Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2y50_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A N GLN 27.A O no hydrogen 2.889 N/A TYR 7.A N ASP 4.A O no hydrogen 3.101 N/A LEU 8.A N ASP 4.A O no hydrogen 3.184 N/A ASN 9.A N PHE 5.A O no hydrogen 2.940 N/A ASN 9.A ND2 GLY 37.A O no hydrogen 3.184 N/A LEU 11.A N LEU 8.A O no hydrogen 3.325 N/A TYR 13.A OH ASP 44.A OD2 no hydrogen 2.780 N/A GLU 15.A N SER 12.A OG no hydrogen 3.106 N/A LEU 16.A N SER 12.A O no hydrogen 2.770 N/A THR 17.A N TYR 13.A O no hydrogen 2.832 N/A THR 17.A OG1 TYR 13.A O no hydrogen 2.839 N/A THR 17.A OG1 THR 14.A O no hydrogen 3.280 N/A ASN 18.A N THR 14.A O no hydrogen 3.404 N/A LEU 19.A N GLU 15.A O no hydrogen 3.020 N/A ILE 20.A N LEU 16.A O no hydrogen 2.955 N/A LYS 21.A N THR 17.A O no hydrogen 3.117 N/A ASN 22.A N LEU 19.A O no hydrogen 3.010 N/A ILE 23.A N ILE 20.A O no hydrogen 3.329 N/A LYS 24.A N GLN 27.A OE1 no hydrogen 2.856 N/A GLN 27.A N LYS 24.A O no hydrogen 2.941 N/A GLN 27.A NE2 THR 1.A O no hydrogen 2.722 N/A ILE 28.A N TRP 25.A O no hydrogen 3.385 N/A ASN 29.A N TYR 3.A O no hydrogen 2.815 N/A ASN 29.A ND2 TYR 3.A O no hydrogen 3.629 N/A ASN 33.A N GLY 30.A O no hydrogen 3.120 N/A SER 35.A OG ASN 33.A O no hydrogen 3.308 N/A GLN 39.A N SER 35.A O no hydrogen 2.883 N/A LYS 40.A N THR 36.A O no hydrogen 3.210 N/A PHE 41.A N GLY 37.A O no hydrogen 2.900 N/A PHE 42.A N SER 38.A O no hydrogen 3.058 N/A ASN 46.A N ASP 44.A OD1 no hydrogen 3.103 N/A ARG 47.A N ASP 44.A OD1 no hydrogen 3.360 N/A ARG 47.A NE PHE 41.A O no hydrogen 3.337 N/A ARG 47.A NH1 ASN 9.A O no hydrogen 3.094 N/A ARG 47.A NH2 LYS 40.A O no hydrogen 3.426 N/A VAL 48.A N ASP 44.A O no hydrogen 3.228 N/A GLN 49.A N LYS 45.A O no hydrogen 3.330 N/A GLN 49.A NE2 GLN 49.A O no hydrogen 3.159 N/A GLN 49.A NE2 ASN 53.A OD1 no hydrogen 2.627 N/A ALA 50.A N ASN 46.A O no hydrogen 2.841 N/A ILE 51.A N ARG 47.A O no hydrogen 2.965 N/A ILE 52.A N VAL 48.A O no hydrogen 2.818 N/A ASN 53.A N GLN 49.A O no hydrogen 2.884 N/A ALA 54.A N ALA 50.A O no hydrogen 2.901 N/A LEU 55.A N ILE 51.A O no hydrogen 2.853 N/A GLN 56.A N ILE 52.A O no hydrogen 3.037 N/A GLU 57.A N ASN 53.A O no hydrogen 3.043 N/A SER 58.A N ALA 54.A O no hydrogen 2.972 N/A SER 58.A OG ALA 54.A O no hydrogen 3.177 N/A SER 58.A OG LYS 68.A O no hydrogen 2.989 N/A GLY 59.A N LEU 55.A O no hydrogen 2.725 N/A ARG 60.A N GLN 56.A O no hydrogen 3.025 N/A ARG 60.A NE GLU 57.A OE1 no hydrogen 3.559 N/A ARG 60.A NH2 GLU 57.A OE2 no hydrogen 2.936 N/A THR 61.A OG1 GLU 57.A O no hydrogen 3.109 N/A TYR 62.A N SER 58.A O no hydrogen 3.099 N/A TYR 62.A OH ILE 109.A O no hydrogen 3.095 N/A THR 63.A N ASP 66.A O no hydrogen 3.246 N/A THR 72.A OG1 ILE 23.A O no hydrogen 2.682 N/A PHE 73.A N GLY 69.A O no hydrogen 2.943 N/A THR 74.A N GLU 71.A O no hydrogen 3.281 N/A THR 74.A OG1 ILE 70.A O no hydrogen 