Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4cjn_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 5.A ND2 ASP 1.A O no hydrogen 3.555 N/A ASN 6.A ND2 LYS 2.A O no hydrogen 2.581 N/A THR 7.A N GLU 3.A O no hydrogen 3.263 N/A THR 7.A OG1 GLU 3.A O no hydrogen 3.305 N/A ILE 8.A N ILE 4.A O no hydrogen 3.004 N/A ASP 9.A N ASN 5.A O no hydrogen 2.808 N/A ALA 10.A N ASN 6.A O no hydrogen 3.087 N/A ILE 11.A N THR 7.A O no hydrogen 3.170 N/A GLU 12.A N ILE 8.A O no hydrogen 2.981 N/A ASP 13.A N ASP 9.A O no hydrogen 2.862 N/A LYS 14.A N ILE 11.A O no hydrogen 2.979 N/A LYS 14.A NZ LYS 50.A O no hydrogen 3.059 N/A ASN 15.A N ALA 10.A O no hydrogen 2.849 N/A PHE 16.A N LYS 14.A O no hydrogen 2.962 N/A LYS 17.A NZ GLU 33.A OE2 no hydrogen 3.021 N/A LYS 17.A NZ THR 37.A OG1 no hydrogen 3.035 N/A GLN 18.A N ASN 15.A OD1 no hydrogen 3.346 N/A GLN 18.A NE2 GLN 18.A O no hydrogen 3.400 N/A GLN 18.A NE2 ASP 22.A OD1 no hydrogen 3.084 N/A VAL 19.A N ASN 15.A O no hydrogen 3.105 N/A TYR 20.A N PHE 16.A O no hydrogen 2.888 N/A LYS 21.A N LYS 17.A O no hydrogen 3.056 N/A ASP 22.A N GLN 18.A O no hydrogen 2.781 N/A ASP 22.A N VAL 19.A O no hydrogen 3.016 N/A SER 23.A N TYR 20.A O no hydrogen 3.310 N/A SER 23.A OG VAL 19.A O no hydrogen 2.893 N/A SER 24.A N LEU 99.A O no hydrogen 2.855 N/A SER 24.A OG SER 27.A OG no hydrogen 2.915 N/A SER 24.A OG LEU 99.A O no hydrogen 3.544 N/A TYR 25.A N GLU 93.A OE2 no hydrogen 3.030 N/A SER 27.A N SER 24.A OG no hydrogen 3.135 N/A SER 27.A OG SER 24.A O no hydrogen 3.346 N/A SER 27.A OG SER 24.A OG no hydrogen 2.915 N/A SER 27.A OG LEU 99.A O no hydrogen 3.201 N/A LYS 28.A N SER 24.A O no hydrogen 2.928 N/A SER 29.A N TYR 25.A O no hydrogen 2.914 N/A ASP 30.A N ILE 26.A O no hydrogen 2.781 N/A ASN 31.A N SER 27.A O no hydrogen 3.275 N/A ASN 31.A ND2 SER 27.A O no hydrogen 3.096 N/A GLY 32.A N LYS 28.A O no hydrogen 2.801 N/A MET 36.A N GLY 32.A O no hydrogen 3.077 N/A THR 37.A N GLU 33.A O no hydrogen 2.862 N/A THR 37.A OG1 GLU 33.A O no hydrogen 2.480 N/A GLU 38.A N VAL 34.A O no hydrogen 2.866 N/A ARG 39.A N VAL 34.A O no hydrogen 3.101 N/A ARG 39.A NH1 GLU 35.A OE2 no hydrogen 2.930 N/A ARG 39.A NH2 GLN 114.A O no hydrogen 2.786 N/A LYS 42.A N GLU 38.A O no hydrogen 3.336 N/A ILE 43.A N ARG 39.A O no hydrogen 2.960 N/A TYR 44.A N PRO 40.A O no hydrogen 2.785 N/A TYR 44.A OH ILE 106.A O no hydrogen 2.794 N/A ASN 45.A N ILE 41.A O no hydrogen 2.927 N/A SER 46.A N LYS 42.A O no hydrogen 3.134 N/A SER 46.A OG ILE 43.A O no hydrogen 2.996 N/A LEU 47.A N ILE 43.A O no hydrogen 3.234 N/A LEU 47.A N TYR 44.A O no hydrogen 3.298 N/A GLY 48.A N ASN 45.A O no hydrogen 3.254 N/A VAL 49.A N TYR 44.A O no hydrogen 3.046 N/A LYS 50.A N LYS 76.A O no hydrogen 2.623 N/A LYS 50.A NZ ASN 78.A OD1 no hydrogen 3.249 N/A ASN 53.A N LYS 74.A O no hydrogen 2.977 N/A ILE 54.A N GLU 12.A OE2 no hydrogen 2.533 N/A GLN 55.A N GLN 72.A O no hydrogen 3.102 N/A ARG 57.A NE ILE 54.A O no hydrogen 2.902 N/A ARG 57.A NH1 ASN 5.A O no hydrogen 3.419 N/A ARG 57.A NH1 ASN 5.A OD1 no hydrogen 3.011 N/A ARG 57.A NH1 ASP 9.A OD1 no hydrogen 2.595 N/A ARG 57.A NH2 ASP 9.A OD1 no hydrogen 2.668 N/A ARG 57.A NH2 ILE 54.A O no hydrogen 3.497 N/A LYS 58.A N ASP 70.A O no hydrogen 2.878 N/A LYS 60.A N ARG 68.A O no hydrogen 2.839 N/A VAL 62.A N LYS 66.A O no hydrogen 3.117 N/A SER 63.A N LYS 66.A O no hydrogen 3.263 N/A SER 63.A OG VAL 62.A O no hydrogen 2.700 N/A ASN 65.A ND2 LYS 92.A O no hydrogen 2.826 N/A LYS 66.A N SER 63.A O no hydrogen 3.302 N/A LYS 67.A N PHE 90.A O no hydrogen 2.904 N/A ARG 68.A N LYS 60.A O no hydrogen 2.824 N/A ARG 68.A NE ASP 70.A OD1 no hydrogen 3.237 N/A ARG 68.A NH2 ASP 70.A OD1 no hydrogen 3.463 N/A VAL 69.A N PHE 88.A O no hydrogen 