Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4qj4_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A NE2 GLU 3.A OE1 no hydrogen 3.195 N/A LEU 11.A N VAL 8.A O no hydrogen 2.966 N/A ARG 12.A N VAL 8.A O no hydrogen 3.229 N/A ARG 12.A NE VAL 7.A O no hydrogen 2.669 N/A ARG 13.A N GLU 9.A O no hydrogen 3.048 N/A GLY 14.A N THR 10.A O no hydrogen 3.012 N/A SER 15.A N LEU 32.A O no hydrogen 3.148 N/A PHE 17.A N VAL 30.A O no hydrogen 2.900 N/A ILE 18.A N MET 106.A O no hydrogen 2.760 N/A LYS 19.A N ASN 28.A O no hydrogen 2.887 N/A TRP 20.A N ASN 104.A O no hydrogen 3.201 N/A THR 24.A N ASP 21.A OD2 no hydrogen 3.011 N/A THR 24.A OG1 ASP 21.A OD2 no hydrogen 2.606 N/A THR 24.A OG1 SER 26.A OG no hydrogen 2.852 N/A SER 25.A OG THR 24.A O no hydrogen 2.457 N/A SER 26.A OG THR 24.A OG1 no hydrogen 2.852 N/A ASN 28.A N LYS 19.A O no hydrogen 3.435 N/A VAL 30.A N PHE 17.A O no hydrogen 2.811 N/A LEU 32.A N SER 15.A O no hydrogen 2.960 N/A ARG 33.A N TYR 42.A O no hydrogen 2.934 N/A VAL 34.A N LEU 11.A O no hydrogen 2.664 N/A ASP 35.A N PHE 40.A O no hydrogen 3.431 N/A ASN 37.A N ASP 35.A OD1 no hydrogen 2.856 N/A GLY 38.A N ASP 35.A O no hydrogen 2.894 N/A PHE 39.A N ASP 35.A OD2 no hydrogen 3.051 N/A PHE 40.A N ASP 35.A OD2 no hydrogen 2.833 N/A LEU 41.A N LEU 53.A O no hydrogen 3.017 N/A TYR 42.A N ARG 33.A O no hydrogen 3.270 N/A TRP 43.A N ASP 51.A O no hydrogen 3.125 N/A GLY 45.A N GLU 49.A O no hydrogen 3.463 N/A GLU 49.A N PRO 46.A O no hydrogen 3.106 N/A ASP 51.A N TRP 43.A O no hydrogen 3.135 N/A LEU 53.A N LEU 41.A O no hydrogen 2.678 N/A ILE 55.A N PHE 39.A O no hydrogen 2.999 N/A SER 56.A OG ASP 54.A OD1 no hydrogen 3.150 N/A SER 57.A N ASP 54.A O no hydrogen 2.713 N/A SER 57.A OG ASP 54.A O no hydrogen 2.565 N/A ILE 58.A N ILE 55.A O no hydrogen 2.904 N/A ARG 59.A N VAL 92.A O no hydrogen 2.786 N/A ARG 59.A NE GLY 94.A O no hydrogen 2.961 N/A ASP 60.A N VAL 92.A O no hydrogen 3.136 N/A THR 61.A OG1 SER 117.A O no hydrogen 2.693 N/A THR 61.A OG1 SER 117.A OG no hydrogen 3.328 N/A ARG 62.A N THR 90.A O no hydrogen 2.714 N/A ARG 62.A NE ASP 60.A OD2 no hydrogen 2.642 N/A ARG 62.A NH1 GLU 333.A OE1 no hydrogen 3.179 N/A ARG 62.A NH1 GLU 333.A OE2 no hydrogen 3.297 N/A ARG 62.A NH2 ASP 60.A OD2 no hydrogen 3.112 N/A ARG 62.A NH2 GLU 333.A OE2 no hydrogen 2.859 N/A THR 63.A OG1 LEU 88.A O no hydrogen 2.938 N/A ARG 65.A NH2 TYR 66.A OH no hydrogen 2.878 N/A TYR 66.A N THR 63.A O no hydrogen 3.325 N/A ALA 67.A N GLY 64.A O no hydrogen 3.361 N/A ARG 68.A N THR 90.A OG1 no hydrogen 2.815 N/A LYS 74.A N ASP 72.A OD1 no hydrogen 3.332 N/A ILE 75.A N ASP 72.A OD2 no hydrogen 3.398 N/A ARG 76.A N ASP 72.A O no hydrogen 3.198 N/A GLU 77.A N PRO 73.A O no hydrogen 2.837 N/A VAL 78.A N LYS 74.A O no hydrogen 3.425 N/A LEU 79.A N ILE 75.A O no hydrogen 2.992 N/A GLY 80.A N ARG 76.A O no hydrogen 2.835 N/A GLU 86.A N ALA 82.A O no hydrogen 3.001 N/A LYS 87.A NZ VAL 108.A O no hydrogen 2.908 N/A LYS 87.A NZ ASP 110.A OD1 no hydrogen 2.734 N/A MET 89.A N PHE 105.A O no hydrogen 3.058 N/A THR 90.A N ARG 62.A O no hydrogen 2.759 N/A THR 90.A OG1 ASN 104.A OD1 no hydrogen 2.896 N/A VAL 91.A N LEU 103.A O no hydrogen 3.101 N/A VAL 92.A N ASP 60.A O no hydrogen 2.766 N/A SER 93.A N VAL 101.A O no hydrogen 3.286 N/A GLY 94.A N SER 57.A O no hydrogen 3.120 N/A ASN 99.A N ASP 96.A OD1 no hydrogen 2.586 N/A THR 100.A N VAL 98.A O no hydrogen 3.241 N/A VAL 101.A N SER 93.A O no hydrogen 2.996 N/A LEU 103.A N VAL 91.A O no hydrogen 2.978 N/A PHE 105.A N MET 89.A O no hydrogen 2.750 N/A MET 106.A N ILE 18.A O no hydrogen 3.213 N/A ALA 107.A N LYS 87.A O no hydrogen 3.125 N/A VAL 108.A N LYS 16.A O no hydrogen 3.375 N/A THR 112.A OG1 ASP 110.A O no hydrogen 3.211 N/A VAL 115.A N THR 112.A O no hydrogen 