Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1jqk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A N HIS 5.A ND1 no hydrogen 3.319 N/A THR 2.A OG1 GLU 294.A OE2 no hydrogen 3.469 N/A ALA 3.A N GLU 294.A OE2 no hydrogen 2.948 N/A ARG 6.A N THR 2.A O no hydrogen 3.044 N/A TYR 7.A N ALA 3.A O no hydrogen 2.947 N/A GLU 8.A N TRP 4.A O no hydrogen 3.089 N/A LYS 9.A N HIS 5.A O no hydrogen 3.067 N/A GLN 10.A N TYR 7.A O no hydrogen 2.963 N/A GLN 11.A N GLU 8.A O no hydrogen 2.832 N/A GLN 13.A NE2 GLN 11.A OE1 no hydrogen 3.584 N/A SER 18.A N CYS 14.A O no hydrogen 3.350 N/A SER 18.A OG CYS 14.A O no hydrogen 3.091 N/A ALA 19.A N GLY 15.A O no hydrogen 3.030 N/A GLY 20.A N GLY 17.A O no hydrogen 2.574 N/A LEU 21.A N PHE 16.A O no hydrogen 2.771 N/A CYS 22.A SG CYS 31.A O no hydrogen 4.003 N/A CYS 23.A N CYS 31.A O no hydrogen 2.902 N/A GLY 29.A N CYS 26.A O no hydrogen 3.182 N/A CYS 31.A N CYS 23.A O no hydrogen 3.325 N/A ILE 33.A N LEU 21.A O no hydrogen 2.904 N/A ASP 34.A N PRO 40.A O no hydrogen 2.928 N/A GLU 38.A N PHE 36.A O no hydrogen 2.158 N/A GLY 39.A N ASP 34.A OD2 no hydrogen 2.595 N/A GLY 43.A N ALA 47.A O no hydrogen 2.864 N/A GLY 46.A N GLY 43.A O no hydrogen 2.705 N/A ARG 49.A NE GLY 566.A O no hydrogen 3.474 N/A ARG 49.A NH1 PRO 35.A O no hydrogen 3.489 N/A THR 51.A OG1 ASP 48.A OD1 no hydrogen 3.184 N/A THR 51.A OG1 ALA 180.A O no hydrogen 2.706 N/A ILE 52.A N ASP 48.A O no hydrogen 2.800 N/A VAL 53.A N ARG 49.A O no hydrogen 2.729 N/A ALA 54.A N ASP 50.A O no hydrogen 2.973 N/A ARG 55.A N THR 51.A O no hydrogen 3.027 N/A LEU 57.A N VAL 53.A O no hydrogen 3.431 N/A VAL 58.A N ALA 54.A O no hydrogen 3.014 N/A ARG 59.A N ARG 55.A O no hydrogen 2.854 N/A ARG 59.A NH1 THR 174.A OG1 no hydrogen 2.888 N/A MET 60.A N HIS 56.A O no hydrogen 3.081 N/A MET 60.A N LEU 57.A O no hydrogen 3.082 N/A ILE 61.A N LEU 57.A O no hydrogen 3.141 N/A ALA 62.A N VAL 58.A O no hydrogen 2.946 N/A ALA 63.A N ARG 59.A O no hydrogen 3.066 N/A GLY 64.A N MET 60.A O no hydrogen 3.075 N/A THR 65.A N ILE 61.A O no hydrogen 2.748 N/A THR 65.A OG1 ILE 61.A O no hydrogen 3.160 N/A THR 65.A OG1 VAL 192.A O no hydrogen 2.892 N/A ALA 66.A N ALA 62.A O no hydrogen 2.850 N/A ALA 67.A N ALA 63.A O no hydrogen 3.016 N/A HIS 68.A N GLY 64.A O no hydrogen 3.120 N/A HIS 68.A ND1 ASP 196.A OD1 no hydrogen 2.490 N/A SER 69.A N THR 65.A O no hydrogen 2.803 N/A SER 69.A OG ALA 66.A O no hydrogen 3.330 N/A GLU 70.A N ALA 66.A O no hydrogen 3.152 N/A HIS 71.A N HIS 68.A O no hydrogen 2.798 N/A GLY 72.A N HIS 68.A O no hydrogen 3.079 N/A ARG 73.A N SER 69.A O no hydrogen 2.686 N/A ARG 73.A NE GLU 70.A OE1 no hydrogen 3.302 N/A ARG 73.A NE GLU 70.A OE2 no hydrogen 3.409 N/A ARG 73.A NH1 GLU 70.A OE1 no hydrogen 3.383 N/A ARG 73.A NH1 ASP 164.A OD1 no hydrogen 2.930 N/A ARG 73.A NH1 ASP 164.A OD2 no hydrogen 2.592 N/A ARG 73.A NH2 ASP 164.A OD2 no hydrogen 2.813 N/A ALA 76.A N GLY 72.A O no hydrogen 2.915 N/A LEU 77.A N ARG 73.A O no hydrogen 2.978 N/A ALA 78.A N HIS 74.A O no hydrogen 3.228 N/A ALA 78.A N ILE 75.A O no hydrogen 2.958 N/A MET 79.A N ILE 75.A O no hydrogen 3.061 N/A GLN 80.A N ALA 76.A O no hydrogen 3.228 N/A HIS 81.A N LEU 77.A O no hydrogen 3.112 N/A ILE 82.A N ALA 78.A O no hydrogen 2.906 N/A SER 83.A N MET 79.A O no hydrogen 2.759 N/A SER 83.A OG GLN 80.A O no hydrogen 3.042 N/A GLN 84.A N HIS 81.A O no hydrogen 3.128 N/A GLN 84.A NE2 GLU 86.A