2.736 N/A ASP 70.A N LYS 58.A O no hydrogen 3.095 N/A ALA 71.A N VAL 86.A O no hydrogen 3.075 N/A GLN 72.A N GLN 55.A O no hydrogen 2.911 N/A GLN 72.A NE2 ASN 85.A OD1 no hydrogen 2.176 N/A TYR 73.A N ARG 84.A O no hydrogen 2.748 N/A TYR 73.A OH TYR 44.A OH no hydrogen 3.051 N/A TYR 73.A OH VAL 105.A O no hydrogen 2.783 N/A LYS 74.A N ASN 53.A O no hydrogen 2.980 N/A LYS 74.A NZ GLN 55.A OE1 no hydrogen 2.945 N/A ILE 75.A N ILE 82.A O no hydrogen 2.681 N/A LYS 76.A N ASP 51.A O no hydrogen 3.164 N/A THR 77.A N GLY 80.A O no hydrogen 3.131 N/A THR 77.A OG1 GLY 80.A O no hydrogen 2.682 N/A ASN 78.A N LEU 47.A O no hydrogen 3.054 N/A TYR 79.A N THR 77.A OG1 no hydrogen 2.974 N/A GLY 80.A N THR 77.A O no hydrogen 3.116 N/A ILE 82.A N ILE 75.A O no hydrogen 2.781 N/A ARG 84.A N TYR 73.A O no hydrogen 3.194 N/A ARG 84.A NE PRO 108.A O no hydrogen 3.359 N/A VAL 86.A N ALA 71.A O no hydrogen 2.807 N/A PHE 88.A N VAL 69.A O no hydrogen 2.829 N/A PHE 90.A N LYS 67.A O no hydrogen 2.893 N/A VAL 91.A N LYS 98.A O no hydrogen 2.806 N/A LYS 92.A NZ GLY 95.A O no hydrogen 3.497 N/A GLU 93.A N MET 96.A O no hydrogen 3.075 N/A TRP 97.A N GLU 3.A OE1 no hydrogen 3.507 N/A LYS 98.A N VAL 91.A O no hydrogen 2.665 N/A LYS 98.A NZ LYS 21.A O no hydrogen 2.947 N/A LEU 99.A N ASP 22.A O no hydrogen 2.818 N/A ASP 100.A N ASN 89.A O no hydrogen 2.743 N/A TRP 101.A N SER 27.A OG no hydrogen 3.297 N/A HIS 103.A NE2 GLU 35.A OE2 no hydrogen 2.675 N/A SER 104.A N ASP 102.A OD1 no hydrogen 3.020 N/A SER 104.A OG MET 110.A O no hydrogen 3.092 N/A VAL 105.A N ASP 102.A O no hydrogen 3.001 N/A ILE 106.A N HIS 103.A O no hydrogen 2.958 N/A ILE 107.A N HIS 103.A O no hydrogen 3.181 N/A GLY 109.A N SER 104.A OG no hydrogen 3.008 N/A MET 110.A N ILE 107.A O no hydrogen 2.836 N/A GLN 111.A N GLN 114.A OE1 no hydrogen 2.498 N/A GLN 114.A NE2 ASP 277.A OD1 no hydrogen 3.100 N/A SER 115.A N VAL 276.A O no hydrogen 2.928 N/A HIS 117.A N THR 274.A O no hydrogen 2.934 N/A GLU 119.A N ARG 272.A O no hydrogen 2.830 N/A ASN 120.A ND2 ASP 269.A OD2 no hydrogen 3.421 N/A LEU 121.A N GLY 270.A O no hydrogen 2.720 N/A LYS 122.A NZ SER 123.A O no hydrogen 2.524 N/A SER 123.A N ASP 269.A OD1 no hydrogen 2.689 N/A SER 123.A OG HIS 267.A ND1 no hydrogen 2.687 N/A SER 123.A OG ASP 269.A OD1 no hydrogen 2.663 N/A GLU 124.A N ASP 294.A OD1 no hydrogen 2.749 N/A ARG 125.A NE GLU 258.A OE1 no hydrogen 2.953 N/A ARG 125.A NH1 ASP 262.A OD1 no hydrogen 2.973 N/A ARG 125.A NH2 GLU 258.A OE1 no hydrogen 3.242 N/A ARG 125.A NH2 ASP 262.A OD1 no hydrogen 2.624 N/A GLY 126.A N LEU 265.A O no hydrogen 2.904 N/A LYS 127.A N ASP 297.A OD1 no hydrogen 2.796 N/A LYS 127.A NZ GLU 135.A OE2 no hydrogen 3.146 N/A ILE 128.A N ALA 137.A O no hydrogen 2.998 N/A LEU 129.A N ILE 298.A O no hydrogen 2.729 N/A ASP 130.A N VAL 134.A O no hydrogen 2.838 N/A ARG 131.A N ILE 302.A O no hydrogen 2.909 N/A ARG 131.A NE ILE 640.A O no hydrogen 2.909 N/A ARG 131.A NE ASP 641.A OD1 no hydrogen 3.182 N/A ARG 131.A NH1 THR 301.A O no hydrogen 2.850 N/A ARG 131.A NH1 GLU 330.A OE2 no hydrogen 2.953 N/A ARG 131.A NH2 GLU 330.A OE2 no hydrogen 2.838 N/A ARG 131.A NH2 ASP 641.A OD1 no hydrogen 2.949 N/A ASN 132.A N ASP 130.A OD1 no hydrogen 2.754 N/A ASN 132.A ND2 ILE 640.A O no hydrogen 3.120 N/A ASN 133.A N ASP 130.A O no hydrogen 2.842 N/A VAL 134.A N ASP 130.A OD1 no hydrogen 2.829 N/A LEU 136.A N ILE 128.A O no hydrogen 2.804 N/A ALA 137.A N ILE 128.A O no hydrogen 3.098 N/A ASN 138.A N ASN 216.A O no hydrogen 3.024 N/A ASN 138.A ND2 GLU 135.A OE1 no hydrogen 2.781 N/A GLY 140.A N SER 214.A O no hydrogen 2.817 N/A ALA 142.A N THR 212.A O no hydrogen 2.856 N/A TYR 143.A N VAL 191.A O no hydrogen 2.839 N/A GLU 144.A N ASN 210.A O no