Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wyl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 8.A N LEU 5.A O no hydrogen 3.236 N/A LEU 14.A N PRO 11.A O no hydrogen 2.945 N/A CYS 15.A N VAL 12.A O no hydrogen 3.170 N/A CYS 15.A SG TYR 38.A OH no hydrogen 3.874 N/A ILE 18.A N LEU 14.A O no hydrogen 2.970 N/A LEU 20.A N GLU 17.A O no hydrogen 3.193 N/A PHE 23.A N LEU 20.A O no hydrogen 3.433 N/A GLY 26.A N ASP 24.A OD1 no hydrogen 3.039 N/A PHE 28.A N ILE 25.A O no hydrogen 2.924 N/A MET 31.A N PHE 28.A O no hydrogen 2.899 N/A TRP 32.A N GLU 29.A O no hydrogen 3.121 N/A TRP 32.A NE1 ILE 25.A O no hydrogen 2.713 N/A ILE 35.A N MET 31.A O no hydrogen 2.760 N/A PHE 36.A N TRP 32.A O no hydrogen 3.007 N/A VAL 37.A N PRO 33.A O no hydrogen 3.182 N/A TYR 38.A N GLY 34.A O no hydrogen 2.801 N/A MET 39.A N ILE 35.A O no hydrogen 2.949 N/A VAL 40.A N PHE 36.A O no hydrogen 2.969 N/A HIS 41.A N VAL 37.A O no hydrogen 3.026 N/A ARG 42.A N TYR 38.A O no hydrogen 3.085 N/A ARG 42.A NE TYR 38.A OH no hydrogen 2.991 N/A SER 43.A N MET 39.A O no hydrogen 3.134 N/A CYS 44.A N VAL 40.A O no hydrogen 2.879 N/A CYS 44.A SG VAL 40.A O no hydrogen 3.580 N/A LYS 53.A NZ SER 158.A OG no hydrogen 2.985 N/A LEU 54.A N GLU 50.A O no hydrogen 3.016 N/A CYS 55.A N LEU 51.A O no hydrogen 3.116 N/A CYS 55.A SG LEU 51.A O no hydrogen 3.511 N/A ARG 56.A N GLU 52.A O no hydrogen 3.346 N/A ARG 56.A NH1 GLY 153.A O no hydrogen 2.811 N/A PHE 57.A N LYS 53.A O no hydrogen 3.177 N/A ILE 58.A N LEU 54.A O no hydrogen 3.227 N/A MET 59.A N CYS 55.A O no hydrogen 3.272 N/A SER 60.A N ARG 56.A O no hydrogen 3.005 N/A SER 60.A OG ARG 56.A O no hydrogen 3.070 N/A SER 60.A OG HIS 154.A NE2 no hydrogen 2.691 N/A VAL 61.A N PHE 57.A O no hydrogen 2.863 N/A LYS 62.A N ILE 58.A O no hydrogen 2.884 N/A LYS 63.A N MET 59.A O no hydrogen 2.958 N/A ASN 64.A N SER 60.A O no hydrogen 3.152 N/A ASN 64.A N VAL 61.A O no hydrogen 3.283 N/A ASN 64.A ND2 SER 60.A O no hydrogen 2.726 N/A TYR 65.A N LYS 62.A O no hydrogen 3.186 N/A TYR 65.A OH LEU 107.A O no hydrogen 2.632 N/A ARG 66.A NE ASP 112.A OD1 no hydrogen 2.694 N/A ARG 66.A NH2 ASP 112.A OD1 no hydrogen 3.087 N/A ARG 66.A NH2 ASP 112.A OD2 no hydrogen 3.387 N/A TYR 70.A N GLU 241.A OE1 no hydrogen 2.720 N/A TYR 70.A OH SER 223.A OG no hydrogen 3.303 N/A HIS 71.A N GLU 241.A OE1 no hydrogen 3.163 N/A HIS 71.A ND1 GLU 241.A OE2 no hydrogen 