Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7skr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 5.A N VAL 21.A O no hydrogen 3.157 N/A VAL 7.A N GLN 19.A O no hydrogen 2.859 N/A PHE 8.A N LYS 53.A O no hydrogen 3.201 N/A THR 9.A N HIS 17.A O no hydrogen 3.141 N/A THR 10.A N PHE 55.A O no hydrogen 2.873 N/A THR 10.A OG1 ASN 15.A O no hydrogen 2.966 N/A ASP 12.A N THR 10.A OG1 no hydrogen 3.182 N/A ASN 13.A N THR 10.A OG1 no hydrogen 2.928 N/A THR 14.A N ASP 12.A OD2 no hydrogen 2.703 N/A THR 14.A OG1 ASP 12.A O no hydrogen 3.511 N/A ASN 15.A N ASP 12.A OD2 no hydrogen 2.574 N/A ASN 15.A ND2 ASP 12.A OD1 no hydrogen 3.090 N/A HIS 17.A N THR 9.A O no hydrogen 3.073 N/A GLN 19.A N VAL 7.A O no hydrogen 2.851 N/A GLN 19.A NE2 THR 9.A OG1 no hydrogen 3.312 N/A VAL 21.A N ILE 5.A O no hydrogen 3.018 N/A ASP 22.A N HIS 30.A NE2 no hydrogen 3.255 N/A MET 23.A N LYS 3.A O no hydrogen 3.436 N/A SER 24.A N ASP 22.A OD1 no hydrogen 3.002 N/A MET 25.A N ASP 22.A O no hydrogen 3.224 N/A THR 26.A N GLN 29.A OE1 no hydrogen 3.174 N/A THR 26.A OG1 THR 42.A O no hydrogen 3.090 N/A TYR 27.A N VAL 44.A O no hydrogen 3.080 N/A TYR 27.A OH HIS 50.A ND1 no hydrogen 2.657 N/A GLY 28.A N THR 42.A O no hydrogen 2.821 N/A GLN 29.A N THR 26.A OG1 no hydrogen 3.236 N/A HIS 30.A N TYR 27.A O no hydrogen 3.072 N/A HIS 30.A ND1 THR 26.A O no hydrogen 3.035 N/A PHE 31.A N TYR 27.A O no hydrogen 2.867 N/A GLY 32.A N GLY 28.A O no hydrogen 2.978 N/A THR 34.A N THR 42.A OG1 no hydrogen 3.308 N/A THR 34.A OG1 GLY 32.A O no hydrogen 2.944 N/A TYR 35.A N PHE 56.A O no hydrogen 2.859 N/A LEU 36.A N ALA 39.A O no hydrogen 2.920 N/A GLY 38.A N SER 85.A OG no hydrogen 2.868 N/A ALA 39.A N LEU 36.A O no hydrogen 3.084 N/A VAL 41.A N THR 34.A O no hydrogen 3.008 N/A THR 42.A N ASP 40.A OD1 no hydrogen 3.165 N/A THR 42.A OG1 THR 34.A O no hydrogen 3.513 N/A THR 42.A OG1 ASP 40.A OD1 no hydrogen 2.453 N/A VAL 44.A N VAL 41.A O no hydrogen 3.332 N/A HIS 47.A N HIS 50.A ND1 no hydrogen 3.211 N/A HIS 50.A N HIS 47.A O no hydrogen 2.721 N/A GLY 52.A N LYS 6.A O no hydrogen 3.084 N/A LYS 53.A N HIS 50.A O no hydrogen 3.217 N/A PHE 55.A N PHE 8.A O no hydrogen 2.659 N/A PHE 56.A N TYR 35.A O no hydrogen 2.977 N/A VAL 57.A N THR 10.A O no hydrogen 2.884 N/A LEU 58.A N PRO 33.A O no hydrogen 3.234 N/A THR 63.A N ASP 61.A OD1 no hydrogen 3.362 N/A THR 63.A OG1 ASP 61.A OD1 no hydrogen 3.248 N/A THR 63.A OG1 ASP 61.A OD2 no hydrogen 3.134 N/A LEU 64.A