Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1tk5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 49.A OE2 no hydrogen 3.315 N/A ILE 2.A N LEU 55.A O no hydrogen 2.974 N/A VAL 3.A N TYR 24.A O no hydrogen 2.851 N/A SER 4.A N VAL 57.A O no hydrogen 2.814 N/A SER 4.A OG VAL 22.A O no hydrogen 2.657 N/A SER 4.A OG TYR 42.A OH no hydrogen 2.647 N/A ASP 5.A N VAL 22.A O no hydrogen 3.346 N/A ILE 6.A N ASP 65.A OD2 no hydrogen 3.291 N/A GLU 7.A N CYS 20.A O no hydrogen 2.846 N/A ASN 9.A N LYS 17.A O no hydrogen 3.067 N/A ASN 9.A ND2 THR 16.A OG1 no hydrogen 2.846 N/A SER 14.A N LEU 11.A O no hydrogen 3.030 N/A THR 16.A N ASN 9.A OD1 no hydrogen 2.886 N/A LYS 17.A N ASN 9.A OD1 no hydrogen 3.042 N/A PHE 18.A N GLN 76.A OE1 no hydrogen 2.863 N/A HIS 19.A N GLU 7.A O no hydrogen 2.809 N/A HIS 19.A NE2 TRP 154.A O no hydrogen 2.700 N/A CYS 20.A N GLU 7.A O no hydrogen 3.157 N/A CYS 20.A SG ASN 165.A OD1 no hydrogen 3.220 N/A GLY 21.A N TYR 34.A O no hydrogen 2.930 N/A VAL 22.A N ASP 5.A O no hydrogen 3.112 N/A ILE 23.A N VAL 32.A O no hydrogen 2.972 N/A TYR 24.A N VAL 3.A O no hydrogen 2.820 N/A ASP 25.A N GLU 30.A O no hydrogen 3.258 N/A TYR 26.A N MET 1.A O no hydrogen 3.024 N/A TYR 26.A OH GLU 177.A OE2 no hydrogen 2.880 N/A SER 27.A N ASP 25.A OD1 no hydrogen 2.889 N/A SER 27.A OG ASP 25.A OD1 no hydrogen 2.529 N/A THR 28.A N ASP 25.A O no hydrogen 3.320 N/A ALA 29.A N ASP 25.A O no hydrogen 2.714 N/A VAL 32.A N ILE 23.A O no hydrogen 2.886 N/A TYR 34.A N GLY 21.A O no hydrogen 2.765 N/A ARG 35.A N ASP 38.A OD2 no hydrogen 2.824 N/A ARG 35.A NE GLU 159.A OE2 no hydrogen 3.174 N/A ARG 35.A NH2 GLU 159.A OE1 no hydrogen 3.040 N/A ARG 35.A NH2 GLU 159.A OE2 no hydrogen 3.499 N/A ASP 38.A N ARG 35.A O no hydrogen 2.735 N/A TYR 42.A N ASP 38.A O no hydrogen 2.896 N/A TYR 42.A OH SER 4.A OG no hydrogen 2.647 N/A LEU 43.A N PHE 39.A O no hydrogen 3.024 N/A ASP 44.A N GLY 40.A O no hydrogen 3.026 N/A ALA 45.A N ALA 41.A O no hydrogen 3.059 N/A LEU 46.A N TYR 42.A O no hydrogen 3.218 N/A GLU 47.A N LEU 43.A O no hydrogen 2.995 N/A ALA 48.A N ASP 44.A O no hydrogen 2.845 N/A GLU 49.A N ALA 45.A O no hydrogen 3.272 N/A VAL 50.A N LEU 46.A O no hydrogen 3.198 N/A ALA 51.A N GLU 47.A O no hydrogen 2.922 N/A ARG 52.A N ALA 48.A O no hydrogen 3.094 N/A ARG 52.A N GLU 49.A O no hydrogen 3.155 N/A GLY 53.A N VAL 50.A O no hydrogen 3.003 N/A GLY 54.A N GLU 49.A O no hydrogen 2.852 N/A LEU 55.A N GLU 49.A OE2 no hydrogen 3.079 N/A ILE 56.A N ASN 87.A O no hydrogen 2.691 N/A VAL 57.A N ILE 2.A O no hydrogen 2.822 N/A PHE 58.A N ILE 89.A O no hydrogen 2.936 N/A HIS 59.A ND1 THR 91.A OG1 no hydrogen 2.731 N/A ASN 60.A N ASP 90.A OD1 no hydrogen 2.687 N/A HIS 62.A N ASP 90.A OD2 no hydrogen 3.054 N/A LYS 63.A NZ GLU 222.A OE1 no hydrogen 3.458 N/A LYS 63.A NZ GLU 222.A OE2 no hydrogen 2.686 N/A LYS 63.A NZ VAL 410.A O no hydrogen 3.373 N/A TYR 64.A N ASN 60.A O no hydrogen 3.099 N/A TYR 64.A OH ALA 10.A O no hydrogen 2.796 N/A VAL 66.A N GLY 61.A O no hydrogen 2.929 N/A ALA 68.A N TYR 64.A O no hydrogen 2.829 N/A LEU 69.A N ASP 65.A O no hydrogen 2.964 N/A THR 70.A N VAL 66.A O no hydrogen 3.286 N/A THR 70.A OG1 VAL 66.A O no hydrogen 3.363 N/A THR 70.A OG1 PHE 81.A O no hydrogen 2.941 N/A LYS 71.A N PRO 67.A O no hydrogen 3.090 N/A LYS 71.A NZ LEU 12.A O no hydrogen 2.671 N/A LEU 72.A N ALA 68.A O no hydrogen 2.780 N/A ALA 73.A N LEU 69.A O no hydrogen 2.846 N/A LYS 74.A N THR 70.A O no hydrogen 3.280 N/A LYS 74.A NZ ASN 78.A OD1 no hydrogen 3.153 N/A LEU 75.A N LYS 71.A O no hydrogen 3.004 N/A GLN 76.A N LEU 72.A O no hydrogen 2.845 N/A LEU 77.A N ALA 73.A O no hydrogen 2.957 N/A ASN 78.A N LYS 74.A O no hydrogen 2.960 N/A ARG 79.A N ALA 73.A O no hydrogen 3.024 N/A ARG 79.A NH1 ASP 44.A