3.070 N/A TRP 116.A N THR 112.A O no hydrogen 3.346 N/A TRP 116.A NE1 SER 15.A OG no hydrogen 3.227 N/A SER 117.A N ALA 113.A O no hydrogen 2.865 N/A SER 117.A OG THR 61.A OG1 no hydrogen 3.328 N/A GLU 118.A N LYS 114.A O no hydrogen 3.304 N/A GLU 119.A N VAL 115.A O no hydrogen 2.976 N/A LEU 120.A N TRP 116.A O no hydrogen 2.687 N/A PHE 121.A N SER 117.A O no hydrogen 3.106 N/A LYS 122.A N GLU 118.A O no hydrogen 3.116 N/A LEU 123.A N GLU 119.A O no hydrogen 3.025 N/A ALA 124.A N LEU 120.A O no hydrogen 2.861 N/A MET 125.A N PHE 121.A O no hydrogen 2.862 N/A ASN 126.A N LEU 123.A O no hydrogen 3.267 N/A ASN 126.A ND2 GLU 3.A O no hydrogen 3.540 N/A ALA 129.A N ASN 126.A OD1 no hydrogen 2.602 N/A GLN 130.A NE2 GLU 558.A OE2 no hydrogen 2.921 N/A ASN 131.A N ILE 127.A O no hydrogen 2.839 N/A ASN 131.A ND2 ILE 127.A O no hydrogen 3.302 N/A ASN 131.A ND2 GLU 558.A OE2 no hydrogen 3.402 N/A SER 133.A OG THR 136.A OG1 no hydrogen 2.843 N/A SER 133.A OG GLU 288.A OE2 no hydrogen 2.507 N/A ARG 134.A NH1 CYS 701.A O no hydrogen 2.954 N/A ARG 134.A NH1 LEU 702.A O no hydrogen 3.006 N/A ARG 134.A NH2 LEU 702.A O no hydrogen 2.627 N/A ASN 135.A N GLY 286.A O no hydrogen 2.943 N/A ASN 135.A ND2 ARG 283.A O no hydrogen 2.702 N/A THR 136.A N SER 133.A OG no hydrogen 3.235 N/A THR 136.A OG1 SER 133.A OG no hydrogen 2.843 N/A THR 136.A OG1 GLU 288.A OE2 no hydrogen 3.079 N/A PHE 137.A N SER 133.A O no hydrogen 3.244 N/A LEU 138.A N ARG 134.A O no hydrogen 3.008 N/A ARG 139.A N ASN 135.A O no hydrogen 2.786 N/A LYS 140.A N THR 136.A O no hydrogen 2.812 N/A LYS 140.A NZ ASP 54.A OD1 no hydrogen 2.642 N/A LYS 140.A NZ SER 56.A OG no hydrogen 3.262 N/A ALA 141.A N PHE 137.A O no hydrogen 3.256 N/A TYR 142.A N LEU 138.A O no hydrogen 3.139 N/A TYR 142.A OH PHE 193.A O no hydrogen 2.567 N/A THR 143.A N ARG 139.A O no hydrogen 3.131 N/A THR 143.A OG1 ARG 139.A O no hydrogen 2.801 N/A LYS 144.A N LYS 140.A O no hydrogen 3.137 N/A LEU 145.A N ALA 141.A O no hydrogen 3.180 N/A LYS 146.A N TYR 142.A O no hydrogen 3.127 N/A LEU 147.A N THR 143.A O no hydrogen 2.720 N/A GLN 148.A N LYS 144.A O no hydrogen 3.010 N/A ASN 150.A N ARG 154.A O no hydrogen 3.123 N/A GLY 153.A N ASN 150.A O no hydrogen 3.097 N/A ILE 155.A N ILE 188.A O no hydrogen 2.665 N/A VAL 157.A N GLU 186.A O no hydrogen 3.186 N/A ASN 159.A N PRO 156.A O no hydrogen 3.367 N/A ASN 159.A ND2 GLN 148.A O no hydrogen 3.657 N/A LEU 161.A N VAL 157.A O no hydrogen 2.974 N/A LYS 162.A N LYS 158.A O no hydrogen 3.006 N/A MET 163.A N ASN 159.A O no hydrogen 2.862 N/A PHE 164.A N ILE 160.A O no hydrogen 3.324 N/A SER 165.A OG LYS 162.A O no hydrogen 3.393 N/A SER 165.A OG ASP 607.A O no hydrogen 2.933 N/A ARG 170.A N ASP 167.A O no hydrogen 3.032 N/A ARG 170.A NH1 LEU 205.A O no hydrogen 3.161 N/A ARG 170.A NH1 ASN 640.A OD1 no hydrogen 3.487 N/A VAL 171.A N ASP 167.A O no hydrogen 3.168 N/A GLU 172.A N LYS 168.A O no hydrogen 3.037 N/A THR 173.A N LYS 169.A O no hydrogen 3.346 N/A THR 173.A OG1 LYS 169.A O no hydrogen 3.007 N/A THR 173.A OG1 ARG 170.A O no hydrogen 2.843 N/A ALA 174.A N ARG 170.A O no hydrogen 2.759 N/A LEU 175.A N VAL 171.A O no hydrogen 3.092 N/A GLU 176.A N GLU 172.A O no hydrogen 3.080 N/A SER 177.A N THR 173.A O no hydrogen 3.420 N/A CYS 178.A SG ALA 174.A O no hydrogen 3.257 N/A GLY 179.A N GLU 176.A O no hydrogen 3.142 N/A LEU 180.A N LEU 175.A O no hydrogen 3.002 N/A LYS 181.A NZ SER 187.A O no hydrogen 3.472 N/A ASN 183.A N GLU 186.A OE2 no hydrogen 3.357 N/A SER 185.A N ASN 183.A OD1 no hydrogen 3.246 N/A SER 185.A OG ASN 183.A OD1 no hydrogen 3.537 N/A ILE 188.A N ILE 155.A O no hydrogen 2.610 N/A GLU 192.A N ARG 189.A O no hydrogen 2.923 N/A PHE 193.A N ARG 189.A O no hydrogen 3.198 N/A PHE 193.A N PRO 190.A O no hydrogen 2.991 