2.433 N/A ASN 72.A N TYR 70.A O no hydrogen 2.881 N/A ASN 72.A ND2 VAL 68.A O no hydrogen 3.052 N/A HIS 75.A N ASN 72.A O no hydrogen 3.160 N/A HIS 75.A N ASN 72.A OD1 no hydrogen 3.310 N/A HIS 75.A NE2 HIS 109.A NE2 no hydrogen 3.219 N/A ALA 76.A N ASN 72.A O no hydrogen 3.219 N/A VAL 77.A N TRP 73.A O no hydrogen 3.123 N/A THR 78.A N LYS 74.A O no hydrogen 3.061 N/A THR 78.A OG1 LYS 74.A O no hydrogen 2.821 N/A VAL 79.A N HIS 75.A O no hydrogen 2.947 N/A ALA 80.A N ALA 76.A O no hydrogen 3.024 N/A HIS 81.A N VAL 77.A O no hydrogen 2.819 N/A HIS 81.A NE2 ILE 18.A O no hydrogen 2.634 N/A CYS 82.A N THR 78.A O no hydrogen 3.183 N/A MET 83.A N VAL 79.A O no hydrogen 3.144 N/A TYR 84.A N ALA 80.A O no hydrogen 2.923 N/A TYR 84.A OH GLU 19.A OE2 no hydrogen 2.779 N/A ALA 85.A N HIS 81.A O no hydrogen 2.937 N/A ILE 86.A N CYS 82.A O no hydrogen 2.964 N/A LEU 87.A N MET 83.A O no hydrogen 2.918 N/A GLN 88.A N TYR 84.A O no hydrogen 2.964 N/A ASN 89.A N ILE 86.A O no hydrogen 3.125 N/A ASN 89.A ND2 ALA 85.A O no hydrogen 2.709 N/A ASN 90.A N LEU 87.A O no hydrogen 3.203 N/A ASN 90.A ND2 ILE 86.A O no hydrogen 2.923 N/A LEU 93.A N ASN 90.A O no hydrogen 2.948 N/A THR 95.A N GLU 98.A OE1 no hydrogen 2.947 N/A THR 95.A OG1 GLU 98.A OE1 no hydrogen 3.313 N/A ARG 99.A N THR 95.A O no hydrogen 3.211 N/A ARG 99.A NE SER 43.A O no hydrogen 3.379 N/A LYS 100.A NZ ASP 96.A OD2 no hydrogen 2.939 N/A GLY 101.A N LEU 97.A O no hydrogen 3.177 N/A LEU 102.A N GLU 98.A O no hydrogen 2.928 N/A ILE 104.A N LYS 100.A O no hydrogen 3.308 N/A ALA 105.A N GLY 101.A O no hydrogen 2.639 N/A CYS 106.A N LEU 102.A O no hydrogen 2.961 N/A CYS 106.A SG LEU 102.A O no hydrogen 3.423 N/A LEU 107.A N LEU 103.A O no hydrogen 3.210 N/A CYS 108.A N ILE 104.A O no hydrogen 3.132 N/A CYS 108.A SG ILE 104.A O no hydrogen 3.413 N/A HIS 109.A N CYS 106.A O no hydrogen 3.504 N/A HIS 109.A ND1 CYS 106.A O no hydrogen 2.872 N/A HIS 109.A NE2 ASP 220.A OD1 no hydrogen 3.090 N/A ASP 110.A N TYR 65.A OH no hydrogen 3.322 N/A LEU 111.A N CYS 108.A O no hydrogen 3.264 N/A ARG 114.A NE ASP 112.A O no hydrogen 2.972 N/A ARG 114.A NH2 ASP 112.A OD2 no hydrogen 3.174 N/A GLY 115.A N HIS 113.A ND1 no hydrogen 3.199 N/A SER 117.A N GLU 245.A OE1 no hydrogen 3.282 N/A SER 117.A N GLU 245.A OE2 no hydrogen 3.236 N/A SER 117.A OG GLU 245.A OE2 no hydrogen 2.670 N/A ASN 118.A ND2 GLU 138.A OE1 no hydrogen 3.194 