Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2is4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A OG ASP 2.A O no hydrogen 2.958 N/A TYR 5.A N ASP 2.A O no hydrogen 2.657 N/A ASP 8.A N SER 4.A O no hydrogen 3.061 N/A ASN 11.A N GLN 14.A OE1 no hydrogen 2.958 N/A ASN 11.A ND2 TYR 280.A OH no hydrogen 2.744 N/A GLN 14.A N ASN 11.A OD1 no hydrogen 3.067 N/A GLN 14.A NE2 SER 33.A O no hydrogen 3.198 N/A ARG 15.A N ASN 11.A O no hydrogen 2.857 N/A GLU 16.A N ASP 12.A O no hydrogen 3.101 N/A ALA 17.A N GLN 14.A O no hydrogen 2.902 N/A VAL 18.A N GLN 14.A O no hydrogen 2.905 N/A ALA 19.A N ARG 15.A O no hydrogen 2.750 N/A ARG 22.A NE ASN 213.A OD1 no hydrogen 3.229 N/A ARG 22.A NH2 THR 212.A O no hydrogen 3.060 N/A ARG 22.A NH2 ASN 213.A OD1 no hydrogen 3.486 N/A SER 23.A OG ASN 24.A O no hydrogen 3.123 N/A ASN 24.A ND2 PRO 269.A O no hydrogen 2.943 N/A LEU 25.A N VAL 240.A O no hydrogen 2.996 N/A LEU 26.A N GLU 272.A O no hydrogen 2.865 N/A VAL 27.A N ILE 242.A O no hydrogen 2.796 N/A LEU 28.A N ILE 274.A O no hydrogen 3.045 N/A ALA 29.A N GLY 244.A O no hydrogen 3.076 N/A ALA 31.A N TYR 584.A OH no hydrogen 3.394 N/A SER 33.A OG GLY 30.A O no hydrogen 2.630 N/A LYS 35.A NZ ALA 29.A O no hydrogen 2.988 N/A LYS 35.A NZ GLY 30.A O no hydrogen 2.698 N/A THR 36.A OG1 ASP 217.A OD1 no hydrogen 3.518 N/A THR 36.A OG1 ASP 217.A OD2 no hydrogen 2.920 N/A VAL 38.A N GLY 34.A O no hydrogen 2.645 N/A LEU 39.A N LYS 35.A O no hydrogen 2.781 N/A VAL 40.A N THR 36.A O no hydrogen 3.049 N/A HIS 41.A N ARG 37.A O no hydrogen 2.889 N/A HIS 41.A ND1 LEU 6.A O no hydrogen 2.869 N/A ARG 42.A N VAL 38.A O no hydrogen 2.721 N/A ARG 42.A NH1 VAL 18.A O no hydrogen 2.848 N/A ARG 42.A NH1 ALA 20.A O no hydrogen 2.810 N/A ARG 42.A NH2 ALA 20.A O no hydrogen 3.196 N/A ARG 42.A NH2 PRO 21.A O no hydrogen 3.207 N/A ILE 43.A N LEU 39.A O no hydrogen 3.289 N/A ALA 44.A N VAL 40.A O no hydrogen 3.398 N/A TRP 45.A N HIS 41.A O no hydrogen 2.842 N/A LEU 46.A N ARG 42.A O no hydrogen 2.710 N/A MET 47.A N ALA 44.A O no hydrogen 3.015 N/A SER 48.A N ALA 44.A O no hydrogen 2.951 N/A SER 48.A OG ALA 44.A O no hydrogen 2.995 N/A VAL 49.A N TRP 45.A O no hydrogen 3.015 N/A GLU 50.A N TRP 45.A O no hydrogen 3.302 N/A ASN 51.A ND2 VAL 49.A O no hydrogen 3.498 N/A CYS 52.A N LEU 46.A O no hydrogen 2.903 N/A CYS 52.A SG GLU 50.A O no hydrogen 3.715 N/A TYR 55.A N SER 53.A OG no hydrogen 2.849 N/A SER 56.A N SER 53.A O no hydrogen 2.939 N/A SER 56.A OG SER 53.A O no hydrogen 2.533 N/A ILE 57.A N PRO 54.A O no hydrogen 3.234 N/A MET 58.A N ASN 213.A O no hydrogen 2.869 N/A ALA 59.A N TRP 86.A O no hydrogen 2.676 N/A VAL 60.A N LEU 215.A O no hydrogen 2.866 N/A THR 61.A N GLY 88.A O no hydrogen 3.255 N/A THR 61.A OG1 ASP 217.A O no hydrogen 2.898 N/A ALA 66.A N THR 63.A OG1 no hydrogen 3.197 N/A ALA 67.A N THR 63.A O no hydrogen 2.937 N/A ALA 68.A N ASN 64.A O no hydrogen 2.733 N/A GLU 69.A N LYS 65.A O no hydrogen 2.829 N/A MET 70.A N ALA 66.A O no hydrogen 3.117 N/A ARG 71.A N ALA 67.A O no hydrogen 2.866 N/A ARG 71.A NH1 VAL 87.A O no hydrogen 2.940 N/A HIS 72.A N ALA 68.A O no hydrogen 3.000 N/A ARG 73.A N GLU 69.A O no hydrogen 3.229 N/A ARG 73.A NE GLU 69.A OE2 no hydrogen 2.833 N/A ARG 73.A NH2 GLU 69.A OE2 no hydrogen 3.254 N/A ILE 74.A N MET 70.A O no hydrogen 2.843 N/A GLY 75.A N ARG 71.A O no hydrogen 3.255 N/A GLN 76.A N HIS 72.A O no hydrogen 2.991 