N/A GLU 196.A N SER 194.A OG no hydrogen 3.137 N/A GLU 196.A N GLU 196.A OE1 no hydrogen 2.670 N/A PHE 198.A N SER 194.A O no hydrogen 2.799 N/A GLU 199.A N LEU 195.A O no hydrogen 2.713 N/A ARG 200.A N GLU 196.A O no hydrogen 3.163 N/A PHE 201.A N ILE 197.A O no hydrogen 2.903 N/A LEU 202.A N PHE 198.A O no hydrogen 3.051 N/A ASN 203.A N GLU 199.A O no hydrogen 3.340 N/A LYS 204.A N ARG 200.A O no hydrogen 3.104 N/A LYS 204.A NZ SER 177.A OG no hydrogen 3.324 N/A LEU 205.A N PHE 201.A O no hydrogen 2.930 N/A CYS 206.A N LEU 202.A O no hydrogen 3.066 N/A ARG 208.A NE ASP 210.A OD1 no hydrogen 3.081 N/A ARG 208.A NH1 TYR 689.A OH no hydrogen 2.860 N/A ARG 208.A NH2 ASP 210.A OD2 no hydrogen 2.725 N/A ILE 211.A N ASP 210.A OD1 no hydrogen 2.768 N/A ASP 212.A N ARG 208.A O no hydrogen 3.143 N/A LYS 213.A N PRO 209.A O no hydrogen 2.906 N/A LYS 213.A NZ TYR 687.A OH no hydrogen 3.501 N/A ILE 214.A N ASP 210.A O no hydrogen 2.943 N/A LEU 215.A N ILE 211.A O no hydrogen 3.060 N/A LEU 216.A N ASP 212.A O no hydrogen 3.108 N/A GLU 217.A N LYS 213.A O no hydrogen 2.949 N/A ILE 218.A N ILE 214.A O no hydrogen 3.222 N/A THR 227.A N GLN 230.A OE1 no hydrogen 2.932 N/A THR 227.A OG1 GLN 230.A OE1 no hydrogen 3.407 N/A GLN 230.A N THR 227.A OG1 no hydrogen 3.045 N/A LEU 231.A N THR 227.A O no hydrogen 3.298 N/A MET 232.A N LEU 228.A O no hydrogen 2.963 N/A ASP 233.A N GLU 229.A O no hydrogen 2.709 N/A PHE 234.A N GLN 230.A O no hydrogen 2.868 N/A ILE 235.A N LEU 231.A O no hydrogen 2.791 N/A ASN 236.A N MET 232.A O no hydrogen 2.785 N/A ASN 236.A ND2 LEU 252.A O no hydrogen 3.345 N/A GLN 237.A N ASP 233.A O no hydrogen 2.833 N/A LYS 238.A N PHE 234.A O no hydrogen 2.807 N/A LYS 238.A NZ GLU 217.A OE2 no hydrogen 2.641 N/A GLN 239.A N PHE 234.A O no hydrogen 3.109 N/A GLN 239.A NE2 ASN 290.A OD1 no hydrogen 2.978 N/A GLN 239.A NE2 TYR 687.A O no hydrogen 2.788 N/A ARG 240.A NH2 ASN 245.A O no hydrogen 3.183 N/A ARG 240.A NH2 TYR 249.A O no hydrogen 2.365 N/A ARG 243.A N ASP 241.A OD1 no hydrogen 3.415 N/A ARG 243.A NE ASP 241.A OD1 no hydrogen 2.969 N/A ARG 243.A NE ASP 241.A OD2 no hydrogen 3.503 N/A ARG 243.A NH1 VAL 680.A O no hydrogen 2.864 N/A ARG 243.A NH2 ASP 241.A OD1 no hydrogen 3.466 N/A ARG 243.A NH2 ASP 241.A OD2 no hydrogen 3.474 N/A ARG 243.A NH2 VAL 680.A O no hydrogen 3.528 N/A LEU 244.A N ASP 241.A O no hydrogen 3.339 N/A GLU 246.A N GLU 246.A OE1 no hydrogen 2.870 N/A VAL 247.A N ASN 245.A OD1 no hydrogen 2.700 N/A TYR 249.A N ASN 245.A O no hydrogen 3.083 N/A LEU 252.A N ASN 236.A OD1 no hydrogen 2.661 N/A ARG 253.A N GLN 256.A OE1 no hydrogen 2.785 N/A GLN 256.A N ARG 253.A O no hydrogen 3.105 N/A ALA 257.A N ARG 253.A O no hydrogen 3.155 N/A ARG 258.A N PRO 254.A O no hydrogen 2.923 N/A ARG 258.A NE ASP 274.A OD2 no hydrogen 3.287 N/A ARG 258.A NH2 ASP 274.A OD2 no hydrogen 2.781 N/A LEU 259.A N SER 255.A O no hydrogen 3.357 N/A LEU 260.A N GLN 256.A O no hydrogen 3.336 N/A ILE 261.A N ALA 257.A O no hydrogen 3.185 N/A GLU 262.A N ARG 258.A O no hydrogen 3.095 N/A LYS 263.A N LEU 259.A O no hydrogen 3.087 N/A LYS 263.A NZ TYR 264.A OH no hydrogen 2.767 N/A LYS 263.A NZ GLU 288.A OE1 no hydrogen 2.980 N/A LYS 263.A NZ GLU 289.A OE2 no hydrogen 3.301 N/A TYR 264.A N LEU 260.A O no hydrogen 3.171 N/A TYR 264.A N ILE 261.A O no hydrogen 3.101 N/A TYR 264.A OH GLU 289.A OE1 no hydrogen 2.437 N/A GLU 265.A N ILE 261.A O no hydrogen 2.818 N/A ASN 267.A N GLU 265.A OE2 no hydrogen 3.077 N/A GLN 269.A N ASN 267.A OD1 no hydrogen 3.226 N/A LEU 271.A N ASN 267.A O no hydrogen 3.091 N/A GLU 272.A N GLN 268.A O no hydrogen 3.125 N/A ARG 273.A N PHE 270.A O no hydrogen 3.023 N/A ARG 273.A NE GLN 275.A OE1 no hydrogen 2.963 N/A ASP 274.A N LEU 271.A O no hydrogen 3.178 N/A GLN 275.A N PHE 270.A