N/A TYR 120.A N SER 117.A OG no hydrogen 3.250 N/A LEU 121.A N SER 117.A O no hydrogen 3.364 N/A GLN 122.A N ASN 118.A O no hydrogen 2.732 N/A GLN 122.A NE2 THR 136.A OG1 no hydrogen 2.503 N/A LYS 123.A N SER 119.A O no hydrogen 2.699 N/A PHE 124.A N TYR 120.A O no hydrogen 3.338 N/A HIS 126.A N LEU 121.A O no hydrogen 3.245 N/A ALA 130.A N HIS 126.A O no hydrogen 3.123 N/A LEU 131.A N PRO 127.A O no hydrogen 2.983 N/A TYR 132.A N LEU 128.A O no hydrogen 2.688 N/A SER 135.A OG ASP 180.A OD2 no hydrogen 3.360 N/A THR 136.A OG1 TYR 132.A O no hydrogen 3.090 N/A MET 137.A N ASN 118.A OD1 no hydrogen 3.079 N/A GLN 139.A N SER 135.A O no hydrogen 2.974 N/A GLN 139.A NE2 THR 134.A O no hydrogen 2.828 N/A HIS 140.A N THR 136.A O no hydrogen 3.332 N/A HIS 141.A N MET 137.A O no hydrogen 2.931 N/A HIS 141.A ND1 LEU 111.A O no hydrogen 2.791 N/A PHE 142.A N GLU 138.A O no hydrogen 3.375 N/A SER 143.A N GLN 139.A O no hydrogen 3.019 N/A SER 143.A OG TYR 132.A OH no hydrogen 2.663 N/A SER 143.A OG GLN 139.A O no hydrogen 3.120 N/A GLN 144.A N HIS 140.A O no hydrogen 2.874 N/A THR 145.A N HIS 141.A O no hydrogen 3.166 N/A THR 145.A OG1 HIS 141.A O no hydrogen 2.896 N/A VAL 146.A N PHE 142.A O no hydrogen 3.018 N/A SER 147.A N SER 143.A O no hydrogen 2.976 N/A SER 147.A OG SER 143.A O no hydrogen 3.325 N/A ILE 148.A N GLN 144.A O no hydrogen 3.038 N/A LEU 149.A N THR 145.A O no hydrogen 3.153 N/A GLN 150.A N VAL 146.A O no hydrogen 3.222 N/A LEU 151.A N ILE 148.A O no hydrogen 3.376 N/A HIS 154.A N LEU 151.A O no hydrogen 3.415 N/A HIS 154.A ND1 GLU 152.A O no hydrogen 2.874 N/A HIS 154.A NE2 SER 60.A OG no hydrogen 2.691 N/A ASN 155.A ND2 TYR 165.A OH no hydrogen 3.095 N/A PHE 157.A N ASN 155.A OD1 no hydrogen 2.972 N/A SER 158.A N ASN 155.A O no hydrogen 3.232 N/A SER 158.A OG ASN 155.A O no hydrogen 2.684 N/A TYR 165.A N SER 161.A O no hydrogen 2.827 N/A GLU 166.A N SER 162.A O no hydrogen 3.087 N/A GLN 167.A N SER 163.A O no hydrogen 3.184 N/A VAL 168.A N GLU 164.A O no hydrogen 3.376 N/A LEU 169.A N TYR 165.A O no hydrogen 3.281 N/A GLU 170.A N GLU 166.A O no hydrogen 3.274 N/A ILE 171.A N GLN 167.A O no hydrogen 2.997 N/A ILE 172.A N VAL 168.A O no hydrogen 2.840 N/A ARG 173.A N LEU 169.A O no hydrogen 2.747 N/A ARG 173.A NE GLU 170.A OE2 no hydrogen 3.230 N/A ARG 173.A NH2 GLU 170.A OE1 no hydrogen 2.650 N/A LYS 174.A N GLU 170.A O no hydrogen 3.038 N/A LYS 