OD1 no hydrogen 2.989 N/A ARG 79.A NH2 GLY 40.A O no hydrogen 3.157 N/A ARG 79.A NH2 ASP 44.A OD1 no hydrogen 2.924 N/A HIS 82.A NE2 GLU 80.A OE1 no hydrogen 2.803 N/A GLU 86.A N GLU 86.A OE1 no hydrogen 2.793 N/A ASN 87.A N PRO 84.A O no hydrogen 3.155 N/A ASN 87.A ND2 GLY 54.A O no hydrogen 2.967 N/A CYS 88.A N ARG 85.A O no hydrogen 3.141 N/A CYS 88.A SG PRO 84.A O no hydrogen 3.364 N/A ILE 89.A N ILE 56.A O no hydrogen 2.812 N/A ASP 90.A N HIS 212.A NE2 no hydrogen 3.020 N/A THR 91.A N PHE 58.A O no hydrogen 2.879 N/A THR 91.A OG1 PHE 58.A O no hydrogen 3.407 N/A THR 91.A OG1 HIS 59.A ND1 no hydrogen 2.731 N/A LEU 92.A N ASP 90.A OD1 no hydrogen 2.783 N/A VAL 93.A N ASP 90.A OD1 no hydrogen 3.325 N/A LEU 94.A N ASP 90.A O no hydrogen 2.987 N/A SER 95.A N THR 91.A O no hydrogen 2.935 N/A SER 95.A OG THR 91.A O no hydrogen 2.721 N/A ARG 96.A N LEU 92.A O no hydrogen 3.063 N/A ARG 96.A NE ASP 104.A OD2 no hydrogen 2.743 N/A ARG 96.A NH2 ASP 104.A OD1 no hydrogen 2.980 N/A ARG 96.A NH2 ASP 104.A OD2 no hydrogen 3.355 N/A ARG 96.A NH2 ASP 106.A OD1 no hydrogen 3.161 N/A LEU 97.A N VAL 93.A O no hydrogen 3.233 N/A LEU 97.A N LEU 94.A O no hydrogen 3.168 N/A ILE 98.A N LEU 94.A O no hydrogen 2.910 N/A HIS 99.A N SER 95.A O no hydrogen 2.745 N/A SER 100.A OG LEU 97.A O no hydrogen 3.468 N/A LEU 102.A N HIS 99.A O no hydrogen 2.975 N/A ASP 106.A N ASP 104.A OD1 no hydrogen 2.650 N/A GLY 108.A N THR 105.A OG1 no hydrogen 3.016 N/A LEU 109.A N ASP 106.A O no hydrogen 3.392 N/A LEU 110.A N THR 105.A O no hydrogen 2.962 N/A SER 112.A OG GLU 128.A OE2 no hydrogen 3.278 N/A LYS 114.A N ARG 111.A O no hydrogen 3.169 N/A LEU 115.A N SER 112.A O no hydrogen 3.037 N/A TRP 122.A N GLU 120.A OE2 no hydrogen 3.065 N/A GLY 123.A N GLU 120.A OE1 no hydrogen 2.551 N/A TYR 124.A N GLU 120.A O no hydrogen 2.856 N/A ARG 125.A N ALA 121.A O no hydrogen 3.017 N/A LEU 126.A N TRP 122.A O no hydrogen 3.067 N/A GLY 127.A N GLY 123.A O no hydrogen 3.044 N/A GLU 128.A N TYR 124.A O no hydrogen 3.035 N/A GLU 128.A N ARG 125.A O no hydrogen 3.115 N/A MET 129.A N LEU 126.A O no hydrogen 3.434 N/A GLU 132.A N GLU 128.A O no hydrogen 3.009 N/A TYR 133.A N MET 129.A O no hydrogen 2.884 N/A TYR 133.A OH GLU 153.A O no hydrogen 2.618 N/A LYS 134.A N LYS 130.A O no hydrogen 2.983 N/A ASP 135.A N GLY 131.A O no hydrogen 3.130 N/A ASP 136.A N GLU 132.A O no hydrogen 2.921 N/A PHE 137.A N TYR 133.A O no hydrogen 2.880 N/A LYS 138.A N LYS 134.A O no hydrogen 2.981 N/A ARG 139.A N ASP 135.A O no hydrogen 3.123 N/A ARG 139.A NH1 ASP 136.A OD1 no hydrogen 3.356 N/A MET 140.A N ASP 136.A O no hydrogen 3.112 N/A LEU 141.A N PHE 137.A O no hydrogen 3.090 N/A LEU 141.A N LYS 138.A O no hydrogen 3.177 N/A GLU 142.A N LYS 138.A O no hydrogen 3.037 N/A GLU 143.A N ARG 139.A O no hydrogen 3.080 N/A GLN 144.A N LEU 141.A O no hydrogen 2.684 N/A GLY 145.A N GLU 142.A O no hydrogen 3.228 N/A GLU 146.A N LEU 141.A O no hydrogen 3.128 N/A TYR 148.A OH ASP 150.A O no hydrogen 2.472 N/A TYR 148.A OH GLU 153.A OE1 no hydrogen 2.579 N/A TYR 148.A OH GLU 153.A OE2 no hydrogen 3.400 N/A MET 152.A N VAL 149.A O no hydrogen 2.944 N/A GLU 153.A N GLU 153.A OE1 no hydrogen 2.686 N/A TRP 154.A N GLY 151.A O no hydrogen 3.403 N/A TRP 155.A N MET 152.A O no hydrogen 3.135 N/A ASN 158.A ND2 TYR 133.A OH no hydrogen 2.763 N/A ASN 158.A ND2 ASN 156.A O no hydrogen 3.671 N/A MET 161.A N ASN 158.A O no hydrogen 3.162 N/A MET 161.A N ASN 158.A OD1 no hydrogen 2.801 N/A MET 162.A N ASN 158.A O no hydrogen 3.209 N/A ASP 163.A N GLU 159.A O no hydrogen 3.003 N/A TYR 164.A N GLU 160.A O no hydrogen 3.126 N/A ASN 165.A N MET 161.A O no hydrogen 2.937 N/A ASN 165.A ND2 ASP 5.A O no hydrogen 3.223 N/A VAL 166.A N MET 162.A O no hydrogen 2.941 N/A GLN 167.A