11.A N PHE 18.A O no hydrogen 3.187 N/A GLU 13.A N ILE 16.A O no hydrogen 2.909 N/A ILE 16.A N GLU 13.A O no hydrogen 3.333 N/A ALA 17.A N VAL 53.A O no hydrogen 2.835 N/A PHE 18.A N GLU 11.A O no hydrogen 3.007 N/A VAL 19.A N VAL 55.A O no hydrogen 2.680 N/A ILE 20.A N LYS 9.A O no hydrogen 2.955 N/A LEU 21.A N THR 57.A O no hydrogen 2.747 N/A ASN 22.A N THR 7.A O no hydrogen 2.744 N/A ARG 23.A N ASN 28.A OD1 no hydrogen 2.956 N/A ARG 23.A NH1 ALA 29.A O no hydrogen 2.638 N/A ARG 23.A NH1 ASP 68.A OD2 no hydrogen 2.757 N/A ARG 23.A NH2 ASP 68.A OD2 no hydrogen 3.146 N/A LYS 26.A N ARG 23.A O no hydrogen 2.814 N/A ARG 27.A N PRO 24.A O no hydrogen 3.001 N/A ARG 27.A NH1 GLU 61.A OE1 no hydrogen 3.528 N/A ASN 28.A N ARG 23.A O no hydrogen 2.604 N/A ASN 28.A ND2 ALA 59.A O no hydrogen 2.889 N/A ASN 28.A ND2 TRP 63.A O no hydrogen 3.080 N/A ALA 29.A N LYS 26.A O no hydrogen 3.260 N/A MET 30.A N GLY 66.A O no hydrogen 2.876 N/A LEU 34.A N SER 31.A OG no hydrogen 3.315 N/A ASN 35.A N SER 31.A O no hydrogen 3.027 N/A ARG 36.A N PRO 32.A O no hydrogen 3.083 N/A ARG 36.A NH1 GLU 82.A OE1 no hydrogen 2.997 N/A GLU 37.A N THR 33.A O no hydrogen 3.013 N/A MET 38.A N LEU 34.A O no hydrogen 2.930 N/A ILE 39.A N ASN 35.A O no hydrogen 3.159 N/A ASP 40.A N ARG 36.A O no hydrogen 3.258 N/A VAL 41.A N GLU 37.A O no hydrogen 2.647 N/A LEU 42.A N MET 38.A O no hydrogen 2.942 N/A GLU 43.A N ILE 39.A O no hydrogen 2.958 N/A THR 44.A N ASP 40.A O no hydrogen 3.026 N/A THR 44.A OG1 ASP 40.A O no hydrogen 2.736 N/A THR 44.A OG1 ASP 40.A OD1 no hydrogen 3.569 N/A LEU 45.A N VAL 41.A O no hydrogen 2.852 N/A GLU 46.A N LEU 42.A O no hydrogen 3.289 N/A GLU 46.A N GLU 43.A O no hydrogen 3.153 N/A GLN 47.A N THR 44.A O no hydrogen 3.347 N/A ALA 50.A N ASP 48.A OD1 no hydrogen 2.848 N/A GLY 52.A N GLY 15.A O no hydrogen 2.631 N/A VAL 53.A N GLY 15.A O no hydrogen 3.402 N/A LEU 54.A N PRO 97.A O no hydrogen 2.996 N/A VAL 55.A N ALA 17.A O no hydrogen 2.895 N/A LEU 56.A N ILE 99.A O no hydrogen 2.854 N/A THR 57.A N VAL 19.A O no hydrogen 2.905 N/A THR 57.A OG1 MET 101.A O no hydrogen 2.681 N/A THR 57.A OG1 ASN 103.A OD1 no hydrogen 3.173 N/A GLY 58.A N ASN 103.A OD1 no hydrogen 3.103 N/A ALA 59.A N LEU 21.A O no hydrogen 2.760 N/A TRP 63.A N TRP 105.A O no hydrogen 2.853 N/A TRP 63.A NE1 LEU 56.A O no hydrogen 2.794 N/A THR 64.A N TRP 105.A O no hydrogen 2.899 N/A THR 64.A OG1 ASN 28.A O no hydrogen 2.890 N/A ALA 65.A N ARG 27.A O no hydrogen 3.067 N/A