174.A NZ ASP 209.A OD2 no hydrogen 3.020 N/A ALA 175.A N ILE 171.A O no hydrogen 2.989 N/A ILE 176.A N ILE 172.A O no hydrogen 3.080 N/A ILE 177.A N ARG 173.A O no hydrogen 3.005 N/A ALA 178.A N LYS 174.A O no hydrogen 2.869 N/A THR 179.A N ILE 176.A O no hydrogen 3.138 N/A THR 179.A OG1 ILE 176.A O no hydrogen 2.212 N/A ASP 180.A N ILE 177.A O no hydrogen 2.971 N/A ALA 182.A N ASP 180.A OD1 no hydrogen 3.370 N/A LEU 183.A N ASP 180.A O no hydrogen 3.168 N/A TYR 184.A N LEU 181.A O no hydrogen 3.303 N/A ASN 187.A N LEU 183.A O no hydrogen 3.054 N/A ASN 187.A ND2 ARG 210.A O no hydrogen 3.484 N/A ARG 188.A N TYR 184.A O no hydrogen 2.820 N/A ARG 188.A NE THR 286.A OG1 no hydrogen 2.999 N/A ARG 188.A NH2 THR 286.A OG1 no hydrogen 3.195 N/A LYS 189.A N PHE 185.A O no hydrogen 3.184 N/A GLN 190.A N GLY 186.A O no hydrogen 2.874 N/A LEU 191.A N ASN 187.A O no hydrogen 3.064 N/A GLU 192.A N ARG 188.A O no hydrogen 3.148 N/A GLU 193.A N LYS 189.A O no hydrogen 3.330 N/A MET 194.A N GLN 190.A O no hydrogen 3.207 N/A TYR 195.A N LEU 191.A O no hydrogen 3.108 N/A GLN 196.A N GLU 192.A O no hydrogen 3.015 N/A THR 197.A N GLU 193.A O no hydrogen 3.024 N/A THR 197.A OG1 GLU 193.A O no hydrogen 2.998 N/A GLY 198.A N TYR 195.A O no hydrogen 3.167 N/A SER 199.A N MET 194.A O no hydrogen 2.738 N/A ASN 201.A N HIS 207.A ND1 no hydrogen 3.206 N/A ASN 203.A N ASN 201.A OD1 no hydrogen 2.949 N/A ASN 203.A ND2 ASN 201.A OD1 no hydrogen 3.030 N/A ASN 204.A N ASN 201.A O no hydrogen 2.967 N/A GLN 205.A NE2 ASP 209.A OD1 no hydrogen 2.715 N/A SER 206.A N ASN 204.A OD1 no hydrogen 2.833 N/A SER 206.A OG ASN 204.A OD1 no hydrogen 2.581 N/A HIS 207.A N ASN 204.A OD1 no hydrogen 3.358 N/A ARG 208.A N ASN 204.A O no hydrogen 2.972 N/A ARG 208.A NE GLU 98.A OE2 no hydrogen 2.987 N/A ARG 208.A NH1 LEU 202.A O no hydrogen 2.869 N/A ARG 208.A NH2 LEU 93.A O no hydrogen 2.793 N/A ARG 208.A NH2 GLU 98.A OE1 no hydrogen 2.878 N/A ASP 209.A N GLN 205.A O no hydrogen 2.968 N/A ARG 210.A N SER 206.A O no hydrogen 3.300 N/A VAL 211.A N HIS 207.A O no hydrogen 3.139 N/A ILE 212.A N ARG 208.A O no hydrogen 2.929 N/A GLY 213.A N ASP 209.A O no hydrogen 3.065 N/A LEU 214.A N ARG 210.A O no hydrogen 3.056 N/A MET 215.A N VAL 211.A O no hydrogen 2.909 N/A MET 216.A N ILE 212.A O no hydrogen 2.966 N/A THR 217.A N GLY 213.A O no hydrogen 3.194 N/A THR 217.A OG1 ALA 178.A O no hydrogen 3.390 N/A ALA 