hydrogen 2.734 N/A ILE 145.A N LYS 189.A O no hydrogen 2.708 N/A GLY 146.A N THR 208.A O no hydrogen 2.836 N/A ILE 147.A N VAL 186.A O no hydrogen 2.876 N/A LYS 150.A N ASP 182.A O no hydrogen 2.978 N/A ASN 151.A N VAL 148.A O no hydrogen 2.770 N/A VAL 152.A N PRO 149.A O no hydrogen 3.215 N/A LYS 155.A N SER 153.A OG no hydrogen 3.083 N/A ASP 156.A N SER 153.A O no hydrogen 3.027 N/A TYR 157.A N LYS 154.A O no hydrogen 3.217 N/A ILE 160.A N ASP 156.A O no hydrogen 2.921 N/A ALA 161.A N TYR 157.A O no hydrogen 3.062 N/A LYS 162.A N LYS 158.A O no hydrogen 3.070 N/A GLU 163.A N ALA 159.A O no hydrogen 3.200 N/A LEU 164.A N ILE 160.A O no hydrogen 3.110 N/A SER 165.A N LYS 162.A O no hydrogen 3.297 N/A ILE 166.A N ALA 161.A O no hydrogen 3.072 N/A TYR 170.A N SER 167.A OG no hydrogen 2.996 N/A ILE 171.A N SER 167.A O no hydrogen 3.243 N/A LYS 172.A N GLU 168.A O no hydrogen 2.949 N/A GLN 173.A N ASP 169.A O no hydrogen 2.909 N/A GLN 174.A N TYR 170.A O no hydrogen 2.905 N/A GLN 174.A NE2 GLN 173.A OE1 no hydrogen 3.572 N/A MET 175.A N ILE 171.A O no hydrogen 2.960 N/A ASP 176.A N LYS 172.A O no hydrogen 2.946 N/A GLN 177.A N GLN 174.A O no hydrogen 3.373 N/A GLN 177.A NE2 GLN 174.A O no hydrogen 2.898 N/A VAL 180.A N GLN 177.A O no hydrogen 3.043 N/A GLN 181.A N THR 184.A OG1 no hydrogen 2.854 N/A THR 184.A N GLN 181.A O no hydrogen 3.174 N/A THR 184.A OG1 GLN 181.A O no hydrogen 3.416 N/A VAL 186.A N ILE 147.A O no hydrogen 2.667 N/A LEU 188.A N ILE 145.A O no hydrogen 2.812 N/A LYS 189.A N ILE 145.A O no hydrogen 3.186 N/A LYS 189.A NZ LEU 164.A O no hydrogen 2.708 N/A LYS 189.A NZ GLY 348.A O no hydrogen 3.253 N/A VAL 191.A N TYR 143.A O no hydrogen 2.763 N/A LYS 192.A NZ THR 141.A O no hydrogen 3.032 N/A LYS 192.A NZ ASN 216.A OD1 no hydrogen 2.808 N/A TYR 197.A OH GLU 163.A OE2 no hydrogen 2.447 N/A LEU 198.A N ASP 195.A OD1 no hydrogen 2.953 N/A SER 199.A N ASP 195.A O no hydrogen 2.987 N/A SER 199.A OG ASP 195.A O no hydrogen 3.068 N/A ASP 200.A N GLU 196.A O no hydrogen 3.159 N/A PHE 201.A N TYR 197.A O no hydrogen 2.946 N/A ALA 202.A N LEU 198.A O no hydrogen 2.722 N/A LYS 203.A N SER 199.A O no hydrogen 3.187 N/A LYS 204.A N ASP 200.A O no hydrogen 2.899 N/A PHE 205.A N PHE 201.A O no hydrogen 3.262 N/A PHE 205.A N ALA 202.A O no hydrogen 3.285 N/A HIS 206.A N LYS 203.A O no hydrogen 3.361 N/A LEU 207.A N ALA 202.A O no hydrogen 2.761 N/A THR 208.A N GLY 146.A O no hydrogen 2.912 N/A ASN 210.A N GLU 144.A O no hydrogen 2.820 N/A ASN 210.A ND2 GLU 144.A OE1 no hydrogen 3.374 N/A THR 212.A N ALA 142.A O no hydrogen 2.876 N/A THR 212.A OG1 GLU 213.A O no hydrogen 3.433 N/A SER 214.A N GLY 140.A O no hydrogen 3.188 N/A SER 214.A OG TYR 347.A OH no hydrogen 2.504 N/A ARG 215.A NE GLU 258.A OE2 no hydrogen 2.765 N/A ARG 215.A NH1 GLY 126.A O no hydrogen 2.977 N/A ARG 215.A NH2 GLY 126.A O no hydrogen 2.821 N/A ARG 215.A NH2 GLU 258.A OE1 no hydrogen 3.242 N/A ARG 215.A NH2 GLU 258.A OE2 no hydrogen 3.408 N/A ASN 216.A N ASN 138.A O no hydrogen 2.925 N/A ASN 216.A ND2 ASN 138.A OD1 no hydrogen 3.042 N/A TYR 217.A N TYR 343.A OH no hydrogen 3.038 N/A TYR 217.A OH GLU 258.A OE2 no hydrogen 2.625 N/A GLY 220.A N TYR 217.A O no hydrogen 2.816 N/A ALA 222.A N LEU 219.A O no hydrogen 3.022 N/A THR 223.A N GLY 220.A O no hydrogen 3.148 N/A THR 223.A OG1 GLY 220.A O no hydrogen 3.477 N/A SER 224.A OG GLY 220.A O no hydrogen 3.414 N/A SER 224.A OG SER 339.A OG no hydrogen 3.292 N/A SER 224.A OG TYR 340.A O no hydrogen 2.706 N/A HIS 225.A NE2 PRO 364.A O no hydrogen 2.731 N/A LEU 227.A N THR 223.A O no hydrogen 3.035 N/A GLY 228.A N SER 224.A O no hydrogen 2.940 N/A GLY 231.A N ILE 252.A O no hydrogen 2.818 N/A ILE 233.A N ALA 250.A O no hydrogen 2.786 N/A ASN 