GLY 66.A N THR 64.A OG1 no hydrogen 3.245 N/A ASP 68.A N MET 30.A O no hydrogen 3.129 N/A LEU 75.A N PRO 72.A O no hydrogen 3.041 N/A GLN 76.A N GLU 73.A O no hydrogen 3.202 N/A ILE 79.A N LEU 75.A O no hydrogen 3.081 N/A ARG 80.A N GLN 76.A O no hydrogen 2.703 N/A ARG 81.A N GLU 77.A O no hydrogen 2.853 N/A GLU 82.A N LYS 78.A O no hydrogen 2.877 N/A ALA 83.A N ILE 79.A O no hydrogen 3.080 N/A SER 84.A N ARG 80.A O no hydrogen 3.136 N/A SER 84.A OG ARG 80.A O no hydrogen 3.030 N/A GLN 85.A N ARG 81.A O no hydrogen 2.858 N/A TRP 86.A NE1 ASN 35.A OD1 no hydrogen 2.771 N/A GLN 87.A N ALA 83.A O no hydrogen 3.328 N/A TRP 88.A N SER 84.A O no hydrogen 3.285 N/A TRP 88.A NE1 ASN 141.A OD1 no hydrogen 2.754 N/A LYS 89.A N SER 84.A O no hydrogen 3.054 N/A LEU 90.A N GLN 85.A O no hydrogen 2.749 N/A ARG 92.A N TRP 88.A O no hydrogen 2.577 N/A ARG 92.A NH2 GLU 217.A OE2 no hydrogen 3.140 N/A TYR 94.A N LEU 91.A O no hydrogen 3.118 N/A TYR 94.A OH LEU 42.A O no hydrogen 2.314 N/A LYS 96.A NZ LEU 45.A O no hydrogen 2.795 N/A LYS 96.A NZ ASP 48.A O no hydrogen 2.618 N/A LYS 96.A NZ ALA 51.A O no hydrogen 2.731 N/A THR 98.A N ASP 118.A OD2 no hydrogen 3.138 N/A ILE 99.A N LEU 54.A O no hydrogen 2.962 N/A ALA 100.A N LEU 119.A O no hydrogen 2.879 N/A MET 101.A N LEU 56.A O no hydrogen 3.019 N/A VAL 102.A N ILE 121.A O no hydrogen 2.711 N/A ASN 103.A ND2 GLY 60.A O no hydrogen 3.230 N/A ASN 103.A ND2 ALA 62.A O no hydrogen 3.090 N/A TRP 105.A NE1 GLU 61.A OE1 no hydrogen 3.335 N/A CYS 106.A N THR 127.A O no hydrogen 2.754 N/A PHE 107.A N THR 64.A O no hydrogen 2.989 N/A GLY 108.A N GLY 129.A O no hydrogen 3.155 N/A GLY 110.A N PHE 107.A O no hydrogen 2.872 N/A PHE 111.A N GLY 108.A O no hydrogen 3.056 N/A LEU 114.A N GLY 110.A O no hydrogen 3.248 N/A VAL 115.A N PHE 111.A O no hydrogen 2.946 N/A ALA 116.A N SER 112.A O no hydrogen 3.061 N/A CYS 117.A N PRO 113.A O no hydrogen 3.087 N/A CYS 117.A SG PRO 113.A O no hydrogen 3.326 N/A ASP 118.A N THR 98.A O no hydrogen 2.944 N/A ASP 118.A N THR 98.A OG1 no hydrogen 2.774 N/A LEU 119.A N THR 98.A O no hydrogen 3.142 N/A ALA 120.A N ASN 178.A OD1 no hydrogen 2.764 N/A ILE 121.A N ALA 100.A O no hydrogen 2.806 N/A CYS 122.A N GLU 179.A O no hydrogen 3.244 N/A CYS 122.A SG ALA 123.A O no hydrogen 4.008 N/A CYS 122.A SG GLY 168.A O no hydrogen 3.594 N/A CYS 122.A SG GLU 179.A O no hydrogen 3.856 N/A CYS 122.A SG SER 180.A OG no hydrogen 3.248 N/A ALA 123.A N VAL 102.A O no hydrogen 2.940 N/A ASP 