O no hydrogen 3.050 N/A MET 276.A N LEU 226.A O no hydrogen 2.991 N/A SER 277.A N GLU 265.A OE1 no hydrogen 2.619 N/A SER 277.A OG GLU 265.A OE1 no hydrogen 2.874 N/A SER 277.A OG GLU 265.A OE2 no hydrogen 3.004 N/A SER 277.A OG GLU 279.A OE1 no hydrogen 2.673 N/A GLU 279.A N GLU 279.A OE1 no hydrogen 2.848 N/A GLY 280.A N SER 277.A OG no hydrogen 3.260 N/A PHE 281.A N SER 277.A O no hydrogen 2.748 N/A SER 282.A N MET 278.A O no hydrogen 2.632 N/A SER 282.A OG MET 278.A O no hydrogen 2.692 N/A ARG 283.A N GLU 279.A O no hydrogen 2.896 N/A ARG 283.A NH1 TYR 264.A O no hydrogen 2.981 N/A TYR 284.A N GLY 280.A O no hydrogen 2.903 N/A LEU 285.A N PHE 281.A O no hydrogen 2.817 N/A GLY 287.A N TYR 284.A O no hydrogen 2.700 N/A GLU 288.A N TYR 264.A OH no hydrogen 3.330 N/A ASN 290.A ND2 LEU 285.A O no hydrogen 2.990 N/A ASN 290.A ND2 TYR 687.A O no hydrogen 2.924 N/A GLU 296.A N GLU 296.A OE1 no hydrogen 2.770 N/A ALA 297.A N PRO 294.A O no hydrogen 3.288 N/A ASP 299.A N LEU 295.A O no hydrogen 2.785 N/A SER 301.A N ASP 299.A O no hydrogen 2.820 N/A SER 301.A OG GLU 296.A O no hydrogen 2.519 N/A SER 301.A OG ASP 299.A O no hydrogen 3.545 N/A THR 302.A N ASN 560.A OD1 no hydrogen 3.306 N/A THR 302.A OG1 ASN 560.A OD1 no hydrogen 2.894 N/A THR 305.A N ASP 303.A OD1 no hydrogen 2.853 N/A THR 305.A OG1 ASP 303.A OD1 no hydrogen 2.611 N/A THR 305.A OG1 ASP 303.A OD2 no hydrogen 3.172 N/A GLN 306.A N TYR 311.A OH no hydrogen 3.119 N/A GLN 306.A NE2 ASP 303.A OD2 no hydrogen 2.503 N/A SER 309.A OG LYS 508.A O no hydrogen 3.443 N/A SER 309.A OG GLN 509.A O no hydrogen 2.703 N/A ALA 310.A N PRO 307.A O no hydrogen 2.926 N/A TYR 311.A OH ASP 303.A O no hydrogen 2.816 N/A PHE 312.A N LEU 566.A O no hydrogen 2.706 N/A ILE 313.A N GLN 537.A O no hydrogen 2.974 N/A ASN 314.A N GLY 564.A O no hydrogen 2.941 N/A ASN 314.A ND2 GLY 342.A O no hydrogen 3.096 N/A SER 315.A OG ILE 313.A O no hydrogen 3.135 N/A SER 316.A N CYS 345.A O no hydrogen 2.598 N/A SER 316.A OG THR 319.A OG1 no hydrogen 2.869 N/A HIS 317.A N LEU 541.A O no hydrogen 2.888 N/A HIS 317.A ND1 ASN 542.A OD1 no hydrogen 3.339 N/A ASN 318.A N GLU 347.A OE1 no hydrogen 2.897 N/A THR 319.A OG1 SER 316.A OG no hydrogen 2.869 N/A LEU 321.A N ASN 318.A O no hydrogen 3.154 N/A THR 322.A N THR 329.A O no hydrogen 3.211 N/A THR 322.A OG1 THR 329.A O no hydrogen 3.242 N/A GLN 325.A N VAL 521.A O no hydrogen 3.139 N/A SER 330.A N THR 370.A OG1 no hydrogen 2.721 N/A SER 330.A OG THR 370.A O no hydrogen 2.595 N/A SER 331.A N TYR 320.A O no hydrogen 2.911 N/A GLU 333.A N SER 331.A OG no hydrogen 3.281 N/A TYR 335.A N VAL 332.A O no hydrogen 3.221 N/A TYR 335.A OH GLU 347.A O no hydrogen 2.600 N/A ARG 336.A NH1 GLU 333.A OE1 no hydrogen 2.571 N/A GLN 337.A N GLU 333.A O no hydrogen 2.718 N/A GLN 337.A NE2 GLU 333.A OE2 no hydrogen 2.806 N/A ALA 338.A N MET 334.A O no hydrogen 2.672 N/A LEU 339.A N TYR 335.A O no hydrogen 3.144 N/A LEU 340.A N ARG 336.A O no hydrogen 2.937 N/A TRP 341.A N ALA 338.A O no hydrogen 3.136 N/A GLY 342.A N LEU 339.A O no hydrogen 3.066 N/A CYS 343.A N ALA 338.A O no hydrogen 3.067 N/A CYS 343.A SG ASN 314.A O no hydrogen 3.799 N/A CYS 343.A SG CYS 345.A O no hydrogen 3.233 N/A ARG 344.A N ASN 314.A O no hydrogen 2.812 N/A ARG 344.A NE CYS 343.A O no hydrogen 2.963 N/A ARG 344.A NH1 ALA 385.A O no hydrogen 2.988 N/A ARG 344.A NH1 TYR 391.A O no hydrogen 3.032 N/A ARG 344.A NH2 LEU 339.A O no hydrogen 3.060 N/A ARG 344.A NH2 ALA 385.A O no hydrogen 2.756 N/A CYS 345.A N ASN 314.A O no hydrogen 3.180 N/A CYS 345.A SG ILE 394.A O no hydrogen 3.905 N/A VAL 346.A N ILE 394.A O no hydrogen 3.272 N/A GLU 347.A N THR 319.A OG1 no hydrogen 2.988 N/A LEU 348.A N SER 396.A O no hydrogen 2.879 N/A TRP 351.A N PHE 361.A O no hydrogen 2.825 N/A