N ASP 163.A O no hydrogen 2.972 N/A ASP 168.A N TYR 164.A O no hydrogen 2.864 N/A VAL 169.A N ASN 165.A O no hydrogen 3.339 N/A VAL 170.A N VAL 166.A O no hydrogen 3.022 N/A VAL 171.A N GLN 167.A O no hydrogen 2.941 N/A THR 172.A N ASP 168.A O no hydrogen 2.838 N/A THR 172.A OG1 ASP 168.A O no hydrogen 2.722 N/A LYS 173.A N VAL 169.A O no hydrogen 2.937 N/A LYS 173.A NZ GLU 177.A OE1 no hydrogen 3.399 N/A LYS 173.A NZ GLU 177.A OE2 no hydrogen 2.749 N/A ALA 174.A N VAL 170.A O no hydrogen 3.215 N/A LEU 175.A N VAL 171.A O no hydrogen 2.829 N/A LEU 176.A N THR 172.A O no hydrogen 2.848 N/A GLU 177.A N LYS 173.A O no hydrogen 3.105 N/A LYS 178.A N ALA 174.A O no hydrogen 3.095 N/A LYS 178.A NZ GLU 120.A OE2 no hydrogen 2.610 N/A LEU 179.A N LEU 175.A O no hydrogen 2.833 N/A LEU 180.A N LEU 176.A O no hydrogen 2.803 N/A SER 181.A N LYS 178.A O no hydrogen 3.265 N/A SER 181.A OG LYS 178.A O no hydrogen 2.642 N/A ASP 182.A N LEU 179.A O no hydrogen 3.139 N/A HIS 184.A N ASP 182.A OD1 no hydrogen 2.921 N/A HIS 184.A NE2 GLY 575.A O no hydrogen 2.785 N/A TYR 185.A N ASP 182.A O no hydrogen 3.131 N/A PHE 186.A N ASP 182.A O no hydrogen 2.969 N/A ILE 190.A N PRO 187.A O no hydrogen 3.100 N/A THR 193.A N ASP 191.A OD1 no hydrogen 2.901 N/A THR 193.A OG1 ASP 191.A OD1 no hydrogen 2.568 N/A ASP 194.A N ASP 191.A O no hydrogen 3.033 N/A TYR 197.A N GLY 53.A O no hydrogen 3.124 N/A PHE 200.A N GLY 196.A O no hydrogen 3.160 N/A TRP 201.A N TYR 197.A O no hydrogen 3.193 N/A TRP 201.A NE1 GLU 86.A O no hydrogen 2.760 N/A SER 202.A N THR 198.A O no hydrogen 3.153 N/A SER 202.A OG THR 198.A O no hydrogen 2.963 N/A SER 202.A OG THR 199.A O no hydrogen 3.334 N/A GLU 203.A N THR 199.A O no hydrogen 2.811 N/A SER 204.A N PHE 200.A O no hydrogen 3.319 N/A SER 204.A OG PHE 200.A O no hydrogen 2.858 N/A SER 204.A OG TRP 201.A O no hydrogen 3.444 N/A LEU 205.A N TYR 185.A O no hydrogen 3.009 N/A VAL 208.A N LEU 205.A O no hydrogen 3.036 N/A ILE 210.A N GLU 206.A O no hydrogen 3.129 N/A GLU 211.A N ALA 207.A O no hydrogen 2.934 N/A HIS 212.A N VAL 208.A O no hydrogen 3.309 N/A HIS 212.A ND1 VAL 208.A O no hydrogen 2.863 N/A ARG 213.A N ASP 209.A O no hydrogen 3.027 N/A ARG 213.A NE ASP 209.A OD1 no hydrogen 3.268 N/A ARG 213.A NE ASP 209.A OD2 no hydrogen 3.238 N/A ALA 214.A N ILE 210.A O no hydrogen 2.924 N/A ALA 215.A N GLU 211.A O no hydrogen 3.051 N/A TRP 216.A N HIS 212.A O no hydrogen 3.026 N/A LEU 217.A N ARG 213.A O no hydrogen 3.081 N/A LEU 218.A N ALA 214.A O no hydrogen 2.855 N/A ALA 219.A N ALA 215.A O no hydrogen 3.002 N/A LYS 220.A N TRP 216.A O no hydrogen 3.252 N/A LYS 220.A NZ HIS 617.A O no hydrogen 3.115 N/A GLN 221.A N LEU 217.A O no hydrogen 2.940 N/A GLU 222.A N LEU 218.A O no hydrogen 2.933 N/A ARG 223.A N ALA 219.A O no hydrogen 3.036 N/A ASN 224.A N LYS 220.A O no hydrogen 2.854 N/A ASN 224.A ND2 HIS 617.A NE2 no hydrogen 3.212 N/A ASN 224.A ND2 TYR 625.A O no hydrogen 2.892 N/A GLY 225.A N GLN 221.A O no hydrogen 2.977 N/A PHE 226.A N ILE 406.A O no hydrogen 2.865 N/A PHE 228.A N GLY 404.A O no hydrogen 2.985 N/A ASP 229.A N ALA 444.A O no hydrogen 2.719 N/A THR 230.A N PHE 228.A O no hydrogen 3.201 N/A LYS 231.A NZ GLU 234.A OE1 no hydrogen 3.364 N/A ALA 232.A N ASP 229.A OD1 no hydrogen 3.236 N/A ILE 233.A N ASP 229.A O no hydrogen 3.217 N/A GLU 234.A N THR 230.A O no hydrogen 2.971 N/A GLU 235.A N LYS 231.A O no hydrogen 3.041 N/A LEU 236.A N ALA 232.A O no hydrogen 3.021 N/A TYR 237.A N ILE 233.A O no hydrogen 2.837 N/A TYR 237.A OH GLU 391.A OE2 no hydrogen 2.660 N/A VAL 238.A N GLU 234.A O no hydrogen 3.092 N/A GLU 239.A N GLU 235.A O no hydrogen 3.159 N/A LEU 240.A N LEU 236.A O no hydrogen 2.818 N/A ALA 241.A N TYR 237.A O no hydrogen 2.817 N/A ALA 242.A N VAL 238.A