Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1xsm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 6.A N SER 3.A O no hydrogen 2.830 N/A GLU 7.A N VAL 4.A O no hydrogen 2.847 N/A LEU 10.A N GLU 7.A O no hydrogen 2.989 N/A ARG 11.A N GLU 7.A O no hydrogen 2.425 N/A ARG 16.A NH1 GLU 94.A OE1 no hydrogen 3.131 N/A ARG 16.A NH2 GLU 94.A OE2 no hydrogen 3.379 N/A GLU 23.A N GLU 94.A OE2 no hydrogen 2.847 N/A TYR 24.A N GLU 94.A OE2 no hydrogen 2.965 N/A ILE 27.A N ASP 26.A OD1 no hydrogen 2.869 N/A TRP 28.A N TYR 24.A O no hydrogen 3.082 N/A GLN 29.A N HIS 25.A O no hydrogen 3.137 N/A MET 30.A N ILE 27.A O no hydrogen 2.852 N/A TYR 31.A N ILE 27.A O no hydrogen 3.197 N/A LYS 32.A N TRP 28.A O no hydrogen 2.932 N/A LYS 32.A NZ GLU 35.A OE1 no hydrogen 2.904 N/A LYS 33.A N GLN 29.A O no hydrogen 3.066 N/A ALA 34.A N MET 30.A O no hydrogen 2.943 N/A GLU 35.A N TYR 31.A O no hydrogen 2.824 N/A ALA 36.A N LYS 32.A O no hydrogen 3.136 N/A SER 37.A N ALA 34.A O no hydrogen 2.732 N/A SER 37.A OG LYS 33.A O no hydrogen 2.757 N/A SER 37.A OG ALA 34.A O no hydrogen 3.451 N/A TRP 39.A NE1 ASP 202.A OD2 no hydrogen 2.917 N/A GLU 43.A N THR 40.A O no hydrogen 2.931 N/A VAL 44.A N ALA 41.A O no hydrogen 3.310 N/A SER 47.A N ASP 45.A OD1 no hydrogen 2.720 N/A SER 47.A OG ASP 45.A OD1 no hydrogen 2.683 N/A GLN 51.A N LYS 48.A O no hydrogen 2.830 N/A TRP 53.A N ASP 49.A O no hydrogen 2.780 N/A GLU 54.A N ILE 50.A O no hydrogen 3.195 N/A ALA 55.A N GLN 51.A O no hydrogen 3.046 N/A LYS 57.A N GLU 60.A OE1 no hydrogen 3.324 N/A ARG 61.A N LYS 57.A O no hydrogen 2.983 N/A ARG 61.A NE TRP 53.A O no hydrogen 2.586 N/A ARG 61.A NH2 TRP 53.A O no hydrogen 3.373 N/A ARG 61.A NH2 GLU 54.A O no hydrogen 2.643 N/A HIS 62.A N PRO 58.A O no hydrogen 2.932 N/A PHE 63.A N ASP 59.A O no hydrogen 3.097 N/A ILE 64.A N GLU 60.A O no hydrogen 3.104 N/A SER 65.A N ARG 61.A O no hydrogen 2.912 N/A SER 65.A OG HIS 62.A O no hydrogen 3.173 N/A SER 65.A OG HIS 66.A ND1 no hydrogen 2.705 N/A HIS 66.A N HIS 62.A O no hydrogen 3.085 N/A HIS 66.A ND1 SER 65.A OG no hydrogen 2.705 N/A VAL 67.A N PHE 63.A O no hydrogen 2.922 N/A LEU 68.A N ILE 64.A O no hydrogen 3.048 N/A ALA 69.A N SER 65.A O no hydrogen 3.224 N/A PHE 70.A N HIS 66.A O no hydrogen 2.858 N/A PHE 71.A N VAL 67.A O no hydrogen 2.775 N/A ALA 72.A N LEU 68.A O no hydrogen 2.830 N/A ALA 73.A N ALA 69.A O no hydrogen 3.335 N/A SER 74.A N PHE 70.A O no hydrogen 3.118 N/A SER 74.A OG PHE 70.A O no hydrogen 3.238 N/A ASP 75.A N PHE 71.A O no hydrogen 3.126 N/A ILE 77.A N ALA 73.A O no hydrogen 3.108 N/A VAL 78.A N SER 74.A O no hydrogen 2.862 N/A ASN 79.A N ASP 75.A O no