N ASP 61.A O no hydrogen 3.340 N/A ARG 65.A N ASP 62.A O no hydrogen 3.324 N/A ARG 65.A NH2.A GLU 77.A OE2 no hydrogen 3.511 N/A ARG 65.A NH2.B GLU 77.A OE2 no hydrogen 2.966 N/A ALA 68.A N LEU 64.A O no hydrogen 2.921 N/A PHE 69.A N ARG 65.A O no hydrogen 3.084 N/A GLU 70.A N SER 66.A O no hydrogen 3.268 N/A GLU 70.A N GLU 67.A O no hydrogen 2.783 N/A TYR 71.A N GLU 67.A O no hydrogen 3.189 N/A TYR 71.A OH GLU 67.A OE1 no hydrogen 3.102 N/A TYR 72.A N ALA 68.A O no hydrogen 3.059 N/A HIS 73.A N PHE 69.A O no hydrogen 3.059 N/A ASP 76.A N THR 74.A OG1 no hydrogen 3.308 N/A SER 78.A N ASP 76.A OD1 no hydrogen 3.011 N/A SER 78.A OG ASP 76.A OD1 no hydrogen 3.072 N/A SER 78.A OG ASP 76.A OD2 no hydrogen 2.983 N/A PHE 79.A N ASP 76.A O no hydrogen 3.136 N/A ARG 82.A N SER 78.A O no hydrogen 3.090 N/A ARG 82.A NH2 ASP 76.A OD2 no hydrogen 2.872 N/A ARG 82.A NH2 SER 78.A OG no hydrogen 3.100 N/A TYR 83.A N PHE 79.A O no hydrogen 2.863 N/A MET 84.A N LEU 80.A O no hydrogen 3.013 N/A SER 85.A N GLY 81.A O no hydrogen 3.107 N/A SER 85.A OG GLY 81.A O no hydrogen 3.207 N/A SER 85.A OG ARG 82.A O no hydrogen 3.408 N/A ALA 86.A N ARG 82.A O no hydrogen 3.067 N/A LEU 87.A N TYR 83.A O no hydrogen 2.897 N/A ASN 88.A N MET 84.A O no hydrogen 2.996 N/A HIS 89.A N ALA 86.A O no hydrogen 3.051 N/A HIS 89.A NE2 ASP 37.A OD2 no hydrogen 2.781 N/A THR 90.A N ALA 86.A O no hydrogen 3.117 N/A THR 90.A OG1 LEU 87.A O no hydrogen 3.486 N/A THR 90.A OG1 ALA 144.A O no hydrogen 2.889 N/A LYS 91.A N LEU 87.A O no hydrogen 3.126 N/A LYS 91.A NZ ASN 88.A OD1 no hydrogen 3.504 N/A LYS 92.A N HIS 89.A O no hydrogen 3.370 N/A TRP 93.A N THR 90.A O no hydrogen 3.053 N/A VAL 98.A N LEU 101.A O no hydrogen 2.715 N/A LEU 101.A N VAL 98.A O no hydrogen 2.922 N/A THR 102.A N GLN 120.A OE1 no hydrogen 3.007 N/A THR 102.A OG1 ALA 138.A O no hydrogen 3.501 N/A SER 103.A N PRO 96.A O no hydrogen 2.989 N/A SER 103.A OG SER 113.A OG no hydrogen 3.240 N/A SER 103.A OG GLY 286.A O no hydrogen 2.594 N/A ILE 104.A N SER 103.A OG no hydrogen 2.650 N/A LYS 105.A N LYS 94.A O no hydrogen 2.830 N/A TRP 106.A NE1 ASP 285.A OD1 no hydrogen 3.056 N/A ASN 109.A ND2 GLY 159.A O no hydrogen 2.789 N/A ASN 110.A ND2 LYS 105.A O no hydrogen 2.866 N/A SER 113.A N ASN 110.A O no hydrogen 2.797 N/A SER 113.A OG SER 103.A OG no hydrogen 3.240 N/A VAL 115.A N TYR 111.A O no hydrogen 3.141 N/A LEU 116.A N LEU 112.A O no hydrogen 2.939 N/A LEU 117.A N SER 113.A O no hydrogen 