O no hydrogen 2.999 N/A ARG 243.A N GLU 239.A O no hydrogen 3.195 N/A ARG 243.A NE GLU 378.A OE2 no hydrogen 2.985 N/A ARG 243.A NH2 GLU 378.A OE1 no hydrogen 2.781 N/A ARG 243.A NH2 GLU 378.A OE2 no hydrogen 3.409 N/A ARG 244.A N LEU 240.A O no hydrogen 2.870 N/A ARG 244.A NH1 GLN 383.A OE1 no hydrogen 2.721 N/A ARG 244.A NH1 GLU 391.A OE1 no hydrogen 2.917 N/A ARG 244.A NH2 GLU 391.A OE2 no hydrogen 2.887 N/A SER 245.A N ALA 241.A O no hydrogen 3.027 N/A SER 245.A OG ALA 241.A O no hydrogen 3.117 N/A GLU 246.A N ALA 242.A O no hydrogen 3.174 N/A LEU 247.A N ARG 243.A O no hydrogen 2.951 N/A LEU 248.A N ARG 244.A O no hydrogen 2.894 N/A ARG 249.A N SER 245.A O no hydrogen 2.847 N/A ARG 249.A NE GLU 246.A OE1 no hydrogen 3.175 N/A ARG 249.A NE GLU 246.A OE2 no hydrogen 3.183 N/A ARG 249.A NH2 GLU 246.A OE2 no hydrogen 2.550 N/A LYS 250.A N GLU 246.A O no hydrogen 3.047 N/A LEU 251.A N LEU 247.A O no hydrogen 2.827 N/A THR 252.A N LEU 248.A O no hydrogen 2.775 N/A THR 252.A OG1 LEU 248.A O no hydrogen 2.669 N/A THR 252.A OG1 ARG 249.A O no hydrogen 3.059 N/A GLU 253.A N LYS 250.A O no hydrogen 3.035 N/A THR 254.A N LYS 250.A O no hydrogen 2.966 N/A THR 254.A OG1 LYS 250.A O no hydrogen 3.208 N/A THR 254.A OG1 GLU 368.A OE2 no hydrogen 2.822 N/A PHE 255.A N LEU 251.A O no hydrogen 2.743 N/A SER 257.A OG HIS 321.A NE2 no hydrogen 2.793 N/A TRP 258.A N VAL 322.A O no hydrogen 2.968 N/A TRP 258.A NE1 GLN 260.A OE1 no hydrogen 3.083 N/A GLN 260.A N GLU 320.A O no hydrogen 2.965 N/A LYS 262.A N PRO 318.A O no hydrogen 2.821 N/A LYS 262.A NZ GLU 320.A OE2 no hydrogen 2.919 N/A THR 265.A N ILE 283.A O no hydrogen 3.273 N/A GLU 266.A N ILE 283.A O no hydrogen 2.849 N/A CYS 269.A SG MET 267.A O no hydrogen 3.950 N/A HIS 270.A N LYS 275.A O no hydrogen 3.211 N/A LEU 277.A N PHE 268.A O no hydrogen 2.795 N/A TYR 280.A N LEU 277.A O no hydrogen 3.065 N/A ILE 283.A N GLU 266.A O no hydrogen 2.742 N/A LYS 284.A N TYR 316.A O no hydrogen 3.011 N/A THR 285.A OG1 GLU 266.A OE1 no hydrogen 3.021 N/A THR 285.A OG1 GLU 266.A OE2 no hydrogen 3.394 N/A GLY 290.A N ASP 306.A OD1 no hydrogen 3.099 N/A LYS 293.A N GLU 304.A O no hydrogen 2.802 N/A LYS 293.A NZ GLU 304.A OE2 no hydrogen 3.032 N/A GLY 301.A N ALA 297.A O no hydrogen 2.818 N/A CYS 303.A SG LYS 293.A O no hydrogen 3.446 N/A ASP 306.A N ILE 291.A O no hydrogen 2.780 N/A ARG 308.A N ASP 306.A OD2 no hydrogen 3.120 N/A ARG 308.A NE ASP 306.A OD1 no hydrogen 3.215 N/A ARG 308.A NE ASP 306.A OD2 no hydrogen 2.947 N/A ARG 308.A NH2 ASP 306.A OD1 no hydrogen 2.966 N/A ALA 312.A N GLY 289.A O no hydrogen 2.936 N/A GLY 313.A N PRO 286.A O no hydrogen 2.894 N/A ALA 314.A N VAL 311.A O no hydrogen 2.844 N/A TYR 316.A N LYS 284.A O no hydrogen 3.106 N/A GLU 320.A N GLN 260.A O no hydrogen 2.786 N/A VAL 322.A N TRP 258.A O no hydrogen 2.754 N/A ASN 325.A N HIS 331.A ND1 no hydrogen 3.000 N/A SER 327.A N ASN 325.A OD1 no hydrogen 2.985 N/A SER 328.A N ASN 325.A O no hydrogen 2.946 N/A ARG 329.A NH1 VAL 354.A O no hydrogen 2.718 N/A HIS 331.A N SER 328.A OG no hydrogen 3.140 N/A ILE 332.A N SER 328.A O no hydrogen 3.042 N/A GLN 333.A N ARG 329.A O no hydrogen 2.931 N/A GLN 333.A NE2 ASP 330.A O no hydrogen 2.971 N/A LYS 334.A N ASP 330.A O no hydrogen 2.898 N/A LYS 335.A N HIS 331.A O no hydrogen 2.862 N/A LYS 335.A NZ GLY 256.A O no hydrogen 2.757 N/A LEU 336.A N ILE 332.A O no hydrogen 3.004 N/A GLN 337.A N GLN 333.A O no hydrogen 3.129 N/A GLN 337.A NE2 GLN 333.A OE1 no hydrogen 2.705 N/A GLU 338.A N LYS 334.A O no hydrogen 3.280 N/A ALA 339.A N LEU 336.A O no hydrogen 2.935 N/A GLY 340.A N GLN 337.A O no hydrogen 2.659 N/A TRP 341.A N LEU 336.A O no hydrogen 2.995 N/A THR 347.A N ALA 351.A O no hydrogen 2.677 N/A THR 347.A OG1 ALA 351.A O no hydrogen 