OE1 no hydrogen 3.568 N/A GLY 85.A N ILE 82.A O no hydrogen 2.952 N/A GLU 86.A N HIS 81.A O no hydrogen 2.847 N/A ASP 89.A N LEU 87.A O no hydrogen 2.794 N/A TYR 90.A N LEU 87.A O no hydrogen 3.092 N/A TYR 90.A OH MET 241.A O no hydrogen 2.873 N/A ARG 93.A NE LEU 210.A O no hydrogen 2.835 N/A ARG 93.A NH2 LEU 210.A O no hydrogen 2.971 N/A LYS 97.A N ASP 94.A OD2 no hydrogen 2.375 N/A LYS 97.A NZ GLU 205.A O no hydrogen 3.218 N/A LYS 97.A NZ GLU 205.A OE2 no hydrogen 2.519 N/A LEU 98.A N ASP 94.A O no hydrogen 2.994 N/A TYR 99.A N ALA 96.A O no hydrogen 2.920 N/A TYR 99.A OH THR 109.A O no hydrogen 3.148 N/A ALA 100.A N ALA 96.A O no hydrogen 2.733 N/A ILE 101.A N LYS 97.A O no hydrogen 2.789 N/A LYS 103.A N TYR 99.A O no hydrogen 3.042 N/A THR 104.A N ALA 100.A O no hydrogen 3.080 N/A THR 104.A OG1 ALA 100.A O no hydrogen 3.342 N/A LEU 105.A N ILE 101.A O no hydrogen 2.900 N/A GLY 106.A N LYS 103.A O no hydrogen 3.158 N/A VAL 107.A N ALA 102.A O no hydrogen 2.608 N/A ARG 112.A N THR 109.A O no hydrogen 2.975 N/A ALA 116.A N GLY 113.A O no hydrogen 3.066 N/A ILE 117.A N LEU 114.A O no hydrogen 2.448 N/A VAL 118.A N LEU 114.A O no hydrogen 2.603 N/A ASP 120.A N ALA 116.A O no hydrogen 3.037 N/A LEU 121.A N ILE 117.A O no hydrogen 3.414 N/A ALA 122.A N VAL 118.A O no hydrogen 3.384 N/A ALA 123.A N GLY 119.A O no hydrogen 3.070 N/A ALA 123.A N ASP 120.A O no hydrogen 2.725 N/A ILE 124.A N ASP 120.A O no hydrogen 2.856 N/A THR 125.A N LEU 121.A O no hydrogen 2.825 N/A THR 125.A OG1 LEU 121.A O no hydrogen 3.253 N/A LEU 126.A N ALA 122.A O no hydrogen 2.966 N/A ASP 128.A N ILE 124.A O no hydrogen 3.149 N/A ASP 128.A N THR 125.A O no hydrogen 2.861 N/A PHE 129.A N LEU 126.A O no hydrogen 2.896 N/A GLN 130.A N GLY 127.A O no hydrogen 2.757 N/A ASN 131.A N GLY 127.A O no hydrogen 2.950 N/A ASN 131.A ND2 ASP 133.A O no hydrogen 3.256 N/A ASN 131.A ND2 HIS 161.A O no hydrogen 3.166 N/A GLN 132.A NE2 GLN 130.A O no hydrogen 2.793 N/A ASP 133.A N ASN 131.A OD1 no hydrogen 2.660 N/A ASP 135.A N ASP 133.A OD1 no hydrogen 3.002 N/A LYS 136.A N ASP 133.A O no hydrogen 2.958 N/A LYS 136.A NZ PRO 137.A O no hydrogen 3.166 N/A CYS 138.A N PRO 160.A O no hydrogen 2.988 N/A CYS 138.A SG PRO 160.A O no hydrogen 3.305 N/A ALA 139.A N ASP 128.A OD1 no hydrogen 2.826 N/A TRP 140.A N ASP 128.A OD2 no hydrogen 3.433 N/A TRP 140.A NE1 THR 125.A OG1 no hydrogen 2.672 N/A LEU 141.A N ASP 198.A OD1 no hydrogen 3.208 N/A ALA 142.A N CYS 138.A O no hydrogen 3.137 N/A ALA 143.A N ALA 139.A O no hydrogen 2.931 N/A SER 144.A N TRP 140.A O no hydrogen 2.778 N/A SER 144.A N LEU 141.A O no hydrogen 3.164 N/A SER 144.A OG TRP 140.A O no hydrogen 2.919 N/A LEU 145.A N LEU 141.A O no hydrogen 3.160 N/A THR 146.A OG1 ASP 524.A OD2 no hydrogen 3.398 N/A ARG 148.A NH1 GLY 522.A O no hydrogen 2.764 N/A ARG 148.A NH2 GLY 522.A O no hydrogen 3.100 N/A ARG 149.A N THR 146.A OG1 no hydrogen 2.932 N/A ARG 149.A NE THR 551.A O no hydrogen 2.859 N/A ARG 149.A NH2 THR 551.A O no hydrogen 3.478 N/A VAL 150.A N THR 146.A O no hydrogen 3.223 N/A LYS 151.A N PRO 147.A O no hydrogen 3.149 N/A LYS 151.A NZ ASP 155.A OD2 no hydrogen 3.344 N/A ARG 152.A N ARG 148.A O no hydrogen 3.009 N/A ARG 152.A NH2 ASP 580.A O no hydrogen 2.847 N/A LEU 153.A N ARG 149.A O no hydrogen 2.865 N/A GLY 154.A N VAL 150.A O no hydrogen 3.126 N/A ASP 155.A N LYS 151.A O no hydrogen 3.221 N/A LEU 156.A N ARG 152.A O no