GLY 353.A N GLN 406.A OE1 no hydrogen 3.164 N/A GLU 358.A N ARG 354.A O no hydrogen 3.075 N/A ILE 362.A N VAL 372.A O no hydrogen 2.727 N/A THR 363.A OG1 THR 369.A O no hydrogen 3.383 N/A THR 363.A OG1 THR 370.A O no hydrogen 2.809 N/A THR 367.A N HIS 364.A O no hydrogen 3.444 N/A THR 367.A OG1 GLN 325.A O no hydrogen 3.455 N/A THR 367.A OG1 LEU 326.A O no hydrogen 3.227 N/A THR 367.A OG1 HIS 364.A ND1 no hydrogen 3.411 N/A THR 367.A OG1 THR 369.A OG1 no hydrogen 2.926 N/A MET 368.A N LEU 326.A O no hydrogen 2.798 N/A THR 369.A OG1 THR 363.A OG1 no hydrogen 2.816 N/A THR 369.A OG1 THR 367.A OG1 no hydrogen 2.926 N/A THR 370.A N GLY 328.A O no hydrogen 3.356 N/A VAL 372.A N ILE 362.A O no hydrogen 3.200 N/A LEU 374.A N PRO 360.A O no hydrogen 2.845 N/A LEU 378.A N LEU 374.A O no hydrogen 3.109 N/A GLU 379.A N ARG 375.A O no hydrogen 3.309 N/A ALA 380.A N ASP 376.A O no hydrogen 3.042 N/A ILE 381.A N VAL 377.A O no hydrogen 3.096 N/A ALA 382.A N LEU 378.A O no hydrogen 2.852 N/A GLU 383.A N GLU 379.A O no hydrogen 3.147 N/A THR 384.A N ALA 380.A O no hydrogen 3.265 N/A THR 384.A OG1 ALA 380.A O no hydrogen 2.951 N/A ALA 385.A N ILE 381.A O no hydrogen 2.721 N/A LYS 387.A N THR 384.A O no hydrogen 3.231 N/A LYS 387.A NZ ASP 60.A OD1 no hydrogen 2.933 N/A THR 388.A OG1 LEU 340.A O no hydrogen 3.181 N/A SER 389.A OG SER 563.A O no hydrogen 2.645 N/A VAL 393.A N ARG 447.A O no hydrogen 3.240 N/A ILE 394.A N ARG 344.A O no hydrogen 2.648 N/A LEU 395.A N LEU 449.A O no hydrogen 2.606 N/A SER 396.A N VAL 346.A O no hydrogen 2.822 N/A PHE 397.A N LYS 451.A O no hydrogen 3.229 N/A GLU 398.A N LEU 348.A O no hydrogen 2.894 N/A ASN 399.A ND2 VAL 401.A O no hydrogen 3.599 N/A ASN 399.A ND2 GLN 407.A OE1 no hydrogen 2.790 N/A HIS 400.A N VAL 350.A O no hydrogen 2.875 N/A HIS 400.A NE2 GLU 398.A OE2 no hydrogen 3.116 N/A VAL 401.A N ASN 399.A OD1 no hydrogen 2.740 N/A ASP 402.A N ASP 402.A OD1 no hydrogen 2.622 N/A LYS 405.A NZ GLU 358.A OE1 no hydrogen 3.030 N/A GLN 406.A NE2 GLY 353.A O no hydrogen 3.578 N/A GLN 407.A N SER 403.A O no hydrogen 3.101 N/A ALA 408.A N ALA 404.A O no hydrogen 3.155 N/A LYS 409.A N LYS 405.A O no hydrogen 3.192 N/A MET 410.A N GLN 406.A O no hydrogen 2.895 N/A ALA 411.A N GLN 407.A O no hydrogen 3.143 N/A GLU 412.A N ALA 408.A O no hydrogen 3.046 N/A TYR 413.A N LYS 409.A O no hydrogen 2.717 N/A TYR 413.A OH GLU 359.A OE1 no hydrogen 3.331 N/A TYR 413.A OH GLU 359.A OE2 no hydrogen 2.730 N/A CYS 414.A N MET 410.A O no hydrogen 3.039 N/A CYS 414.A SG MET 410.A O no hydrogen 3.307 N/A ARG 415.A N ALA 411.A O no hydrogen 2.844 N/A SER 416.A N GLU 412.A O no hydrogen 2.616 N/A SER 416.A OG GLU 412.A O no hydrogen 2.751 N/A ILE 417.A N TYR 413.A O no hydrogen 3.235 N/A PHE 418.A N CYS 414.A O no hydrogen 3.242 N/A GLY 419.A N ARG 415.A O no hydrogen 2.900 N/A LEU 423.A N ILE 448.A O no hydrogen 3.256 N/A LEU 427.A N TYR 463.A OH no hydrogen 2.836 N/A TYR 430.A OH ASP 443.A OD2 no hydrogen 2.932 N/A GLY 435.A N ASN 479.A O no hydrogen 3.233 N/A GLN 442.A N MET 304.A O no hydrogen 3.099 N/A ASP 443.A N SER 440.A OG no hydrogen 3.069 N/A LEU 444.A N SER 440.A O no hydrogen 3.167 N/A LEU 444.A N PRO 441.A O no hydrogen 3.082 N/A MET 445.A N GLN 442.A O no hydrogen 3.381 N/A GLY 446.A N PRO 390.A O no hydrogen 2.728 N/A ARG 447.A N LEU 444.A O no hydrogen 3.180 N/A ARG 447.A NH1 ALA 421.A O no hydrogen 3.073 N/A LEU 449.A N VAL 393.A O no hydrogen 3.013 N/A LYS 451.A N LEU 395.A O no hydrogen 2.905 N/A LYS 451.A NZ SER 486.A OG no hydrogen 3.403 N/A VAL 461.A N SER 458.A O no hydrogen 2.766 N/A ASN 462.A ND2 LEU 423.A O no hydrogen 3.223 N/A TYR 463.A N ASN 462.A OD1 no hydrogen 2.658 N/A TYR 463.A OH TYR 430.A O no hydrogen 2.511 N/A GLU 465.A N PHE 482.A O no hydrogen 3.147 N/A