124.A N VAL 181.A O no hydrogen 2.803 N/A GLU 125.A N GLU 125.A OE1 no hydrogen 3.157 N/A ALA 126.A N ALA 123.A O no hydrogen 2.854 N/A PHE 128.A N PHE 166.A O no hydrogen 2.914 N/A GLY 129.A N CYS 106.A O no hydrogen 3.165 N/A GLU 132.A N GLU 132.A OE1 no hydrogen 2.885 N/A ASN 134.A ND2 GLY 163.A O no hydrogen 3.384 N/A TRP 135.A N SER 131.A O no hydrogen 3.298 N/A GLY 136.A N ILE 133.A O no hydrogen 3.086 N/A ILE 137.A N GLU 132.A O no hydrogen 3.289 N/A ASN 141.A ND2 SER 84.A OG no hydrogen 3.020 N/A LEU 142.A N ASN 141.A OD1 no hydrogen 2.802 N/A VAL 143.A N GLY 140.A O no hydrogen 3.349 N/A LYS 145.A N LEU 142.A O no hydrogen 3.060 N/A ALA 146.A N LEU 142.A O no hydrogen 2.945 N/A MET 147.A N VAL 143.A O no hydrogen 3.080 N/A ALA 148.A N SER 144.A O no hydrogen 2.930 N/A ASP 149.A N LYS 145.A O no hydrogen 2.826 N/A THR 150.A N MET 147.A O no hydrogen 2.938 N/A THR 150.A OG1 ALA 146.A O no hydrogen 3.062 N/A VAL 151.A N MET 147.A O no hydrogen 2.796 N/A SER 156.A N GLY 152.A O no hydrogen 2.805 N/A SER 156.A OG VAL 151.A O no hydrogen 3.252 N/A SER 156.A OG GLY 152.A O no hydrogen 2.977 N/A LEU 157.A N HIS 153.A O no hydrogen 3.053 N/A TYR 158.A N ARG 154.A O no hydrogen 2.857 N/A TYR 159.A N GLN 155.A O no hydrogen 3.129 N/A ILE 160.A N SER 156.A O no hydrogen 2.955 N/A MET 161.A N LEU 157.A O no hydrogen 2.809 N/A THR 162.A N TYR 158.A O no hydrogen 2.775 N/A THR 162.A OG1 TYR 158.A O no hydrogen 2.741 N/A GLY 163.A N TYR 159.A O no hydrogen 3.034 N/A LYS 164.A N THR 162.A OG1 no hydrogen 3.295 N/A PHE 166.A N PHE 128.A O no hydrogen 2.978 N/A GLY 168.A N ASP 124.A O no hydrogen 3.280 N/A LYS 170.A NZ GLN 155.A OE1 no hydrogen 3.305 N/A LYS 170.A NZ TYR 159.A OH no hydrogen 3.070 N/A ALA 171.A N GLY 167.A O no hydrogen 2.977 N/A ALA 172.A N GLY 168.A O no hydrogen 3.157 N/A GLU 173.A N GLN 169.A O no hydrogen 3.108 N/A MET 174.A N.A LYS 170.A O no hydrogen 3.056 N/A MET 174.A N.B LYS 170.A O no hydrogen 3.062 N/A GLY 175.A N ALA 171.A O no hydrogen 3.201 N/A LEU 176.A N ALA 171.A O no hydrogen 3.022 N/A ASN 178.A N ALA 120.A O no hydrogen 2.745 N/A SER 180.A OG ASP 124.A OD1 no hydrogen 3.034 N/A VAL 181.A N CYS 122.A O no hydrogen 3.033 N/A LEU 183.A N GLU 125.A OE1 no hydrogen 2.589 N/A GLN 185.A N PRO 182.A O no hydrogen 3.023 N/A LEU 186.A N LEU 183.A O no hydrogen 2.918 N/A ARG 187.A NH2 GLU 13.A OE2 no hydrogen 3.115 N/A VAL 189.A N GLN 185.A O no hydrogen 3.098 N/A THR 190.A N LEU 186.A O no hydrogen 3.071 