hydrogen 3.203 N/A GLY 157.A N GLY 154.A O no hydrogen 3.028 N/A LEU 158.A N LEU 153.A O no hydrogen 2.963 N/A ASN 162.A ND2 PHE 129.A O no hydrogen 3.036 N/A ASN 162.A ND2 ASN 131.A O no hydrogen 3.059 N/A ILE 163.A N ASP 128.A O no hydrogen 2.886 N/A ALA 165.A N ASN 162.A OD1 no hydrogen 2.709 N/A SER 166.A N ASN 162.A O no hydrogen 2.789 N/A SER 166.A OG ASN 162.A O no hydrogen 2.983 N/A VAL 167.A N ILE 163.A O no hydrogen 3.186 N/A ALA 168.A N ASP 164.A O no hydrogen 3.153 N/A GLN 169.A N ALA 165.A O no hydrogen 2.964 N/A THR 170.A N SER 166.A O no hydrogen 3.092 N/A THR 170.A N VAL 167.A O no hydrogen 3.109 N/A THR 170.A OG1 SER 166.A O no hydrogen 2.549 N/A MET 171.A N VAL 167.A O no hydrogen 2.986 N/A SER 172.A N ALA 168.A O no hydrogen 2.758 N/A ARG 173.A N GLN 169.A O no hydrogen 2.901 N/A ARG 173.A NE ASP 179.A OD2 no hydrogen 3.216 N/A ARG 173.A NH2 ASP 179.A OD2 no hydrogen 3.338 N/A THR 174.A OG1 THR 170.A O no hydrogen 2.926 N/A THR 174.A OG1 MET 171.A O no hydrogen 3.273 N/A CYS 178.A SG SER 172.A O no hydrogen 3.212 N/A CYS 178.A SG VAL 176.A O no hydrogen 3.758 N/A ASP 179.A N ARG 173.A O no hydrogen 2.669 N/A ASN 184.A N ASP 181.A OD2 no hydrogen 2.680 N/A LEU 185.A N ASP 181.A O no hydrogen 2.869 N/A ILE 186.A N PRO 182.A O no hydrogen 3.025 N/A LEU 187.A N THR 183.A O no hydrogen 3.022 N/A GLY 188.A N ASN 184.A O no hydrogen 3.041 N/A GLY 189.A N LEU 185.A O no hydrogen 3.011 N/A LEU 190.A N ILE 186.A O no hydrogen 2.976 N/A ARG 191.A N LEU 187.A O no hydrogen 3.044 N/A ARG 191.A NH1 GLY 157.A O no hydrogen 2.988 N/A ARG 191.A NH2 TYR 134.A O no hydrogen 3.248 N/A ARG 191.A NH2 HIS 161.A ND1 no hydrogen 3.048 N/A VAL 192.A N GLY 188.A O no hydrogen 3.134 N/A ALA 193.A N GLY 189.A O no hydrogen 2.974 N/A MET 194.A N LEU 190.A O no hydrogen 3.144 N/A MET 194.A N ARG 191.A O no hydrogen 2.906 N/A ALA 195.A N ARG 191.A O no hydrogen 3.271 N/A ALA 195.A N VAL 192.A O no hydrogen 2.927 N/A ASP 196.A N ALA 193.A O no hydrogen 2.996 N/A LEU 197.A N ALA 193.A O no hydrogen 3.396 N/A ASP 198.A N MET 194.A O no hydrogen 3.007 N/A GLY 199.A N ALA 195.A O no hydrogen 3.121 N/A SER 200.A N ASP 196.A O no hydrogen 2.808 N/A SER 200.A OG ASP 196.A O no hydrogen 2.757 N/A MET 201.A N LEU 197.A O no hydrogen 2.664 N/A LEU 202.A N ASP 198.A O no hydrogen 2.976 N/A ALA 203.A N GLY 199.A O no hydrogen 2.918 N/A THR 204.A N SER 200.A O no hydrogen 2.921 N/A THR 204.A OG1 SER 200.A O no hydrogen 2.957 N/A THR 204.A OG1 VAL 505.A O no hydrogen 3.045 N/A THR 204.A OG1 ASP 506.A OD1 no hydrogen 3.053 N/A THR 204.A OG1 SER 508.A OG no hydrogen 2.981 N/A GLU 205.A N MET 201.A O no hydrogen 2.991 N/A LEU 206.A N LEU 202.A O no hydrogen 3.381 N/A SER 207.A N ALA 203.A O no hydrogen 3.156 N/A SER 207.A OG ALA 203.A O no hydrogen 2.594 N/A ASP 208.A N THR 204.A O no hydrogen 2.894 N/A ALA 209.A N GLU 205.A O no hydrogen 3.136 N/A LEU 210.A N LEU 206.A O no hydrogen 3.046 N/A PHE 211.A N SER 207.A O no hydrogen 2.937 N/A GLY 212.A N ASP 208.A O no hydrogen 2.531 N/A THR 213.A OG1 GLU 388.A OE1 no hydrogen 3.233 N/A GLN 215.A N GLN 215.A OE1 no hydrogen 3.144 N/A VAL 217.A N VAL 383.A O no hydrogen 2.719 N/A SER 219.A N SER 381.A O no hydrogen 2.601 N/A SER 219.A OG ALA 220.A O no hydrogen 3.479 N/A SER 219.A OG GLY 283.A O no hydrogen 2.570 N/A SER 219.A OG VAL 284.A O no hydrogen 3.499 N/A ALA 220.A N SER 219.A OG no hydrogen 2.713 N/A ALA 221.A