218.A N LEU 214.A O no hydrogen 2.878 N/A CYS 219.A N MET 215.A O no hydrogen 2.926 N/A CYS 219.A SG MET 215.A O no hydrogen 3.210 N/A ASP 220.A N MET 216.A O no hydrogen 2.704 N/A LEU 221.A N THR 217.A O no hydrogen 3.034 N/A CYS 222.A N CYS 219.A O no hydrogen 3.083 N/A CYS 222.A SG THR 78.A O no hydrogen 3.968 N/A CYS 222.A SG CYS 219.A O no hydrogen 3.220 N/A SER 223.A OG TYR 70.A OH no hydrogen 3.303 N/A VAL 224.A N LEU 221.A O no hydrogen 3.203 N/A THR 225.A N CYS 222.A O no hydrogen 2.832 N/A THR 225.A OG1 CYS 222.A O no hydrogen 2.461 N/A LYS 226.A NZ PHE 21.A O no hydrogen 3.387 N/A LYS 226.A NZ PHE 23.A O no hydrogen 3.094 N/A THR 231.A N LEU 227.A O no hydrogen 3.045 N/A THR 231.A OG1 SER 223.A O no hydrogen 3.115 N/A THR 231.A OG1 LYS 226.A O no hydrogen 2.948 N/A THR 231.A OG1 LEU 227.A O no hydrogen 3.159 N/A LYS 232.A N TRP 228.A O no hydrogen 2.902 N/A LEU 233.A N PRO 229.A O no hydrogen 3.342 N/A THR 234.A N VAL 230.A O no hydrogen 2.947 N/A THR 234.A OG1 VAL 230.A O no hydrogen 2.726 N/A ALA 235.A N THR 231.A O no hydrogen 3.095 N/A ASP 237.A N LEU 233.A O no hydrogen 3.396 N/A ILE 238.A N THR 234.A O no hydrogen 3.178 N/A TYR 239.A N ALA 235.A O no hydrogen 3.051 N/A ALA 240.A N ASN 236.A O no hydrogen 3.108 N/A GLU 241.A N ASP 237.A O no hydrogen 3.369 N/A PHE 242.A N ILE 238.A O no hydrogen 2.902 N/A TRP 243.A N TYR 239.A O no hydrogen 2.594 N/A ALA 244.A N ALA 240.A O no hydrogen 3.033 N/A GLU 245.A N GLU 241.A O no hydrogen 3.264 N/A GLY 246.A N PHE 242.A O no hydrogen 3.158 N/A ASP 247.A N TRP 243.A O no hydrogen 2.933 N/A GLU 248.A N ALA 244.A O no hydrogen 3.215 N/A MET 249.A N GLY 246.A O no hydrogen 3.154 N/A LYS 250.A N GLY 246.A O no hydrogen 3.040 N/A LYS 250.A NZ ASP 261.A OD1 no hydrogen 2.848 N/A LYS 250.A NZ ASP 263.A OD2 no hydrogen 3.513 N/A LYS 251.A N ASP 247.A O no hydrogen 3.259 N/A GLY 253.A N MET 249.A O no hydrogen 3.177 N/A ILE 254.A N MET 249.A O no hydrogen 2.942 N/A MET 260.A N ILE 257.A O no hydrogen 3.022 N/A ASP 261.A N PRO 258.A O no hydrogen 3.210 N/A ARG 262.A NE ASP 247.A OD2 no hydrogen 2.946 N/A ARG 262.A NH2 ASP 247.A OD2 no hydrogen 3.078 N/A ASP 263.A N ASP 261.A OD1 no hydrogen 3.146 N/A LYS 264.A N ASP 261.A O no hydrogen 3.127 N/A LYS 264.A NZ ASP 261.A OD2 no hydrogen 2.697 N/A GLU 267.A N LYS 264.A O no hydrogen 3.226 N/A VAL 268.A N LYS 265.A O no hydrogen 3.166 N/A GLY 271.A N GLU 