hydrogen 3.150 N/A ASN 79.A ND2 ILE 103.A O no hydrogen 3.691 N/A GLU 80.A N GLY 76.A O no hydrogen 3.132 N/A ASN 81.A N ILE 77.A O no hydrogen 3.275 N/A LEU 82.A N VAL 78.A O no hydrogen 3.192 N/A VAL 83.A N ASN 79.A O no hydrogen 2.908 N/A GLU 84.A N GLU 80.A O no hydrogen 2.671 N/A ARG 85.A N ASN 81.A O no hydrogen 2.894 N/A ARG 85.A NE ILE 151.A O no hydrogen 3.058 N/A ARG 85.A NH2 ILE 151.A O no hydrogen 3.374 N/A ARG 85.A NH2 ASP 153.A O no hydrogen 2.373 N/A PHE 86.A N ASN 81.A O no hydrogen 3.049 N/A SER 87.A N LEU 82.A O no hydrogen 2.818 N/A SER 87.A OG LEU 82.A O no hydrogen 2.414 N/A GLN 88.A N ARG 85.A O no hydrogen 3.019 N/A GLN 88.A NE2 VAL 83.A O no hydrogen 3.271 N/A GLU 89.A N ARG 85.A O no hydrogen 2.805 N/A VAL 90.A N PHE 86.A O no hydrogen 3.169 N/A GLN 91.A N LEU 9.A O no hydrogen 2.801 N/A GLN 91.A NE2 GLN 88.A O no hydrogen 3.315 N/A GLN 91.A NE2 GLU 89.A O no hydrogen 3.667 N/A GLU 94.A N GLU 94.A OE1 no hydrogen 2.658 N/A ARG 96.A N VAL 92.A O no hydrogen 3.082 N/A ARG 96.A NE VAL 90.A O no hydrogen 3.049 N/A CYS 97.A N THR 93.A O no hydrogen 3.013 N/A CYS 97.A SG THR 93.A O no hydrogen 3.315 N/A PHE 98.A N GLU 94.A O no hydrogen 3.194 N/A TYR 99.A N ALA 95.A O no hydrogen 2.834 N/A TYR 99.A OH TYR 158.A OH no hydrogen 2.767 N/A GLY 100.A N ARG 96.A O no hydrogen 2.928 N/A PHE 101.A N CYS 97.A O no hydrogen 2.866 N/A GLN 102.A N PHE 98.A O no hydrogen 2.992 N/A ILE 103.A N TYR 99.A O no hydrogen 3.213 N/A ALA 104.A N GLY 100.A O no hydrogen 3.367 N/A MET 105.A N PHE 101.A O no hydrogen 3.123 N/A GLU 106.A N GLN 102.A O no hydrogen 2.726 N/A ASN 107.A N ILE 103.A O no hydrogen 3.242 N/A ILE 108.A N ALA 104.A O no hydrogen 3.180 N/A HIS 109.A N MET 105.A O no hydrogen 2.947 N/A HIS 109.A NE2 ASP 202.A OD2 no hydrogen 2.457 N/A SER 110.A N GLU 106.A O no hydrogen 2.789 N/A GLU 111.A N ASN 107.A O no hydrogen 3.233 N/A MET 112.A N ILE 108.A O no hydrogen 2.945 N/A TYR 113.A N HIS 109.A O no hydrogen 3.065 N/A SER 114.A N SER 110.A O no hydrogen 3.307 N/A SER 114.A OG SER 110.A O no hydrogen 3.089 N/A LEU 115.A N GLU 111.A O no hydrogen 2.950 N/A LEU 116.A N MET 112.A O no hydrogen 3.056 N/A ILE 117.A N TYR 113.A O no hydrogen 2.964 N/A ASP 118.A N SER 114.A O no hydrogen 2.757 N/A THR 119.A N LEU 115.A O no hydrogen 2.787 N/A THR 119.A OG1 LEU 115.A O no hydrogen 2.920 N/A TYR 120.A N LEU 116.A O no hydrogen 2.767 N/A TYR 120.A N ILE 117.A O no hydrogen 3.186 N/A TYR 120.A OH ASP 49.A OD2 no hydrogen 2.773 N/A ILE 121.A N ILE 117.A O no hydrogen 3.069 N/A GLU 126.A N ASP 123.A O no hydrogen 2.554 N/A ARG 127.A N ASP 123.A O no hydrogen 3.233 N/A ARG 127.A NE ILE 121.A