N GLN 379.A O no hydrogen 2.812 N/A ASN 222.A ND2 PHE 377.A O no hydrogen 3.000 N/A VAL 225.A N LEU 223.A O no hydrogen 2.668 N/A LYS 227.A NZ GLU 264.A OE1 no hydrogen 2.543 N/A GLY 229.A N GLU 264.A OE2 no hydrogen 3.267 N/A ALA 230.A N LYS 227.A O no hydrogen 3.233 N/A VAL 231.A N GLY 265.A O no hydrogen 2.615 N/A ASN 232.A N GLU 303.A OE2 no hydrogen 2.536 N/A ASN 232.A ND2 LYS 227.A O no hydrogen 3.121 N/A ASN 232.A ND2 ALA 301.A O no hydrogen 2.620 N/A ILE 233.A N ASN 267.A O no hydrogen 3.221 N/A ALA 234.A N ALA 304.A O no hydrogen 2.836 N/A VAL 235.A N ILE 269.A O no hydrogen 2.984 N/A ASN 236.A N VAL 306.A O no hydrogen 2.993 N/A ASN 236.A ND2 GLN 293.A OE1 no hydrogen 2.987 N/A HIS 238.A N ASP 308.A OD1 no hydrogen 3.250 N/A HIS 238.A N ASP 308.A OD2 no hydrogen 3.195 N/A ASN 239.A N ASP 308.A OD2 no hydrogen 2.676 N/A SER 243.A OG PRO 240.A O no hydrogen 3.348 N/A SER 243.A OG THR 274.A OG1 no hydrogen 3.086 N/A ASP 244.A N PRO 240.A O no hydrogen 2.903 N/A ILE 246.A N LEU 242.A O no hydrogen 2.991 N/A CYS 247.A N SER 243.A O no hydrogen 2.942 N/A CYS 247.A SG SER 243.A O no hydrogen 3.505 N/A ASP 248.A N ASP 244.A O no hydrogen 3.295 N/A VAL 249.A N ILE 245.A O no hydrogen 2.913 N/A ALA 250.A N ILE 246.A O no hydrogen 2.657 N/A ALA 251.A N CYS 247.A O no hydrogen 3.342 N/A ASP 252.A N ASP 248.A O no hydrogen 3.281 N/A LEU 253.A N VAL 249.A O no hydrogen 3.289 N/A LEU 253.A N ALA 250.A O no hydrogen 2.964 N/A ARG 254.A N ALA 251.A O no hydrogen 2.636 N/A GLU 256.A N ASP 255.A OD1 no hydrogen 2.735 N/A ALA 257.A N LEU 253.A O no hydrogen 3.351 N/A ALA 259.A N ASP 255.A O no hydrogen 2.830 N/A ALA 260.A N GLU 256.A O no hydrogen 2.919 N/A GLY 261.A N ILE 258.A O no hydrogen 2.910 N/A ALA 262.A N ALA 257.A O no hydrogen 2.955 N/A GLU 264.A N GLY 229.A O no hydrogen 2.680 N/A GLY 265.A N ALA 262.A O no hydrogen 2.988 N/A ASN 267.A N VAL 231.A O no hydrogen 2.593 N/A ASN 267.A ND2 VAL 225.A O no hydrogen 2.909 N/A ASN 267.A ND2 ASN 232.A OD1 no hydrogen 2.800 N/A ILE 269.A N ILE 233.A O no hydrogen 2.909 N/A GLY 270.A N PRO 285.A O no hydrogen 3.087 N/A CYS 272.A N THR 288.A O no hydrogen 3.313 N/A CYS 272.A SG ASN 236.A OD1 no hydrogen 3.540 N/A CYS 273.A SG HIS 238.A NE2 no hydrogen 3.116 N/A THR 274.A N GLY 237.A O no hydrogen 2.902 N/A THR 274.A OG1 SER 243.A OG no hydrogen 3.086 N/A HIS 276.A N CYS 272.A O no hydrogen 2.722 N/A GLU 277.A N CYS 273.A O no hydrogen 2.601 N/A VAL 278.A N THR 274.A O no hydrogen 3.275 N/A MET 279.A N GLY 275.A O no hydrogen 2.891 N/A MET 280.A N HIS 276.A O no hydrogen 2.774 N/A ARG 281.A N GLU 277.A O no hydrogen 3.172 N/A ARG 281.A NE GLY 212.A O no hydrogen 2.871 N/A ARG 281.A NH1 GLU 277.A O no hydrogen 3.365 N/A ARG 281.A NH1 GLU 277.A OE1 no hydrogen 3.196 N/A ARG 281.A NH2 ASP 208.A OD1 no hydrogen 3.320 N/A HIS 282.A N VAL 278.A O no hydrogen 3.011 N/A LEU 286.A N ALA 220.A O no hydrogen 3.106 N/A ALA 287.A N GLY 270.A O no hydrogen 2.692 N/A THR 288.A OG1 ASN 289.A OD1 no hydrogen 3.423 N/A THR 288.A OG1 SER 292.A OG no hydrogen 2.506 N/A ASN 289.A ND2 ASP 432.A OD1 no hydrogen 3.286 N/A ASN 289.A ND2 CYS 454.A O no hydrogen 3.372 N/A SER 292.A OG THR 288.A OG1 no hydrogen 2.506 N/A GLN 293.A N TYR 290.A O no hydrogen 3.076 N/A GLN 293.A NE2 TYR 290.A O no hydrogen 3.168 N/A GLN 293.A NE2 CYS 311.A O no hydrogen 2.978 N/A LEU 295.A N SER 292.A O no hydrogen 3.189 N/A ILE 297.A N GLU 