N/A GLN 76.A N ARG 73.A O no hydrogen 3.128 N/A LEU 77.A N ARG 73.A O no hydrogen 2.965 N/A MET 78.A N ILE 74.A O no hydrogen 2.821 N/A TRP 86.A N ILE 57.A O no hydrogen 3.141 N/A GLY 88.A N ALA 59.A O no hydrogen 3.267 N/A PHE 90.A N THR 61.A O no hydrogen 3.011 N/A GLY 92.A N THR 89.A OG1 no hydrogen 2.943 N/A LEU 93.A N THR 89.A O no hydrogen 2.830 N/A ALA 94.A N PHE 90.A O no hydrogen 2.706 N/A HIS 95.A N HIS 91.A O no hydrogen 2.727 N/A ARG 96.A N GLY 92.A O no hydrogen 2.882 N/A LEU 97.A N LEU 93.A O no hydrogen 3.071 N/A LEU 98.A N ALA 94.A O no hydrogen 3.288 N/A ARG 99.A N HIS 95.A O no hydrogen 3.018 N/A ALA 100.A N ARG 96.A O no hydrogen 3.376 N/A HIS 101.A NE2 TYR 207.A OH no hydrogen 2.719 N/A ALA 105.A N HIS 101.A O no hydrogen 2.903 N/A ASN 106.A N MET 103.A O no hydrogen 2.877 N/A LEU 107.A N HIS 102.A O no hydrogen 2.734 N/A PHE 111.A N PRO 108.A O no hydrogen 3.330 N/A GLN 112.A N GLY 182.A O no hydrogen 3.206 N/A GLN 112.A NE2 ILE 113.A O no hydrogen 3.586 N/A LEU 114.A N VAL 184.A O no hydrogen 2.631 N/A ASP 118.A N ASP 115.A OD2 no hydrogen 3.127 N/A GLN 119.A N ASP 115.A O no hydrogen 3.003 N/A GLN 119.A NE2 ASN 147.A OD1 no hydrogen 3.528 N/A LEU 120.A N SER 116.A O no hydrogen 3.265 N/A ARG 121.A N GLU 117.A O no hydrogen 2.988 N/A LEU 122.A N ASP 118.A O no hydrogen 2.639 N/A LEU 123.A N GLN 119.A O no hydrogen 2.972 N/A LYS 124.A N LEU 120.A O no hydrogen 3.070 N/A ARG 125.A N ARG 121.A O no hydrogen 3.255 N/A LEU 126.A N LEU 122.A O no hydrogen 3.180 N/A ILE 127.A N LEU 123.A O no hydrogen 2.783 N/A LYS 128.A N LYS 124.A O no hydrogen 3.008 N/A ALA 129.A N ARG 125.A O no hydrogen 2.964 N/A MET 130.A N ILE 127.A O no hydrogen 3.415 N/A ASN 131.A N LYS 128.A O no hydrogen 2.526 N/A LEU 132.A N ILE 127.A O no hydrogen 3.385 N/A GLN 136.A N ASP 133.A O no hydrogen 2.896 N/A GLN 136.A NE2 ASP 133.A OD2 no hydrogen 3.325 N/A TRP 137.A N ASP 133.A O no hydrogen 3.078 N/A ALA 142.A N PRO 139.A O no hydrogen 2.921 N/A MET 143.A N PRO 139.A O no hydrogen 2.837 N/A TRP 144.A N ARG 140.A O no hydrogen 2.997 N/A TYR 145.A OH GLU 164.A OE2 no hydrogen 3.399 N/A TYR 145.A OH GLN 168.A OE1 no hydrogen 3.182 N/A ILE 146.A N ALA 142.A O no hydrogen 3.028 N/A ASN 147.A N MET 143.A O no hydrogen 3.152 N/A ASN 147.A ND2 GLN 119.A OE1 no hydrogen 3.071 N/A SER 148.A N TRP 144.A O no hydrogen 3.080 N/A SER 148.A OG TRP 144.A O no hydrogen 2.825 N/A GLN 149.A N TYR 145.A O no hydrogen 2.986 N/A LYS 150.A N ILE 146.A O no hydrogen 2.983 N/A LYS 150.A NZ ASP 185.A OD1 no hydrogen 3.461 N/A LYS 150.A NZ ASP 185.A OD2 no hydrogen 2.516 N/A LYS 150.A NZ GLU 188.A OE1 no hydrogen 2.666 N/A ASP 151.A N ASN 147.A O no hydrogen 2.723 N/A GLU 152.A N SER 148.A O no hydrogen 3.274 N/A GLU 152.A N GLN 149.A O no hydrogen 2.759 N/A GLY 153.A N GLN 149.A O no hydrogen 2.951 N/A GLY 153.A N LYS 150.A O no hydrogen 2.907 N/A LEU 154.A N GLN 149.A O no hydrogen 3.187 N/A ARG 155.A NE GLU 195.A OE2 no hydrogen 2.851 N/A ARG 155.A NH1 GLU 188.A OE1 no hydrogen 3.109 N/A ARG 155.A NH2 GLU 188.A OE2 no hydrogen 2.985 N/A ARG 155.A NH2 GLU 195.A OE1 no hydrogen 3.207 N/A ARG 155.A NH2 GLU 195.A OE2 no hydrogen 3.078 N/A HIS 158.A N ARG 155.A O no hydrogen 3.046 N/A THR 166.A N PRO 162.A O no hydrogen 3.099 N/A THR 166.A OG1 PRO 162.A O no hydrogen 2.893 N/A THR 166.A OG1 VAL 163.A O no hydrogen 3.183 N/A TRP 167.A N VAL 163.A O no hydrogen 3.213 