Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7p1g_K.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A N ALA 1.A O no hydrogen 2.805 N/A ARG 6.A N ASP 2.A O no hydrogen 2.858 N/A ALA 7.A N MET 3.A O no hydrogen 2.826 N/A LEU 8.A N GLN 4.A O no hydrogen 2.932 N/A GLN 9.A N ALA 5.A O no hydrogen 2.822 N/A GLN 9.A NE2 ASP 13.A OD2 no hydrogen 2.840 N/A LEU 11.A N ALA 7.A O no hydrogen 2.943 N/A PHE 12.A N LEU 8.A O no hydrogen 2.898 N/A ASP 13.A N GLN 9.A O no hydrogen 2.855 N/A ALA 14.A N ASP 10.A O no hydrogen 2.963 N/A GLY 16.A N ASP 13.A O no hydrogen 3.197 N/A VAL 17.A N PHE 12.A O no hydrogen 3.082 N/A GLY 18.A N VAL 43.A O no hydrogen 2.534 N/A GLU 22.A N GLU 22.A OE1 no hydrogen 2.692 N/A HIS 23.A N PRO 20.A O no hydrogen 2.691 N/A HIS 23.A ND1 TYR 190.A OH no hydrogen 3.260 N/A ALA 24.A N PRO 20.A O no hydrogen 2.977 N/A LEU 25.A N VAL 21.A O no hydrogen 2.943 N/A ARG 26.A NE CYS 256.A O no hydrogen 3.089 N/A ARG 26.A NH2 CYS 256.A O no hydrogen 3.073 N/A MET 27.A N HIS 23.A O no hydrogen 2.863 N/A GLN 28.A N ALA 24.A O no hydrogen 2.891 N/A GLN 28.A NE2 LEU 289.A O no hydrogen 3.261 N/A ALA 29.A N LEU 25.A O no hydrogen 2.947 N/A VAL 30.A N ARG 26.A O no hydrogen 3.091 N/A ALA 31.A N MET 27.A O no hydrogen 2.829 N/A ARG 32.A N GLN 28.A O no hydrogen 2.851 N/A GLN 33.A N ALA 29.A O no hydrogen 2.981 N/A THR 34.A N VAL 30.A O no hydrogen 2.859 N/A THR 34.A OG1 VAL 30.A O no hydrogen 2.913 N/A ASN 35.A N ARG 32.A O no hydrogen 3.267 N/A THR 36.A N ALA 31.A O no hydrogen 3.152 N/A THR 36.A OG1 THR 34.A O no hydrogen 3.000 N/A THR 36.A OG1 THR 34.A OG1 no hydrogen 3.323 N/A VAL 37.A N ALA 196.A O no hydrogen 3.166 N/A GLY 39.A N LEU 194.A O no hydrogen 2.852 N/A ILE 40.A N THR 286.A O no hydrogen 2.940 N/A ARG 41.A N ASP 191.A O no hydrogen 2.790 N/A ARG 41.A NH1 ASP 281.A OD2 no hydrogen 3.029 N/A ARG 41.A NH2 ASP 281.A OD2 no hydrogen 3.254 N/A ARG 41.A NH2 ASN 282.A OD1 no hydrogen 2.384 N/A ARG 45.A NH2 ASN 127.A OD1 no hydrogen 2.167 N/A VAL 47.A N GLU 44.A O no hydrogen 3.068 N/A THR 48.A N ARG 45.A O no hydrogen 3.396 N/A THR 48.A OG1 GLY 18.A O no hydrogen 3.445 N/A THR 48.A OG1 ARG 45.A O no hydrogen 2.809 N/A THR 49.A OG1 GLU 123.A OE1 no hydrogen 3.127 N/A THR 49.A OG1 GLU 123.A OE2 no hydrogen 2.581 N/A LEU 50.A N VAL 47.A O no hydrogen 2.600 N/A ILE 51.A N VAL 47.A O no hydrogen 3.415 N/A GLU 52.A N THR 48.A O no hydrogen 3.065 N/A GLU 53.A N THR 49.A O no hydrogen 2.766 N/A GLY 54.A N LEU 50.A O no hydrogen 3.180 N/A THR 57.A OG1 GLU 264.A O no hydrogen 2.784 N/A LYS 58.A N THR 187.A O no hydrogen 2.478 N/A LYS 58.A NZ GLY 64.A O no hydrogen 2.803 N/A LYS 63.A NZ ALA 99.A