VAL 467.A N MET 484.A O no hydrogen 2.691 N/A ALA 474.A N SER 471.A OG no hydrogen 3.068 N/A ALA 475.A N SER 471.A O no hydrogen 3.080 N/A ARG 476.A N PHE 472.A O no hydrogen 3.256 N/A LYS 477.A N GLU 473.A O no hydrogen 2.944 N/A ARG 478.A N ALA 474.A O no hydrogen 3.412 N/A ARG 478.A NE GLU 483.A OE1 no hydrogen 2.896 N/A ARG 478.A NH2 GLU 483.A OE1 no hydrogen 3.522 N/A ARG 478.A NH2 GLU 483.A OE2 no hydrogen 2.700 N/A ASN 479.A N ALA 475.A O no hydrogen 3.079 N/A CYS 481.A SG VAL 436.A O no hydrogen 3.160 N/A CYS 481.A SG GLN 509.A O no hydrogen 3.853 N/A MET 484.A N GLU 465.A O no hydrogen 2.794 N/A SER 485.A N LEU 511.A O no hydrogen 3.343 N/A SER 485.A OG VAL 467.A O no hydrogen 2.857 N/A PHE 487.A N ARG 513.A O no hydrogen 2.644 N/A ALA 492.A N VAL 488.A O no hydrogen 2.967 N/A MET 493.A N GLU 489.A O no hydrogen 2.952 N/A GLU 494.A N THR 490.A O no hydrogen 3.087 N/A GLN 495.A N LYS 491.A O no hydrogen 3.200 N/A LEU 496.A N ALA 492.A O no hydrogen 2.891 N/A THR 497.A N MET 493.A O no hydrogen 3.193 N/A THR 497.A OG1 MET 493.A O no hydrogen 3.285 N/A THR 497.A OG1 GLU 494.A O no hydrogen 3.499 N/A LYS 498.A N GLU 494.A O no hydrogen 3.269 N/A LYS 498.A NZ GLU 494.A OE2 no hydrogen 3.323 N/A SER 499.A N GLN 495.A O no hydrogen 2.896 N/A SER 499.A OG GLU 502.A OE1 no hydrogen 3.515 N/A PHE 503.A N SER 499.A O no hydrogen 3.043 N/A VAL 504.A N PRO 500.A O no hydrogen 3.230 N/A GLU 505.A N MET 501.A O no hydrogen 3.034 N/A TYR 506.A N GLU 502.A O no hydrogen 2.885 N/A TYR 506.A OH LEU 511.A O no hydrogen 2.531 N/A ASN 507.A N PHE 503.A O no hydrogen 2.821 N/A ASN 507.A ND2 VAL 534.A O no hydrogen 2.682 N/A LYS 508.A N VAL 504.A O no hydrogen 2.892 N/A LYS 508.A NZ GLU 505.A OE2 no hydrogen 2.794 N/A LYS 508.A NZ ARG 574.A O no hydrogen 2.653 N/A GLN 509.A N TYR 506.A O no hydrogen 3.287 N/A GLN 510.A N TYR 506.A O no hydrogen 3.053 N/A GLN 510.A NE2 GLU 483.A O no hydrogen 3.306 N/A SER 512.A N GLN 537.A OE1 no hydrogen 2.934 N/A SER 512.A OG ASN 507.A OD1 no hydrogen 2.657 N/A ARG 513.A N SER 485.A O no hydrogen 2.990 N/A ARG 513.A NH2 SER 316.A O no hydrogen 3.529 N/A ARG 513.A NH2 GLU 347.A OE1 no hydrogen 2.975 N/A ILE 514.A N LEU 538.A O no hydrogen 2.735 N/A TYR 515.A N PHE 487.A O no hydrogen 3.180 N/A LYS 517.A N GLU 489.A OE1 no hydrogen 3.468 N/A ARG 520.A N LYS 517.A O no hydrogen 3.157 N/A ARG 520.A NE GLU 489.A OE1 no hydrogen 2.688 N/A ARG 520.A NH2 GLU 489.A OE2 no hydrogen 3.054 N/A VAL 521.A N THR 519.A O no hydrogen 2.823 N/A SER 523.A N ARG 520.A O no hydrogen 3.227 N/A SER 523.A OG ALA 323.A O no hydrogen 2.546 N/A ASN 525.A ND2 ASN 542.A O no hydrogen 3.360 N/A ASN 525.A ND2 ASP 547.A OD1 no hydrogen 3.361 N/A ASN 525.A ND2 ASP 547.A OD2 no hydrogen 3.434 N/A GLN 529.A NE2 ASN 533.A OD1 no hydrogen 3.105 N/A GLN 529.A NE2 LEU 658.A O no hydrogen 3.560 N/A LEU 530.A N MET 527.A O no hydrogen 3.254 N/A PHE 531.A N PRO 528.A O no hydrogen 3.024 N/A TRP 532.A N PRO 528.A O no hydrogen 3.152 N/A ASN 533.A N GLN 529.A O no hydrogen 2.989 N/A ASN 533.A ND2 GLY 620.A O no hydrogen 2.967 N/A VAL 534.A N PHE 531.A O no hydrogen 3.296 N/A GLY 535.A N TRP 532.A O no hydrogen 3.122 N/A CYS 536.A N PHE 531.A O no hydrogen 2.877 N/A CYS 536.A SG SER 512.A OG no hydrogen 2.993 N/A GLN 537.A NE2 SER 309.A O no hydrogen 2.735 N/A GLN 537.A NE2 GLN 510.A O no hydrogen 3.190 N/A LEU 538.A N SER 512.A O no hydrogen 3.356 N/A ALA 540.A N ILE 514.A O no hydrogen 2.588 N/A LEU 541.A N SER 315.A O no hydrogen 3.368 N/A ASN 542.A N ASN 525.A OD1 no hydrogen 2.990 N/A ASN 542.A ND2 SER 524.A O no hydrogen 3.653 N/A GLN 544.A N GLN 544.A OE1 no hydrogen 2.752 N/A GLN 544.A NE2 SER 523.A OG no hydrogen 3.248 N/A GLN 544.A NE2 ASN 542.A OD1 no hydrogen 3.436 N/A THR 545.A N ASN 542.A O no