Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2cyp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 7.A N THR 274.A O no hydrogen 2.939 N/A SER 8.A N GLY 128.A O no hydrogen 2.791 N/A GLU 10.A N GLU 10.A OE2 no hydrogen 2.816 N/A ARG 13.A N GLU 10.A O no hydrogen 2.943 N/A ARG 13.A NH1 ASP 17.A OD2 no hydrogen 3.104 N/A SER 14.A N ASP 17.A OD1 no hydrogen 2.750 N/A ASP 17.A N SER 14.A O no hydrogen 3.087 N/A PHE 18.A N SER 14.A O no hydrogen 3.328 N/A GLN 19.A N TYR 15.A O no hydrogen 2.989 N/A GLN 19.A NE2 TYR 15.A OH no hydrogen 2.630 N/A LYS 20.A N GLU 16.A O no hydrogen 3.177 N/A VAL 21.A N ASP 17.A O no hydrogen 3.316 N/A TYR 22.A N PHE 18.A O no hydrogen 2.847 N/A TYR 22.A OH GLU 117.A OE1 no hydrogen 2.431 N/A ASN 23.A N GLN 19.A O no hydrogen 3.008 N/A ASN 23.A ND2 GLN 19.A OE1 no hydrogen 2.964 N/A ASN 23.A ND2 GLN 291.A OE1 no hydrogen 2.789 N/A ALA 24.A N LYS 20.A O no hydrogen 2.974 N/A ILE 25.A N VAL 21.A O no hydrogen 3.076 N/A ALA 26.A N TYR 22.A O no hydrogen 2.856 N/A LEU 27.A N ASN 23.A O no hydrogen 2.831 N/A LYS 28.A N ALA 24.A O no hydrogen 3.035 N/A LYS 28.A NZ ASP 32.A OD1 no hydrogen 2.588 N/A LEU 29.A N ILE 25.A O no hydrogen 2.859 N/A ARG 30.A N ALA 26.A O no hydrogen 3.179 N/A ARG 30.A NH1 LEU 293.A OXT no hydrogen 2.911 N/A ARG 30.A NH2 LEU 293.A O no hydrogen 2.655 N/A ARG 30.A NH2 LEU 293.A OXT no hydrogen 3.436 N/A GLU 31.A N LEU 27.A O no hydrogen 3.190 N/A ASP 32.A N LYS 28.A O no hydrogen 2.870 N/A TYR 38.A N GLU 34.A O no hydrogen 3.177 N/A ILE 39.A N ASP 36.A O no hydrogen 3.025 N/A GLY 40.A N TYR 35.A O no hydrogen 2.919 N/A LEU 45.A N TYR 41.A O no hydrogen 3.119 N/A LEU 45.A N GLY 42.A O no hydrogen 3.111 N/A VAL 46.A N GLY 42.A O no hydrogen 3.054 N/A ARG 47.A N PRO 43.A O no hydrogen 2.952 N/A ARG 47.A NH1 ALA 82.A O no hydrogen 3.131 N/A LEU 48.A N VAL 44.A O no hydrogen 2.810 N/A ALA 49.A N LEU 45.A O no hydrogen 2.978 N/A TRP 50.A N VAL 46.A O no hydrogen 2.980 N/A HIS 51.A N ARG 47.A O no hydrogen 2.791 N/A HIS 51.A ND1 ASN 81.A OD1 no hydrogen 2.693 N/A THR 52.A N LEU 48.A O no hydrogen 2.989 N/A THR 52.A OG1 LEU 48.A O no hydrogen 2.999 N/A THR 52.A OG1 ALA 49.A O no hydrogen 3.176 N/A SER 53.A N ALA 49.A O no hydrogen 3.244 N/A SER 53.A OG ALA 49.A O no hydrogen 2.947 N/A TRP 56.A NE1 ASN 61.A OD1 no hydrogen 2.607 N/A ASP 57.A N THR 62.A O no hydrogen 3.007 N/A LYS 58.A N ARG 159.A O no hydrogen 3.043 N/A LYS 58.A NZ GLN 158.A O no hydrogen 2.816 N/A HIS 59.A N ASP 57.A OD1 no hydrogen 2.875 N/A ASN 61.A N ASP 57.A O no hydrogen 2.919 N/A ASN 61.A ND2 LEU 3.A O no hydrogen 2.925 N/A ASN 61.A ND2 GLY 272.A O no hydrogen 3.105 N/A THR 62.A N ASP 60.A OD1 no hydrogen 3.172 N/A THR 62.A OG1.B ASP 60.A OD1 no