O no hydrogen 3.268 N/A SER 66.A OG PHE 75.A O no hydrogen 2.823 N/A SER 67.A N PHE 75.A O no hydrogen 3.066 N/A SER 67.A OG TRP 69.A O no hydrogen 3.171 N/A TRP 69.A N SER 67.A OG no hydrogen 3.214 N/A GLN 72.A N GLN 72.A OE1 no hydrogen 2.619 N/A ALA 73.A N GLY 70.A O no hydrogen 3.004 N/A GLY 74.A N SER 67.A O no hydrogen 2.719 N/A PHE 75.A N GLN 72.A O no hydrogen 2.908 N/A VAL 78.A N GLN 175.A O no hydrogen 2.854 N/A HIS 81.A N ASP 79.A O no hydrogen 2.697 N/A SER 83.A N GLN 80.A O no hydrogen 3.097 N/A SER 83.A OG ILE 93.A O no hydrogen 2.238 N/A LYS 84.A N HIS 81.A O no hydrogen 3.221 N/A ARG 85.A N LEU 82.A O no hydrogen 2.598 N/A ARG 85.A NH1 SER 147.A OG no hydrogen 2.599 N/A GLU 86.A N LEU 82.A O no hydrogen 2.281 N/A ARG 88.A NE LYS 84.A O no hydrogen 2.737 N/A ILE 93.A N THR 90.A O no hydrogen 3.049 N/A LYS 95.A N ALA 91.A O no hydrogen 3.021 N/A LEU 96.A N GLU 92.A O no hydrogen 2.808 N/A LEU 98.A N ARG 94.A O no hydrogen 3.056 N/A ALA 99.A N LYS 95.A O no hydrogen 2.911 N/A VAL 100.A N LEU 96.A O no hydrogen 2.875 N/A ALA 101.A N ASN 97.A O no hydrogen 2.898 N/A LYS 102.A N LEU 98.A O no hydrogen 2.990 N/A LYS 102.A NZ LEU 98.A O no hydrogen 3.317 N/A GLY 103.A N ALA 99.A O no hydrogen 2.994 N/A MET 104.A N VAL 100.A O no hydrogen 2.695 N/A ASP 105.A N ALA 101.A O no hydrogen 3.029 N/A ASP 105.A N LYS 102.A O no hydrogen 3.238 N/A GLY 106.A N GLY 103.A O no hydrogen 3.207 N/A GLN 111.A NE2 GLY 183.A O no hydrogen 2.867 N/A THR 112.A OG1 THR 112.A O no hydrogen 2.628 N/A ARG 115.A NE ASP 160.A OD2 no hydrogen 2.938 N/A ARG 115.A NH2 ASP 160.A OD2 no hydrogen 2.257 N/A ILE 116.A N TYR 163.A O no hydrogen 3.100 N/A GLN 119.A NE2 GLU 53.A OE1 no hydrogen 2.998 N/A ARG 120.A NH1 ILE 46.A O no hydrogen 3.276 N/A ARG 120.A NH1 GLU 123.A OE2 no hydrogen 3.278 N/A ARG 120.A NH2 ILE 46.A O no hydrogen 3.273 N/A LEU 121.A N SER 117.A O no hydrogen 2.723 N/A ALA 122.A N ARG 118.A O no hydrogen 2.700 N/A GLU 123.A N GLN 119.A O no hydrogen 2.946 N/A LEU 124.A N ARG 120.A O no hydrogen 2.902 N/A VAL 125.A N LEU 121.A O no hydrogen 2.878 N/A ARG 126.A N ALA 122.A O no hydrogen 2.817 N/A ASN 127.A N LEU 124.A O no hydrogen 3.074 N/A ASN 127.A ND2 GLU 123.A O no hydrogen 2.665 N/A PHE 128.A N LEU 124.A O no hydrogen 2.770 N/A VAL 131.A N THR 142.A O no hydrogen 2.555 N/A ASP 133.A N LEU 140.A O no hydrogen 3.268 N/A VAL 135.A N VAL 138.A O no hydrogen 3.009 N/A VAL 138.A N VAL 135.A O no hydrogen 2.881 N/A ARG 139.A N PRO 137.A O no hydrogen 2.981 N/A LEU 140.A N ASP 133.A O no hydrogen 3.317 N/A LEU 141.A N PHE 153.A O no hydrogen 2.736 N/A THR 142.A OG1 TYR 151.A O no hydrogen 3.552 N/A GLY 145.A N