2.981 N/A GLY 350.A N THR 347.A O no hydrogen 2.814 N/A VAL 353.A N LYS 345.A O no hydrogen 3.033 N/A VAL 358.A N ASP 355.A OD1 no hydrogen 2.791 N/A LEU 359.A N ASP 355.A O no hydrogen 2.933 N/A GLU 360.A N ASP 356.A O no hydrogen 3.023 N/A GLY 361.A N VAL 358.A O no hydrogen 2.962 N/A VAL 362.A N LEU 359.A O no hydrogen 3.227 N/A ARG 363.A NH1 GLU 360.A O no hydrogen 3.029 N/A ARG 363.A NH1 VAL 362.A O no hydrogen 2.950 N/A VAL 364.A N GLN 370.A OE1 no hydrogen 2.690 N/A LYS 369.A N ASP 366.A OD2 no hydrogen 2.903 N/A GLN 370.A N ASP 366.A O no hydrogen 2.902 N/A GLN 370.A NE2 VAL 362.A O no hydrogen 3.098 N/A GLN 370.A NE2 GLN 370.A O no hydrogen 3.464 N/A ALA 371.A N PRO 367.A O no hydrogen 2.983 N/A ALA 372.A N GLU 368.A O no hydrogen 2.945 N/A ILE 373.A N GLN 370.A O no hydrogen 3.326 N/A ASP 374.A N ALA 371.A O no hydrogen 3.194 N/A ILE 376.A N ALA 372.A O no hydrogen 2.950 N/A LYS 377.A N ILE 373.A O no hydrogen 3.010 N/A LYS 377.A NZ GLU 360.A OE1 no hydrogen 3.411 N/A GLU 378.A N ASP 374.A O no hydrogen 2.935 N/A TYR 379.A N LEU 375.A O no hydrogen 2.825 N/A LEU 380.A N ILE 376.A O no hydrogen 2.912 N/A MET 381.A N LYS 377.A O no hydrogen 3.121 N/A ILE 382.A N GLU 378.A O no hydrogen 2.909 N/A GLN 383.A N TYR 379.A O no hydrogen 2.969 N/A GLN 383.A NE2 GLN 383.A O no hydrogen 3.113 N/A LYS 384.A N LEU 380.A O no hydrogen 3.139 N/A ARG 385.A N MET 381.A O no hydrogen 3.077 N/A ARG 385.A NE PRO 436.A O no hydrogen 2.803 N/A ARG 385.A NH2 PRO 436.A O no hydrogen 3.190 N/A ILE 386.A N ILE 382.A O no hydrogen 2.909 N/A GLY 387.A N GLN 383.A O no hydrogen 2.862 N/A GLN 388.A N LYS 384.A O no hydrogen 3.153 N/A GLN 388.A NE2 GLN 429.A O no hydrogen 3.089 N/A SER 389.A N ARG 385.A O no hydrogen 2.985 N/A SER 389.A OG ARG 385.A O no hydrogen 2.866 N/A ALA 390.A N ILE 386.A O no hydrogen 2.790 N/A GLU 391.A N ILE 386.A O no hydrogen 2.865 N/A GLY 392.A N GLY 387.A O no hydrogen 2.676 N/A ALA 395.A N GLY 392.A O no hydrogen 3.037 N/A TRP 396.A N GLN 388.A O no hydrogen 3.068 N/A LEU 397.A N SER 389.A O no hydrogen 3.130 N/A ARG 398.A N ALA 395.A O no hydrogen 3.001 N/A ARG 398.A NE GLY 392.A O no hydrogen 2.753 N/A ARG 398.A NH2 GLU 391.A O no hydrogen 3.117 N/A TYR 399.A N ALA 395.A O no hydrogen 3.299 N/A TYR 399.A N TRP 396.A O no hydrogen 3.023 N/A VAL 400.A N TRP 396.A O no hydrogen 3.081 N/A ALA 401.A N LYS 405.A O no hydrogen 2.926 N/A GLY 404.A N ALA 401.A O no hydrogen 3.117 N/A LYS 405.A N ASP 403.A OD1 no hydrogen 3.224 N/A LYS 405.A NZ ASP 403.A O no hydrogen 3.239 N/A LYS 405.A NZ HIS 450.A ND1 no hydrogen 2.744 N/A ILE 406.A N PHE 226.A O no hydrogen 3.013 N/A HIS 407.A ND1 GLU 222.A O no hydrogen 2.757 N/A HIS 407.A NE2 ASP 403.A OD1 no hydrogen 3.314 N/A HIS 407.A NE2 ASP 403.A OD2 no hydrogen 2.946 N/A SER 409.A N ALA 423.A O no hydrogen 2.743 N/A VAL 410.A N GLU 222.A OE2 no hydrogen 2.990 N/A ASN 411.A N THR 421.A O no hydrogen 2.828 N/A ASN 413.A N ASN 411.A OD1 no hydrogen 3.061 N/A ASN 413.A ND2 ARG 96.A O no hydrogen 2.890 N/A GLY 414.A N ASN 411.A O no hydrogen 3.128 N/A ALA 415.A N ARG 419.A O no hydrogen 2.951 N/A THR 417.A OG1 GLN 592.A OE1 no hydrogen 2.712 N/A GLY 418.A N ALA 415.A O no hydrogen 2.874 N/A THR 421.A N ASN 411.A O no hydrogen 2.916 N/A HIS 422.A NE2 TRP 628.A O no hydrogen 2.698 N/A ALA 423.A N SER 409.A O no hydrogen 2.998 N/A ALA 428.A N ASN 426.A OD1 no hydrogen 2.707 N/A GLN 429.A N ASN 426.A O no hydrogen 3.337 N/A SER 435.A N GLY 432.A O no hydrogen 3.077 N/A SER 435.A OG GLY 432.A O no hydrogen 2.870 N/A GLY 438.A N SER 435.A O no hydrogen 2.783 N/A GLN 440.A NE2 GLU 239.A OE1 no hydrogen 3.490 N/A CYS 441.A N TYR 437.A O no hydrogen 3.108 N/A CYS 441.A SG TYR 437.A O no hydrogen 3.288 N/A ARG 442.A N GLY 438.A O no hydrogen 