2.932 N/A ALA 118.A N SER 114.A O no hydrogen 3.227 N/A LEU 119.A N VAL 115.A O no hydrogen 3.150 N/A GLN 121.A N ALA 118.A O no hydrogen 3.060 N/A GLN 121.A NE2 LEU 117.A O no hydrogen 2.984 N/A LYS 125.A NZ PHE 126.A O no hydrogen 3.337 N/A PHE 126.A N GLN 132.A OE1 no hydrogen 2.699 N/A ASN 127.A N HIS 174.A O no hydrogen 2.776 N/A ALA 130.A N TYR 71.A O no hydrogen 3.075 N/A GLN 132.A N ALA 128.A O no hydrogen 3.033 N/A GLU 133.A N PRO 129.A O no hydrogen 2.949 N/A ALA 134.A N ALA 130.A O no hydrogen 3.172 N/A TYR 135.A N LEU 131.A O no hydrogen 3.047 N/A TYR 135.A OH LEU 119.A O no hydrogen 2.368 N/A TYR 136.A N GLN 132.A O no hydrogen 2.844 N/A ARG 137.A N GLU 133.A O no hydrogen 3.017 N/A ARG 137.A NE GLU 133.A OE1 no hydrogen 3.014 N/A ARG 137.A NE GLU 133.A OE2 no hydrogen 3.405 N/A ARG 137.A NH1 GLU 133.A OE2 no hydrogen 3.165 N/A ARG 137.A NH2 ASN 145.A OD1 no hydrogen 3.091 N/A ALA 138.A N ALA 134.A O no hydrogen 2.836 N/A ARG 139.A N TYR 135.A O no hydrogen 3.152 N/A ALA 140.A N ARG 137.A O no hydrogen 3.086 N/A GLY 141.A N ALA 138.A O no hydrogen 3.115 N/A ASP 142.A N ARG 137.A O no hydrogen 2.931 N/A ASN 145.A ND2 TYR 83.A OH no hydrogen 3.464 N/A CYS 147.A N ALA 143.A O no hydrogen 3.057 N/A CYS 147.A SG ALA 143.A O no hydrogen 3.119 N/A ALA 148.A N ALA 144.A O no hydrogen 3.310 N/A LEU 149.A N ASN 145.A O no hydrogen 3.051 N/A ILE 150.A N PHE 146.A O no hydrogen 2.962 N/A LEU 151.A N CYS 147.A O no hydrogen 2.972 N/A ALA 152.A N ALA 148.A O no hydrogen 3.095 N/A TYR 153.A N LEU 149.A O no hydrogen 2.801 N/A TYR 153.A OH TYR 72.A O no hydrogen 2.910 N/A SER 154.A N ILE 150.A O no hydrogen 3.150 N/A SER 154.A OG ILE 150.A O no hydrogen 2.800 N/A ASN 155.A N ALA 152.A O no hydrogen 3.226 N/A LYS 156.A N LEU 151.A O no hydrogen 3.101 N/A LYS 156.A NZ GLU 160.A OE1 no hydrogen 3.446 N/A VAL 158.A N ASP 37.A O no hydrogen 2.925 N/A GLU 160.A N THR 157.A O no hydrogen 3.344 N/A THR 167.A N ASP 163.A O no hydrogen 3.006 N/A THR 167.A OG1 ASP 163.A O no hydrogen 2.765 N/A MET 168.A N VAL 164.A O no hydrogen 3.048 N/A THR 169.A N ARG 165.A O no hydrogen 3.098 N/A THR 169.A OG1 GLU 166.A O no hydrogen 2.405 N/A THR 169.A OG1 HIS 170.A ND1 no hydrogen 2.965 N/A HIS 170.A N GLU 166.A O no hydrogen 3.256 N/A HIS 170.A ND1 GLU 166.A O no hydrogen 2.523 N/A LEU 171.A N THR 167.A O no hydrogen 2.977 N/A LEU 172.A N MET 168.A O no hydrogen 2.817 N/A HIS 174.A N LEU 171.A O no hydrogen 3.133 N/A ALA 175.A N LEU 