Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6kac_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 1.A N GLU 1.A OE1 no hydrogen 2.762 N/A ALA 7.A N SER 4.A OG no hydrogen 3.086 N/A ARG 8.A N SER 4.A O no hydrogen 3.461 N/A ARG 8.A NE SER 4.A O no hydrogen 2.966 N/A PHE 9.A N LEU 5.A O no hydrogen 3.202 N/A CYS 10.A N TRP 6.A O no hydrogen 2.933 N/A CYS 10.A SG TRP 6.A O no hydrogen 3.236 N/A GLU 11.A N ALA 7.A O no hydrogen 3.106 N/A TRP 12.A N PHE 9.A O no hydrogen 3.249 N/A ILE 13.A N PHE 9.A O no hydrogen 2.948 N/A THR 14.A N CYS 10.A O no hydrogen 3.121 N/A THR 14.A OG1 CYS 10.A O no hydrogen 2.560 N/A SER 15.A N TRP 12.A O no hydrogen 3.377 N/A GLU 17.A N SER 15.A OG no hydrogen 3.217 N/A ASN 18.A ND2 TRP 12.A O no hydrogen 3.019 N/A ASN 18.A ND2 SER 15.A O no hydrogen 3.545 N/A ARG 19.A NH1 ARG 19.A O no hydrogen 3.159 N/A GLY 23.A N ILE 13.A O no hydrogen 3.022 N/A TRP 24.A N GLU 124.A OE2 no hydrogen 3.071 N/A PHE 25.A N GLU 124.A OE1 no hydrogen 3.385 N/A GLY 26.A N GLY 23.A O no hydrogen 3.132 N/A MET 29.A N PHE 25.A O no hydrogen 2.873 N/A ILE 30.A N GLY 26.A O no hydrogen 3.098 N/A CYS 32.A N ILE 28.A O no hydrogen 3.109 N/A CYS 32.A SG ILE 28.A O no hydrogen 3.219 N/A LEU 33.A N MET 29.A O no hydrogen 2.680 N/A LEU 34.A N ILE 30.A O no hydrogen 2.947 N/A THR 35.A OG1 PRO 31.A O no hydrogen 2.448 N/A ALA 36.A N CYS 32.A O no hydrogen 2.963 N/A THR 37.A OG1 LEU 33.A O no hydrogen 2.380 N/A SER 38.A N LEU 34.A O no hydrogen 3.171 N/A SER 38.A OG LEU 34.A O no hydrogen 2.976 N/A SER 38.A OG THR 35.A O no hydrogen 2.843 N/A VAL 39.A N THR 35.A O no hydrogen 3.098 N/A PHE 40.A N ALA 36.A O no hydrogen 3.003 N/A ILE 41.A N THR 37.A O no hydrogen 3.156 N/A ILE 42.A N SER 38.A O no hydrogen 3.230 N/A ALA 43.A N VAL 39.A O no hydrogen 3.246 N/A PHE 44.A N PHE 40.A O no hydrogen 2.688 N/A ILE 45.A N ILE 41.A O no hydrogen 3.232 N/A ALA 46.A N ILE 42.A O no hydrogen 2.730 N/A VAL 50.A N VAL 59.A O no hydrogen 2.973 N/A ASP 51.A N TYR 99.A O no hydrogen 3.124 N/A ARG 56.A N ASP 51.A OD1 no hydrogen 3.116 N/A ARG 56.A N ASP 51.A OD2 no hydrogen 2.974 N/A VAL 59.A N VAL 50.A O no hydrogen 2.596 N/A SER 62.A OG ALA 43.A O no hydrogen 3.350 N/A SER 62.A OG ALA 47.A O no hydrogen 2.434 N/A LEU 63.A N PHE 44.A O no hydrogen 3.155 N/A LEU 64.A N ILE 45.A O no hydrogen 2.996 N/A TYR 65.A N SER 62.A O no hydrogen 3.105 N/A ASN 67.A ND2 SER 62.A O no hydrogen 3.133 N/A ASN 68.A N THR 71.A OG1 no hydrogen 3.398 N/A THR 71.A N ASN 68.A OD1 no hydrogen 3.397 N/A THR 