LYS 149.A O no hydrogen 2.463 N/A SER 147.A OG GLY 145.A O no hydrogen 3.540 N/A GLY 148.A N GLY 145.A O no hydrogen 2.384 N/A LYS 149.A N GLY 145.A O no hydrogen 2.617 N/A LYS 149.A NZ HIS 81.A NE2 no hydrogen 3.463 N/A ARG 150.A NE ALA 143.A O no hydrogen 3.399 N/A PHE 153.A N LEU 141.A O no hydrogen 2.643 N/A ALA 155.A N PHE 153.A O no hydrogen 3.127 N/A ARG 156.A N ARG 164.A O no hydrogen 3.165 N/A ARG 156.A NE GLU 154.A OE1 no hydrogen 2.375 N/A ARG 156.A NH1 GLU 172.A OE2 no hydrogen 2.646 N/A GLU 158.A N GLN 157.A OE1 no hydrogen 2.893 N/A GLY 161.A N GLU 158.A O no hydrogen 2.871 N/A TYR 163.A N ILE 116.A O no hydrogen 2.792 N/A TYR 163.A OH GLY 136.A O no hydrogen 2.956 N/A ARG 164.A N ARG 156.A O no hydrogen 2.775 N/A ARG 164.A NE ASP 113.A OD2 no hydrogen 2.864 N/A ARG 164.A NH1 GLU 172.A OE1 no hydrogen 3.541 N/A ARG 164.A NH2 GLU 172.A OE1 no hydrogen 2.631 N/A SER 166.A OG GLU 154.A O no hydrogen 2.970 N/A ARG 167.A NH2 ASP 79.A O no hydrogen 2.608 N/A GLU 172.A N ARG 170.A O no hydrogen 2.611 N/A GLN 175.A N ASP 79.A OD1 no hydrogen 2.857 N/A GLN 175.A NE2 ASP 79.A OD2 no hydrogen 2.802 N/A VAL 176.A N GLN 111.A O no hydrogen 2.809 N/A LEU 177.A N ILE 76.A O no hydrogen 3.261 N/A ALA 178.A N TYR 109.A O no hydrogen 2.933 N/A MET 186.A N LEU 177.A O no hydrogen 2.996 N/A THR 187.A N PRO 56.A O no hydrogen 2.952 N/A THR 187.A OG1 GLY 74.A O no hydrogen 2.593 N/A ALA 188.A N THR 187.A OG1 no hydrogen 2.703 N/A TYR 190.A N MET 265.A O no hydrogen 3.200 N/A TYR 190.A OH HIS 23.A ND1 no hydrogen 3.260 N/A PHE 193.A N GLY 39.A O no hydrogen 2.488 N/A ALA 196.A N VAL 37.A O no hydrogen 2.740 N/A SER 198.A OG GLU 200.A OE1 no hydrogen 2.601 N/A ILE 199.A N GLY 319.A O no hydrogen 2.811 N/A GLU 200.A N GLU 200.A OE1 no hydrogen 2.711 N/A ALA 201.A N SER 198.A O no hydrogen 2.499 N/A HIS 202.A N SER 198.A O no hydrogen 2.980 N/A GLY 203.A N ASP 208.A OD2 no hydrogen 2.699 N/A SER 204.A N ALA 201.A O no hydrogen 3.037 N/A SER 204.A OG ALA 201.A O no hydrogen 3.218 N/A LEU 207.A N SER 204.A O no hydrogen 2.898 N/A ALA 209.A N GLY 206.A O no hydrogen 2.664 N/A ARG 210.A NH1 ASN 241.A O no hydrogen 3.233 N/A ARG 210.A NH1 ASP 270.A OD2 no hydrogen 2.686 N/A ARG 210.A NH2 ASP 270.A OD1 no hydrogen 3.111 N/A ARG 210.A NH2 ASP 270.A OD2 no hydrogen 3.081 N/A ARG 211.A NE ARG 234.A O no hydrogen 2.938 N/A ASN 212.A N ASN 241.A OD1 no hydrogen 2.779 N/A ASN 212.A ND2 PHE 231.A O no hydrogen 3.333 N/A THR 213.A OG1 ARG 210.A O no hydrogen 3.411 N/A TYR 217.A N TYR 232.A OH no hydrogen 3.321 N/A TYR 217.A OH LEU 226.A O no hydrogen 3.352 N/A LEU 220.A N ASP 224.A OD2 no hydrogen 3.287 N/A ASP 224.A N GLY 221.A