294.A O no hydrogen 2.883 N/A THR 299.A N PRO 296.A O no hydrogen 3.275 N/A THR 299.A OG1 ALA 373.A O no hydrogen 3.307 N/A GLY 300.A N ILE 297.A O no hydrogen 2.814 N/A ALA 304.A N ASN 232.A O no hydrogen 3.229 N/A MET 305.A N GLN 326.A O no hydrogen 2.836 N/A VAL 306.A N ALA 234.A O no hydrogen 2.652 N/A VAL 307.A N ILE 328.A O no hydrogen 2.864 N/A ASP 308.A N ASN 236.A O no hydrogen 3.188 N/A MET 313.A N GLN 293.A OE1 no hydrogen 3.302 N/A SER 315.A OG GLU 294.A OE1 no hydrogen 2.547 N/A LEU 316.A N MET 313.A O no hydrogen 3.449 N/A ILE 319.A N SER 315.A O no hydrogen 3.137 N/A ALA 320.A N LEU 316.A O no hydrogen 2.816 N/A GLU 321.A N PRO 317.A O no hydrogen 2.779 N/A GLU 321.A N ARG 318.A O no hydrogen 2.686 N/A CYS 322.A N ILE 319.A O no hydrogen 3.293 N/A CYS 322.A SG ARG 318.A O no hydrogen 4.014 N/A PHE 323.A N ALA 320.A O no hydrogen 2.735 N/A HIS 324.A N HIS 324.A ND1 no hydrogen 2.843 N/A HIS 324.A NE2 GLU 303.A OE1 no hydrogen 2.965 N/A THR 325.A OG1 LEU 302.A O no hydrogen 2.867 N/A GLN 326.A N GLU 303.A O no hydrogen 3.056 N/A ILE 328.A N MET 305.A O no hydrogen 2.950 N/A THR 329.A N THR 340.A O no hydrogen 3.358 N/A THR 329.A OG1 HIS 341.A ND1 no hydrogen 2.704 N/A THR 330.A OG1 VAL 307.A O no hydrogen 3.071 N/A HIS 333.A N ASP 331.A OD1 no hydrogen 2.441 N/A ASN 334.A N ASP 331.A O no hydrogen 2.965 N/A ALA 339.A N ILE 336.A O no hydrogen 3.023 N/A THR 340.A N ILE 327.A O no hydrogen 2.877 N/A HIS 341.A ND1 THR 329.A OG1 no hydrogen 2.704 N/A VAL 342.A N THR 329.A O no hydrogen 3.223 N/A PHE 344.A N THR 330.A O no hydrogen 3.381 N/A LYS 348.A N ASP 345.A O no hydrogen 2.604 N/A ALA 349.A N GLU 346.A O no hydrogen 2.996 N/A THR 352.A N LYS 348.A O no hydrogen 2.826 N/A THR 352.A OG1 LYS 348.A O no hydrogen 3.202 N/A ALA 353.A N ALA 349.A O no hydrogen 2.763 N/A LYS 354.A N VAL 350.A O no hydrogen 3.062 N/A THR 355.A N GLU 351.A O no hydrogen 3.333 N/A THR 355.A OG1 GLU 351.A O no hydrogen 3.243 N/A ILE 356.A N THR 352.A O no hydrogen 3.022 N/A ILE 357.A N ALA 353.A O no hydrogen 2.816 N/A ARG 358.A N LYS 354.A O no hydrogen 2.833 N/A ARG 358.A NE GLU 256.A OE1 no hydrogen 3.365 N/A ARG 358.A NE GLU 256.A OE2 no hydrogen 2.923 N/A ARG 358.A NH2 GLU 256.A OE1 no hydrogen 2.984 N/A MET 359.A N THR 355.A O no hydrogen 2.982 N/A ALA 360.A N ILE 356.A O no hydrogen 3.155 N/A ILE 361.A N ILE 357.A O no hydrogen 2.862 N/A ALA 362.A N ARG 358.A O no hydrogen 2.954 N/A ALA 363.A N MET 359.A O no hydrogen 3.052 N/A PHE 364.A N ALA 360.A O no hydrogen 2.839 N/A GLY 365.A N ALA 362.A O no hydrogen 2.971 N/A ARG 366.A N ALA 363.A O no hydrogen 3.083 N/A ARG 366.A NH1 HIS 324.A O no hydrogen 3.047 N/A ARG 366.A NH2 HIS 324.A O no hydrogen 3.196 N/A ARG 367.A N PHE 364.A O no hydrogen 2.963 N/A ARG 367.A NE GLU 303.A OE1 no hydrogen 3.134 N/A ARG 367.A NH2 ARG 228.A O no hydrogen 3.544 N/A ARG 367.A NH2 GLU 303.A OE2 no hydrogen 3.268 N/A ASN 370.A N ASP 368.A OD1 no hydrogen 2.829 N/A ARG 371.A N ASP 368.A O no hydrogen 3.399 N/A ARG 371.A NH1 CYS 322.A O no hydrogen 2.995 N/A ARG 371.A NH2 CYS 322.A O no hydrogen 3.333 N/A ALA 373.A N THR 299.A O no hydrogen 2.718 N/A GLN 379.A NE2 LYS 380.A O no hydrogen 2.798 N/A SER 381.A N SER 219.A O no hydrogen 2.770 N/A SER 381.A OG ALA 460.A O no hydrogen 3.326 N/A ILE 382.A N MET 465.A O no hydrogen 2.851 N/A VAL 383.A N VAL 217.A O no hydrogen 2.803 N/A PHE 385.A N HIS 500.A O no hydrogen 3.085 