hydrogen 2.255 N/A THR 62.A OG1.B ASP 60.A OD2 no hydrogen 3.199 N/A GLY 64.A N THR 55.A OG1 no hydrogen 2.929 N/A SER 65.A OG LEU 269.A O no hydrogen 2.677 N/A TYR 66.A OH VAL 6.A O no hydrogen 2.433 N/A THR 69.A OG1 GLU 75.A OE2 no hydrogen 2.518 N/A ARG 71.A N GLY 68.A O no hydrogen 3.449 N/A ARG 71.A NH1 GLY 67.A O no hydrogen 2.884 N/A ARG 71.A NH1 GLY 68.A O no hydrogen 2.904 N/A ARG 71.A NH2 THR 132.A O no hydrogen 2.763 N/A PHE 72.A N THR 69.A O no hydrogen 2.980 N/A LYS 74.A NZ THR 137.A O no hydrogen 3.300 N/A LYS 74.A NZ ASP 139.A OD2 no hydrogen 2.761 N/A GLU 75.A N PHE 72.A O no hydrogen 3.165 N/A PHE 76.A N PHE 72.A O no hydrogen 3.102 N/A ASN 77.A N LYS 73.A O no hydrogen 2.845 N/A ASP 78.A N GLU 75.A O no hydrogen 3.244 N/A SER 80.A N ASP 78.A OD1 no hydrogen 2.803 N/A SER 80.A OG ASP 78.A OD1 no hydrogen 3.418 N/A ASN 81.A N ASP 78.A O no hydrogen 2.619 N/A ASN 81.A ND2 GLU 75.A O no hydrogen 2.799 N/A ALA 82.A N PRO 79.A O no hydrogen 3.248 N/A LEU 84.A N ASN 81.A O no hydrogen 2.937 N/A ASN 86.A N GLY 83.A O no hydrogen 3.233 N/A ASN 86.A ND2 GLY 83.A O no hydrogen 2.874 N/A GLY 87.A N LEU 84.A O no hydrogen 2.906 N/A PHE 88.A N LEU 84.A O no hydrogen 3.089 N/A LYS 89.A N GLN 85.A O no hydrogen 2.980 N/A PHE 90.A N ASN 86.A O no hydrogen 3.386 N/A LEU 91.A N GLY 87.A O no hydrogen 3.152 N/A GLU 92.A N PHE 88.A O no hydrogen 3.094 N/A HIS 95.A N LEU 91.A O no hydrogen 3.042 N/A HIS 95.A NE2 ILE 101.A O no hydrogen 2.634 N/A LYS 96.A N GLU 92.A O no hydrogen 3.043 N/A GLU 97.A N PRO 93.A O no hydrogen 3.208 N/A PHE 98.A N ILE 94.A O no hydrogen 2.960 N/A ILE 101.A N PHE 98.A O no hydrogen 3.326 N/A SER 102.A N GLU 10.A OE1 no hydrogen 3.352 N/A SER 102.A OG GLU 10.A OE1 no hydrogen 3.343 N/A SER 102.A OG ARG 129.A O no hydrogen 2.449 N/A SER 103.A N ASP 131.A OD1 no hydrogen 2.835 N/A ASP 105.A N SER 102.A OG no hydrogen 3.271 N/A LEU 106.A N SER 102.A O no hydrogen 3.185 N/A PHE 107.A N SER 103.A O no hydrogen 2.984 N/A SER 108.A N GLY 104.A O no hydrogen 3.012 N/A SER 108.A OG GLY 104.A O no hydrogen 3.196 N/A SER 108.A OG ASP 105.A O no hydrogen 3.397 N/A LEU 109.A N ASP 105.A O no hydrogen 2.782 N/A GLY 110.A N LEU 106.A O no hydrogen 2.876 N/A GLY 111.A N SER 108.A O no hydrogen 3.213 N/A VAL 112.A N SER 108.A O no hydrogen 3.279 N/A THR 113.A N LEU 109.A O no hydrogen 2.943 N/A THR 113.A OG1 LEU 109.A O no hydrogen 2.926 N/A ALA 114.A N GLY 110.A O no hydrogen 3.035 N/A VAL 115.A N GLY 111.A O no hydrogen 3.098 N/A GLN 116.A N VAL 112.A O no hydrogen 3.118 N/A GLN 116.A NE2 TYR 22.A OH no hydrogen 3.338 N/A GLN 116.A NE2 PHE 285.A O no hydrogen 2.951 N/A GLU 117.A N THR 113.A O no hydrogen 2.843 N/A MET 118.A N ALA 114.A O no hydrogen 2.811 N/A GLN 