172.A O no hydrogen 3.084 N/A ASN 176.A N LYS 125.A O no hydrogen 2.853 N/A ASN 176.A ND2 ASN 127.A OD1 no hydrogen 2.647 N/A ALA 180.A N LEU 177.A O no hydrogen 3.271 N/A LYS 181.A N GLU 237.A O no hydrogen 3.056 N/A ARG 182.A N LEU 198.A O no hydrogen 2.750 N/A ARG 182.A NE GLN 236.A OE1 no hydrogen 2.639 N/A ARG 182.A NH2 GLN 236.A OE1 no hydrogen 3.070 N/A VAL 183.A N GLN 235.A O no hydrogen 2.781 N/A LEU 184.A N THR 196.A O no hydrogen 2.974 N/A ASN 185.A N TYR 232.A O no hydrogen 3.205 N/A ASN 185.A ND2 GLN 193.A OE1 no hydrogen 2.741 N/A ASN 185.A ND2 TYR 232.A OH no hydrogen 2.696 N/A LEU 186.A N LYS 194.A O no hydrogen 2.719 N/A VAL 187.A N THR 230.A O no hydrogen 2.710 N/A CYS 188.A N GLY 192.A O no hydrogen 3.105 N/A GLY 192.A N CYS 188.A O no hydrogen 2.947 N/A THR 196.A N LEU 184.A O no hydrogen 2.983 N/A LEU 198.A N ARG 182.A O no hydrogen 2.683 N/A GLY 200.A N ALA 180.A O no hydrogen 3.442 N/A ALA 203.A N GLY 200.A O no hydrogen 3.252 N/A TYR 206.A N MET 242.A O no hydrogen 3.210 N/A GLY 208.A N SER 244.A O no hydrogen 2.841 N/A THR 209.A OG1 GLU 214.A OE1 no hydrogen 2.988 N/A TYR 212.A OH GLU 306.A OE1 no hydrogen 2.668 N/A GLU 214.A N SER 211.A OG no hydrogen 2.992 N/A LYS 216.A N TYR 212.A O no hydrogen 3.295 N/A ALA 217.A N ASP 213.A O no hydrogen 2.986 N/A GLY 218.A N GLU 214.A O no hydrogen 2.843 N/A VAL 219.A N GLN 231.A O no hydrogen 3.094 N/A SER 220.A OG ALA 229.A O no hydrogen 3.509 N/A ILE 221.A N ALA 229.A O no hydrogen 3.145 N/A CYS 223.A N ARG 227.A O no hydrogen 2.778 N/A GLY 226.A N CYS 223.A O no hydrogen 3.097 N/A ALA 229.A N ILE 221.A O no hydrogen 2.724 N/A THR 230.A N VAL 187.A O no hydrogen 3.165 N/A GLN 231.A N VAL 219.A O no hydrogen 3.136 N/A GLN 231.A NE2 TYR 206.A OH no hydrogen 2.954 N/A TYR 232.A N ASN 185.A O no hydrogen 3.358 N/A LEU 233.A N LEU 215.A O no hydrogen 2.899 N/A VAL 234.A N VAL 183.A O no hydrogen 2.852 N/A GLN 235.A N VAL 183.A O no hydrogen 3.378 N/A GLN 236.A N TYR 309.A O no hydrogen 3.022 N/A GLN 236.A NE2 ALA 203.A O no hydrogen 2.786 N/A GLN 236.A NE2 SER 238.A OG no hydrogen 2.712 N/A GLU 237.A N LYS 181.A O no hydrogen 2.874 N/A SER 238.A OG PHE 240.A O no hydrogen 2.941 N/A SER 239.A OG GLU 123.A O no hydrogen 2.750 N/A VAL 241.A N TYR 304.A O no hydrogen 3.081 N/A MET 242.A N VAL 204.A O no hydrogen 2.729 N/A MET 243.A N VAL 302.A O no hydrogen 2.854 N/A SER 244.A N TYR 206.A O no hydrogen 2.982 N/A SER 244.A OG ASP 301.A OD1 no hydrogen 