Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3cs8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A N ARG 1.A O no hydrogen 3.131 N/A SER 4.A OG ARG 1.A O no hydrogen 2.825 N/A SER 7.A OG SER 4.A O no hydrogen 2.770 N/A ALA 8.A N SER 4.A O no hydrogen 3.041 N/A ASP 9.A N PRO 5.A O no hydrogen 2.915 N/A LEU 10.A N GLU 6.A O no hydrogen 3.003 N/A ARG 11.A N SER 7.A O no hydrogen 3.182 N/A ARG 11.A NH1 GLN 213.A OE1 no hydrogen 3.246 N/A ARG 11.A NH2 GLN 213.A OE1 no hydrogen 2.378 N/A ALA 12.A N ALA 8.A O no hydrogen 3.059 N/A LEU 13.A N ASP 9.A O no hydrogen 2.992 N/A ALA 14.A N LEU 10.A O no hydrogen 3.061 N/A LYS 15.A N ARG 11.A O no hydrogen 2.861 N/A LYS 15.A NZ ASP 19.A OD2 no hydrogen 3.310 N/A HIS 16.A N ALA 12.A O no hydrogen 2.874 N/A LEU 17.A N LEU 13.A O no hydrogen 2.896 N/A TYR 18.A N ALA 14.A O no hydrogen 2.916 N/A ASP 19.A N LYS 15.A O no hydrogen 2.876 N/A SER 20.A N HIS 16.A O no hydrogen 2.984 N/A SER 20.A OG HIS 16.A O no hydrogen 3.311 N/A SER 20.A OG SER 95.A OG no hydrogen 3.102 N/A TYR 21.A N LEU 17.A O no hydrogen 2.913 N/A TYR 21.A OH ASP 174.A OD1 no hydrogen 2.495 N/A ILE 22.A N TYR 18.A O no hydrogen 2.920 N/A LYS 23.A N ASP 19.A O no hydrogen 3.192 N/A SER 24.A N SER 20.A O no hydrogen 2.852 N/A SER 24.A OG SER 20.A O no hydrogen 2.770 N/A PHE 25.A N TYR 21.A O no hydrogen 3.006 N/A LYS 29.A N ASP 174.A OD1 no hydrogen 2.887 N/A LYS 29.A NZ LEU 172.A O no hydrogen 2.675 N/A ALA 30.A N ASP 174.A OD2 no hydrogen 3.151 N/A LYS 31.A N THR 28.A OG1 no hydrogen 3.347 N/A ALA 32.A N THR 28.A O no hydrogen 2.796 N/A ARG 33.A N LYS 29.A O no hydrogen 2.650 N/A ARG 33.A NH1 ALA 124.A O no hydrogen 3.124 N/A ARG 33.A NH1 SER 125.A O no hydrogen 2.662 N/A ARG 33.A NH1 MET 127.A O no hydrogen 2.982 N/A ARG 33.A NH1 ASN 168.A OD1 no hydrogen 3.407 N/A ARG 33.A NH2 MET 127.A O no hydrogen 3.081 N/A ALA 34.A N ALA 30.A O no hydrogen 3.202 N/A ILE 35.A N LYS 31.A O no hydrogen 3.331 N/A LEU 36.A N ALA 32.A O no hydrogen 2.886 N/A THR 37.A N ARG 33.A O no hydrogen 3.028 N/A THR 37.A OG1 ARG 33.A O no hydrogen 2.523 N/A GLY 38.A N ILE 35.A O no hydrogen 2.958 N/A LYS 39.A N ALA 34.A O no hydrogen 2.794 N/A PHE 46.A N GLN 138.A O no hydrogen 2.960 N/A ILE 48.A N PHE 140.A O no hydrogen 2.780 N/A TYR 49.A N SER 53.A OG no hydrogen 2.992 N/A ASP 50.A