234.A N GLU 237.A OE1 no hydrogen 2.866 N/A GLU 237.A N ASN 234.A OD1 no hydrogen 2.629 N/A LEU 238.A N ASN 234.A O no hydrogen 2.750 N/A LYS 239.A N GLU 236.A O no hydrogen 3.106 N/A GLN 240.A N GLU 237.A O no hydrogen 2.917 N/A TYR 243.A N GLN 240.A O no hydrogen 3.067 N/A LYS 244.A N LYS 241.A O no hydrogen 3.456 N/A TYR 246.A OH ASP 262.A OD2 no hydrogen 2.497 N/A ILE 252.A N GLY 231.A O no hydrogen 2.798 N/A GLY 253.A N ASP 262.A OD1 no hydrogen 2.873 N/A LYS 254.A N TYR 229.A O no hydrogen 2.604 N/A LYS 254.A NZ PRO 232.A O no hydrogen 3.015 N/A LYS 254.A NZ GLU 237.A OE1 no hydrogen 2.850 N/A LYS 254.A NZ GLU 237.A OE2 no hydrogen 2.665 N/A LEU 257.A N LEU 226.A O no hydrogen 2.904 N/A GLU 258.A N LEU 227.A O no hydrogen 3.042 N/A LYS 259.A N LYS 255.A O no hydrogen 3.203 N/A LEU 260.A N GLY 256.A O no hydrogen 2.901 N/A TYR 261.A N LEU 257.A O no hydrogen 2.883 N/A TYR 261.A OH ASP 469.A O no hydrogen 2.655 N/A ASP 262.A N LYS 259.A O no hydrogen 3.334 N/A LEU 265.A N TYR 261.A O no hydrogen 3.173 N/A GLN 266.A N LYS 263.A O no hydrogen 3.419 N/A GLN 266.A NE2 VAL 251.A O no hydrogen 2.831 N/A GLN 266.A NE2 ASP 262.A OD1 no hydrogen 3.355 N/A GLN 266.A NE2 ASP 262.A OD2 no hydrogen 3.085 N/A HIS 267.A N GLN 266.A OE1 no hydrogen 3.110 N/A HIS 267.A ND1 SER 123.A OG no hydrogen 2.687 N/A GLU 268.A N LYS 293.A O no hydrogen 2.974 N/A GLY 270.A N LEU 121.A O no hydrogen 2.752 N/A TYR 271.A N LYS 290.A O no hydrogen 2.978 N/A TYR 271.A OH TYR 79.A O no hydrogen 2.825 N/A ARG 272.A N GLU 119.A O no hydrogen 3.057 N/A ARG 272.A NH1 GLU 289.A OE2 no hydrogen 2.997 N/A VAL 273.A N ILE 288.A O no hydrogen 2.803 N/A THR 274.A N HIS 117.A O no hydrogen 2.868 N/A THR 274.A OG1 HIS 117.A O no hydrogen 3.449 N/A ILE 275.A N HIS 285.A O no hydrogen 2.787 N/A VAL 276.A N SER 115.A O no hydrogen 2.942 N/A ASP 277.A N THR 282.A O no hydrogen 2.981 N/A ASP 278.A N ASP 113.A O no hydrogen 2.894 N/A SER 280.A N ASP 278.A O no hydrogen 2.753 N/A SER 280.A OG THR 282.A OG1 no hydrogen 3.105 N/A ASN 281.A N ASP 277.A O no hydrogen 3.170 N/A ASN 281.A ND2 ASN 279.A O no hydrogen 2.758 N/A THR 282.A N SER 280.A OG no hydrogen 3.356 N/A THR 282.A OG1 SER 280.A OG no hydrogen 3.105 N/A ALA 284.A N ILE 275.A O no hydrogen 2.747 N/A HIS 285.A N ILE 275.A O no hydrogen 3.376 N/A LEU 287.A N VAL 273.A O no hydrogen 2.776 N/A ILE 288.A N VAL 273.A O no hydrogen 3.238 N/A LYS 290.A N TYR 271.A O no hydrogen 2.797 N/A LYS 290.A NZ GLU 268.A OE2 no hydrogen 3.011 N/A LYS 292.A NZ ASP 294.A OD2 no hydrogen 3.057 N/A LYS 293.A N GLU 268.A O no hydrogen 2.816 N/A LYS 293.A NZ GLU 268.A OE1 no hydrogen 3.384 N/A GLY 295.A N GLU 124.A O no hydrogen 2.759 N/A ILE 298.A N LYS 127.A O no hydrogen 2.706 N/A GLN 299.A NE2 ASP 130.A O no hydrogen 3.207 N/A LEU 300.A N LEU 129.A O no hydrogen 2.725 N/A THR 301.A N LEU 523.A O no hydrogen 2.706 N/A THR 301.A OG1 LEU 331.A O no hydrogen 2.714 N/A THR 301.A OG1 HIS 522.A O no hydrogen 3.343 N/A ASP 303.A N LEU 332.A O no hydrogen 2.842 N/A ALA 304.A N ASP 130.A OD2 no hydrogen 2.744 N/A LYS 305.A N ASP 303.A OD1 no hydrogen 3.025 N/A LYS 305.A NZ GLU 642.A OXT no hydrogen 2.597 N/A VAL 306.A N ASP 303.A O no hydrogen 3.026 N/A GLN 307.A N ASP 303.A O no hydrogen 2.991 N/A GLN 307.A NE2 ALA 222.A O no hydrogen 3.005 N/A GLN 307.A NE2 LEU 334.A O no hydrogen 2.823 N/A LYS 308.A N ALA 304.A O no hydrogen 2.885 N/A SER 309.A N LYS 305.A O no hydrogen 3.081 N/A SER 309.A OG GLU 629.A OE1 no hydrogen 2.999 N/A ILE 310.A N VAL 306.A O no hydrogen 2.927 N/A TYR 311.A N GLN 307.A O no hydrogen 3.043 N/A ASN 312.A N LYS 308.A O no hydrogen 2.943 N/A ASN 313.A N SER 309.A O no hydrogen 3.230 N/A ASN 313.A ND2 SER 309.A O no hydrogen 2.861 N/A MET 314.A