hydrogen 3.226 N/A THR 545.A OG1 SER 523.A O no hydrogen 2.835 N/A MET 550.A N ASP 547.A OD1 no hydrogen 3.121 N/A GLN 551.A N ASP 547.A O no hydrogen 3.101 N/A GLN 551.A NE2 LEU 546.A O no hydrogen 3.398 N/A LEU 552.A N VAL 548.A O no hydrogen 3.022 N/A ASN 553.A N ALA 549.A O no hydrogen 3.184 N/A ASN 553.A ND2 ASN 314.A OD1 no hydrogen 2.755 N/A ALA 554.A N MET 550.A O no hydrogen 2.791 N/A GLY 555.A N GLN 551.A O no hydrogen 2.907 N/A VAL 556.A N LEU 552.A O no hydrogen 2.829 N/A PHE 557.A N ASN 553.A O no hydrogen 3.180 N/A TYR 559.A N VAL 556.A O no hydrogen 3.307 N/A TYR 559.A OH ILE 677.A O no hydrogen 2.570 N/A ASN 560.A N ALA 297.A O no hydrogen 3.213 N/A ASN 560.A ND2 TYR 565.A O no hydrogen 2.764 N/A GLY 561.A N LEU 298.A O no hydrogen 2.700 N/A ARG 562.A N GLU 558.A O no hydrogen 2.930 N/A SER 563.A N ASN 560.A O no hydrogen 2.913 N/A SER 563.A OG ASN 560.A O no hydrogen 2.589 N/A SER 563.A OG TYR 565.A O no hydrogen 3.178 N/A TYR 565.A OH PRO 392.A O no hydrogen 2.588 N/A LEU 566.A N PHE 312.A O no hydrogen 2.861 N/A LYS 568.A N ALA 310.A O no hydrogen 3.047 N/A LYS 568.A NZ SER 309.A O no hydrogen 3.117 N/A LYS 568.A NZ ASN 507.A O no hydrogen 3.271 N/A LYS 568.A NZ GLY 535.A O no hydrogen 3.227 N/A MET 572.A N PRO 569.A O no hydrogen 3.139 N/A ARG 573.A N GLU 570.A O no hydrogen 3.188 N/A ARG 573.A NE LYS 568.A O no hydrogen 2.736 N/A ARG 573.A NH2 LYS 568.A O no hydrogen 3.469 N/A ARG 574.A N GLU 570.A O no hydrogen 3.010 N/A ARG 574.A NE ASP 576.A OD1 no hydrogen 3.150 N/A ARG 574.A NH1 GLU 570.A OE2 no hydrogen 2.889 N/A ARG 574.A NH2 ASP 576.A OD2 no hydrogen 2.830 N/A LYS 577.A N ARG 574.A O no hydrogen 3.450 N/A PHE 582.A N ASP 580.A OD1 no hydrogen 3.137 N/A THR 583.A N ASP 580.A O no hydrogen 2.781 N/A THR 583.A OG1 ASP 580.A O no hydrogen 2.571 N/A ILE 590.A N VAL 587.A O no hydrogen 3.281 N/A ASN 593.A N VAL 653.A O no hydrogen 2.896 N/A ALA 594.A N SER 712.A O no hydrogen 3.028 N/A LEU 595.A N PHE 650.A O no hydrogen 2.919 N/A ARG 596.A NE ASP 649.A OD1 no hydrogen 3.220 N/A ARG 596.A NH1 GLU 710.A OE1 no hydrogen 3.285 N/A LYS 598.A N TYR 708.A O no hydrogen 3.100 N/A ILE 600.A N LEU 706.A O no hydrogen 3.112 N/A SER 601.A N LEU 706.A O no hydrogen 3.415 N/A SER 601.A OG ASP 210.A OD2 no hydrogen 2.797 N/A SER 601.A OG GLN 603.A OE1 no hydrogen 3.277 N/A GLY 602.A N PRO 641.A O no hydrogen 3.255 N/A GLN 603.A N ALA 704.A O no hydrogen 2.786 N/A PHE 604.A N PHE 639.A O no hydrogen 2.993 N/A LEU 605.A N SER 638.A O no hydrogen 3.319 N/A SER 606.A OG GLU 667.A OE2 no hydrogen 2.690 N/A ILE 612.A N SER 634.A OG no hydrogen 2.726 N/A TYR 613.A N PHE 666.A O no hydrogen 2.994 N/A VAL 614.A N THR 631.A OG1 no hydrogen 2.747 N/A GLU 615.A N ALA 664.A O no hydrogen 2.764 N/A ASP 617.A N ARG 662.A O no hydrogen 2.948 N/A MET 618.A N ARG 626.A O no hydrogen 3.002 N/A PHE 619.A N SER 660.A O no hydrogen 2.821 N/A GLY 620.A N THR 625.A OG1 no hydrogen 3.104 N/A THR 625.A N LEU 621.A O no hydrogen 2.747 N/A THR 625.A OG1 LEU 621.A O no hydrogen 3.137 N/A TYR 629.A OH ASP 649.A O no hydrogen 2.653 N/A ARG 630.A NH2 THR 633.A OG1 no hydrogen 2.728 N/A THR 631.A N VAL 614.A O no hydrogen 2.949 N/A THR 631.A OG1 VAL 614.A O no hydrogen 3.398 N/A ARG 632.A N GLU 645.A OE1 no hydrogen 3.296 N/A SER 634.A N ILE 612.A O no hydrogen 2.789 N/A SER 634.A OG ILE 612.A O no hydrogen 3.452 N/A SER 634.A OG ASN 637.A O no hydrogen 3.203 N/A GLY 636.A N SER 634.A O no hydrogen 3.002 N/A ASN 637.A ND2 ASN 640.A OD1 no hydrogen 3.104 N/A SER 638.A OG ARG 608.A O no hydrogen 3.311 N/A ASN 640.A ND2 LEU 207.A O no hydrogen 3.262 N/A PHE 648.A N VAL 597.A O no hydrogen 2.733 N/A PHE 650.A N LEU 595.A O no hydrogen 2.815 N/A LYS 652.A NZ GLU 584.A O no hydrogen 3.075 N/A VAL 653.A N ASN 593.A