N SER 53.A OG no hydrogen 2.943 N/A SER 53.A N ASP 50.A OD1 no hydrogen 2.773 N/A SER 53.A OG ASP 50.A O no hydrogen 2.867 N/A SER 53.A OG ASP 50.A OD1 no hydrogen 2.858 N/A LEU 54.A N ASP 50.A O no hydrogen 2.798 N/A MET 55.A N MET 51.A O no hydrogen 2.987 N/A MET 56.A N ASN 52.A O no hydrogen 3.081 N/A GLY 57.A N SER 53.A O no hydrogen 2.847 N/A GLU 58.A N LEU 54.A O no hydrogen 2.870 N/A GLU 65.A N PRO 62.A O no hydrogen 3.006 N/A GLN 66.A NE2 LEU 63.A O no hydrogen 3.188 N/A LYS 68.A NZ ASP 255.A OD2 no hydrogen 2.844 N/A ARG 73.A N GLU 69.A O no hydrogen 3.043 N/A ARG 73.A NE GLU 58.A OE2 no hydrogen 2.665 N/A ARG 73.A NH1 LYS 68.A O no hydrogen 2.923 N/A ARG 73.A NH2 GLU 58.A OE1 no hydrogen 2.691 N/A ARG 73.A NH2 GLU 58.A OE2 no hydrogen 3.254 N/A ILE 74.A N VAL 70.A O no hydrogen 2.916 N/A PHE 75.A N ALA 71.A O no hydrogen 3.261 N/A GLN 76.A N ILE 72.A O no hydrogen 2.882 N/A GLN 76.A NE2 GLN 64.A O no hydrogen 3.261 N/A GLY 77.A N ARG 73.A O no hydrogen 3.292 N/A CYS 78.A N ILE 74.A O no hydrogen 2.958 N/A GLN 79.A N PHE 75.A O no hydrogen 2.968 N/A PHE 80.A N GLN 76.A O no hydrogen 3.270 N/A ARG 81.A N GLY 77.A O no hydrogen 3.120 N/A ARG 81.A NH1 GLU 88.A OE2 no hydrogen 3.419 N/A ARG 81.A NH2 GLU 88.A OE1 no hydrogen 3.267 N/A SER 82.A N CYS 78.A O no hydrogen 3.119 N/A VAL 83.A N GLN 79.A O no hydrogen 3.090 N/A GLU 84.A N PHE 80.A O no hydrogen 2.936 N/A ALA 85.A N ARG 81.A O no hydrogen 2.835 N/A VAL 86.A N SER 82.A O no hydrogen 2.968 N/A GLN 87.A N VAL 83.A O no hydrogen 3.037 N/A GLU 88.A N GLU 84.A O no hydrogen 2.919 N/A ILE 89.A N ALA 85.A O no hydrogen 2.811 N/A THR 90.A N VAL 86.A O no hydrogen 2.886 N/A THR 90.A OG1 VAL 86.A O no hydrogen 2.813 N/A GLU 91.A N GLN 87.A O no hydrogen 3.094 N/A TYR 92.A N GLU 88.A O no hydrogen 2.813 N/A TYR 92.A OH ALA 178.A O no hydrogen 2.438 N/A ALA 93.A N ILE 89.A O no hydrogen 2.736 N/A LYS 94.A N THR 90.A O no hydrogen 3.108 N/A LYS 94.A N GLU 91.A O no hydrogen 3.162 N/A LYS 94.A NZ GLU 91.A OE2 no hydrogen 3.324 N/A SER 95.A N TYR 92.A O no hydrogen 2.994 N/A SER 95.A OG TYR 92.A O no hydrogen 2.519 N/A ILE 96.A N ALA 93.A O no hydrogen 3.115 N/A PHE 99.A N ILE 96.A O no hydrogen 2.988 N/A ASN 101.A N GLY 98.A O no hydrogen 3.263 N/A LEU 102.A N PHE 99.A O no hydrogen 2.909 N/A ASN 105.A N ASP 103.A OD1 no