2.867 N/A ARG 442.A NH1 PRO 431.A O no hydrogen 3.240 N/A ALA 443.A N GLU 439.A O no hydrogen 3.003 N/A ALA 444.A N GLN 440.A O no hydrogen 3.278 N/A ALA 444.A N CYS 441.A O no hydrogen 3.145 N/A PHE 445.A N ARG 442.A O no hydrogen 3.191 N/A GLY 446.A N PRO 227.A O no hydrogen 3.058 N/A ALA 447.A N GLN 461.A OE1 no hydrogen 2.926 N/A GLU 448.A N PRO 675.A O no hydrogen 2.903 N/A HIS 449.A N GLY 446.A O no hydrogen 3.004 N/A HIS 449.A NE2 ALA 443.A O no hydrogen 2.781 N/A HIS 450.A N ALA 447.A O no hydrogen 2.887 N/A ASP 452.A N LYS 457.A O no hydrogen 2.722 N/A ILE 454.A N ASP 452.A OD2 no hydrogen 2.893 N/A THR 455.A N ASP 452.A OD2 no hydrogen 3.075 N/A GLY 456.A N ASP 452.A O no hydrogen 2.811 N/A LYS 457.A N THR 455.A OG1 no hydrogen 3.219 N/A TRP 459.A N HIS 450.A O no hydrogen 3.055 N/A TRP 459.A NE1 ASP 452.A OD1 no hydrogen 2.894 N/A VAL 460.A N CYS 637.A O no hydrogen 2.826 N/A GLN 461.A N GLY 674.A O no hydrogen 2.669 N/A GLN 461.A NE2 GLN 634.A OE1 no hydrogen 2.656 N/A ALA 462.A N VAL 635.A O no hydrogen 2.890 N/A GLY 463.A N LYS 672.A O no hydrogen 2.801 N/A ILE 464.A N ILE 633.A O no hydrogen 3.015 N/A ASP 465.A N GLU 670.A O no hydrogen 2.910 N/A ALA 466.A N ASP 631.A O no hydrogen 2.801 N/A SER 467.A N ASP 668.A O no hydrogen 3.019 N/A ARG 472.A N GLY 468.A O no hydrogen 3.120 N/A ARG 472.A NH1 LEU 666.A O no hydrogen 2.778 N/A ARG 472.A NH1 ASP 668.A OD2 no hydrogen 2.748 N/A CYS 473.A N LEU 469.A O no hydrogen 2.865 N/A CYS 473.A SG LEU 469.A O no hydrogen 3.266 N/A LEU 474.A N GLU 470.A O no hydrogen 3.076 N/A ALA 475.A N LEU 471.A O no hydrogen 2.953 N/A HIS 476.A N ARG 472.A O no hydrogen 2.974 N/A PHE 477.A N CYS 473.A O no hydrogen 3.121 N/A MET 478.A N LEU 474.A O no hydrogen 2.979 N/A ALA 479.A N HIS 476.A O no hydrogen 3.189 N/A PHE 481.A N MET 478.A O no hydrogen 2.691 N/A ASP 482.A N MET 478.A O no hydrogen 2.777 N/A ASN 483.A N ALA 479.A O no hydrogen 2.687 N/A GLY 484.A N ASP 482.A OD1 no hydrogen 2.972 N/A GLU 485.A N ASP 482.A O no hydrogen 3.153 N/A TYR 486.A N ASP 482.A OD2 no hydrogen 2.636 N/A TYR 486.A OH ASN 499.A OD1 no hydrogen 2.699 N/A HIS 488.A N GLY 484.A O no hydrogen 2.836 N/A GLU 489.A N GLU 485.A O no hydrogen 3.094 N/A ILE 490.A N TYR 486.A O no hydrogen 3.053 N/A LEU 491.A N ALA 487.A O no hydrogen 3.415 N/A THR 497.A N ASP 494.A OD2 no hydrogen 2.673 N/A THR 497.A OG1 ASP 494.A O no hydrogen 3.081 N/A THR 497.A OG1 ASP 494.A OD2 no hydrogen 3.042 N/A LYS 498.A N ASP 494.A O no hydrogen 3.225 N/A ASN 499.A N ILE 495.A O no hydrogen 2.876 N/A ASN 499.A ND2 TYR 486.A OH no hydrogen 2.876 N/A GLN 500.A N HIS 496.A O no hydrogen 2.950 N/A ILE 501.A N THR 497.A O no hydrogen 3.132 N/A ALA 502.A N LYS 498.A O no hydrogen 3.250 N/A ALA 503.A N ASN 499.A O no hydrogen 2.853 N/A GLU 504.A N ILE 501.A O no hydrogen 3.393 N/A LEU 505.A N GLN 500.A O no hydrogen 3.061 N/A ASN 510.A N THR 507.A O no hydrogen 2.727 N/A ASN 510.A N THR 507.A OG1 no hydrogen 3.143 N/A ALA 511.A N THR 507.A O no hydrogen 3.304 N/A ALA 511.A N ARG 508.A O no hydrogen 2.754 N/A LYS 512.A N ARG 508.A O no hydrogen 3.180 N/A THR 513.A N ASP 509.A O no hydrogen 3.028 N/A THR 513.A OG1 ASP 509.A O no hydrogen 2.685 N/A PHE 514.A N ASN 510.A O no hydrogen 2.771 N/A ILE 515.A N ALA 511.A O no hydrogen 2.796 N/A TYR 516.A N LYS 512.A O no hydrogen 3.343 N/A GLY 517.A N PHE 514.A O no hydrogen 3.311 N/A PHE 518.A N PHE 514.A O no hydrogen 2.791 N/A PHE 518.A N ILE 515.A O no hydrogen 2.925 N/A LEU 519.A N ILE 515.A O no hydrogen 3.176 N/A TYR 520.A N GLY 517.A O no hydrogen 3.143 N/A GLY 521.A N PHE 518.A O no hydrogen 3.381 N/A ALA 522.A N GLY 517.A O no hydrogen 3.302 N/A VAL 527.A N GLY 524.A O no hydrogen 3.040 N/A GLY 528.A N GLY 524.A O no hydrogen 2.997 N/A