71.A OG1 ASN 67.A OD1 no hydrogen 3.135 N/A THR 71.A OG1 ASN 68.A OD1 no hydrogen 2.374 N/A GLY 72.A N ASN 68.A O no hydrogen 2.823 N/A ALA 73.A N GLY 61.A O no hydrogen 2.860 N/A VAL 74.A N LEU 166.A O no hydrogen 2.974 N/A THR 77.A OG1 GLY 101.A O no hydrogen 3.137 N/A SER 78.A N ASN 100.A O no hydrogen 2.935 N/A SER 78.A OG ASP 51.A O no hydrogen 3.314 N/A ALA 80.A N SER 78.A OG no hydrogen 3.204 N/A GLY 82.A N SER 78.A O no hydrogen 3.360 N/A HIS 84.A N ILE 81.A O no hydrogen 3.290 N/A TYR 86.A OH GLU 96.A O no hydrogen 3.220 N/A ALA 91.A N ILE 88.A O no hydrogen 3.144 N/A GLU 96.A N SER 93.A OG no hydrogen 3.075 N/A TRP 97.A N SER 93.A O no hydrogen 3.453 N/A LEU 98.A N LEU 94.A O no hydrogen 3.054 N/A TYR 99.A N ASP 95.A O no hydrogen 2.817 N/A ASN 100.A N GLU 96.A O no hydrogen 3.140 N/A ASN 100.A ND2 TYR 86.A OH no hydrogen 3.371 N/A GLY 102.A N TRP 97.A O no hydrogen 2.883 N/A TYR 104.A N GLY 101.A O no hydrogen 3.257 N/A TYR 104.A OH MET 164.A O no hydrogen 2.684 N/A GLN 105.A NE2 HIS 84.A O no hydrogen 3.172 N/A LEU 106.A N GLY 102.A O no hydrogen 3.398 N/A ILE 107.A N PRO 103.A O no hydrogen 3.038 N/A VAL 108.A N TYR 104.A O no hydrogen 2.896 N/A CYS 109.A N GLN 105.A O no hydrogen 3.137 N/A CYS 109.A SG GLN 105.A O no hydrogen 3.207 N/A HIS 110.A N LEU 106.A O no hydrogen 3.381 N/A HIS 110.A ND1 LEU 106.A O no hydrogen 2.569 N/A PHE 111.A N ILE 107.A O no hydrogen 2.659 N/A LEU 112.A N VAL 108.A O no hydrogen 3.053 N/A LEU 113.A N CYS 109.A O no hydrogen 3.309 N/A GLY 114.A N PHE 111.A O no hydrogen 3.164 N/A VAL 115.A N PHE 111.A O no hydrogen 2.864 N/A TYR 116.A N LEU 112.A O no hydrogen 3.108 N/A TYR 116.A OH SER 147.A OG no hydrogen 2.549 N/A CYS 117.A SG LEU 113.A O no hydrogen 3.389 N/A TYR 118.A N GLY 114.A O no hydrogen 2.790 N/A MET 119.A N VAL 115.A O no hydrogen 3.182 N/A GLY 120.A N TYR 116.A O no hydrogen 3.232 N/A ARG 121.A N CYS 117.A O no hydrogen 3.109 N/A ARG 121.A NE TYR 21.A O no hydrogen 3.226 N/A ARG 121.A NH2 TYR 21.A O no hydrogen 2.454 N/A GLU 122.A N TYR 118.A O no hydrogen 3.137 N/A TRP 123.A N MET 119.A O no hydrogen 3.438 N/A GLU 124.A N GLY 120.A O no hydrogen 3.158 N/A LEU 125.A N ARG 121.A O no hydrogen 3.005 N/A SER 126.A OG GLU 122.A O no hydrogen 3.498 N/A SER 126.A OG TRP 123.A O no hydrogen 2.307 N/A PHE 127.A N TRP 123.A O no hydrogen 3.001 N/A ARG 128.A N GLU 124.A O no hydrogen 2.885 N/A LEU 129.A N LEU 125.A O no hydrogen 2.779 N/A MET 131.A N SER 126.A O no hydrogen 2.653 N/A ALA 138.A N TRP 134.A O no hydrogen 