119.A N GLN 116.A O no hydrogen 3.220 N/A GLY 120.A N VAL 115.A O no hydrogen 2.992 N/A LYS 122.A NZ PHE 285.A O no hydrogen 2.986 N/A LYS 122.A NZ GLU 290.A OE1 no hydrogen 3.125 N/A LYS 122.A NZ GLU 290.A OE2 no hydrogen 2.752 N/A ILE 123.A N GLN 116.A OE1 no hydrogen 3.117 N/A TRP 125.A N PHE 283.A O no hydrogen 2.953 N/A TRP 125.A NE1 SER 108.A OG no hydrogen 2.842 N/A ARG 126.A NH2 PRO 280.A O no hydrogen 3.090 N/A GLY 128.A N ASP 105.A OD2 no hydrogen 2.894 N/A ARG 129.A N ASP 105.A OD1 no hydrogen 2.960 N/A ARG 129.A NE SER 65.A OG no hydrogen 2.856 N/A ARG 129.A NH1 ASP 105.A OD1 no hydrogen 2.950 N/A ARG 129.A NH1 ARG 126.A O no hydrogen 2.635 N/A ARG 129.A NH2 LEU 269.A O no hydrogen 2.937 N/A THR 132.A N GLY 67.A O no hydrogen 3.276 N/A THR 132.A OG1 THR 136.A OG1 no hydrogen 2.702 N/A THR 136.A N PRO 133.A O no hydrogen 2.924 N/A THR 136.A OG1 THR 132.A OG1 no hydrogen 2.702 N/A THR 136.A OG1 PRO 133.A O no hydrogen 2.576 N/A THR 137.A N GLU 134.A O no hydrogen 3.398 N/A THR 137.A OG1 GLU 134.A O no hydrogen 2.819 N/A ARG 142.A NH1 THR 62.A OG1.B no hydrogen 3.318 N/A ARG 142.A NH2 THR 55.A O no hydrogen 2.714 N/A ARG 142.A NH2 THR 62.A OG1.B no hydrogen 3.237 N/A ASP 145.A N TYR 152.A OH no hydrogen 2.809 N/A LYS 148.A NZ ASP 145.A OD2 no hydrogen 3.475 N/A LYS 148.A NZ ASP 147.A OD1 no hydrogen 2.928 N/A ASP 151.A N ASP 149.A OD2 no hydrogen 3.351 N/A VAL 153.A N ASP 149.A O no hydrogen 3.157 N/A ARG 154.A N ALA 150.A O no hydrogen 2.942 N/A ARG 154.A NE ASP 164.A OD1 no hydrogen 2.745 N/A ARG 154.A NH1 ASP 240.A OD1 no hydrogen 2.982 N/A ARG 154.A NH2 ASP 164.A OD1 no hydrogen 3.272 N/A ARG 154.A NH2 ASP 164.A OD2 no hydrogen 3.216 N/A ARG 154.A NH2 ASP 240.A OD2 no hydrogen 3.202 N/A THR 155.A N ASP 151.A O no hydrogen 3.089 N/A THR 155.A OG1 ASP 151.A O no hydrogen 2.827 N/A PHE 156.A N TYR 152.A O no hydrogen 2.814 N/A PHE 157.A N VAL 153.A O no hydrogen 2.977 N/A ARG 159.A N PHE 156.A O no hydrogen 3.265 N/A ARG 159.A NE TRP 56.A O no hydrogen 2.917 N/A ARG 159.A NH1 ARG 142.A O no hydrogen 2.957 N/A ARG 159.A NH2 TRP 56.A O no hydrogen 2.825 N/A ARG 159.A NH2 ARG 142.A O no hydrogen 3.368 N/A LEU 160.A N PHE 157.A O no hydrogen 3.039 N/A ASN 161.A N GLN 158.A O no hydrogen 2.968 N/A MET 162.A N PHE 157.A O no hydrogen 2.938 N/A ASN 163.A N GLU 166.A OE2 no hydrogen 2.847 N/A ARG 165.A NH1 ASP 260.A OD2 no hydrogen 3.241 N/A ARG 165.A NH2 GLU 249.A OE1 no hydrogen 2.671 N/A GLU 166.A N ASN 163.A OD1 no hydrogen 2.996 N/A VAL 167.A N ASN 163.A O no hydrogen 2.833 N/A VAL 168.A N ASP 164.A O no hydrogen 3.141 N/A ALA 169.A N ARG 165.A O no hydrogen 2.906 N/A LEU 170.A N GLU 166.A O no hydrogen 2.871 N/A MET 171.A N VAL 167.A O no hydrogen 2.898 N/A