N/A SER 386.A OG PRO 214.A O no hydrogen 2.509 N/A SER 386.A OG GLU 388.A OE1 no hydrogen 3.473 N/A ALA 389.A N SER 386.A OG no hydrogen 3.111 N/A VAL 390.A N SER 386.A O no hydrogen 3.039 N/A VAL 391.A N ALA 387.A O no hydrogen 3.101 N/A ALA 392.A N GLU 388.A O no hydrogen 2.683 N/A ALA 393.A N ALA 389.A O no hydrogen 2.914 N/A LEU 394.A N VAL 390.A O no hydrogen 3.107 N/A ALA 395.A N ALA 392.A O no hydrogen 3.167 N/A ASN 398.A N ALA 395.A O no hydrogen 2.875 N/A LYS 404.A N ASP 401.A O no hydrogen 2.852 N/A VAL 407.A N LEU 403.A O no hydrogen 2.628 N/A ASP 408.A N LYS 404.A O no hydrogen 2.809 N/A ASN 409.A N PRO 405.A O no hydrogen 3.067 N/A ASN 409.A ND2 PRO 405.A O no hydrogen 2.871 N/A VAL 410.A N VAL 407.A O no hydrogen 3.184 N/A VAL 411.A N VAL 407.A O no hydrogen 3.235 N/A VAL 411.A N ASP 408.A O no hydrogen 2.592 N/A ASN 412.A N ASP 408.A O no hydrogen 3.007 N/A ASN 412.A ND2 ASN 409.A OD1 no hydrogen 3.639 N/A GLY 413.A N ASN 409.A O no hydrogen 3.227 N/A ASN 414.A N ASN 412.A OD1 no hydrogen 2.678 N/A ASN 414.A ND2 ASN 409.A OD1 no hydrogen 2.771 N/A ILE 415.A N ASN 409.A O no hydrogen 3.054 N/A GLN 416.A N ASN 446.A O no hydrogen 2.692 N/A GLN 416.A NE2 GLY 413.A O no hydrogen 3.279 N/A ILE 418.A N PRO 529.A O no hydrogen 3.019 N/A VAL 419.A N LEU 448.A O no hydrogen 2.938 N/A LEU 420.A N VAL 531.A O no hydrogen 2.796 N/A PHE 421.A N LEU 450.A O no hydrogen 2.673 N/A VAL 422.A N SER 533.A O no hydrogen 3.197 N/A CYS 424.A SG SER 539.A OG no hydrogen 3.341 N/A LYS 428.A N THR 426.A OG1 no hydrogen 3.254 N/A GLN 431.A NE2 ASN 289.A OD1 no hydrogen 3.284 N/A SER 433.A N GLN 430.A O no hydrogen 2.710 N/A TYR 435.A OH CYS 424.A O no hydrogen 2.696 N/A VAL 436.A N ASP 432.A O no hydrogen 3.482 N/A ASP 437.A N SER 433.A O no hydrogen 3.324 N/A LEU 438.A N ALA 434.A O no hydrogen 2.799 N/A ALA 439.A N TYR 435.A O no hydrogen 2.933 N/A LYS 440.A N VAL 436.A O no hydrogen 3.118 N/A LYS 440.A NZ TYR 473.A OH no hydrogen 3.130 N/A SER 441.A N ASP 437.A O no hydrogen 2.880 N/A LEU 442.A N LEU 438.A O no hydrogen 3.160 N/A ALA 443.A N ALA 439.A O no hydrogen 2.881 N/A LYS 444.A N LYS 440.A O no hydrogen 3.028 N/A ARG 445.A NE SER 441.A O no hydrogen 2.626 N/A ARG 445.A NH2 SER 441.A OG no hydrogen 3.169 N/A ASN 446.A N ALA 443.A O no hydrogen 3.288 N/A VAL 447.A N LEU 442.A O no hydrogen 3.021 N/A LEU 448.A N GLY 417.A O no hydrogen 2.912 N/A LEU 450.A N VAL 419.A O no hydrogen 2.970 N/A ALA 451.A N MET 499.A O no hydrogen 3.070 N/A THR 452.A N PHE 421.A O no hydrogen 2.980 N/A THR 452.A OG1 ASN 507.A OD1 no hydrogen 2.522 N/A GLY 453.A N GLY 502.A O no hydrogen 2.876 N/A ALA 455.A N GLY 423.A O no hydrogen 3.266 N/A ALA 456.A N THR 452.A O no hydrogen 2.688 N/A GLY 457.A N GLY 453.A O no hydrogen 2.857 N/A ALA 458.A N CYS 454.A O no hydrogen 2.768 N/A PHE 459.A N ALA 455.A O no hydrogen 3.241 N/A ALA 460.A N ALA 456.A O no hydrogen 2.989 N/A LYS 461.A N GLY 457.A O no hydrogen 3.039 N/A LYS 461.A NZ THR 288.A OG1 no hydrogen 2.960 N/A LYS 461.A NZ ASN 289.A OD1 no hydrogen 3.025 N/A LYS 461.A NZ SER 292.A OG no hydrogen 3.353 N/A LYS 461.A NZ ASP 432.A OD2 no hydrogen 3.457 N/A ALA 462.A N ALA 458.A O no hydrogen 2.703 N/A GLY 463.A N PHE 459.A O no hydrogen 2.897 N/A GLY 463.A N ALA 460.A O no hydrogen 3.183 N/A LEU 464.A N PHE 459.A O no hydrogen 3.073 N/A THR 466.A OG1 LYS 380.A O no hydrogen 3.416 N/A THR 470.A N SER 467.A O no