N TYR 311.A O no hydrogen 2.980 N/A LYS 315.A NZ ASN 312.A O no hydrogen 2.907 N/A ASP 317.A N MET 314.A O no hydrogen 2.969 N/A GLY 319.A N THR 337.A O no hydrogen 2.865 N/A SER 320.A N ASN 606.A O no hydrogen 3.044 N/A GLY 321.A N VAL 335.A O no hydrogen 2.959 N/A THR 322.A N ALA 604.A O no hydrogen 3.040 N/A ALA 323.A N ALA 333.A O no hydrogen 3.106 N/A ILE 324.A N MET 602.A O no hydrogen 2.930 N/A HIS 325.A N GLU 330.A O no hydrogen 2.847 N/A HIS 325.A ND1 ASN 600.A O no hydrogen 2.685 N/A GLN 327.A N GLN 327.A OE1 no hydrogen 2.666 N/A GLN 327.A NE2 PRO 599.A O no hydrogen 2.986 N/A THR 328.A N HIS 325.A O no hydrogen 3.157 N/A THR 328.A OG1 GLU 330.A OE1 no hydrogen 2.645 N/A GLY 329.A N HIS 325.A O no hydrogen 2.829 N/A GLU 330.A N THR 328.A OG1 no hydrogen 3.234 N/A LEU 331.A N HIS 522.A O no hydrogen 2.938 N/A LEU 332.A N ALA 323.A O no hydrogen 2.808 N/A ALA 333.A N ALA 323.A O no hydrogen 3.354 N/A LEU 334.A N GLN 307.A OE1 no hydrogen 2.865 N/A VAL 335.A N GLY 321.A O no hydrogen 2.846 N/A SER 336.A OG LEU 366.A O no hydrogen 3.222 N/A THR 337.A N GLY 319.A O no hydrogen 2.761 N/A THR 337.A OG1 MET 314.A O no hydrogen 3.205 N/A THR 337.A OG1 ASP 317.A O no hydrogen 2.867 N/A THR 337.A OG1 GLY 319.A O no hydrogen 3.237 N/A SER 339.A OG LYS 221.A O no hydrogen 2.778 N/A SER 339.A OG SER 224.A OG no hydrogen 3.292 N/A SER 339.A OG TYR 340.A O no hydrogen 3.529 N/A TYR 340.A N SER 339.A OG no hydrogen 2.609 N/A MET 346.A N VAL 342.A O no hydrogen 2.951 N/A TYR 347.A N TYR 343.A O no hydrogen 2.787 N/A TYR 347.A OH SER 214.A OG no hydrogen 2.504 N/A GLY 348.A N PRO 344.A O no hydrogen 2.839 N/A SER 350.A N GLU 353.A OE1 no hydrogen 2.836 N/A GLU 353.A N SER 350.A OG no hydrogen 3.127 N/A TYR 354.A N SER 350.A O no hydrogen 3.097 N/A ASN 355.A N ASN 351.A O no hydrogen 2.854 N/A LYS 356.A N GLU 352.A O no hydrogen 2.925 N/A LEU 357.A N TYR 354.A O no hydrogen 3.095 N/A THR 358.A N TYR 354.A O no hydrogen 3.098 N/A THR 358.A OG1 ASN 355.A O no hydrogen 3.171 N/A GLU 359.A N ASN 355.A O no hydrogen 2.919 N/A ASP 360.A N LEU 357.A O no hydrogen 3.483 N/A LYS 362.A N ASP 360.A OD1 no hydrogen 2.937 N/A LYS 362.A NZ ASN 316.A O no hydrogen 3.137 N/A GLU 363.A N ASP 360.A O no hydrogen 2.837 N/A LEU 366.A N GLU 363.A O no hydrogen 3.156 N/A LYS 368.A N SER 336.A OG no hydrogen 2.637 N/A LYS 368.A NZ THR 337.A O no hydrogen 3.070 N/A LYS 368.A NZ LYS 362.A O no hydrogen 2.876 N/A LYS 368.A NZ GLU 363.A O no hydrogen 2.800 N/A PHE 369.A N ASN 367.A OD1 no hydrogen 3.124 N/A GLN 370.A N ASN 367.A O no hydrogen 3.266 N/A GLN 370.A NE2 PRO 471.A O no hydrogen 2.870 N/A THR 373.A N ILE 500.A O no hydrogen 2.927 N/A GLY 376.A N SER 374.A OG no hydrogen 3.142 N/A SER 377.A OG SER 436.A OG no hydrogen 3.349 N/A THR 378.A N PRO 375.A O no hydrogen 2.966 N/A THR 378.A OG1 PRO 375.A O no hydrogen 2.688 N/A GLN 379.A N GLY 376.A O no hydrogen 3.323 N/A GLN 379.A NE2 THR 383.A OG1 no hydrogen 3.139 N/A LYS 380.A N SER 377.A O no hydrogen 3.159 N/A LYS 380.A NZ SER 377.A OG no hydrogen 2.874 N/A LYS 380.A NZ SER 436.A O no hydrogen 3.013 N/A LYS 380.A NZ SER 436.A OG no hydrogen 2.692 N/A LYS 380.A NZ ASN 438.A OD1 no hydrogen 3.136 N/A THR 383.A N GLN 379.A O no hydrogen 2.932 N/A THR 383.A OG1 GLN 379.A O no hydrogen 3.407 N/A THR 383.A OG1 GLY 492.A O no hydrogen 2.561 N/A ALA 384.A N LYS 380.A O no hydrogen 3.058 N/A MET 385.A N ILE 381.A O no hydrogen 2.897 N/A ILE 386.A N LEU 382.A O no hydrogen 3.031 N/A GLY 387.A N THR 383.A O no hydrogen 2.896 N/A LEU 388.A N ALA 384.A O no hydrogen 2.656 N/A ASN 389.A N MET 385.A O no hydrogen 2.940 N/A ASN 390.A N ILE 386.A O no hydrogen 2.924 N/A ASN 390.A ND2 ILE 386.A O no hydrogen 2.808 N/A LYS 391.A N LEU 388.A O