O no hydrogen 3.190 N/A LEU 226.A N ASP 224.A OD1 no hydrogen 3.032 N/A GLY 230.A N SER 227.A OG no hydrogen 3.237 N/A PHE 231.A N SER 227.A O no hydrogen 2.575 N/A TYR 232.A N GLU 228.A O no hydrogen 2.952 N/A GLY 233.A N ASP 229.A O no hydrogen 2.852 N/A ARG 234.A N PHE 231.A O no hydrogen 3.330 N/A ARG 234.A NE ASN 212.A OD1 no hydrogen 2.974 N/A ARG 234.A NH1 ASN 212.A OD1 no hydrogen 3.392 N/A GLU 235.A N TYR 232.A O no hydrogen 2.983 N/A ASP 236.A N GLY 240.A O no hydrogen 3.017 N/A ALA 238.A N ASP 236.A OD1 no hydrogen 2.852 N/A ARG 239.A N ASP 236.A OD1 no hydrogen 2.668 N/A ARG 239.A NE ASP 236.A OD1 no hydrogen 3.042 N/A ARG 239.A NH2 ASP 236.A OD2 no hydrogen 3.412 N/A GLY 240.A N ASP 236.A O no hydrogen 2.578 N/A ASN 241.A ND2 ASN 212.A O no hydrogen 3.191 N/A ASN 241.A ND2 GLY 273.A O no hydrogen 2.963 N/A ILE 242.A N GLY 240.A O no hydrogen 2.643 N/A THR 243.A OG1 LEU 207.A O no hydrogen 3.458 N/A THR 243.A OG1 THR 246.A OG1 no hydrogen 2.706 N/A ARG 245.A N LEU 207.A O no hydrogen 2.624 N/A ARG 245.A NE ASP 208.A OD1 no hydrogen 2.878 N/A ARG 245.A NE ASP 208.A OD2 no hydrogen 3.252 N/A ARG 245.A NH2 ASP 208.A OD2 no hydrogen 3.245 N/A THR 246.A N THR 243.A OG1 no hydrogen 2.953 N/A THR 246.A OG1 THR 243.A OG1 no hydrogen 2.706 N/A ARG 247.A N THR 243.A O no hydrogen 2.786 N/A GLN 248.A N PRO 244.A O no hydrogen 2.989 N/A LEU 249.A N ARG 245.A O no hydrogen 2.874 N/A VAL 250.A N THR 246.A O no hydrogen 2.857 N/A ASP 251.A N ARG 247.A O no hydrogen 2.955 N/A ASP 251.A N GLN 248.A O no hydrogen 3.214 N/A ALA 252.A N GLN 248.A O no hydrogen 2.980 N/A LEU 253.A N LEU 249.A O no hydrogen 2.764 N/A ASN 254.A N ASP 251.A O no hydrogen 2.976 N/A ASN 254.A ND2 VAL 250.A O no hydrogen 2.502 N/A ASN 254.A ND2 PHE 266.A O no hydrogen 2.889 N/A ASP 255.A N ASP 251.A O no hydrogen 2.887 N/A CYS 256.A N ALA 252.A O no hydrogen 2.986 N/A CYS 256.A SG ARG 26.A O no hydrogen 4.014 N/A CYS 256.A SG ALA 252.A O no hydrogen 3.344 N/A LEU 257.A N ASN 254.A O no hydrogen 3.343 N/A ARG 259.A NE ARG 263.A O no hydrogen 2.595 N/A ARG 259.A NH1 ILE 51.A O no hydrogen 2.795 N/A ARG 263.A N GLY 260.A O no hydrogen 2.672 N/A ARG 263.A NH1 GLY 54.A O no hydrogen 3.015 N/A GLU 264.A N GLU 264.A OE2 no hydrogen 2.768 N/A MET 265.A N ASN 254.A OD1 no hydrogen 3.024 N/A PHE 266.A N ASN 254.A OD1 no hydrogen 3.265 N/A HIS 268.A ND1 SER 269.A O no hydrogen 3.207 N/A HIS 268.A NE2 ASP 189.A OD1 no hydrogen 2.639 N/A SER 269.A N ARG 239.A O no hydrogen 2.990 N/A SER 269.A OG ARG 239.A O no hydrogen 3.135 N/A ASP 271.A N LEU 192.A O no hydrogen 2.842 N/A ALA 272.A N PHE 193.A O no hydrogen 3.083 N/A GLY 273.A N ASP 270.A O