N/A THR 190.A OG1 LEU 186.A O no hydrogen 2.844 N/A ILE 191.A N ARG 187.A O no hydrogen 2.971 N/A GLU 192.A N GLU 188.A O no hydrogen 2.976 N/A LEU 193.A N VAL 189.A O no hydrogen 3.163 N/A ALA 194.A N THR 190.A O no hydrogen 2.768 N/A ARG 195.A N ILE 191.A O no hydrogen 2.847 N/A ASN 196.A N GLU 192.A O no hydrogen 3.082 N/A LEU 197.A N LEU 193.A O no hydrogen 3.235 N/A LEU 198.A N ALA 194.A O no hydrogen 3.183 N/A LYS 200.A N LEU 197.A O no hydrogen 3.035 N/A ASN 201.A ND2 ASP 238.A O no hydrogen 3.372 N/A LEU 205.A N ASN 201.A O no hydrogen 2.975 N/A LEU 205.A N PRO 202.A O no hydrogen 2.946 N/A ARG 206.A N PRO 202.A O no hydrogen 2.886 N/A ARG 206.A NE ALA 95.A O no hydrogen 3.210 N/A ALA 207.A N VAL 203.A O no hydrogen 3.139 N/A ALA 208.A N VAL 204.A O no hydrogen 3.281 N/A LYS 209.A N LEU 205.A O no hydrogen 3.038 N/A LYS 209.A NZ TYR 94.A O no hydrogen 2.880 N/A LYS 209.A NZ LYS 96.A O no hydrogen 3.518 N/A LYS 209.A NZ ASP 118.A OD2 no hydrogen 3.156 N/A LYS 209.A NZ HIS 210.A NE2 no hydrogen 3.505 N/A HIS 210.A N ARG 206.A O no hydrogen 3.077 N/A HIS 210.A NE2 TYR 94.A O no hydrogen 2.909 N/A GLY 211.A N ALA 207.A O no hydrogen 2.995 N/A PHE 212.A N ALA 208.A O no hydrogen 2.913 N/A LYS 213.A N LYS 209.A O no hydrogen 3.252 N/A LYS 213.A NZ ARG 92.A O no hydrogen 2.797 N/A LYS 213.A NZ ASP 118.A OD1 no hydrogen 2.874 N/A ARG 214.A N HIS 210.A O no hydrogen 3.080 N/A ARG 214.A NH2 GLU 217.A OE1 no hydrogen 2.951 N/A CYS 215.A N GLY 211.A O no hydrogen 2.920 N/A CYS 215.A SG PHE 212.A O no hydrogen 3.265 N/A ARG 216.A NH1 ASP 149.A O no hydrogen 2.916 N/A GLU 217.A N ARG 214.A O no hydrogen 2.949 N/A LEU 218.A N CYS 215.A O no hydrogen 3.059 N/A GLN 222.A N THR 219.A OG1 no hydrogen 3.076 N/A ASN 223.A N THR 219.A O no hydrogen 2.887 N/A ASN 223.A ND2 CYS 215.A O no hydrogen 2.822 N/A GLU 224.A N TRP 220.A O no hydrogen 2.988 N/A TYR 226.A N GLN 222.A O no hydrogen 2.906 N/A LEU 227.A N ASN 223.A O no hydrogen 2.756 N/A ALA 229.A N ASP 225.A O no hydrogen 3.097 N/A LYS 230.A N TYR 226.A O no hydrogen 2.917 N/A LEU 231.A N LEU 227.A O no hydrogen 3.101 N/A ASP 232.A N TYR 228.A O no hydrogen 3.123 N/A GLN 233.A N ALA 229.A O no hydrogen 2.927 N/A SER 234.A N LYS 230.A O no hydrogen 2.984 N/A ARG 235.A N LEU 231.A O no hydrogen 3.106 N/A LEU 236.A N GLN 233.A O no hydrogen 3.253 N/A LEU 237.A N GLN 233.A O no hydrogen 3.090 N/A ASP 238.A N SER 234.A O no hydrogen 2.698 N/A THR 239.A N LEU 237.A O no hydrogen 3.470 N/A