O no hydrogen 2.819 N/A ARG 127.A NH2 ASP 118.A O no hydrogen 2.601 N/A GLU 128.A N PRO 124.A O no hydrogen 3.256 N/A TYR 129.A N LYS 125.A O no hydrogen 3.352 N/A LEU 130.A N GLU 126.A O no hydrogen 3.108 N/A PHE 131.A N ARG 127.A O no hydrogen 2.796 N/A ASN 132.A N GLU 128.A O no hydrogen 2.899 N/A ALA 133.A N LEU 130.A O no hydrogen 3.251 N/A GLU 135.A N ASN 132.A O no hydrogen 3.077 N/A THR 136.A N ALA 133.A O no hydrogen 3.118 N/A THR 136.A OG1 TYR 129.A O no hydrogen 2.768 N/A THR 136.A OG1 ASN 132.A O no hydrogen 2.801 N/A VAL 140.A N MET 137.A O no hydrogen 3.057 N/A LYS 141.A N PRO 138.A O no hydrogen 3.036 N/A LYS 142.A NZ GLU 239.A OE2 no hydrogen 2.380 N/A LYS 143.A NZ PHE 172.A O no hydrogen 3.026 N/A LYS 143.A NZ GLU 237.A OE1 no hydrogen 2.758 N/A ALA 144.A N VAL 140.A O no hydrogen 3.057 N/A ASP 145.A N LYS 141.A O no hydrogen 2.435 N/A TRP 146.A N LYS 142.A O no hydrogen 2.532 N/A ALA 147.A N LYS 143.A O no hydrogen 3.011 N/A LEU 148.A N ALA 144.A O no hydrogen 2.945 N/A ARG 149.A N ASP 145.A O no hydrogen 3.183 N/A ARG 149.A NE ASP 153.A OD2 no hydrogen 3.109 N/A TRP 150.A N ALA 147.A O no hydrogen 3.183 N/A ILE 151.A N LEU 148.A O no hydrogen 3.029 N/A GLY 152.A N LEU 148.A O no hydrogen 3.192 N/A GLU 155.A N ASP 153.A OD1 no hydrogen 2.994 N/A TYR 158.A OH TYR 99.A OH no hydrogen 2.767 N/A GLU 160.A N THR 157.A OG1 no hydrogen 2.976 N/A ARG 161.A N THR 157.A O no hydrogen 2.909 N/A ARG 161.A NH1 GLU 89.A OE2 no hydrogen 2.936 N/A ARG 161.A NH1 ALA 156.A O no hydrogen 3.133 N/A ARG 161.A NH2 GLU 89.A OE1 no hydrogen 2.748 N/A ARG 161.A NH2 GLU 89.A OE2 no hydrogen 2.875 N/A VAL 162.A N TYR 158.A O no hydrogen 2.701 N/A VAL 163.A N GLY 159.A O no hydrogen 3.382 N/A ALA 164.A N GLU 160.A O no hydrogen 3.052 N/A PHE 165.A N ARG 161.A O no hydrogen 2.880 N/A ALA 166.A N VAL 162.A O no hydrogen 3.097 N/A ALA 167.A N VAL 163.A O no hydrogen 2.961 N/A VAL 168.A N ALA 164.A O no hydrogen 2.779 N/A GLU 169.A N PHE 165.A O no hydrogen 2.908 N/A GLY 170.A N ALA 166.A O no hydrogen 2.909 N/A ILE 171.A N ALA 167.A O no hydrogen 2.601 N/A PHE 172.A N ALA 167.A O no hydrogen 2.922 N/A SER 174.A N ILE 171.A O no hydrogen 3.405 N/A SER 174.A OG ILE 171.A O no hydrogen 2.702 N/A GLY 175.A N GLU 237.A OE2 no hydrogen 3.139 N/A PHE 177.A N PHE 173.A O no hydrogen 2.857 N/A ALA 178.A N SER 174.A O no hydrogen 3.015 N/A SER 179.A N GLY 175.A O no hydrogen 2.796 N/A SER 179.A OG GLY 175.A O no hydrogen 2.841 N/A ILE 180.A N SER 176.A O no hydrogen 3.016 N/A PHE 181.A N PHE 177.A O no hydrogen 2.926 N/A TRP 182.A N ALA 178.A O no hydrogen 3.046 N/A TRP 182.A NE1 ILE 250.A O no hydrogen 2.711 