N/A GLN 168.A N GLU 164.A O no hydrogen 2.954 N/A GLN 168.A NE2 PRO 156.A O no hydrogen 2.570 N/A LYS 169.A N GLN 165.A O no hydrogen 3.121 N/A LYS 169.A N THR 166.A O no hydrogen 2.512 N/A VAL 170.A N THR 166.A O no hydrogen 2.968 N/A TYR 171.A N TRP 167.A O no hydrogen 2.558 N/A TYR 171.A OH LEU 154.A O no hydrogen 2.874 N/A GLN 172.A N GLN 168.A O no hydrogen 3.072 N/A ALA 173.A N LYS 169.A O no hydrogen 2.724 N/A TYR 174.A N VAL 170.A O no hydrogen 2.965 N/A TYR 174.A OH ASP 185.A OD2 no hydrogen 3.053 N/A GLN 175.A N TYR 171.A O no hydrogen 2.921 N/A GLN 175.A NE2 GLU 188.A OE1 no hydrogen 3.453 N/A GLU 176.A N GLN 172.A O no hydrogen 2.994 N/A ALA 177.A N ALA 173.A O no hydrogen 3.008 N/A CYS 178.A N TYR 174.A O no hydrogen 2.963 N/A CYS 178.A SG TYR 174.A O no hydrogen 3.447 N/A ASP 179.A N GLN 175.A O no hydrogen 2.907 N/A ARG 180.A N GLU 176.A O no hydrogen 2.952 N/A ARG 180.A NH2 GLN 431.A OE1 no hydrogen 3.115 N/A ALA 181.A N ALA 177.A O no hydrogen 3.068 N/A GLY 182.A N CYS 178.A O no hydrogen 2.467 N/A GLY 182.A N ASP 179.A O no hydrogen 3.241 N/A LEU 183.A N CYS 178.A O no hydrogen 3.068 N/A VAL 184.A N GLN 112.A O no hydrogen 2.812 N/A GLU 188.A N ASP 185.A OD1 no hydrogen 2.542 N/A LEU 189.A N PHE 186.A O no hydrogen 3.028 N/A LEU 191.A N ALA 187.A O no hydrogen 3.195 N/A ARG 192.A N GLU 188.A O no hydrogen 2.826 N/A ARG 192.A NE ALA 105.A O no hydrogen 3.364 N/A ARG 192.A NH1 GLU 188.A OE2 no hydrogen 2.870 N/A ARG 192.A NH2 ASN 106.A O no hydrogen 3.515 N/A ALA 193.A N LEU 189.A O no hydrogen 3.299 N/A HIS 194.A N LEU 190.A O no hydrogen 2.977 N/A GLU 195.A N LEU 191.A O no hydrogen 2.999 N/A LEU 196.A N ARG 192.A O no hydrogen 2.800 N/A TRP 197.A N HIS 194.A O no hydrogen 2.978 N/A ASN 199.A N GLU 195.A O no hydrogen 2.694 N/A ILE 203.A N LYS 200.A O no hydrogen 2.537 N/A LEU 204.A N LYS 200.A O no hydrogen 3.182 N/A GLN 205.A N PRO 201.A O no hydrogen 2.929 N/A HIS 206.A N HIS 202.A O no hydrogen 3.164 N/A TYR 207.A N ILE 203.A O no hydrogen 3.266 N/A TYR 207.A OH HIS 101.A NE2 no hydrogen 2.719 N/A ARG 208.A N LEU 204.A O no hydrogen 2.888 N/A GLU 209.A N GLN 205.A O no hydrogen 2.985 N/A ARG 210.A N TYR 207.A O no hydrogen 2.924 N/A ARG 210.A NE TYR 55.A O no hydrogen 2.818 N/A ARG 210.A NH2 GLY 84.A O no hydrogen 2.944 N/A PHE 211.A N TYR 207.A O no hydrogen 2.749 N/A ASN 213.A N SER 56.A O no hydrogen 3.148 N/A ASN 213.A ND2 SER 56.A OG no hydrogen 3.234 N/A ILE 214.A N LYS 239.A O no hydrogen 3.124 N/A LEU 215.A N MET 58.A O no hydrogen 2.915 N/A VAL 216.A N MET 241.A O no hydrogen 2.916 N/A ASP 217.A N VAL 60.A O no hydrogen 3.167 N/A GLU 218.A N ASP 217.A OD1 no hydrogen 2.776 N/A PHE 219.A N VAL 243.A O no hydrogen 2.853 N/A GLN 220.A N GLN 220.A OE1 no hydrogen 2.858 N/A GLN 220.A NE2 GLU 218.A OE1 no hydrogen 2.906 N/A GLN 220.A NE2 GLN 248.A O no hydrogen 3.560 N/A ASP 221.A N GLU 218.A O no hydrogen 2.931 N/A THR 222.A N PHE 219.A O no hydrogen 2.824 N/A THR 222.A OG1 PHE 219.A O no hydrogen 2.998 N/A ASN 223.A N GLN 226.A OE1 no hydrogen 3.077 N/A ILE 225.A N ASP 151.A O no hydrogen 3.032 N/A TYR 227.A N ASN 223.A O no hydrogen 3.097 N/A TYR 227.A OH ASP 267.A OD2 no hydrogen 2.626 N/A ALA 228.A N ASN 224.A O no hydrogen 3.019 N/A TRP 229.A N ILE 225.A O no hydrogen 3.090 N/A ILE 230.A N GLN 226.A O no hydrogen 3.139 N/A ILE 230.A N TYR 227.A O no hydrogen 2.836 N/A ARG 231.A N TYR 227.A O