hydrogen 3.284 N/A ASN 105.A ND2 ASP 103.A OD1 no hydrogen 3.109 N/A ASP 106.A N ASP 103.A O no hydrogen 3.042 N/A GLN 107.A N ASP 103.A O no hydrogen 3.030 N/A GLN 107.A NE2 VAL 100.A O no hydrogen 3.242 N/A GLN 107.A NE2 LEU 102.A O no hydrogen 2.679 N/A VAL 108.A N LEU 104.A O no hydrogen 2.974 N/A THR 109.A N ASN 105.A O no hydrogen 3.007 N/A THR 109.A OG1 ASN 105.A O no hydrogen 2.946 N/A LEU 110.A N ASP 106.A O no hydrogen 2.867 N/A LEU 111.A N GLN 107.A O no hydrogen 2.921 N/A LYS 112.A N VAL 108.A O no hydrogen 2.738 N/A LYS 112.A NZ GLU 264.A O no hydrogen 3.207 N/A TYR 113.A N THR 109.A O no hydrogen 3.010 N/A GLY 114.A N LEU 110.A O no hydrogen 2.730 N/A VAL 115.A N LEU 111.A O no hydrogen 2.932 N/A ILE 118.A N GLY 114.A O no hydrogen 3.058 N/A ILE 119.A N VAL 115.A O no hydrogen 2.908 N/A TYR 120.A N HIS 116.A O no hydrogen 3.004 N/A THR 121.A N GLU 117.A O no hydrogen 2.960 N/A THR 121.A OG1 GLU 117.A O no hydrogen 2.741 N/A MET 122.A N ILE 118.A O no hydrogen 2.820 N/A LEU 123.A N ILE 119.A O no hydrogen 2.789 N/A ALA 124.A N TYR 120.A O no hydrogen 3.256 N/A SER 125.A N MET 122.A O no hydrogen 3.038 N/A LEU 126.A N LEU 123.A O no hydrogen 2.788 N/A MET 127.A N ALA 124.A O no hydrogen 3.198 N/A ASN 128.A N GLY 131.A O no hydrogen 3.044 N/A LYS 129.A NZ ASP 130.A OD1 no hydrogen 3.473 N/A ASP 130.A N ASN 128.A OD1 no hydrogen 2.947 N/A GLY 131.A N ASN 128.A OD1 no hydrogen 3.045 N/A VAL 132.A N MET 141.A O no hydrogen 2.960 N/A LEU 133.A N LEU 126.A O no hydrogen 2.801 N/A ILE 134.A N GLY 139.A O no hydrogen 2.800 N/A GLY 137.A N ILE 134.A O no hydrogen 3.091 N/A GLN 138.A N SER 135.A O no hydrogen 3.109 N/A GLY 139.A N ILE 134.A O no hydrogen 2.928 N/A PHE 140.A N PHE 46.A O no hydrogen 2.781 N/A MET 141.A N VAL 132.A O no hydrogen 2.880 N/A THR 142.A N ILE 48.A O no hydrogen 3.185 N/A THR 142.A OG1 ILE 48.A O no hydrogen 3.449 N/A ARG 143.A N ASP 130.A O no hydrogen 2.730 N/A ARG 143.A NE GLU 158.A OE1 no hydrogen 3.171 N/A ARG 143.A NE GLU 158.A OE2 no hydrogen 2.990 N/A ARG 143.A NH1 LYS 129.A O no hydrogen 3.253 N/A ARG 143.A NH2 GLU 158.A OE2 no hydrogen 2.536 N/A PHE 145.A N THR 142.A OG1 no hydrogen 3.289 N/A LEU 146.A N THR 142.A O no hydrogen 3.200 N/A LYS 147.A N ARG 143.A O no hydrogen 2.958 N/A SER 148.A N GLU 144.A O no hydrogen 3.045 N/A SER 