LEU 537.A N ARG 533.A O no hydrogen 2.947 N/A LEU 537.A N GLY 534.A O no hydrogen 2.935 N/A LYS 538.A N GLY 534.A O no hydrogen 3.155 N/A LYS 539.A N LYS 535.A O no hydrogen 3.362 N/A LYS 540.A N GLU 536.A O no hydrogen 3.223 N/A PHE 541.A N LEU 537.A O no hydrogen 3.029 N/A LEU 542.A N LYS 538.A O no hydrogen 2.846 N/A GLU 543.A N LYS 539.A O no hydrogen 2.888 N/A ASN 544.A N LYS 540.A O no hydrogen 3.159 N/A ASN 544.A N PHE 541.A O no hydrogen 2.952 N/A ASN 544.A ND2 ALA 502.A O no hydrogen 2.983 N/A THR 545.A N LEU 542.A O no hydrogen 3.399 N/A THR 545.A OG1 PHE 541.A O no hydrogen 3.062 N/A ILE 548.A N THR 545.A O no hydrogen 3.070 N/A ALA 550.A N PRO 546.A O no hydrogen 2.925 N/A LEU 551.A N ALA 547.A O no hydrogen 2.969 N/A ARG 552.A N ILE 548.A O no hydrogen 2.982 N/A GLU 553.A N ALA 549.A O no hydrogen 2.944 N/A SER 554.A N ALA 550.A O no hydrogen 2.893 N/A SER 554.A OG ALA 550.A O no hydrogen 3.305 N/A SER 554.A OG LEU 551.A O no hydrogen 2.613 N/A ILE 555.A N LEU 551.A O no hydrogen 2.996 N/A GLN 556.A N ARG 552.A O no hydrogen 2.995 N/A GLN 557.A N GLU 553.A O no hydrogen 2.948 N/A GLN 557.A NE2 GLU 553.A O no hydrogen 3.654 N/A THR 558.A N SER 554.A O no hydrogen 3.243 N/A THR 558.A N ILE 555.A O no hydrogen 3.060 N/A THR 558.A OG1 SER 554.A O no hydrogen 2.957 N/A LEU 559.A N ILE 555.A O no hydrogen 3.165 N/A LEU 559.A N GLN 556.A O no hydrogen 2.818 N/A VAL 560.A N GLN 556.A O no hydrogen 2.809 N/A GLU 561.A N LYS 564.A O no hydrogen 3.182 N/A LYS 564.A N SER 562.A O no hydrogen 2.880 N/A LYS 566.A N LEU 559.A O no hydrogen 2.641 N/A LYS 566.A NZ GLN 557.A O no hydrogen 2.698 N/A ARG 567.A N LEU 559.A O no hydrogen 3.319 N/A ARG 567.A NH1 TRP 569.A O no hydrogen 3.499 N/A ARG 568.A NE VAL 580.A O no hydrogen 3.115 N/A ARG 568.A NH2 ARG 581.A O no hydrogen 2.987 N/A ILE 570.A N VAL 578.A O no hydrogen 2.955 N/A GLY 572.A N ARG 576.A O no hydrogen 2.735 N/A GLY 575.A N GLY 572.A O no hydrogen 2.821 N/A ARG 576.A N ASP 574.A OD1 no hydrogen 3.333 N/A ARG 576.A NH1 GLU 211.A OE2 no hydrogen 2.755 N/A ARG 576.A NH1 ASP 574.A OD2 no hydrogen 2.860 N/A ARG 576.A NH2 GLU 211.A OE2 no hydrogen 2.833 N/A LYS 577.A N TYR 185.A OH no hydrogen 3.034 N/A VAL 578.A N ILE 570.A O no hydrogen 2.787 N/A VAL 580.A N ARG 568.A O no hydrogen 2.936 N/A SER 582.A OG HIS 584.A ND1 no hydrogen 2.934 N/A HIS 584.A ND1 SER 582.A OG no hydrogen 2.934 N/A ALA 585.A N SER 582.A O no hydrogen 3.102 N/A ALA 586.A N PRO 583.A O no hydrogen 3.388 N/A ASN 588.A ND2 LEU 519.A O no hydrogen 3.365 N/A THR 589.A N ALA 585.A O no hydrogen 2.849 N/A THR 589.A OG1 ALA 585.A O no hydrogen 2.947 N/A LEU 590.A N ALA 586.A O no hydrogen 2.969 N/A LEU 591.A N LEU 587.A O no hydrogen 2.893 N/A GLN 592.A N ASN 588.A O no hydrogen 2.740 N/A SER 593.A N THR 589.A O no hydrogen 2.981 N/A SER 593.A OG THR 417.A O no hydrogen 3.010 N/A ALA 594.A N LEU 590.A O no hydrogen 3.114 N/A GLY 595.A N LEU 591.A O no hydrogen 3.032 N/A ALA 596.A N GLN 592.A O no hydrogen 2.925 N/A LEU 597.A N SER 593.A O no hydrogen 2.902 N/A ILE 598.A N ALA 594.A O no hydrogen 2.964 N/A CYS 599.A N GLY 595.A O no hydrogen 2.892 N/A CYS 599.A SG GLY 595.A O no hydrogen 3.430 N/A LYS 600.A N ALA 596.A O no hydrogen 2.897 N/A LYS 600.A NZ GLU 211.A OE2 no hydrogen 3.078 N/A LYS 600.A NZ PRO 412.A O no hydrogen 2.553 N/A LYS 600.A NZ GLY 418.A O no hydrogen 2.710 N/A LEU 601.A N LEU 597.A O no hydrogen 3.022 N/A TRP 602.A N ILE 598.A O no hydrogen 2.910 N/A TRP 602.A NE1 ALA 650.A O no hydrogen 2.847 N/A ILE 603.A N CYS 599.A O no hydrogen 3.084 N/A ILE 604.A N LYS 600.A O no hydrogen 3.282 N/A LYS 605.A N LEU 601.A O no hydrogen 2.835 N/A THR 606.A N TRP 602.A O no hydrogen 2.844 N/A THR 606.A OG1 TRP 602.A O no hydrogen 2.838 N/A GLU 607.A