no hydrogen 3.026 N/A THR 392.A N GLY 387.A O no hydrogen 3.149 N/A THR 392.A OG1 GLY 387.A O no hydrogen 3.553 N/A LEU 393.A N GLY 387.A O no hydrogen 3.190 N/A ASP 394.A N THR 397.A OG1 no hydrogen 3.055 N/A LYS 396.A N ASP 394.A OD1 no hydrogen 2.927 N/A THR 397.A N ASP 394.A O no hydrogen 3.117 N/A THR 397.A OG1 ASP 394.A O no hydrogen 3.257 N/A THR 397.A OG1 ASP 394.A OD1 no hydrogen 3.490 N/A TYR 399.A N ILE 427.A O no hydrogen 2.996 N/A TYR 399.A OH GLU 447.A OE1 no hydrogen 3.112 N/A LYS 400.A NZ ASN 426.A OD1 no hydrogen 3.250 N/A ILE 401.A N GLY 425.A O no hydrogen 2.855 N/A GLY 403.A N ASN 424.A OD1 no hydrogen 2.952 N/A TRP 406.A N VAL 417.A O no hydrogen 3.007 N/A GLN 407.A NE2 GLY 413.A O no hydrogen 3.157 N/A GLN 407.A NE2 TYR 415.A O no hydrogen 3.186 N/A LYS 408.A NZ GLU 485.A OE2 no hydrogen 3.022 N/A LYS 410.A NZ GLN 407.A OE1 no hydrogen 3.097 N/A LYS 410.A NZ GLY 413.A O no hydrogen 3.165 N/A TRP 412.A NE1 GLU 485.A OE1 no hydrogen 3.025 N/A GLY 413.A N LYS 410.A O no hydrogen 2.876 N/A TYR 415.A N TRP 412.A O no hydrogen 3.376 N/A TYR 415.A OH ASP 490.A OD1 no hydrogen 2.506 N/A TYR 415.A OH TYR 493.A OH no hydrogen 3.350 N/A VAL 417.A N TRP 406.A O no hydrogen 2.967 N/A ARG 419.A N LYS 404.A O no hydrogen 2.997 N/A ARG 419.A NE GLY 403.A O no hydrogen 2.830 N/A ARG 419.A NH1 VAL 423.A O no hydrogen 2.913 N/A ARG 419.A NH1 ASP 437.A OD2 no hydrogen 2.947 N/A ARG 419.A NH2 ILE 401.A O no hydrogen 3.486 N/A ARG 419.A NH2 GLY 403.A O no hydrogen 2.817 N/A ARG 419.A NH2 VAL 423.A O no hydrogen 3.312 N/A GLY 425.A N ILE 401.A O no hydrogen 3.138 N/A ILE 427.A N TYR 399.A O no hydrogen 2.813 N/A GLN 431.A N ASP 428.A OD1 no hydrogen 3.047 N/A GLN 431.A NE2 SER 435.A OG no hydrogen 3.188 N/A ALA 432.A N ASP 428.A O no hydrogen 2.943 N/A ILE 433.A N LEU 429.A O no hydrogen 2.898 N/A GLU 434.A N LYS 430.A O no hydrogen 3.042 N/A SER 435.A N GLN 431.A O no hydrogen 2.928 N/A SER 435.A OG GLN 431.A O no hydrogen 3.025 N/A SER 436.A N ILE 433.A O no hydrogen 3.225 N/A SER 436.A OG SER 572.A O no hydrogen 2.946 N/A ASP 437.A N ALA 432.A O no hydrogen 2.912 N/A ASN 438.A ND2 THR 418.A O no hydrogen 2.901 N/A PHE 440.A N ASP 437.A OD1 no hydrogen 3.147 N/A PHE 441.A N ASP 437.A O no hydrogen 3.491 N/A ALA 442.A N ASN 438.A O no hydrogen 3.040 N/A ARG 443.A N ILE 439.A O no hydrogen 2.948 N/A VAL 444.A N PHE 440.A O no hydrogen 3.005 N/A ALA 445.A N PHE 441.A O no hydrogen 3.152 N/A LEU 446.A N ALA 442.A O no hydrogen 3.031 N/A GLU 447.A N ARG 443.A O no hydrogen 2.800 N/A LEU 448.A N VAL 444.A O no hydrogen 2.993 N/A GLY 449.A N ALA 445.A O no hydrogen 3.143 N/A LYS 451.A NZ ASP 483.A OD1 no hydrogen 3.375 N/A PHE 453.A N GLY 449.A O no hydrogen 3.127 N/A GLU 454.A N SER 450.A O no hydrogen 3.055 N/A LYS 455.A N LYS 451.A O no hydrogen 3.036 N/A GLY 456.A N LYS 452.A O no hydrogen 2.877 N/A MET 457.A N PHE 453.A O no hydrogen 2.832 N/A LYS 458.A N GLU 454.A O no hydrogen 3.076 N/A LYS 459.A N LYS 455.A O no hydrogen 2.844 N/A LYS 459.A NZ ASN 535.A O no hydrogen 3.263 N/A LEU 460.A N GLY 456.A O no hydrogen 2.992 N/A GLY 461.A N LYS 458.A O no hydrogen 2.840 N/A VAL 462.A N MET 457.A O no hydrogen 3.086 N/A GLU 464.A N GLY 461.A O no hydrogen 3.158 N/A ILE 466.A N ASN 474.A OD1 no hydrogen 3.226 N/A SER 468.A N ILE 466.A O no hydrogen 2.726 N/A SER 468.A OG ASP 469.A OD1 no hydrogen 3.555 N/A SER 468.A OG PRO 521.A O no hydrogen 2.545 N/A PHE 472.A N TYR 470.A O no hydrogen 2.910 N/A TYR 473.A N GLN 370.A O no hydrogen 3.022 N/A ASN 474.A ND2 ASP 465.A OD2 no hydrogen 3.262 N/A GLN 476.A N LEU 499.A O no hydrogen 2.735 N/A LYS 480.A N SER 478.A OG no hydrogen 3.315 N/A ASP 483.A N ASN 479.A O no hydrogen 2.826 N/A ASN 484.A N ASN 481.A O no