no hydrogen 2.794 N/A LEU 232.A N ALA 228.A O no hydrogen 2.850 N/A LEU 233.A N TRP 229.A O no hydrogen 3.296 N/A ALA 234.A N ILE 230.A O no hydrogen 3.024 N/A GLY 235.A N ARG 231.A O no hydrogen 2.783 N/A GLY 235.A N LEU 232.A O no hydrogen 2.572 N/A THR 237.A N ALA 234.A O no hydrogen 3.129 N/A GLY 238.A N ALA 234.A O no hydrogen 2.736 N/A LYS 239.A N THR 212.A O no hydrogen 3.153 N/A VAL 240.A N ASN 24.A OD1 no hydrogen 2.723 N/A MET 241.A N ILE 214.A O no hydrogen 2.761 N/A ILE 242.A N LEU 25.A O no hydrogen 3.016 N/A VAL 243.A N VAL 216.A O no hydrogen 3.148 N/A GLY 244.A N VAL 27.A O no hydrogen 2.998 N/A ASP 245.A N GLN 220.A OE1 no hydrogen 3.042 N/A ASP 247.A N ASP 245.A OD1 no hydrogen 2.717 N/A GLN 248.A N ASP 245.A O no hydrogen 2.956 N/A GLN 248.A NE2 ASP 245.A OD2 no hydrogen 3.350 N/A GLY 252.A N GLU 578.A OE1 no hydrogen 3.263 N/A TRP 253.A NE1 ILE 250.A O no hydrogen 3.153 N/A ARG 254.A N TYR 251.A O no hydrogen 2.737 N/A ARG 254.A NH1 ASP 221.A O no hydrogen 3.532 N/A ARG 254.A NH1 GLN 226.A OE1 no hydrogen 3.003 N/A ARG 254.A NH2 ASP 221.A O no hydrogen 2.836 N/A GLY 255.A N GLY 252.A O no hydrogen 3.092 N/A ASN 260.A N GLN 257.A O no hydrogen 3.205 N/A ASN 260.A ND2 THR 222.A O no hydrogen 2.730 N/A ILE 261.A N VAL 258.A O no hydrogen 3.050 N/A GLN 262.A N GLU 259.A O no hydrogen 2.652 N/A GLN 262.A NE2 GLN 262.A O no hydrogen 3.561 N/A GLN 262.A NE2 ASN 266.A OD1 no hydrogen 2.973 N/A ARG 263.A N GLU 259.A O no hydrogen 3.042 N/A ARG 263.A NH1 ASN 260.A OD1 no hydrogen 2.943 N/A PHE 264.A N ASN 260.A O no hydrogen 3.097 N/A LEU 265.A N ILE 261.A O no hydrogen 3.369 N/A ASN 266.A N GLN 262.A O no hydrogen 2.767 N/A ASP 267.A N ARG 263.A O no hydrogen 2.619 N/A PHE 268.A N PHE 264.A O no hydrogen 3.076 N/A ALA 271.A N PHE 268.A O no hydrogen 3.150 N/A GLU 272.A N ASN 24.A O no hydrogen 3.281 N/A ILE 274.A N LEU 26.A O no hydrogen 2.889 N/A ASN 279.A N TRP 306.A O no hydrogen 2.933 N/A ASN 279.A ND2 ALA 31.A O no hydrogen 2.989 N/A TYR 280.A N GLY 32.A O no hydrogen 2.970 N/A ARG 281.A NE GLU 550.A OE2 no hydrogen 2.890 N/A ARG 281.A NH1 THR 588.A O no hydrogen 2.889 N/A SER 282.A N ASN 279.A OD1 no hydrogen 3.090 N/A SER 282.A OG ALA 590.A O no hydrogen 2.707 N/A THR 283.A OG1 ASP 311.A O no hydrogen 3.540 N/A SER 284.A N ALA 310.A O no hydrogen 2.974 N/A ASN 285.A N ASP 311.A O no hydrogen 3.081 N/A ASN 285.A ND2 GLU 623.A O no hydrogen 3.669 N/A ILE 286.A N THR 283.A OG1 no hydrogen 3.250 N/A LEU 287.A N THR 283.A O no hydrogen 3.013 N/A SER 288.A N SER 284.A O no hydrogen 2.750 N/A SER 288.A OG SER 284.A O no hydrogen 2.442 N/A ALA 289.A N ASN 285.A O no hydrogen 3.000 N/A ALA 290.A N ILE 286.A O no hydrogen 3.031 N/A ASN 291.A N LEU 287.A O no hydrogen 2.838 N/A ASN 291.A ND2 LEU 305.A O no hydrogen 3.225 N/A ALA 292.A N SER 288.A O no hydrogen 3.021 N/A LEU 293.A N ALA 289.A O no hydrogen 2.746 N/A ILE 294.A N ALA 290.A O no hydrogen 2.867 N/A GLU 295.A N ASN 291.A O no hydrogen 3.101 N/A ASN 296.A N LEU 293.A O no hydrogen 3.407 N/A ASN 296.A ND2 LEU 293.A O no hydrogen 3.332 N/A ASN 297.A N ILE 294.A O no hydrogen 2.920 N/A ASN 297.A ND2 GLU 577.A O no hydrogen 2.783 N/A ASN 298.A N GLU 577.A OE2 no hydrogen 2.710 N/A ARG 300.A NE ASP 247.A OD1 no hydrogen 3.090 N/A ARG 300.A NH2 ASP 247.A OD2 no hydrogen 3.023 N/A TRP 306.A N GLU 277.A O no hydrogen 3.170 N/A THR 307.A OG1 ASN 279.A O no hydrogen 