2.643 N/A ALA 245.A N THR 300.A O no hydrogen 3.033 N/A TYR 250.A N GLY 297.A O no hydrogen 2.897 N/A LYS 251.A NZ GLU 294.A OE2 no hydrogen 3.011 N/A LEU 252.A N TYR 295.A O no hydrogen 2.856 N/A GLN 254.A NE2 SER 293.A O no hydrogen 3.217 N/A THR 256.A OG1 GLN 253.A O no hydrogen 3.109 N/A LEU 258.A N PHE 303.A O no hydrogen 2.827 N/A ALA 260.A N ILE 275.A O no hydrogen 2.758 N/A ASN 261.A N ASP 301.A O no hydrogen 2.743 N/A GLU 262.A N THR 273.A O no hydrogen 3.081 N/A TYR 263.A N PRO 298.A O no hydrogen 2.877 N/A TYR 263.A OH ASN 266.A O no hydrogen 2.857 N/A THR 264.A N HIS 271.A O no hydrogen 3.307 N/A CYS 269.A N ASN 266.A OD1 no hydrogen 2.637 N/A HIS 271.A N THR 264.A O no hydrogen 3.138 N/A HIS 271.A NE2 ASP 285.A OD1 no hydrogen 2.706 N/A THR 273.A N GLU 262.A O no hydrogen 3.208 N/A THR 273.A OG1 GLU 262.A OE2 no hydrogen 2.528 N/A HIS 274.A N ILE 284.A O no hydrogen 3.256 N/A HIS 274.A ND1 ASN 261.A OD1 no hydrogen 3.170 N/A ILE 275.A N ALA 260.A O no hydrogen 2.934 N/A THR 276.A N TYR 282.A O no hydrogen 2.966 N/A THR 276.A OG1 GLN 121.A OE1 no hydrogen 2.824 N/A LYS 278.A N THR 280.A O no hydrogen 3.103 N/A GLU 279.A N GLU 279.A OE1 no hydrogen 2.809 N/A THR 280.A OG1 MET 292.A O no hydrogen 2.411 N/A LEU 281.A N MET 292.A O no hydrogen 2.818 N/A TYR 282.A N THR 276.A O no hydrogen 2.743 N/A TYR 282.A OH GLU 279.A OE1 no hydrogen 2.606 N/A TYR 282.A OH GLU 279.A OE2 no hydrogen 2.711 N/A ARG 283.A N THR 290.A O no hydrogen 2.840 N/A ARG 283.A NE THR 273.A OG1 no hydrogen 3.058 N/A ARG 283.A NH2 GLU 262.A OE2 no hydrogen 2.871 N/A ILE 284.A N HIS 274.A O no hydrogen 2.682 N/A ASP 285.A N HIS 288.A O no hydrogen 2.811 N/A HIS 288.A N ASP 285.A O no hydrogen 3.179 N/A THR 290.A N ARG 283.A O no hydrogen 2.879 N/A LYS 291.A NZ GLU 279.A OE2 no hydrogen 3.044 N/A LYS 291.A NZ TYR 282.A OH no hydrogen 3.255 N/A MET 292.A N LEU 281.A O no hydrogen 2.775 N/A GLY 297.A N TYR 250.A O no hydrogen 3.286 N/A VAL 299.A N GLY 297.A O no hydrogen 2.871 N/A THR 300.A N ASN 261.A O no hydrogen 2.787 N/A ASP 301.A N ASN 261.A O no hydrogen 3.322 N/A VAL 302.A N MET 243.A O no hydrogen 2.868 N/A PHE 303.A N CYS 259.A O no hydrogen 2.740 N/A TYR 304.A N VAL 241.A O no hydrogen 3.020 N/A TYR 304.A OH LEU 210.A O no hydrogen 2.667 N/A GLU 306.A N SER 239.A O no hydrogen 3.322 N/A THR 307.A N GLU 306.A OE2 no hydrogen 3.092 N/A TYR 309.A N GLN 236.A O no hydrogen 2.663 N/A THR 311.A N VAL 234.A O no hydrogen 2.848 N/A