hydrogen 3.019 N/A THR 470.A OG1 LEU 495.A O no hydrogen 2.507 N/A THR 471.A N SER 467.A O no hydrogen 3.419 N/A THR 471.A OG1 GLU 468.A O no hydrogen 2.523 N/A GLN 472.A N GLU 468.A O no hydrogen 2.786 N/A TYR 473.A N THR 470.A O no hydrogen 3.374 N/A TYR 473.A OH GLN 472.A OE1 no hydrogen 3.062 N/A ALA 474.A N THR 470.A O no hydrogen 3.028 N/A GLY 475.A N ALA 443.A O no hydrogen 3.041 N/A LEU 478.A N ASN 446.A OD1 no hydrogen 2.689 N/A LYS 479.A N GLY 475.A O no hydrogen 2.760 N/A LYS 479.A NZ THR 471.A O no hydrogen 2.629 N/A GLY 480.A N GLU 476.A O no hydrogen 2.636 N/A LEU 482.A N LEU 478.A O no hydrogen 3.087 N/A SER 483.A N LYS 479.A O no hydrogen 3.187 N/A SER 483.A N GLY 480.A O no hydrogen 3.030 N/A SER 483.A OG LYS 479.A O no hydrogen 2.780 N/A SER 483.A OG GLY 480.A O no hydrogen 2.663 N/A ALA 484.A N GLY 480.A O no hydrogen 3.097 N/A ILE 485.A N VAL 481.A O no hydrogen 3.134 N/A GLY 486.A N LEU 482.A O no hydrogen 3.320 N/A THR 487.A N SER 483.A O no hydrogen 2.850 N/A THR 487.A OG1 SER 483.A O no hydrogen 2.493 N/A ALA 488.A N ALA 484.A O no hydrogen 2.804 N/A ALA 489.A N GLY 486.A O no hydrogen 3.057 N/A LEU 491.A N ALA 489.A O no hydrogen 2.778 N/A LEU 495.A N LEU 482.A O no hydrogen 3.200 N/A VAL 498.A N LEU 464.A O no hydrogen 3.217 N/A MET 499.A N VAL 449.A O no hydrogen 2.908 N/A MET 501.A N ALA 451.A O no hydrogen 2.916 N/A GLY 502.A N HIS 500.A ND1 no hydrogen 3.019 N/A SER 503.A N ASP 506.A OD2 no hydrogen 3.205 N/A CYS 504.A SG HIS 238.A NE2 no hydrogen 3.960 N/A ASN 507.A N CYS 504.A O no hydrogen 2.908 N/A SER 508.A N VAL 505.A O no hydrogen 3.129 N/A SER 508.A OG SER 200.A O no hydrogen 3.343 N/A SER 508.A OG VAL 505.A O no hydrogen 2.772 N/A ARG 509.A N ASP 506.A O no hydrogen 3.016 N/A ARG 509.A NE ASP 208.A OD2 no hydrogen 3.451 N/A ARG 509.A NH1 MET 501.A O no hydrogen 2.925 N/A ARG 509.A NH2 ASP 208.A OD1 no hydrogen 2.888 N/A ARG 509.A NH2 ASP 208.A OD2 no hydrogen 3.380 N/A ALA 510.A N ASN 507.A O no hydrogen 3.133 N/A VAL 511.A N ASN 507.A O no hydrogen 3.116 N/A ALA 512.A N SER 508.A O no hydrogen 2.736 N/A LEU 513.A N ARG 509.A O no hydrogen 3.301 N/A ALA 514.A N ALA 510.A O no hydrogen 2.991 N/A THR 515.A N VAL 511.A O no hydrogen 2.929 N/A THR 515.A OG1 VAL 511.A O no hydrogen 3.061 N/A THR 515.A OG1 ALA 512.A O no hydrogen 2.664 N/A ALA 516.A N ALA 512.A O no hydrogen 2.921 N/A LEU 517.A N LEU 513.A O no hydrogen 2.985 N/A ALA 518.A N ALA 514.A O no hydrogen 2.773 N/A ASN 519.A N THR 515.A O no hydrogen 2.876 N/A LYS 520.A N ALA 516.A O no hydrogen 3.026 N/A LYS 520.A NZ ASP 401.A OD1 no hydrogen 3.547 N/A LEU 521.A N LEU 517.A O no hydrogen 3.089 N/A GLY 522.A N ASN 519.A O no hydrogen 2.694 N/A VAL 523.A N ALA 518.A O no hydrogen 2.713 N/A ASP 524.A N ASP 527.A OD2 no hydrogen 2.840 N/A LEU 525.A N ASP 524.A OD2 no hydrogen 2.416 N/A ASP 527.A N ASP 524.A O no hydrogen 2.869 N/A LEU 528.A N LEU 525.A O no hydrogen 3.141 N/A VAL 531.A N ILE 418.A O no hydrogen 2.779 N/A ALA 532.A N PRO 555.A O no hydrogen 3.011 N/A SER 533.A N LEU 420.A O no hydrogen 2.912 N/A SER 533.A OG HIS 557.A ND1 no hydrogen 2.999 N/A ALA 534.A N HIS 557.A O no hydrogen 2.576 N/A CYS 537.A N ALA 534.A O no hydrogen 3.422 N/A CYS 537.A SG ALA 534.A O no hydrogen 3.728 N/A LYS 541.A NZ HIS 238.A NE2 no hydrogen 3.020 N/A ALA 542.A N SER 539.A OG no hydrogen 3.100 N/A LEU 543.A N SER 539.A O no hydrogen 3.024 N/A ALA 544.A