267.A O no hydrogen 2.844 N/A GLN 272.A N VAL 268.A O no hydrogen 2.859 N/A GLN 272.A NE2 TYR 239.A OH no hydrogen 3.468 N/A LEU 273.A N PRO 269.A O no hydrogen 2.943 N/A GLY 274.A N GLN 270.A O no hydrogen 2.930 N/A PHE 275.A N GLY 271.A O no hydrogen 2.941 N/A TYR 276.A N GLN 272.A O no hydrogen 2.816 N/A ASN 277.A N LEU 273.A O no hydrogen 3.282 N/A ASN 277.A ND2 LEU 273.A O no hydrogen 2.775 N/A ALA 278.A N GLY 274.A O no hydrogen 3.031 N/A VAL 279.A N PHE 275.A O no hydrogen 3.060 N/A ALA 280.A N PHE 275.A O no hydrogen 3.140 N/A ILE 281.A N TYR 276.A O no hydrogen 2.827 N/A CYS 283.A N VAL 279.A O no hydrogen 3.109 N/A TYR 284.A N ALA 280.A O no hydrogen 3.048 N/A TYR 284.A OH ALA 218.A O no hydrogen 2.759 N/A THR 285.A N ILE 281.A O no hydrogen 2.844 N/A THR 285.A OG1 ILE 281.A O no hydrogen 2.697 N/A THR 286.A N PRO 282.A O no hydrogen 2.916 N/A THR 286.A OG1 PRO 282.A O no hydrogen 2.899 N/A LEU 287.A N CYS 283.A O no hydrogen 2.853 N/A THR 288.A N TYR 284.A O no hydrogen 2.837 N/A THR 288.A OG1 TYR 284.A O no hydrogen 2.855 N/A GLN 289.A N THR 285.A O no hydrogen 3.180 N/A ILE 290.A N THR 286.A O no hydrogen 3.328 N/A ILE 290.A N LEU 287.A O no hydrogen 3.148 N/A LEU 291.A N LEU 287.A O no hydrogen 2.750 N/A THR 294.A N LEU 291.A O no hydrogen 3.042 N/A THR 294.A OG1 LEU 291.A O no hydrogen 2.616 N/A GLU 295.A N PRO 292.A O no hydrogen 3.134 N/A LEU 297.A N THR 294.A O no hydrogen 3.220 N/A LYS 299.A N GLU 295.A O no hydrogen 3.033 N/A ALA 300.A N PRO 296.A O no hydrogen 3.113 N/A CYS 301.A N LEU 297.A O no hydrogen 2.843 N/A ARG 302.A N LEU 298.A O no hydrogen 3.009 N/A ASP 303.A N LYS 299.A O no hydrogen 3.103 N/A ASN 304.A N ALA 300.A O no hydrogen 3.106 N/A ASN 304.A ND2 VAL 224.A O no hydrogen 2.825 N/A ASN 304.A ND2 LYS 226.A O no hydrogen 2.939 N/A LEU 305.A N CYS 301.A O no hydrogen 3.153 N/A SER 306.A N ARG 302.A O no hydrogen 3.132 N/A SER 306.A OG ARG 302.A O no hydrogen 2.879 N/A SER 306.A OG ASP 303.A O no hydrogen 3.421 N/A GLN 307.A N ASP 303.A O no hydrogen 3.196 N/A TRP 308.A N ASN 304.A O no hydrogen 3.056 N/A GLU 309.A N LEU 305.A O no hydrogen 3.115 N/A LYS 310.A N SER 306.A O no hydrogen 3.032 N/A VAL 311.A N GLN 307.A O no hydrogen 3.031 N/A ILE 312.A N TRP 308.A O no hydrogen 2.921 N/A ARG 313.A N GLU 309.A O no hydrogen 2.914 N/A GLY 314.A N VAL 311.A O no hydrogen 2.975 N/A GLU 315.A N LYS 310.A O no hydrogen 2.886 N/A