148.A N PHE 145.A O no hydrogen 3.209 N/A SER 148.A OG PHE 145.A O no hydrogen 2.567 N/A LEU 149.A N LEU 146.A O no hydrogen 3.428 N/A ARG 150.A NH2 GLU 253.A OE1 no hydrogen 2.679 N/A GLY 154.A N ARG 150.A O no hydrogen 2.883 N/A ASP 155.A N PRO 152.A O no hydrogen 3.339 N/A PHE 156.A N PHE 153.A O no hydrogen 3.265 N/A LYS 160.A NZ TYR 120.A OH no hydrogen 2.911 N/A LYS 160.A NZ HIS 242.A ND1 no hydrogen 3.087 N/A PHE 161.A N MET 157.A O no hydrogen 2.915 N/A GLU 162.A N GLU 158.A O no hydrogen 3.099 N/A PHE 163.A N PRO 159.A O no hydrogen 3.068 N/A ALA 164.A N LYS 160.A O no hydrogen 3.056 N/A VAL 165.A N PHE 161.A O no hydrogen 2.997 N/A PHE 167.A N PHE 163.A O no hydrogen 2.906 N/A ASN 168.A N ALA 164.A O no hydrogen 2.758 N/A ASN 168.A ND2 ALA 124.A O no hydrogen 3.316 N/A LEU 170.A N PHE 167.A O no hydrogen 3.193 N/A GLU 171.A N ASN 168.A O no hydrogen 3.052 N/A ASP 173.A N ASP 176.A OD2 no hydrogen 2.759 N/A SER 175.A OG ASP 173.A OD1 no hydrogen 2.691 N/A ASP 176.A N ASP 173.A OD1 no hydrogen 2.986 N/A LEU 177.A N ASP 173.A O no hydrogen 2.976 N/A ALA 178.A N ASP 174.A O no hydrogen 2.991 N/A PHE 180.A N ASP 176.A O no hydrogen 3.130 N/A ILE 181.A N LEU 177.A O no hydrogen 2.823 N/A ALA 182.A N ALA 178.A O no hydrogen 3.272 N/A VAL 183.A N ILE 179.A O no hydrogen 2.988 N/A ILE 184.A N PHE 180.A O no hydrogen 3.167 N/A ILE 185.A N ILE 181.A O no hydrogen 3.215 N/A LEU 186.A N ALA 182.A O no hydrogen 2.998 N/A SER 187.A OG ILE 184.A O no hydrogen 2.773 N/A ARG 190.A NH1 GLU 117.A OE2 no hydrogen 2.906 N/A ARG 190.A NH2 GLU 117.A OE1 no hydrogen 2.789 N/A ARG 190.A NH2 ILE 184.A O no hydrogen 3.164 N/A LEU 194.A N ASP 106.A OD1 no hydrogen 2.840 N/A LEU 194.A N ASP 106.A OD2 no hydrogen 3.160 N/A ASN 195.A N ASP 106.A OD2 no hydrogen 2.984 N/A GLU 200.A N VAL 196.A O no hydrogen 2.939 N/A ASP 201.A N LYS 197.A O no hydrogen 2.867 N/A ILE 202.A N PRO 198.A O no hydrogen 3.266 N/A GLN 203.A N ILE 199.A O no hydrogen 2.999 N/A GLN 203.A NE2 VAL 183.A O no hydrogen 2.728 N/A ASP 204.A N GLU 200.A O no hydrogen 2.977 N/A ASN 205.A N ASP 201.A O no hydrogen 3.341 N/A LEU 206.A N ILE 202.A O no hydrogen 2.953 N/A LEU 207.A N GLN 203.A O no hydrogen 2.638 N/A GLN 208.A N ASP 204.A O no hydrogen 3.095 N/A GLN 208.A NE2 ASP 204.A O no hydrogen 3.449 N/A ALA 209.A N ASN 205.A