hydrogen 3.198 N/A LEU 487.A N ASN 484.A OD1 no hydrogen 3.082 N/A LEU 488.A N ASN 484.A O no hydrogen 2.950 N/A ALA 489.A N GLU 485.A O no hydrogen 3.141 N/A ASP 490.A N ILE 486.A O no hydrogen 2.893 N/A SER 491.A N LEU 487.A O no hydrogen 2.885 N/A SER 491.A OG LEU 487.A O no hydrogen 2.528 N/A GLY 492.A N ALA 489.A O no hydrogen 3.303 N/A TYR 493.A N ASP 490.A O no hydrogen 3.183 N/A TYR 493.A OH ASP 490.A OD1 no hydrogen 2.756 N/A GLN 495.A N ASP 490.A O no hydrogen 2.955 N/A LEU 499.A N GLN 476.A O no hydrogen 2.713 N/A ILE 500.A N THR 373.A O no hydrogen 2.731 N/A ASN 501.A ND2 PHE 369.A O no hydrogen 2.834 N/A ASN 501.A ND2 GLN 370.A O no hydrogen 2.957 N/A ASN 501.A ND2 ILE 371.A O no hydrogen 3.088 N/A VAL 503.A N ASN 501.A OD1 no hydrogen 2.782 N/A GLN 504.A N ASN 501.A OD1 no hydrogen 3.176 N/A GLN 504.A NE2 GLY 461.A O no hydrogen 2.948 N/A ILE 505.A N ASN 501.A O no hydrogen 3.065 N/A LEU 506.A N PRO 502.A O no hydrogen 3.108 N/A SER 507.A N VAL 503.A O no hydrogen 2.876 N/A SER 507.A OG VAL 503.A O no hydrogen 3.023 N/A ILE 508.A N GLN 504.A O no hydrogen 3.116 N/A TYR 509.A N ILE 505.A O no hydrogen 3.180 N/A TYR 509.A OH THR 378.A O no hydrogen 2.681 N/A SER 510.A N LEU 506.A O no hydrogen 2.908 N/A SER 510.A OG SER 507.A O no hydrogen 2.591 N/A ALA 511.A N ILE 508.A O no hydrogen 3.228 N/A LEU 512.A N TYR 509.A O no hydrogen 2.970 N/A GLU 513.A N SER 510.A O no hydrogen 2.807 N/A ASN 514.A N ALA 511.A O no hydrogen 3.056 N/A ASN 514.A ND2 ASN 517.A O no hydrogen 3.171 N/A ASN 514.A ND2 ASN 519.A OD1 no hydrogen 2.790 N/A GLY 516.A N ALA 511.A O no hydrogen 2.999 N/A ASN 517.A N ASN 514.A O no hydrogen 3.142 N/A ILE 518.A N LYS 533.A O no hydrogen 2.879 N/A ASN 519.A ND2 THR 328.A O no hydrogen 2.997 N/A ALA 520.A N LYS 530.A O no hydrogen 2.843 N/A HIS 522.A N GLY 329.A O no hydrogen 3.017 N/A HIS 522.A ND1 ALA 520.A O no hydrogen 2.891 N/A LEU 523.A N ASP 469.A OD1 no hydrogen 2.773 N/A LEU 523.A N ASP 469.A OD2 no hydrogen 3.052 N/A LEU 524.A N ASP 469.A OD2 no hydrogen 2.705 N/A LYS 525.A N GLN 299.A O no hydrogen 2.928 N/A THR 527.A N LEU 524.A O no hydrogen 3.071 N/A THR 527.A OG1 ASP 469.A OD2 no hydrogen 2.956 N/A TRP 532.A N ILE 518.A O no hydrogen 2.704 N/A LYS 533.A N ILE 518.A O no hydrogen 3.027 N/A LYS 533.A NZ GLU 464.A OE1 no hydrogen 3.410 N/A LYS 533.A NZ GLU 464.A OE2 no hydrogen 2.740 N/A ASN 535.A N ASN 517.A OD1 no hydrogen 2.727 N/A ILE 536.A N GLY 516.A O no hydrogen 2.709 N/A ASN 541.A N SER 538.A OG no hydrogen 3.114 N/A ILE 542.A N SER 538.A O no hydrogen 2.991 N/A ILE 542.A N LYS 539.A O no hydrogen 3.255 N/A ASN 543.A N LYS 539.A O no hydrogen 3.336 N/A LEU 544.A N GLU 540.A O no hydrogen 3.462 N/A LEU 545.A N ASN 541.A O no hydrogen 3.290 N/A THR 546.A N ILE 542.A O no hydrogen 2.901 N/A THR 546.A OG1 ILE 542.A O no hydrogen 3.060 N/A THR 546.A OG1 ASN 543.A O no hydrogen 3.081 N/A ASP 547.A N ASN 543.A O no hydrogen 2.963 N/A GLY 548.A N LEU 544.A O no hydrogen 3.203 N/A MET 549.A N LEU 545.A O no hydrogen 2.921 N/A GLN 550.A N THR 546.A O no hydrogen 2.802 N/A GLN 550.A NE2 ASN 567.A OD1 no hydrogen 2.917 N/A GLN 551.A N GLY 548.A O no hydrogen 3.069 N/A GLN 551.A NE2 ASP 547.A O no hydrogen 3.477 N/A ASN 554.A N GLN 550.A O no hydrogen 2.927 N/A LYS 555.A N GLN 551.A O no hydrogen 2.886 N/A THR 556.A N GLN 551.A O no hydrogen 3.251 N/A THR 556.A OG1 GLU 434.A O no hydrogen 2.610 N/A HIS 557.A N VAL 552.A O no hydrogen 2.823 N/A LYS 558.A N LYS 555.A O no hydrogen 3.346 N/A ASP 560.A N HIS 557.A O no hydrogen 2.993 N/A ILE 561.A N HIS 557.A O no hydrogen 2.996 N/A ARG 563.A NE ASP 628.A OD1 no hydrogen 2.733 N/A ARG 563.A NE ASP 628.A OD2 no hydrogen 3.412 N/A ARG 563.A NH1 ASP 560.A O no hydrogen 