3.224 N/A GLY 309.A N THR 307.A OG1 no hydrogen 3.278 N/A ILE 315.A N CYS 624.A O no hydrogen 2.664 N/A SER 316.A N LEU 594.A O no hydrogen 2.967 N/A LEU 317.A N GLU 626.A O no hydrogen 3.296 N/A TYR 318.A N LEU 596.A O no hydrogen 2.879 N/A TYR 318.A OH ASP 325.A OD2 no hydrogen 2.618 N/A CYS 319.A SG ALA 320.A O no hydrogen 3.752 N/A CYS 319.A SG GLU 600.A OE2 no hydrogen 3.643 N/A ALA 320.A N TYR 598.A O no hydrogen 2.858 N/A PHE 321.A N ASP 325.A OD2 no hydrogen 3.291 N/A GLU 323.A N GLU 323.A OE1 no hydrogen 2.804 N/A ASP 325.A N ASN 322.A OD1 no hydrogen 2.692 N/A GLU 326.A N ASN 322.A O no hydrogen 3.046 N/A ALA 327.A N GLU 323.A O no hydrogen 3.138 N/A ARG 328.A N LEU 324.A O no hydrogen 3.024 N/A PHE 329.A N ASP 325.A O no hydrogen 2.944 N/A VAL 330.A N GLU 326.A O no hydrogen 3.169 N/A VAL 331.A N ALA 327.A O no hydrogen 2.910 N/A ASN 332.A N ARG 328.A O no hydrogen 2.910 N/A ARG 333.A N PHE 329.A O no hydrogen 3.074 N/A ILE 334.A N VAL 330.A O no hydrogen 2.858 N/A LYS 335.A N VAL 331.A O no hydrogen 3.112 N/A LYS 335.A NZ ASP 339.A OD2 no hydrogen 3.081 N/A THR 336.A N ASN 332.A O no hydrogen 3.174 N/A THR 336.A OG1 ASN 332.A O no hydrogen 3.313 N/A TRP 337.A N ARG 333.A O no hydrogen 3.193 N/A TRP 337.A NE1 ALA 343.A O no hydrogen 3.032 N/A GLN 338.A N ILE 334.A O no hydrogen 2.939 N/A ASP 339.A N LYS 335.A O no hydrogen 2.857 N/A ASN 340.A N TRP 337.A O no hydrogen 3.196 N/A ASN 340.A ND2 THR 336.A O no hydrogen 2.694 N/A GLY 341.A N GLN 338.A O no hydrogen 2.885 N/A GLY 342.A N TRP 337.A O no hydrogen 2.954 N/A ALA 343.A N GLU 346.A OE1 no hydrogen 3.136 N/A LEU 344.A N ASP 536.A OD2 no hydrogen 2.891 N/A ALA 345.A N ASP 536.A OD1 no hydrogen 2.851 N/A GLU 346.A N ALA 343.A O no hydrogen 2.839 N/A CYS 347.A N LEU 344.A O no hydrogen 2.870 N/A CYS 347.A SG ALA 343.A O no hydrogen 4.035 N/A ALA 348.A N GLN 553.A O no hydrogen 3.063 N/A ILE 349.A N GLN 539.A O no hydrogen 2.736 N/A LEU 350.A N PHE 555.A O no hydrogen 2.652 N/A TYR 351.A N MET 541.A O no hydrogen 3.375 N/A ARG 352.A NE GLU 579.A OE1 no hydrogen 2.844 N/A ARG 352.A NH1 GLU 579.A OE1 no hydrogen 3.380 N/A ARG 352.A NH1 GLU 579.A OE2 no hydrogen 2.774 N/A ARG 352.A NH2 ARG 352.A O no hydrogen 3.068 N/A GLN 356.A N SER 353.A O no hydrogen 3.262 N/A GLN 356.A NE2 SER 353.A O no hydrogen 3.606 N/A GLN 356.A NE2 SER 353.A OG no hydrogen 3.135 N/A SER 357.A N ASN 354.A O no hydrogen 2.829 N/A SER 357.A OG ASN 354.A O no hydrogen 2.810 N/A ARG 358.A N ALA 355.A O no hydrogen 3.297 N/A ARG 358.A NH1 GLU 362.A OE2 no hydrogen 3.261 N/A GLU 361.A N SER 357.A O no hydrogen 3.003 N/A GLU 362.A N ARG 358.A O no hydrogen 3.105 N/A ALA 363.A N VAL 359.A O no hydrogen 3.104 N/A LEU 364.A N LEU 360.A O no hydrogen 2.861 N/A LEU 365.A N GLU 361.A O no hydrogen 2.713 N/A GLN 366.A N GLU 362.A O no hydrogen 2.851 N/A ALA 367.A N ALA 363.A O no hydrogen 2.979 N/A ALA 367.A N LEU 364.A O no hydrogen 2.976 N/A SER 368.A N LEU 365.A O no hydrogen 2.651 N/A MET 369.A N LEU 364.A O no hydrogen 2.870 N/A TYR 371.A OH GLU 361.A OE1 no hydrogen 2.581 N/A ARG 372.A N VAL 538.A O no hydrogen 2.638 N/A ARG 372.A NH2 GLU 529.A O no hydrogen 2.554 N/A TYR 374.A N LEU 540.A O no hydrogen 2.820 N/A TYR 374.A OH GLN 539.A OE1 no hydrogen 2.839 N/A GLY 375.A N ILE 373.A O no hydrogen 2.776 N/A ARG 382.A N PHE 379.A O no hydrogen 3.395 N/A GLU 384.A N GLU 384.A OE2 no hydrogen 2.469 N/A