N/A LEU 183.A N SER 179.A O no hydrogen 3.318 N/A LYS 184.A N ILE 180.A O no hydrogen 3.366 N/A LYS 185.A N PHE 181.A O no hydrogen 3.241 N/A LYS 185.A NZ ASP 285.A OD2 no hydrogen 2.985 N/A ARG 186.A N TRP 182.A O no hydrogen 3.237 N/A ARG 186.A NH1 GLU 60.A OE2 no hydrogen 2.951 N/A ARG 186.A NH2 GLU 60.A OE2 no hydrogen 3.303 N/A GLY 187.A N LYS 184.A O no hydrogen 2.933 N/A LEU 188.A N LEU 183.A O no hydrogen 3.089 N/A GLY 191.A N ASP 49.A OD1 no hydrogen 3.229 N/A LEU 192.A N ASP 49.A OD2 no hydrogen 3.266 N/A THR 193.A N MET 189.A O no hydrogen 2.964 N/A THR 193.A OG1 MET 189.A O no hydrogen 3.484 N/A THR 193.A OG1 PRO 190.A O no hydrogen 3.063 N/A PHE 194.A N PRO 190.A O no hydrogen 2.599 N/A SER 195.A N GLY 191.A O no hydrogen 3.123 N/A SER 195.A OG GLY 191.A O no hydrogen 3.042 N/A SER 195.A OG LEU 192.A O no hydrogen 3.362 N/A ASN 196.A N LEU 192.A O no hydrogen 3.320 N/A ASN 196.A ND2 PHE 177.A O no hydrogen 3.543 N/A GLU 197.A N PHE 194.A O no hydrogen 3.102 N/A ILE 199.A N SER 195.A O no hydrogen 2.902 N/A SER 200.A N ASN 196.A O no hydrogen 2.993 N/A SER 200.A OG GLU 197.A O no hydrogen 3.506 N/A ARG 201.A N GLU 197.A O no hydrogen 3.238 N/A ARG 201.A NE ASP 202.A OD1 no hydrogen 3.038 N/A ARG 201.A NH2 ASP 202.A OD1 no hydrogen 2.895 N/A ASP 202.A N LEU 198.A O no hydrogen 2.998 N/A GLU 203.A N ILE 199.A O no hydrogen 2.866 N/A GLY 204.A N SER 200.A O no hydrogen 3.082 N/A LEU 205.A N ARG 201.A O no hydrogen 3.434 N/A HIS 206.A N ASP 202.A O no hydrogen 3.038 N/A HIS 206.A ND1 GLU 169.A OE2 no hydrogen 2.901 N/A CYS 207.A N GLU 203.A O no hydrogen 2.958 N/A CYS 207.A SG ALA 166.A O no hydrogen 3.824 N/A CYS 207.A SG GLU 203.A O no hydrogen 3.725 N/A ASP 208.A N GLY 204.A O no hydrogen 2.792 N/A PHE 209.A N LEU 205.A O no hydrogen 2.902 N/A ALA 210.A N HIS 206.A O no hydrogen 3.321 N/A CYS 211.A N CYS 207.A O no hydrogen 3.176 N/A CYS 211.A SG CYS 207.A O no hydrogen 3.456 N/A LEU 212.A N ASP 208.A O no hydrogen 3.206 N/A LEU 212.A N PHE 209.A O no hydrogen 3.050 N/A MET 213.A N PHE 209.A O no hydrogen 2.993 N/A PHE 214.A N ALA 210.A O no hydrogen 2.978 N/A LYS 215.A N CYS 211.A O no hydrogen 2.949 N/A LYS 215.A NZ GLU 271.A O no hydrogen 3.151 N/A HIS 216.A N LEU 212.A O no hydrogen 3.129 N/A HIS 216.A N MET 213.A O no hydrogen 2.794 N/A HIS 216.A NE2 ASP 26.A OD2 no hydrogen 2.618 N/A LEU 217.A N PHE 214.A O no hydrogen 2.997 N/A VAL 218.A N GLU 7.A OE1 no hydrogen 2.533 N/A VAL 218.A N GLU 7.A OE2 no hydrogen 3.273 N/A HIS 219.A N GLU 7.A OE2 no hydrogen 2.675 N/A LYS 220.A NZ LEU 217.A O no hydrogen 3.347 N/A ARG 225.A N ALA 222.A O no hydrogen 2.812 N/A ARG 225.A NE