3.232 N/A ARG 563.A NH1 TYR 562.A O no hydrogen 3.019 N/A ARG 563.A NH2 ASP 628.A OD2 no hydrogen 3.037 N/A TYR 565.A OH ASP 628.A OD1 no hydrogen 2.474 N/A ALA 566.A N ARG 563.A O no hydrogen 3.500 N/A ASN 567.A N ASP 595.A OD1 no hydrogen 3.018 N/A ASN 567.A ND2 ASP 597.A OD1 no hydrogen 3.106 N/A ILE 569.A N TYR 594.A O no hydrogen 2.927 N/A GLY 570.A N MET 549.A O no hydrogen 3.152 N/A LYS 571.A N ILE 592.A O no hydrogen 2.864 N/A LYS 571.A NZ SER 436.A OG no hydrogen 3.012 N/A SER 572.A OG HIS 557.A NE2 no hydrogen 3.117 N/A GLY 573.A N TRP 590.A O no hydrogen 3.246 N/A ALA 575.A N ILE 588.A O no hydrogen 2.987 N/A LEU 577.A N ARG 586.A O no hydrogen 2.681 N/A MET 579.A N LEU 577.A O no hydrogen 2.878 N/A THR 584.A OG1 GLU 583.A O no hydrogen 2.450 N/A GLN 587.A N GLN 611.A OE1 no hydrogen 3.005 N/A GLN 587.A NE2 GLU 576.A OE2 no hydrogen 2.780 N/A ILE 588.A N ALA 575.A O no hydrogen 2.831 N/A GLY 589.A N VAL 607.A O no hydrogen 2.799 N/A TRP 590.A N GLY 573.A O no hydrogen 2.942 N/A PHE 591.A N ILE 605.A O no hydrogen 2.973 N/A ILE 592.A N LYS 571.A O no hydrogen 2.790 N/A SER 593.A N MET 603.A O no hydrogen 2.828 N/A SER 593.A OG TYR 627.A OH no hydrogen 2.839 N/A TYR 594.A N ILE 569.A O no hydrogen 3.117 N/A LYS 596.A N ASN 567.A O no hydrogen 2.930 N/A ASP 597.A N ASP 595.A OD1 no hydrogen 2.919 N/A ASN 598.A N ASP 595.A O no hydrogen 2.967 N/A ASN 598.A ND2 TYR 631.A OH no hydrogen 3.020 N/A ASN 598.A ND2 TYR 638.A O no hydrogen 2.922 N/A ASN 600.A N ASN 598.A O no hydrogen 2.883 N/A ASN 600.A ND2 TYR 638.A O no hydrogen 2.867 N/A MET 602.A N ILE 324.A O no hydrogen 2.954 N/A MET 603.A N SER 593.A O no hydrogen 2.873 N/A ALA 604.A N THR 322.A O no hydrogen 2.803 N/A ILE 605.A N PHE 591.A O no hydrogen 2.921 N/A ASN 606.A N SER 320.A O no hydrogen 2.904 N/A VAL 607.A N GLY 589.A O no hydrogen 2.958 N/A LYS 608.A N TYR 318.A O no hydrogen 2.949 N/A ASP 609.A N GLN 587.A O no hydrogen 2.680 N/A VAL 610.A N GLN 587.A O no hydrogen 3.049 N/A GLN 611.A N GLN 611.A OE1 no hydrogen 2.751 N/A GLN 611.A NE2 ASP 609.A OD1 no hydrogen 3.036 N/A LYS 613.A N VAL 610.A O no hydrogen 3.035 N/A LYS 613.A NZ ASP 609.A O no hydrogen 3.189 N/A MET 615.A N VAL 610.A O no hydrogen 2.855 N/A SER 617.A N GLY 614.A O no hydrogen 3.073 N/A SER 617.A OG HIS 557.A ND1 no hydrogen 3.265 N/A TYR 618.A N MET 615.A O no hydrogen 3.032 N/A TYR 618.A OH ASP 317.A OD1 no hydrogen 2.840 N/A TYR 618.A OH ASP 317.A OD2 no hydrogen 2.682 N/A ASN 619.A ND2 GLY 589.A O no hydrogen 2.885 N/A ASN 619.A ND2 ILE 605.A O no hydrogen 3.040 N/A ALA 620.A N ALA 616.A O no hydrogen 3.022 N/A LYS 621.A N SER 617.A O no hydrogen 2.919 N/A ILE 622.A N TYR 618.A O no hydrogen 3.020 N/A SER 623.A N ASN 619.A O no hydrogen 3.012 N/A SER 623.A OG ASN 619.A O no hydrogen 2.856 N/A GLY 624.A N ALA 620.A O no hydrogen 2.836 N/A LYS 625.A N LYS 621.A O no hydrogen 3.145 N/A VAL 626.A N ILE 622.A O no hydrogen 3.101 N/A TYR 627.A N SER 623.A O no hydrogen 3.080 N/A TYR 627.A OH SER 593.A OG no hydrogen 2.839 N/A ASP 628.A N GLY 624.A O no hydrogen 2.947 N/A GLU 629.A N LYS 625.A O no hydrogen 3.061 N/A LEU 630.A N VAL 626.A O no hydrogen 2.879 N/A TYR 631.A N TYR 627.A O no hydrogen 2.737 N/A TYR 631.A OH ASP 595.A OD2 no hydrogen 2.696 N/A GLU 632.A N GLU 629.A O no hydrogen 3.276 N/A ASN 633.A N ASP 628.A O no hydrogen 2.808 N/A GLY 634.A N TYR 631.A O no hydrogen 2.900 N/A ASN 635.A N GLU 632.A O no hydrogen 3.147 N/A LYS 636.A N TYR 631.A O no hydrogen 3.155 N/A LYS 636.A NZ GLU 642.A OE1 no hydrogen 2.480 N/A LYS 636.A NZ GLU 642.A OE2 no hydrogen 3.236 N/A TYR 638.A OH ASP 303.A OD2 no hydrogen 2.535 N/A ASP 641.A N ASP 639.A OD1 no hydrogen 2.984 N/A GLU 642.A N ASP 639.A O no hydrogen 3.321 N/A