LYS 386.A N ARG 382.A O no hydrogen 2.667 N/A LYS 386.A NZ ASP 115.A OD1 no hydrogen 2.617 N/A LYS 386.A NZ ASP 118.A OD1 no hydrogen 2.937 N/A LYS 386.A NZ ASP 118.A OD2 no hydrogen 3.406 N/A ASP 387.A N GLN 383.A O no hydrogen 2.981 N/A ALA 388.A N GLU 384.A O no hydrogen 3.194 N/A LEU 389.A N ILE 385.A O no hydrogen 2.964 N/A SER 390.A N ASP 387.A O no hydrogen 2.556 N/A SER 390.A OG LYS 386.A O no hydrogen 2.957 N/A TYR 391.A N ASP 387.A O no hydrogen 3.131 N/A TYR 391.A OH THR 410.A O no hydrogen 2.800 N/A ARG 393.A N LEU 389.A O no hydrogen 2.970 N/A ARG 393.A NE ASP 400.A OD2 no hydrogen 3.040 N/A ARG 393.A NH1 ASP 118.A OD2 no hydrogen 3.480 N/A ARG 393.A NH1 ASP 400.A OD1 no hydrogen 2.929 N/A ARG 393.A NH2 ASP 118.A OD2 no hydrogen 2.978 N/A LEU 394.A N SER 390.A O no hydrogen 3.344 N/A ILE 395.A N TYR 391.A O no hydrogen 3.034 N/A VAL 396.A N ARG 393.A O no hydrogen 3.139 N/A ASN 397.A N LEU 394.A O no hydrogen 3.151 N/A ASN 397.A ND2 ALA 181.A O no hydrogen 2.909 N/A ASN 399.A ND2 ASN 397.A OD1 no hydrogen 3.308 N/A ASP 400.A N ASN 397.A O no hydrogen 2.894 N/A ALA 403.A N ASP 400.A OD1 no hydrogen 3.224 N/A PHE 404.A N ASP 400.A O no hydrogen 2.836 N/A GLU 405.A N ASP 401.A O no hydrogen 2.984 N/A ARG 406.A N ALA 402.A O no hydrogen 3.468 N/A ARG 406.A NH1 GLN 383.A O no hydrogen 3.452 N/A VAL 407.A N ALA 403.A O no hydrogen 3.238 N/A VAL 408.A N PHE 404.A O no hydrogen 2.917 N/A VAL 408.A N GLU 405.A O no hydrogen 3.030 N/A THR 410.A N VAL 407.A O no hydrogen 3.290 N/A THR 410.A OG1 ARG 406.A O no hydrogen 3.112 N/A ARG 413.A N ASN 409.A OD1 no hydrogen 2.632 N/A LEU 420.A N ASP 417.A O no hydrogen 2.683 N/A ASP 421.A N ASP 417.A O no hydrogen 2.994 N/A VAL 422.A N ARG 418.A O no hydrogen 3.166 N/A ARG 424.A N LEU 420.A O no hydrogen 2.671 N/A GLN 425.A N ASP 421.A O no hydrogen 3.279 N/A THR 426.A N VAL 422.A O no hydrogen 2.638 N/A THR 426.A OG1 VAL 422.A O no hydrogen 3.138 N/A SER 427.A N ARG 424.A O no hydrogen 3.289 N/A SER 427.A OG VAL 423.A O no hydrogen 3.204 N/A SER 427.A OG THR 433.A O no hydrogen 2.965 N/A ARG 428.A N ARG 424.A O no hydrogen 2.976 N/A ASP 429.A N GLN 425.A O no hydrogen 2.890 N/A ARG 430.A NE GLU 440.A OE1 no hydrogen 3.337 N/A ARG 430.A NH1 GLU 444.A OE2 no hydrogen 3.347 N/A GLN 431.A N SER 427.A O no hydrogen 2.942 N/A THR 433.A OG1 ASN 399.A OD1 no hydrogen 3.397 N/A LEU 434.A N ASP 401.A OD1 no hydrogen 3.179 N/A GLN 436.A N THR 433.A OG1 no hydrogen 3.115 N/A ALA 437.A N THR 433.A O no hydrogen 2.919 N/A CYS 438.A N TRP 435.A O no hydrogen 3.205 N/A CYS 438.A SG LEU 434.A O no hydrogen 3.294 N/A ARG 439.A N TRP 435.A O no hydrogen 2.965 N/A GLU 440.A N GLN 436.A O no hydrogen 3.327 N/A LYS 445.A N LEU 442.A O no hydrogen 2.881 N/A ALA 446.A N LEU 441.A O no hydrogen 3.447 N/A SER 453.A N GLY 449.A O no hydrogen 3.145 N/A SER 453.A OG ARG 450.A O no hydrogen 2.379 N/A ALA 454.A N ALA 451.A O no hydrogen 3.078 N/A LEU 455.A N ALA 451.A O no hydrogen 3.220 N/A PHE 458.A N ALA 454.A O no hydrogen 2.808 N/A MET 459.A N LEU 455.A O no hydrogen 3.442 N/A GLU 460.A N GLN 456.A O no hydrogen 2.809 N/A LEU 461.A N ARG 457.A O no hydrogen 2.876 N/A ILE 462.A N PHE 458.A O no hydrogen 3.255 N/A ALA 464.A N GLU 460.A O no hydrogen 2.933 N/A LEU 465.A N LEU 461.A O no hydrogen 2.940 N/A ALA 466.A N ILE 462.A O no hydrogen 2.901 N/A GLN 467.A N ASP 463.A O no hydrogen 3.093 N/A GLU 468.A N ALA 