O no hydrogen 2.650 N/A VAL 654.A N ASP 624.A OD1 no hydrogen 2.628 N/A LEU 655.A N ASP 624.A OD2 no hydrogen 3.140 N/A LEU 658.A N LEU 655.A O no hydrogen 3.208 N/A ALA 659.A N LEU 655.A O no hydrogen 3.223 N/A ALA 659.A N PRO 656.A O no hydrogen 3.034 N/A SER 660.A N PHE 619.A O no hydrogen 2.672 N/A LEU 661.A N LEU 678.A O no hydrogen 2.881 N/A ARG 662.A N ASP 617.A O no hydrogen 2.728 N/A ARG 662.A NH2 GLN 551.A OE1 no hydrogen 3.216 N/A ILE 663.A N ARG 676.A O no hydrogen 2.946 N/A ALA 664.A N GLU 615.A O no hydrogen 3.192 N/A ALA 665.A N GLY 674.A O no hydrogen 2.842 N/A PHE 666.A N TYR 613.A O no hydrogen 2.879 N/A GLU 667.A N LYS 671.A O no hydrogen 2.803 N/A GLU 668.A N GLY 611.A O no hydrogen 2.579 N/A GLY 670.A N GLU 667.A O no hydrogen 2.919 N/A VAL 673.A N ALA 665.A O no hydrogen 3.201 N/A HIS 675.A N ARG 693.A O no hydrogen 2.796 N/A ARG 676.A NE CYS 691.A O no hydrogen 3.235 N/A LEU 678.A N LEU 661.A O no hydrogen 2.772 N/A VAL 680.A N ALA 659.A O no hydrogen 3.253 N/A ALA 682.A N PRO 679.A O no hydrogen 3.006 N/A ILE 683.A N PRO 679.A O no hydrogen 3.029 N/A ARG 684.A N ILE 292.A O no hydrogen 2.982 N/A ARG 684.A NH1 GLU 289.A O no hydrogen 2.952 N/A ARG 684.A NH1 GLY 291.A O no hydrogen 3.341 N/A GLY 686.A N THR 709.A O no hydrogen 2.662 N/A TYR 687.A N GLN 239.A OE1 no hydrogen 2.815 N/A TYR 687.A OH GLU 217.A OE1 no hydrogen 2.841 N/A TYR 687.A OH GLU 217.A OE2 no hydrogen 2.918 N/A HIS 688.A N ILE 707.A O no hydrogen 3.128 N/A HIS 688.A ND1 ASN 290.A O no hydrogen 3.045 N/A HIS 688.A NE2 SER 685.A O no hydrogen 2.731 N/A VAL 690.A N LEU 705.A O no hydrogen 2.684 N/A LEU 692.A N PRO 703.A O no hydrogen 3.224 N/A ARG 693.A N HIS 675.A O no hydrogen 2.913 N/A ARG 693.A NE ASN 697.A O no hydrogen 3.295 N/A ARG 693.A NE ASN 697.A OD1 no hydrogen 3.139 N/A ASN 694.A N GLN 698.A O no hydrogen 2.931 N/A ASN 694.A ND2 PRO 95.A O no hydrogen 3.447 N/A ASN 694.A ND2 GLN 698.A OE1 no hydrogen 3.288 N/A GLU 695.A N GLU 695.A OE1 no hydrogen 2.850 N/A ASN 697.A N ASN 694.A O no hydrogen 2.825 N/A ASN 697.A ND2 ALA 554.A O no hydrogen 3.495 N/A GLN 698.A N ASN 694.A OD1 no hydrogen 2.711 N/A GLN 698.A NE2 SER 57.A O no hydrogen 3.618 N/A GLN 698.A NE2 GLY 94.A O no hydrogen 2.778 N/A LEU 700.A N LEU 692.A O no hydrogen 3.276 N/A CYS 701.A SG PHE 137.A O no hydrogen 3.110 N/A ALA 704.A N GLN 603.A O no hydrogen 3.259 N/A LEU 705.A N VAL 690.A O no hydrogen 3.274 N/A LEU 706.A N SER 601.A O no hydrogen 3.063 N/A ILE 707.A N HIS 688.A O no hydrogen 3.099 N/A TYR 708.A N LYS 598.A O no hydrogen 2.913 N/A TYR 708.A OH GLU 710.A OE2 no hydrogen 2.822 N/A THR 709.A N GLY 686.A O no hydrogen 3.153 N/A THR 709.A OG1 ARG 684.A O no hydrogen 2.645 N/A THR 709.A OG1 GLY 686.A O no hydrogen 3.440 N/A TYR 714.A N ALA 592.A O no hydrogen 2.810 N/A GLN 720.A N ASP 717.A O no hydrogen 3.428 N/A ALA 723.A N HIS 719.A O no hydrogen 3.291 N/A GLU 724.A N GLN 720.A O no hydrogen 3.278 N/A ALA 725.A N TYR 722.A O no hydrogen 3.244 N/A LEU 726.A N TYR 722.A O no hydrogen 3.300 N/A ILE 727.A N ALA 723.A O no hydrogen 3.051 N/A ASN 728.A N GLU 724.A O no hydrogen 2.995 N/A VAL 733.A N PRO 729.A O no hydrogen 2.969 N/A SER 734.A N ILE 730.A O no hydrogen 2.832 N/A LEU 735.A N LYS 731.A O no hydrogen 3.242 N/A MET 736.A N HIS 732.A O no hydrogen 3.171 N/A ASP 737.A N VAL 733.A O no hydrogen 2.986 N/A GLN 738.A N SER 734.A O no hydrogen 3.061 N/A ARG 739.A N LEU 735.A O no hydrogen 2.832 N/A ALA 740.A N MET 736.A O no hydrogen 3.151 N/A ARG 741.A N ASP 737.A O no hydrogen 3.083 N/A GLN 742.A N GLN 738.A O no hydrogen 2.680 N/A LEU 743.A N ARG 739.A O no hydrogen 3.083 N/A ALA 744.A N ARG 741.A O no hydrogen 3.187 N/A ILE 747.A N LEU 743.A O no hydrogen 3.202 N/A GLY 748.A N ALA 744.A O no hydrogen 3.443 N/A