GLU 160.A OE2 no hydrogen 3.148 N/A VAL 226.A N ALA 222.A O no hydrogen 3.093 N/A ARG 227.A N GLU 223.A O no hydrogen 3.139 N/A GLU 228.A N GLN 224.A O no hydrogen 3.093 N/A ILE 229.A N ARG 225.A O no hydrogen 3.020 N/A ILE 230.A N VAL 226.A O no hydrogen 2.965 N/A THR 231.A N ARG 227.A O no hydrogen 2.878 N/A ASN 232.A N GLU 228.A O no hydrogen 2.922 N/A ALA 233.A N ILE 229.A O no hydrogen 3.091 N/A VAL 234.A N ILE 230.A O no hydrogen 2.838 N/A ARG 235.A N THR 231.A O no hydrogen 2.982 N/A ILE 236.A N ASN 232.A O no hydrogen 3.271 N/A GLU 237.A N ALA 233.A O no hydrogen 2.919 N/A GLN 238.A N VAL 234.A O no hydrogen 2.950 N/A GLN 238.A NE2 LYS 258.A O no hydrogen 2.564 N/A GLN 238.A NE2 GLU 262.A OE2 no hydrogen 3.047 N/A GLU 239.A N ARG 235.A O no hydrogen 2.973 N/A PHE 240.A N ILE 236.A O no hydrogen 3.177 N/A LEU 241.A N GLU 237.A O no hydrogen 2.956 N/A THR 242.A N GLU 239.A O no hydrogen 3.349 N/A THR 242.A OG1 GLN 238.A O no hydrogen 3.122 N/A GLU 243.A N GLU 239.A O no hydrogen 2.780 N/A ALA 244.A N GLU 239.A O no hydrogen 3.175 N/A LEU 245.A N PHE 240.A O no hydrogen 2.900 N/A VAL 247.A N LEU 241.A O no hydrogen 3.240 N/A LEU 249.A N PRO 246.A O no hydrogen 3.042 N/A ILE 250.A N VAL 247.A O no hydrogen 2.968 N/A GLY 251.A N LYS 248.A O no hydrogen 2.423 N/A MET 252.A N VAL 247.A O no hydrogen 2.853 N/A THR 255.A N ASN 253.A OD1 no hydrogen 3.000 N/A MET 257.A N ASN 253.A O no hydrogen 3.153 N/A LYS 258.A N CYS 254.A O no hydrogen 3.211 N/A GLN 259.A N LEU 256.A O no hydrogen 3.292 N/A GLN 259.A NE2 GLU 281.A O no hydrogen 3.125 N/A TYR 260.A N LEU 256.A O no hydrogen 3.195 N/A TYR 260.A N MET 257.A O no hydrogen 2.955 N/A ILE 261.A N MET 257.A O no hydrogen 3.126 N/A PHE 263.A N GLN 259.A O no hydrogen 3.034 N/A VAL 264.A N TYR 260.A O no hydrogen 2.686 N/A ALA 265.A N ILE 261.A O no hydrogen 2.788 N/A ASP 266.A N GLU 262.A O no hydrogen 2.990 N/A ARG 267.A N PHE 263.A O no hydrogen 3.129 N/A LEU 268.A N VAL 264.A O no hydrogen 3.239 N/A MET 269.A N ALA 265.A O no hydrogen 2.992 N/A LEU 270.A N ASP 266.A O no hydrogen 3.112 N/A GLU 271.A N ARG 267.A O no hydrogen 2.995 N/A LEU 272.A N LEU 268.A O no hydrogen 2.862 N/A LEU 272.A N MET 269.A O no hydrogen 3.016 N/A GLY 273.A N LEU 270.A O no hydrogen 3.033 N/A PHE 274.A N MET 269.A O no hydrogen 2.976 N/A ILE 277.A N ASP 266.A OD1 no hydrogen 2.667 N/A PHE 278.A N ASP 266.A OD1 no hydrogen 2.862 N/A ARG 279.A N ASP 266.A OD2 no hydrogen 2.879 N/A ASN 282.A ND2 MET 287.A O no hydrogen 3.699 N/A PHE 284.A N ASN 282.A OD1 no hydrogen 2.930 N/A ASP 285.A N ASP 285.A OD1 no hydrogen 2.469 N/A MET 287.A N PHE 284.A O no hydrogen 3.263 N/A