464.A O no hydrogen 2.739 N/A GLU 468.A N LEU 465.A O no hydrogen 3.188 N/A THR 469.A N LEU 465.A O no hydrogen 2.884 N/A THR 469.A OG1 LEU 465.A O no hydrogen 2.698 N/A GLN 477.A N PRO 473.A O no hydrogen 3.113 N/A THR 478.A N LEU 474.A O no hydrogen 2.892 N/A THR 478.A OG1 LEU 474.A O no hydrogen 3.112 N/A ARG 480.A N VAL 476.A O no hydrogen 3.136 N/A VAL 481.A N GLN 477.A O no hydrogen 3.190 N/A ILE 482.A N THR 478.A O no hydrogen 3.060 N/A LYS 483.A N ASP 479.A O no hydrogen 3.372 N/A ASP 484.A N ARG 480.A O no hydrogen 2.742 N/A SER 485.A OG VAL 481.A O no hydrogen 2.835 N/A SER 485.A OG ILE 482.A O no hydrogen 3.013 N/A GLY 486.A N LYS 483.A O no hydrogen 3.241 N/A ARG 488.A N ILE 482.A O no hydrogen 3.092 N/A THR 489.A OG1 GLY 486.A O no hydrogen 3.160 N/A MET 490.A N GLY 486.A O no hydrogen 2.580 N/A TYR 491.A N LEU 487.A O no hydrogen 2.996 N/A TYR 491.A OH ASP 387.A OD2 no hydrogen 2.454 N/A GLN 493.A N MET 490.A O no hydrogen 2.963 N/A LYS 495.A N GLN 493.A O no hydrogen 2.493 N/A ARG 502.A NE GLU 384.A OE2 no hydrogen 3.136 N/A ILE 503.A N GLN 500.A O no hydrogen 3.369 N/A ASN 505.A N THR 501.A O no hydrogen 3.090 N/A GLU 507.A N GLU 504.A O no hydrogen 3.214 N/A GLU 508.A N GLU 504.A O no hydrogen 2.978 N/A LEU 509.A N ASN 505.A O no hydrogen 2.902 N/A THR 511.A N GLU 507.A O no hydrogen 3.023 N/A THR 511.A OG1 GLU 507.A O no hydrogen 3.466 N/A ALA 512.A N GLU 508.A O no hydrogen 2.899 N/A THR 513.A N LEU 509.A O no hydrogen 3.320 N/A THR 513.A OG1 LEU 509.A O no hydrogen 3.228 N/A THR 513.A OG1 VAL 510.A O no hydrogen 2.461 N/A ARG 514.A N VAL 510.A O no hydrogen 2.982 N/A GLN 515.A N THR 511.A O no hydrogen 2.912 N/A PHE 516.A N THR 513.A O no hydrogen 3.223 N/A ALA 521.A N MET 517.A O no hydrogen 2.970 N/A PHE 522.A N PRO 518.A O no hydrogen 2.637 N/A LEU 523.A N LEU 519.A O no hydrogen 3.469 N/A SER 524.A OG GLN 520.A O no hydrogen 3.553 N/A HIS 525.A N ALA 521.A O no hydrogen 3.277 N/A ALA 526.A N PHE 522.A O no hydrogen 3.400 N/A ALA 527.A N LEU 523.A O no hydrogen 3.297 N/A LEU 528.A N SER 524.A O no hydrogen 3.211 N/A GLU 529.A N HIS 525.A O no hydrogen 3.005 N/A ALA 530.A N ALA 526.A O no hydrogen 2.855 N/A GLY 531.A N LEU 528.A O no hydrogen 2.644 N/A GLN 535.A N THR 533.A O no hydrogen 2.489 N/A VAL 538.A N PRO 370.A O no hydrogen 2.868 N/A GLN 539.A N CYS 347.A O no hydrogen 2.907 N/A GLN 539.A NE2 ALA 537.A O no hydrogen 3.000 N/A LEU 540.A N ARG 372.A O no hydrogen 2.920 N/A MET 541.A N ILE 349.A O no hydrogen 3.359 N/A LEU 543.A N TYR 351.A O no hydrogen 3.040 N/A HIS 544.A NE2 ILE 250.A O no hydrogen 3.033 N/A SER 545.A N THR 542.A OG1 no hydrogen 2.949 N/A SER 545.A OG THR 542.A OG1 no hydrogen 3.407 N/A ALA 546.A N THR 542.A O no hydrogen 3.154 N/A LYS 547.A N HIS 544.A O no hydrogen 2.894 N/A LYS 547.A NZ GLU 218.A OE1 no hydrogen 2.609 N/A LYS 547.A NZ ASP 221.A OD1 no hydrogen 3.382 N/A LYS 547.A NZ ASP 221.A OD2 no hydrogen 2.908 N/A LEU 549.A N ALA 546.A O no hydrogen 2.776 N/A PHE 551.A N ARG 589.A O no hydrogen 3.102 N/A GLN 553.A N GLU 346.A O no hydrogen 2.970 N/A VAL 554.A N LYS 593.A O no hydrogen 3.066 N/A PHE 555.A N ALA 348.A O no hydrogen 2.832 N/A ILE 556.A N THR 595.A O no hydrogen 2.935 N/A VAL 557.A N LEU 350.A O no hydrogen 3.081 N/A GLY 558.A N GLU 326.A OE2 no hydrogen 3.011 N/A MET 559.A N THR 597.A O no hydrogen 3.046 N/A GLU 560.A N GLY 558.A O no hydrogen 2.487 N/A