3.423 N/A TYR 139.A N ILE 135.A O no hydrogen 2.978 N/A SER 140.A N VAL 137.A O no hydrogen 3.342 N/A SER 140.A OG VAL 137.A O no hydrogen 2.365 N/A ALA 141.A N ALA 138.A O no hydrogen 3.436 N/A VAL 143.A N TYR 139.A O no hydrogen 3.211 N/A ALA 144.A N SER 140.A O no hydrogen 2.884 N/A ALA 145.A N ALA 141.A O no hydrogen 3.238 N/A ALA 146.A N PRO 142.A O no hydrogen 2.998 N/A SER 147.A N VAL 143.A O no hydrogen 2.750 N/A SER 147.A OG TYR 116.A OH no hydrogen 2.549 N/A SER 147.A OG VAL 143.A O no hydrogen 2.775 N/A ALA 148.A N ALA 144.A O no hydrogen 2.855 N/A VAL 149.A N ALA 145.A O no hydrogen 3.308 N/A PHE 150.A N ALA 146.A O no hydrogen 3.274 N/A LEU 151.A N SER 147.A O no hydrogen 3.125 N/A VAL 152.A N SER 147.A O no hydrogen 2.995 N/A TYR 153.A N ALA 148.A O no hydrogen 2.878 N/A TYR 153.A OH HIS 182.A NE2 no hydrogen 2.636 N/A ILE 155.A N LEU 151.A O no hydrogen 2.948 N/A GLY 156.A N VAL 152.A O no hydrogen 2.847 N/A GLN 157.A N TYR 153.A O no hydrogen 3.087 N/A GLN 157.A NE2 ALA 286.A O no hydrogen 2.866 N/A GLN 157.A NE2 ASN 288.A OD1 no hydrogen 2.559 N/A GLY 158.A N PRO 154.A O no hydrogen 2.752 N/A SER 159.A OG ASN 79.A OD1 no hydrogen 3.484 N/A SER 159.A OG SER 161.A OG no hydrogen 2.675 N/A PHE 160.A N GLY 82.A O no hydrogen 3.237 N/A SER 161.A N SER 159.A OG no hydrogen 2.930 N/A SER 161.A OG SER 159.A OG no hydrogen 2.675 N/A ASP 162.A N SER 159.A O no hydrogen 3.291 N/A GLY 163.A N PHE 160.A O no hydrogen 3.054 N/A MET 164.A N VAL 149.A O no hydrogen 3.340 N/A LEU 166.A N VAL 74.A O no hydrogen 3.091 N/A SER 169.A N ILE 70.A O no hydrogen 2.829 N/A SER 169.A OG ILE 70.A O no hydrogen 3.039 N/A THR 171.A N GLY 167.A O no hydrogen 3.062 N/A THR 171.A OG1 GLY 167.A O no hydrogen 2.612 N/A PHE 172.A N ILE 168.A O no hydrogen 3.327 N/A ASN 173.A N SER 169.A O no hydrogen 3.212 N/A PHE 174.A N GLY 170.A O no hydrogen 3.114 N/A MET 175.A N THR 171.A O no hydrogen 2.946 N/A ILE 176.A N PHE 172.A O no hydrogen 3.088 N/A VAL 177.A N ASN 173.A O no hydrogen 3.036 N/A PHE 178.A N PHE 174.A O no hydrogen 3.240 N/A GLN 179.A N MET 175.A O no hydrogen 3.127 N/A GLN 179.A NE2 ASN 317.A OD1 no hydrogen 2.385 N/A ALA 180.A N VAL 177.A O no hydrogen 3.287 N/A GLU 181.A N VAL 177.A O no hydrogen 3.223 N/A HIS 182.A N PHE 178.A O no hydrogen 2.870 N/A HIS 182.A ND1 ASN 290.A OD1 no hydrogen 2.796 N/A HIS 182.A NE2 TYR 153.A OH no hydrogen 2.636 N/A ASN 183.A N GLN 179.A O no hydrogen 3.185 N/A MET 186.A N ASN 183.A O no hydrogen 3.265 N/A HIS 187.A N ILE 184.A O no hydrogen 