O no hydrogen 3.039 N/A LEU 210.A N LEU 206.A O no hydrogen 2.827 N/A GLU 211.A N LEU 207.A O no hydrogen 2.863 N/A LEU 212.A N GLN 208.A O no hydrogen 3.060 N/A GLN 213.A N ALA 209.A O no hydrogen 2.916 N/A GLN 213.A NE2 ASP 176.A OD1 no hydrogen 2.809 N/A LEU 214.A N LEU 210.A O no hydrogen 2.964 N/A LYS 215.A N GLU 211.A O no hydrogen 3.111 N/A LYS 215.A NZ GLU 211.A OE2 no hydrogen 3.186 N/A LEU 216.A N LEU 212.A O no hydrogen 3.075 N/A ASN 217.A N GLN 213.A O no hydrogen 2.766 N/A HIS 218.A N LEU 214.A O no hydrogen 2.903 N/A HIS 218.A NE2 GLU 171.A O no hydrogen 3.158 N/A SER 221.A N HIS 218.A O no hydrogen 3.289 N/A LEU 224.A N SER 221.A O no hydrogen 3.301 N/A LYS 227.A N GLN 223.A O no hydrogen 2.878 N/A LEU 228.A N LEU 224.A O no hydrogen 2.813 N/A LEU 229.A N PHE 225.A O no hydrogen 2.986 N/A GLN 230.A N ALA 226.A O no hydrogen 3.309 N/A GLN 230.A N LYS 227.A O no hydrogen 3.237 N/A LYS 231.A N LYS 227.A O no hydrogen 3.097 N/A MET 232.A N LEU 228.A O no hydrogen 3.169 N/A THR 233.A OG1 GLN 230.A O no hydrogen 2.765 N/A ASP 234.A N GLN 230.A O no hydrogen 3.062 N/A LEU 235.A N LYS 231.A O no hydrogen 2.791 N/A ARG 236.A N MET 232.A O no hydrogen 3.313 N/A ARG 236.A NH1 ASP 189.A OD1 no hydrogen 3.093 N/A ARG 236.A NH1 ASP 189.A OD2 no hydrogen 2.610 N/A GLN 237.A N THR 233.A O no hydrogen 3.004 N/A ILE 238.A N ASP 234.A O no hydrogen 2.879 N/A VAL 239.A N LEU 235.A O no hydrogen 3.119 N/A THR 240.A OG1 GLN 237.A O no hydrogen 3.127 N/A VAL 243.A N VAL 239.A O no hydrogen 2.850 N/A GLN 244.A N THR 240.A O no hydrogen 3.052 N/A LEU 245.A N GLU 241.A O no hydrogen 2.866 N/A LEU 246.A N HIS 242.A O no hydrogen 3.226 N/A GLN 247.A N GLN 244.A O no hydrogen 2.852 N/A LYS 250.A N GLN 247.A O no hydrogen 3.036 N/A LYS 251.A N VAL 248.A O no hydrogen 3.103 N/A THR 252.A OG1 GLU 253.A OE2 no hydrogen 2.792 N/A MET 256.A N GLU 253.A O no hydrogen 2.752 N/A LEU 261.A N HIS 259.A ND1 no hydrogen 3.169 N/A GLN 263.A N HIS 259.A O no hydrogen 2.999 N/A GLN 263.A NE2 LEU 258.A O no hydrogen 2.937 N/A GLU 264.A N PRO 260.A O no hydrogen 3.169 N/A ILE 265.A N LEU 261.A O no hydrogen 3.131 N/A TYR 266.A N LEU 262.A O no hydrogen 3.104 N/A TYR 266.A N GLN 263.A O no hydrogen 3.203 N/A TYR 266.A OH HIS 242.A NE2 no hydrogen 2.629 N/A LYS 267.A N GLN 263.A O no hydrogen 3.159 N/A