N ILE 603.A O no hydrogen 3.231 N/A GLU 608.A N ILE 604.A O no hydrogen 3.079 N/A MET 609.A N LYS 605.A O no hydrogen 2.893 N/A LEU 610.A N THR 606.A O no hydrogen 3.031 N/A VAL 611.A N GLU 607.A O no hydrogen 2.945 N/A GLU 612.A N GLU 608.A O no hydrogen 2.896 N/A LYS 613.A N MET 609.A O no hydrogen 3.026 N/A LYS 613.A N LEU 610.A O no hydrogen 3.186 N/A LYS 613.A NZ THR 649.A OG1 no hydrogen 2.690 N/A LYS 613.A NZ GLU 652.A OE2 no hydrogen 3.490 N/A GLY 614.A N VAL 611.A O no hydrogen 2.873 N/A LEU 615.A N LEU 610.A O no hydrogen 3.041 N/A LYS 616.A N ASP 622.A OD2 no hydrogen 2.701 N/A HIS 617.A ND1 GLU 607.A OE2 no hydrogen 2.691 N/A GLY 618.A N PHE 623.A O no hydrogen 2.719 N/A TRP 619.A NE1 ASN 224.A O no hydrogen 2.793 N/A GLY 621.A N GLY 618.A O no hydrogen 2.918 N/A ASP 622.A N LYS 616.A O no hydrogen 2.748 N/A PHE 623.A N LYS 616.A O no hydrogen 3.259 N/A ALA 624.A N GLY 636.A O no hydrogen 2.756 N/A TYR 625.A N HIS 617.A NE2 no hydrogen 3.160 N/A TYR 625.A OH ILE 603.A O no hydrogen 2.769 N/A MET 626.A N GLN 634.A O no hydrogen 2.984 N/A ALA 627.A N GLN 634.A O no hydrogen 3.391 N/A TRP 628.A NE1 HIS 630.A O no hydrogen 3.088 N/A VAL 629.A N GLU 632.A O no hydrogen 2.861 N/A GLU 632.A N VAL 629.A O no hydrogen 3.287 N/A ILE 633.A N ILE 464.A O no hydrogen 2.899 N/A GLN 634.A N ALA 627.A O no hydrogen 2.931 N/A GLN 634.A NE2 GLU 632.A OE1 no hydrogen 2.822 N/A GLN 634.A NE2 CYS 680.A O no hydrogen 3.617 N/A VAL 635.A N ALA 462.A O no hydrogen 2.869 N/A GLY 636.A N ALA 624.A O no hydrogen 2.804 N/A CYS 637.A N VAL 460.A O no hydrogen 2.692 N/A CYS 637.A SG VAL 635.A O no hydrogen 3.711 N/A ARG 638.A N ASP 622.A O no hydrogen 2.905 N/A ARG 638.A NE GLY 621.A O no hydrogen 3.163 N/A ARG 638.A NH2 ASP 622.A OD1 no hydrogen 2.878 N/A ILE 642.A N THR 639.A OG1 no hydrogen 3.159 N/A ALA 643.A N THR 639.A O no hydrogen 3.059 N/A GLN 644.A N GLU 640.A O no hydrogen 2.907 N/A VAL 645.A N GLU 641.A O no hydrogen 3.098 N/A VAL 646.A N ILE 642.A O no hydrogen 2.844 N/A ILE 647.A N ALA 643.A O no hydrogen 3.024 N/A GLU 648.A N GLN 644.A O no hydrogen 3.019 N/A THR 649.A N VAL 645.A O no hydrogen 2.777 N/A THR 649.A OG1 VAL 645.A O no hydrogen 2.572 N/A ALA 650.A N VAL 646.A O no hydrogen 2.904 N/A GLN 651.A N ILE 647.A O no hydrogen 3.396 N/A GLN 651.A NE2 ASP 668.A OD1 no hydrogen 3.140 N/A GLU 652.A N GLU 648.A O no hydrogen 3.235 N/A ALA 653.A N THR 649.A O no hydrogen 2.876 N/A MET 654.A N ALA 650.A O no hydrogen 3.099 N/A ARG 655.A N GLN 651.A O no hydrogen 3.082 N/A TRP 656.A N GLU 652.A O no hydrogen 2.932 N/A VAL 657.A N ALA 653.A O no hydrogen 2.901 N/A GLY 658.A N MET 654.A O no hydrogen 2.959 N/A ASP 659.A N ARG 655.A O no hydrogen 3.061 N/A HIS 660.A N TRP 656.A O no hydrogen 2.805 N/A HIS 660.A NE2 GLU 206.A OE2 no hydrogen 2.683 N/A TRP 661.A N VAL 657.A O no hydrogen 3.171 N/A TRP 661.A NE1 GLU 206.A OE1 no hydrogen 3.018 N/A ASN 662.A N ASP 659.A O no hydrogen 3.066 N/A PHE 663.A N GLY 658.A O no hydrogen 2.825 N/A ARG 664.A N HIS 476.A ND1 no hydrogen 2.789 N/A CYS 665.A SG LEU 666.A O no hydrogen 3.907 N/A THR 669.A N GLN 651.A OE1 no hydrogen 2.952 N/A THR 669.A OG1 GLN 651.A OE1 no hydrogen 2.671 N/A GLU 670.A N ASP 465.A O no hydrogen 2.908 N/A LYS 672.A N GLY 463.A O no hydrogen 2.868 N/A LYS 672.A NZ HIS 681.A OXT no hydrogen 2.551 N/A GLY 674.A N GLN 461.A O no hydrogen 2.904 N/A ASN 676.A ND2 GLU 448.A OE2 no hydrogen 2.720 N/A TRP 677.A N PHE 445.A O no hydrogen 2.871 N/A TRP 677.A NE1 GLU 632.A OE1 no hydrogen 3.238 N/A ILE 679.A N ASN 676.A OD1 no hydrogen 3.067 N/A CYS 680.A N ASN 676.A O no hydrogen 3.014 N/A CYS 680.A SG GLN 461.A O no hydrogen 3.567 N/A CYS 680.A SG LYS 672.A O no hydrogen 3.783 N/A CYS 680.A SG ASN 676.A O no hydrogen 3.388 N/A