3.129 N/A MET 191.A N HIS 187.A O no hydrogen 3.105 N/A LEU 192.A N PRO 188.A O no hydrogen 2.794 N/A GLY 193.A N PHE 189.A O no hydrogen 3.029 N/A VAL 194.A N HIS 190.A O no hydrogen 2.893 N/A ALA 195.A N MET 191.A O no hydrogen 3.050 N/A GLY 196.A N LEU 192.A O no hydrogen 2.913 N/A GLY 196.A N GLY 193.A O no hydrogen 3.211 N/A VAL 197.A N GLY 193.A O no hydrogen 3.135 N/A VAL 197.A N VAL 194.A O no hydrogen 3.203 N/A PHE 198.A N VAL 194.A O no hydrogen 2.701 N/A GLY 199.A N ALA 195.A O no hydrogen 2.878 N/A GLY 200.A N GLY 196.A O no hydrogen 2.902 N/A SER 201.A N VAL 197.A O no hydrogen 3.106 N/A SER 201.A OG VAL 197.A O no hydrogen 2.755 N/A LEU 202.A N PHE 198.A O no hydrogen 2.889 N/A PHE 203.A N GLY 199.A O no hydrogen 2.680 N/A SER 204.A N GLY 200.A O no hydrogen 3.318 N/A ALA 205.A N SER 201.A O no hydrogen 3.202 N/A MET 206.A N LEU 202.A O no hydrogen 2.675 N/A HIS 207.A N PHE 203.A O no hydrogen 2.901 N/A GLY 208.A N SER 204.A O no hydrogen 2.970 N/A SER 209.A N ALA 205.A O no hydrogen 3.097 N/A SER 209.A N MET 206.A O no hydrogen 3.222 N/A SER 209.A OG ALA 205.A O no hydrogen 3.003 N/A SER 209.A OG MET 206.A O no hydrogen 3.129 N/A LEU 210.A N MET 206.A O no hydrogen 3.070 N/A VAL 211.A N HIS 207.A O no hydrogen 3.436 N/A THR 212.A OG1 GLY 208.A O no hydrogen 2.684 N/A SER 213.A N SER 209.A O no hydrogen 2.725 N/A SER 213.A OG SER 209.A O no hydrogen 2.952 N/A SER 213.A OG LEU 210.A O no hydrogen 3.255 N/A SER 214.A N VAL 211.A O no hydrogen 3.189 N/A SER 214.A OG LEU 210.A O no hydrogen 2.814 N/A ILE 216.A N THR 237.A O no hydrogen 3.305 N/A THR 219.A OG1 SER 224.A O no hydrogen 3.374 N/A THR 220.A N GLU 223.A OE2 no hydrogen 3.288 N/A THR 220.A OG1 ASN 222.A OD1 no hydrogen 2.540 N/A THR 220.A OG1 GLU 223.A OE2 no hydrogen 3.335 N/A ASN 226.A N SER 224.A OG no hydrogen 3.186 N/A GLU 227.A N SER 224.A O no hydrogen 3.344 N/A GLY 228.A N ALA 225.A O no hydrogen 3.037 N/A GLN 233.A N ARG 230.A O no hydrogen 3.128 N/A ASN 239.A N SER 214.A O no hydrogen 3.036 N/A ALA 243.A N ASN 239.A O no hydrogen 3.034 N/A HIS 244.A N ILE 240.A O no hydrogen 2.731 N/A HIS 244.A ND1 SER 256.A OG no hydrogen 2.867 N/A GLY 245.A N VAL 241.A O no hydrogen 2.689 N/A TYR 246.A N ALA 243.A O no hydrogen 3.259 N/A PHE 247.A N ALA 243.A O no hydrogen 3.261 N/A GLY 248.A N HIS 244.A O no hydrogen 2.994 N/A ILE 251.A N PHE 247.A O no hydrogen 3.511 N/A SER 256.A OG HIS 244.A ND1 no hydrogen 2.867 N/A ARG 261.A N ASN 259.A OD1 no hydrogen 3.210 N/A LEU 263.A N ASN 259.A O no hydrogen 