GLY 172.A N ALA 169.A O no hydrogen 3.155 N/A ALA 173.A N LEU 170.A O no hydrogen 3.119 N/A HIS 174.A N MET 171.A O no hydrogen 2.877 N/A HIS 174.A ND1 ASP 234.A OD1 no hydrogen 2.932 N/A ALA 175.A N GLY 172.A O no hydrogen 3.173 N/A LEU 176.A N ALA 173.A O no hydrogen 2.928 N/A GLY 177.A N ASN 194.A O no hydrogen 2.913 N/A LYS 178.A NZ THR 179.A O no hydrogen 2.837 N/A LYS 178.A NZ GLU 187.A OE1 no hydrogen 2.857 N/A THR 179.A N GLY 188.A O no hydrogen 3.017 N/A THR 179.A OG1 GLY 188.A O no hydrogen 2.907 N/A HIS 180.A NE2 ASP 36.A OD2 no hydrogen 2.628 N/A LEU 181.A N GLU 187.A OE2 no hydrogen 2.792 N/A ASN 183.A N HIS 180.A O no hydrogen 3.020 N/A ASN 183.A ND2 HIS 180.A ND1 no hydrogen 3.553 N/A SER 184.A N HIS 180.A O no hydrogen 3.203 N/A SER 184.A OG HIS 180.A O no hydrogen 3.461 N/A GLY 185.A N LEU 181.A O no hydrogen 2.807 N/A GLY 188.A N THR 179.A O no hydrogen 3.367 N/A TRP 190.A NE1 ASP 234.A OD2 no hydrogen 2.493 N/A ALA 192.A N GLU 200.A OE2 no hydrogen 2.898 N/A ALA 193.A N GLU 200.A OE1 no hydrogen 3.257 N/A ASN 194.A ND2 ALA 192.A O no hydrogen 2.556 N/A ASN 195.A ND2 ILE 39.A O no hydrogen 3.052 N/A PHE 197.A N MET 118.A O no hydrogen 2.720 N/A GLU 200.A N THR 198.A OG1 no hydrogen 2.966 N/A TYR 202.A N ASN 199.A O no hydrogen 3.246 N/A TYR 202.A OH VAL 168.A O no hydrogen 2.485 N/A LEU 203.A N ASN 199.A O no hydrogen 3.486 N/A ASN 204.A N GLU 200.A O no hydrogen 2.907 N/A ASN 204.A ND2 TRP 190.A O no hydrogen 2.967 N/A ASN 204.A ND2 GLU 200.A OE2 no hydrogen 3.366 N/A LEU 205.A N PHE 201.A O no hydrogen 3.105 N/A LEU 206.A N TYR 202.A O no hydrogen 3.125 N/A ASN 207.A N LEU 203.A O no hydrogen 3.014 N/A ASN 207.A N ASN 204.A O no hydrogen 3.367 N/A GLU 208.A N ASN 204.A O no hydrogen 2.979 N/A TRP 210.A NE1 LEU 205.A O no hydrogen 3.114 N/A LYS 211.A N ASP 223.A O no hydrogen 2.849 N/A GLU 213.A N GLN 221.A O no hydrogen 2.908 N/A ASN 215.A N ASN 219.A O no hydrogen 2.848 N/A ASN 215.A ND2 GLY 185.A O no hydrogen 3.160 N/A ALA 217.A N ASN 215.A OD1 no hydrogen 2.797 N/A ASN 218.A N ASN 215.A O no hydrogen 2.587 N/A ASN 219.A N ASN 215.A OD1 no hydrogen 3.145 N/A ASN 219.A ND2 GLY 185.A O no hydrogen 2.694 N/A GLN 221.A N GLU 213.A O no hydrogen 2.787 N/A TRP 222.A N MET 230.A O no hydrogen 3.088 N/A ASP 223.A N LYS 211.A O no hydrogen 2.890 N/A SER 224.A N TYR 228.A O no hydrogen 2.978 N/A SER 224.A OG GLU 208.A OE1 no hydrogen 3.017 N/A SER 226.A N SER 224.A OG no hydrogen 3.128 N/A SER 226.A OG GLU 208.A OE1 no hydrogen 2.876 N/A GLY 227.A N SER 224.A O no hydrogen 3.116 N/A TYR 228.A N SER 224.A OG no hydrogen 3.163 N/A MET 229.A N PRO 189.A O no hydrogen 2.816 N/A MET 230.A N TRP 222.A O no hydrogen 2.726 N/A LEU 231.A N ASP 234.A OD2 no hydrogen 