N GLU 540.A O no hydrogen 2.993 N/A ALA 544.A N LYS 541.A O no hydrogen 2.810 N/A ILE 545.A N LYS 541.A O no hydrogen 2.871 N/A GLY 546.A N ALA 542.A O no hydrogen 2.941 N/A SER 547.A N LEU 543.A O no hydrogen 3.197 N/A SER 547.A OG LEU 543.A O no hydrogen 2.966 N/A TRP 548.A N ALA 544.A O no hydrogen 3.018 N/A TRP 548.A NE1 ASP 196.A OD2 no hydrogen 2.571 N/A ALA 549.A N ILE 545.A O no hydrogen 2.856 N/A VAL 550.A N GLY 546.A O no hydrogen 3.054 N/A THR 551.A N SER 547.A O no hydrogen 3.088 N/A THR 551.A OG1 SER 547.A O no hydrogen 3.071 N/A ILE 552.A N TRP 548.A O no hydrogen 2.671 N/A GLY 553.A N ALA 549.A O no hydrogen 3.358 N/A LEU 554.A N ALA 549.A O no hydrogen 3.084 N/A THR 556.A N TYR 585.A O no hydrogen 2.770 N/A THR 556.A OG1 LEU 554.A O no hydrogen 3.461 N/A HIS 557.A N ALA 532.A O no hydrogen 2.767 N/A HIS 557.A ND1 SER 533.A OG no hydrogen 2.999 N/A HIS 557.A NE2 ASP 589.A O no hydrogen 3.129 N/A VAL 558.A N ILE 587.A O no hydrogen 3.262 N/A GLY 559.A N ALA 534.A O no hydrogen 3.006 N/A SER 560.A OG CYS 537.A O no hydrogen 2.691 N/A VAL 564.A N PRO 562.A O no hydrogen 2.417 N/A GLY 566.A N ALA 19.A O no hydrogen 3.074 N/A SER 567.A N VAL 564.A O no hydrogen 2.668 N/A SER 567.A OG ASP 50.A OD1 no hydrogen 2.636 N/A VAL 570.A N SER 567.A OG no hydrogen 3.329 N/A THR 571.A N SER 567.A O no hydrogen 3.049 N/A THR 571.A OG1 VAL 564.A O no hydrogen 3.415 N/A THR 571.A OG1 SER 567.A O no hydrogen 2.582 N/A LYS 572.A N GLN 568.A O no hydrogen 2.753 N/A LYS 572.A NZ GLU 576.A OE2 no hydrogen 3.329 N/A LEU 573.A N ILE 569.A O no hydrogen 2.933 N/A VAL 574.A N VAL 570.A O no hydrogen 3.112 N/A THR 575.A N LYS 572.A O no hydrogen 3.013 N/A THR 575.A OG1 THR 571.A O no hydrogen 2.584 N/A GLU 576.A N LYS 572.A O no hydrogen 2.797 N/A THR 577.A N LYS 572.A O no hydrogen 3.261 N/A LYS 579.A N GLU 576.A O no hydrogen 3.063 N/A LEU 581.A N THR 577.A O no hydrogen 3.166 N/A VAL 582.A N ALA 578.A O no hydrogen 3.006 N/A GLY 583.A N ASP 580.A O no hydrogen 3.327 N/A PHE 586.A N VAL 574.A O no hydrogen 2.837 N/A ILE 587.A N THR 556.A O no hydrogen 2.650 N/A ASP 589.A N VAL 558.A O no hydrogen 3.264 N/A ASP 591.A N ASP 589.A OD1 no hydrogen 2.802 N/A SER 594.A N ASP 591.A OD2 no hydrogen 3.046 N/A SER 594.A OG ASP 589.A OD2 no hydrogen 2.694 N/A ALA 595.A N ASP 591.A O no hydrogen 2.793 N/A GLY 596.A N PRO 592.A O no hydrogen 2.865 N/A ASP 597.A N LYS 593.A O no hydrogen 3.276 N/A LYS 598.A N SER 594.A O no hydrogen 3.072 N/A LYS 598.A NZ ASP 589.A OD2 no hydrogen 3.173 N/A LEU 599.A N ALA 595.A O no hydrogen 2.705 N/A TYR 600.A N GLY 596.A O no hydrogen 2.758 N/A TYR 600.A OH ARG 445.A O no hydrogen 3.350 N/A ALA 601.A N ASP 597.A O no hydrogen 2.881 N/A ALA 602.A N LYS 598.A O no hydrogen 2.934 N/A ILE 603.A N LEU 599.A O no hydrogen 2.867 N/A GLN 604.A N TYR 600.A O no hydrogen 2.801 N/A GLN 604.A NE2 GLN 416.A OE1 no hydrogen 2.705 N/A GLU 605.A N ALA 601.A O no hydrogen 2.832 N/A ARG 606.A N ALA 602.A O no hydrogen 2.748 N/A ARG 606.A NH2 GLY 553.A O no hydrogen 2.895 N/A ARG 606.A NH2 GLY 583.A O no hydrogen 3.248 N/A ARG 607.A N ILE 603.A O no hydrogen 2.935 N/A ARG 607.A NE VAL 410.A O no hydrogen 3.262 N/A ARG 607.A NH2 VAL 410.A O no hydrogen 3.160 N/A ARG 607.A NH2 ILE 415.A O no hydrogen 3.010 N/A ALA 608.A N GLN 604.A O no hydrogen 3.087 N/A GLY 609.A N GLU 605.A O no hydrogen 3.456 N/A LEU 610.A N ARG 607.A O no hydrogen 2.738 N/A