no hydrogen 2.806 N/A ASN 274.A N ASP 271.A O no hydrogen 3.242 N/A ASN 274.A ND2 ASP 271.A OD2 no hydrogen 3.114 N/A GLY 276.A N ASN 274.A OD1 no hydrogen 2.751 N/A SER 277.A N ASN 274.A O no hydrogen 3.034 N/A SER 277.A OG ASP 271.A OD1 no hydrogen 2.361 N/A SER 277.A OG ASP 271.A OD2 no hydrogen 3.186 N/A ASP 281.A N HIS 278.A O no hydrogen 3.196 N/A ASN 282.A N MET 279.A O no hydrogen 2.922 N/A ASN 282.A ND2 ASP 271.A OD1 no hydrogen 3.516 N/A ALA 285.A N VAL 302.A O no hydrogen 3.136 N/A THR 286.A N ILE 40.A O no hydrogen 3.253 N/A THR 286.A OG1 TYR 288.A OH no hydrogen 3.177 N/A PHE 287.A N CYS 300.A O no hydrogen 2.872 N/A TYR 288.A N PHE 38.A O no hydrogen 3.009 N/A TYR 288.A OH THR 286.A OG1 no hydrogen 3.177 N/A LEU 289.A N GLU 298.A O no hydrogen 3.189 N/A MET 293.A N GLU 298.A OE1 no hydrogen 2.385 N/A CYS 300.A N PHE 287.A O no hydrogen 2.798 N/A CYS 300.A SG PHE 287.A O no hydrogen 3.463 N/A VAL 302.A N ALA 285.A O no hydrogen 2.937 N/A ARG 305.A NH2 ASN 329.A O no hydrogen 3.359 N/A LYS 306.A NZ ASP 304.A OD2 no hydrogen 2.346 N/A SER 307.A N ASP 304.A OD1 no hydrogen 2.882 N/A SER 307.A OG ASP 304.A OD1 no hydrogen 2.636 N/A PHE 308.A N ASP 304.A O no hydrogen 2.770 N/A SER 309.A N ARG 305.A O no hydrogen 2.911 N/A SER 309.A OG ARG 305.A O no hydrogen 3.126 N/A LEU 310.A N LYS 306.A O no hydrogen 2.991 N/A LEU 311.A N SER 307.A O no hydrogen 2.932 N/A VAL 312.A N PHE 308.A O no hydrogen 2.777 N/A GLU 313.A N SER 309.A O no hydrogen 2.930 N/A CYS 314.A N LEU 310.A O no hydrogen 3.009 N/A CYS 314.A SG MET 293.A O no hydrogen 3.510 N/A ILE 315.A N LEU 311.A O no hydrogen 2.795 N/A LYS 316.A N VAL 312.A O no hydrogen 2.853 N/A LYS 316.A NZ PRO 331.A O no hydrogen 3.093 N/A GLY 317.A N GLU 313.A O no hydrogen 2.948 N/A ASN 318.A N CYS 314.A O no hydrogen 2.952 N/A ASN 318.A ND2 MET 293.A O no hydrogen 2.902 N/A ASN 318.A ND2 CYS 314.A O no hydrogen 2.970 N/A GLY 319.A N LYS 316.A O no hydrogen 3.327 N/A TYR 320.A N ILE 315.A O no hydrogen 3.189 N/A TYR 320.A OH ASN 35.A OD1 no hydrogen 2.535 N/A HIS 321.A N PRO 197.A O no hydrogen 3.121 N/A HIS 325.A NE2 ASP 327.A OD2 no hydrogen 3.068 N/A TRP 328.A N HIS 325.A O no hydrogen 3.094 N/A PHE 336.A N ARG 333.A O no hydrogen 2.898 N/A GLN 337.A N ARG 333.A O no hydrogen 2.870 N/A GLN 337.A NE2 ASP 341.A OD2 no hydrogen 2.742 N/A GLU 338.A N PRO 334.A O no hydrogen 2.886 N/A ALA 339.A N PHE 336.A O no hydrogen 2.896 N/A LEU 340.A N PHE 336.A O no hydrogen 2.857 N/A ASP 341.A N GLN 337.A O no hydrogen 2.880 N/A PHE 343.A N ALA 339.A O no hydrogen 3.059 N/A GLN 344.A N LEU 340.A O no hydrogen 2.848 N/A ARG 345.A N ASP 341.A O no hydrogen 3.372 N/A