GLU 561.A N ARG 612.A O no hydrogen 2.838 N/A GLY 562.A N PRO 565.A O no hydrogen 2.936 N/A MET 563.A N GLU 560.A O no hydrogen 2.947 N/A PHE 564.A N GLU 560.A O no hydrogen 2.857 N/A SER 569.A OG SER 566.A O no hydrogen 2.654 N/A LEU 570.A N GLN 567.A O no hydrogen 2.849 N/A ASP 571.A N MET 568.A O no hydrogen 2.686 N/A GLY 574.A N GLU 572.A O no hydrogen 2.614 N/A LEU 576.A N GLY 573.A O no hydrogen 3.275 N/A GLU 578.A N ARG 575.A O no hydrogen 2.922 N/A GLU 579.A N ARG 575.A O no hydrogen 3.024 N/A ARG 580.A N LEU 576.A O no hydrogen 3.121 N/A ARG 580.A NE GLU 619.A OE1 no hydrogen 2.522 N/A ARG 580.A NE GLU 619.A OE2 no hydrogen 3.341 N/A ARG 580.A NH1 GLU 619.A OE2 no hydrogen 2.750 N/A ARG 580.A NH2 ASN 297.A OD1 no hydrogen 2.733 N/A ARG 581.A N GLU 577.A O no hydrogen 3.133 N/A ARG 581.A NE SER 249.A O no hydrogen 2.835 N/A ARG 581.A NH2 SER 249.A O no hydrogen 3.529 N/A LEU 582.A N GLU 578.A O no hydrogen 2.850 N/A ALA 583.A N GLU 579.A O no hydrogen 2.746 N/A TYR 584.A N ARG 580.A O no hydrogen 2.891 N/A VAL 585.A N ARG 581.A O no hydrogen 2.858 N/A GLY 586.A N LEU 582.A O no hydrogen 3.006 N/A VAL 587.A N ALA 583.A O no hydrogen 2.978 N/A THR 588.A N TYR 584.A O no hydrogen 2.969 N/A THR 588.A OG1 TYR 584.A O no hydrogen 2.881 N/A THR 588.A OG1 VAL 585.A O no hydrogen 2.950 N/A ARG 589.A N GLY 586.A O no hydrogen 3.180 N/A ARG 589.A NE LEU 549.A O no hydrogen 3.120 N/A ARG 589.A NH1 VAL 585.A O no hydrogen 3.542 N/A ARG 589.A NH2 LEU 549.A O no hydrogen 2.715 N/A ALA 590.A N VAL 587.A O no hydrogen 3.227 N/A MET 591.A N PHE 551.A O no hydrogen 2.962 N/A GLN 592.A N PRO 552.A O no hydrogen 3.008 N/A LYS 593.A N PRO 552.A O no hydrogen 3.007 N/A LYS 593.A NZ PRO 314.A O no hydrogen 2.672 N/A LYS 593.A NZ SER 316.A OG no hydrogen 2.714 N/A THR 595.A N VAL 554.A O no hydrogen 2.971 N/A LEU 596.A N SER 316.A O no hydrogen 2.751 N/A THR 597.A N ILE 556.A O no hydrogen 3.009 N/A THR 597.A OG1 GLU 326.A OE2 no hydrogen 2.708 N/A TYR 598.A N TYR 318.A O no hydrogen 3.079 N/A ALA 599.A N GLU 560.A OE2 no hydrogen 2.890 N/A GLU 600.A N ALA 320.A O no hydrogen 2.898 N/A THR 601.A OG1 VAL 609.A O no hydrogen 2.734 N/A ARG 602.A N VAL 609.A O no hydrogen 3.354 N/A ARG 602.A NE GLU 560.A OE1 no hydrogen 2.809 N/A ARG 602.A NE GLU 560.A OE2 no hydrogen 2.974 N/A ARG 602.A NH2 GLU 326.A OE1 no hydrogen 3.351 N/A ARG 602.A NH2 GLU 560.A OE2 no hydrogen 2.691 N/A ARG 603.A N GLU 323.A OE2 no hydrogen 2.879 N/A LEU 604.A N LYS 607.A O no hydrogen 3.185 N/A VAL 609.A N ARG 602.A O no hydrogen 2.971 N/A HIS 611.A ND1 GLU 560.A OE1 no hydrogen 3.033 N/A SER 614.A N MET 559.A O no hydrogen 2.875 N/A SER 614.A OG PHE 564.A O no hydrogen 2.764 N/A ARG 615.A N GLU 561.A OE1 no hydrogen 2.958 N/A ARG 615.A NE GLU 561.A OE1 no hydrogen 2.745 N/A ARG 615.A NH2 GLU 561.A OE2 no hydrogen 3.212 N/A PHE 616.A N SER 614.A OG no hydrogen 3.158 N/A ILE 617.A N SER 614.A O no hydrogen 2.858 N/A GLU 619.A N ARG 615.A O no hydrogen 3.100 N/A LEU 620.A N ILE 617.A O no hydrogen 3.098 N/A GLU 623.A N GLU 623.A OE2 no hydrogen 2.503 N/A CYS 624.A N PRO 621.A O no hydrogen 2.685 N/A CYS 624.A SG ASN 285.A O no hydrogen 3.818 N/A VAL 625.A N GLU 622.A O no hydrogen 3.243 N/A GLU 626.A N ILE 315.A O no hydrogen 2.958 N/A VAL 628.A N LEU 317.A O no hydrogen 2.620 N/A ARG 629.A NH2 GLU 626.A OE1 no hydrogen 3.204 N/A ARG 631.A NE THR 633.A O no hydrogen 2.508 N/A