2.713 N/A HIS 264.A N SER 260.A O no hydrogen 3.099 N/A HIS 264.A ND1 SER 260.A O no hydrogen 2.463 N/A PHE 265.A N ARG 261.A O no hydrogen 3.225 N/A PHE 266.A N SER 262.A O no hydrogen 3.315 N/A LEU 267.A N LEU 263.A O no hydrogen 2.882 N/A ALA 268.A N HIS 264.A O no hydrogen 3.159 N/A ALA 268.A N PHE 265.A O no hydrogen 3.051 N/A ALA 269.A N PHE 265.A O no hydrogen 2.743 N/A TRP 270.A N PHE 266.A O no hydrogen 3.120 N/A TRP 270.A NE1 ALA 195.A O no hydrogen 2.544 N/A VAL 272.A N ALA 268.A O no hydrogen 3.441 N/A ILE 273.A N ALA 269.A O no hydrogen 3.234 N/A GLY 274.A N TRP 270.A O no hydrogen 3.343 N/A ILE 275.A N PRO 271.A O no hydrogen 2.817 N/A TRP 276.A N VAL 272.A O no hydrogen 2.907 N/A TRP 276.A NE1 SER 140.A OG no hydrogen 3.277 N/A PHE 277.A N ILE 273.A O no hydrogen 3.095 N/A PHE 277.A N GLY 274.A O no hydrogen 3.268 N/A THR 278.A N GLY 274.A O no hydrogen 3.196 N/A ALA 279.A N ILE 275.A O no hydrogen 2.900 N/A LEU 280.A N TRP 276.A O no hydrogen 3.261 N/A GLY 281.A N PHE 277.A O no hydrogen 2.560 N/A LEU 282.A N THR 278.A O no hydrogen 3.187 N/A SER 283.A N ALA 279.A O no hydrogen 3.245 N/A SER 283.A OG ALA 279.A O no hydrogen 2.805 N/A THR 284.A N LEU 280.A O no hydrogen 2.617 N/A THR 284.A OG1 LEU 280.A O no hydrogen 3.176 N/A THR 284.A OG1 GLY 281.A O no hydrogen 2.920 N/A MET 285.A N GLY 281.A O no hydrogen 2.991 N/A ALA 286.A N LEU 282.A O no hydrogen 2.992 N/A PHE 287.A N THR 284.A O no hydrogen 3.212 N/A ASN 288.A N MET 285.A O no hydrogen 3.005 N/A LEU 289.A N THR 284.A O no hydrogen 3.038 N/A GLY 291.A N HIS 182.A O no hydrogen 2.612 N/A PHE 292.A N MET 186.A O no hydrogen 3.039 N/A GLN 296.A N ASP 311.A OD1 no hydrogen 3.106 N/A ASP 300.A N ARG 304.A O no hydrogen 3.013 N/A ARG 304.A N ASP 300.A OD1 no hydrogen 3.209 N/A LEU 306.A N VAL 298.A O no hydrogen 2.978 N/A THR 308.A N ASP 311.A OD2 no hydrogen 3.314 N/A ILE 312.A N TRP 309.A O no hydrogen 3.184 N/A ILE 313.A N TRP 309.A O no hydrogen 3.011 N/A ASN 314.A N ALA 310.A O no hydrogen 2.965 N/A ARG 315.A N ASP 311.A O no hydrogen 3.279 N/A ALA 316.A N ILE 312.A O no hydrogen 3.099 N/A ASN 317.A N ILE 313.A O no hydrogen 2.559 N/A LEU 318.A N ASN 314.A O no hydrogen 2.730 N/A MET 320.A N ASN 317.A O no hydrogen 3.217 N/A GLU 321.A N ASN 317.A O no hydrogen 3.243 N/A MET 323.A N MET 320.A O no hydrogen 3.013 N/A HIS 324.A N MET 320.A O no hydrogen 2.714 N/A HIS 324.A ND1 GLU 321.A O no hydrogen 3.079 N/A ALA 328.A N GLU 325.A O no hydrogen 2.962 N/A LEU 335.A N LEU 333.A O no hydrogen 2.866 N/A