2.878 N/A THR 233.A N ALA 146.A O no hydrogen 3.364 N/A TYR 235.A N LEU 231.A O no hydrogen 2.949 N/A SER 236.A N PRO 232.A O no hydrogen 3.069 N/A SER 236.A OG THR 233.A O no hydrogen 3.170 N/A LEU 237.A N ASP 234.A O no hydrogen 3.176 N/A ILE 238.A N TYR 235.A O no hydrogen 2.952 N/A GLN 239.A N SER 236.A O no hydrogen 3.054 N/A ASP 240.A N SER 236.A O no hydrogen 3.193 N/A LYS 242.A N ASP 240.A OD2 no hydrogen 2.884 N/A TYR 243.A N ASP 240.A OD2 no hydrogen 3.118 N/A LEU 244.A N ASP 240.A O no hydrogen 2.821 N/A SER 245.A N PRO 241.A O no hydrogen 3.440 N/A SER 245.A OG PRO 241.A O no hydrogen 3.464 N/A VAL 247.A N TYR 243.A O no hydrogen 2.907 N/A LYS 248.A N LEU 244.A O no hydrogen 2.938 N/A GLU 249.A N SER 245.A O no hydrogen 2.997 N/A TYR 250.A N ILE 246.A O no hydrogen 2.890 N/A TYR 250.A OH ASP 260.A OD2 no hydrogen 2.438 N/A ALA 251.A N VAL 247.A O no hydrogen 3.093 N/A ASN 252.A N LYS 248.A O no hydrogen 3.277 N/A ASN 252.A N GLU 249.A O no hydrogen 3.248 N/A ASN 252.A ND2 LYS 248.A O no hydrogen 2.613 N/A LYS 256.A N ASP 253.A OD1 no hydrogen 3.068 N/A LYS 256.A NZ ASP 260.A OD1 no hydrogen 2.917 N/A LYS 256.A NZ ASP 260.A OD2 no hydrogen 3.430 N/A PHE 257.A N ASP 253.A O no hydrogen 3.266 N/A PHE 258.A N GLN 254.A O no hydrogen 2.808 N/A LYS 259.A N ASP 255.A O no hydrogen 2.992 N/A ASP 260.A N LYS 256.A O no hydrogen 2.927 N/A PHE 261.A N PHE 257.A O no hydrogen 2.868 N/A SER 262.A N PHE 258.A O no hydrogen 2.947 N/A SER 262.A OG LYS 122.A O no hydrogen 2.674 N/A LYS 263.A N LYS 259.A O no hydrogen 3.283 N/A ALA 264.A N ASP 260.A O no hydrogen 3.156 N/A PHE 265.A N PHE 261.A O no hydrogen 2.738 N/A GLU 266.A N SER 262.A O no hydrogen 2.948 N/A LYS 267.A N LYS 263.A O no hydrogen 3.082 N/A LYS 267.A NZ ASN 161.A O no hydrogen 2.807 N/A LYS 267.A NZ GLU 166.A OE1 no hydrogen 2.989 N/A LYS 267.A NZ GLU 166.A OE2 no hydrogen 3.298 N/A LEU 268.A N ALA 264.A O no hydrogen 2.959 N/A LEU 269.A N PHE 265.A O no hydrogen 2.984 N/A GLU 270.A N GLU 266.A O no hydrogen 2.937 N/A GLU 270.A N LYS 267.A O no hydrogen 3.118 N/A ASN 271.A N LYS 267.A O no hydrogen 2.964 N/A ASN 271.A ND2 LEU 160.A O no hydrogen 3.253 N/A ILE 273.A N GLU 270.A O no hydrogen 3.157 N/A THR 274.A N HIS 5.A O no hydrogen 2.627 N/A ALA 279.A N PRO 276.A O no hydrogen 2.821 N/A PHE 283.A N TRP 125.A O no hydrogen 2.735 N/A THR 287.A N GLU 290.A OE2 no hydrogen 2.823 N/A LEU 288.A N GLU 117.A OE1 no hydrogen 3.270 N/A GLU 290.A N THR 287.A OG1 no hydrogen 3.088 N/A GLN 291.A N THR 287.A O no hydrogen 3.123 N/A GLN 291.A N LEU 288.A O no hydrogen 2.900 N/A GLN 291.A NE2 ASN 23.A OD1 no hydrogen 3.023 N/A GLY 292.A N GLU 289.A O no hydrogen 3.309 N/A LEU 293.A N LEU 288.A O no hydrogen 3.112 N/A