2.905 N/A THR 74.A OG1 GLU 71.A O no hydrogen 2.611 N/A GLU 75.A N GLU 71.A O no hydrogen 3.109 N/A VAL 76.A N THR 72.A O no hydrogen 3.303 N/A ARG 78.A N THR 74.A O no hydrogen 3.021 N/A ARG 78.A NE ASN 135.A OD1 no hydrogen 2.861 N/A ARG 78.A NH1 GLU 75.A OE2 no hydrogen 3.026 N/A ALA 79.A N GLU 75.A O no hydrogen 2.797 N/A GLY 80.A N VAL 76.A O no hydrogen 2.972 N/A PHE 81.A N LEU 77.A O no hydrogen 3.082 N/A TYR 82.A N ARG 78.A O no hydrogen 2.885 N/A LEU 83.A N ALA 79.A O no hydrogen 3.029 N/A GLY 84.A N GLY 80.A O no hydrogen 2.976 N/A TYR 85.A N TYR 82.A O no hydrogen 3.303 N/A TYR 86.A N TYR 82.A O no hydrogen 3.440 N/A ASN 87.A N LEU 83.A O no hydrogen 3.017 N/A SER 91.A OG ASP 88.A OD1 no hydrogen 3.241 N/A TYR 92.A OH PHE 42.A O no hydrogen 2.559 N/A LEU 93.A N LEU 90.A O no hydrogen 3.039 N/A ASN 94.A N SER 91.A O no hydrogen 3.341 N/A ASN 97.A N ASP 95.A OD1 no hydrogen 3.397 N/A PHE 98.A N ASP 95.A O no hydrogen 3.170 N/A GLN 99.A N ASP 95.A O no hydrogen 3.282 N/A GLN 99.A NE2 LEU 93.A O no hydrogen 3.046 N/A ASP 100.A N ARG 96.A O no hydrogen 2.935 N/A LYS 101.A N PHE 98.A O no hydrogen 2.987 N/A CYS 102.A N GLN 99.A O no hydrogen 3.144 N/A ILE 103.A N ASP 100.A O no hydrogen 3.113 N/A MET 106.A N CYS 102.A O no hydrogen 2.798 N/A ILE 107.A N ILE 103.A O no hydrogen 2.780 N/A ALA 108.A N PRO 104.A O no hydrogen 3.305 N/A ILE 109.A N ALA 105.A O no hydrogen 3.284 N/A GLN 110.A N MET 106.A O no hydrogen 3.207 N/A GLN 110.A NE2 VAL 142.A O no hydrogen 2.719 N/A LYS 111.A N ILE 107.A O no hydrogen 2.856 N/A ASN 112.A ND2 GLY 59.A O no hydrogen 3.060 N/A ASN 112.A ND2 TYR 62.A O no hydrogen 3.178 N/A ASN 114.A N ASN 112.A OD1 no hydrogen 2.784 N/A PHE 115.A N ASN 112.A O no hydrogen 3.033 N/A LYS 116.A N ASN 114.A O no hydrogen 3.115 N/A LEU 117.A N GLN 152.A OE1 no hydrogen 2.669 N/A GLY 118.A N ASP 123.A OD1 no hydrogen 3.021 N/A GLN 122.A NE2 LYS 116.A O no hydrogen 2.816 N/A ASP 123.A N THR 119.A O no hydrogen 2.995 N/A GLU 124.A N ALA 120.A O no hydrogen 2.946 N/A VAL 125.A N VAL 121.A O no hydrogen 2.883 N/A ILE 126.A N GLN 122.A O no hydrogen 3.399 N/A THR 127.A N ASP 123.A O no hydrogen 3.035 N/A THR 127.A OG1 ASP 123.A O no hydrogen 2.768 N/A SER 128.A N GLU 124.A O no hydrogen 2.764 N/A SER 128.A OG GLU 124.A O no hydrogen 2.702 N/A LEU 129.A N VAL 125.A O no hydrogen 2.796 N/A GLY 130.A N ILE 126.A O no hydrogen 2.887 N/A LYS 131.A N THR 127.A O no hydrogen 3.027 N/A LEU 132.A N SER 128.A O no hydrogen 3.124 N/A ILE 133.A N LEU 129.A O no hydrogen 3.123 N/A ASN 135.A N LEU 132.A O no hydrogen 2.926 N/A ALA 136.A N LEU 132.A O no hydrogen 2.750 N/A SER 137.A OG ASP 100.A OD1 no hydrogen 3.024 N/A ALA 138.A N ASP 180.A OD2 no hydrogen 2.702 N/A VAL 142.A N ASN 139.A OD1 no hydrogen 2.978 N/A ASN 144.A N ALA 140.A O no hydrogen 3.009 N/A ASN 144.A ND2 ALA 140.A O no hydrogen 2.930 N/A ASN 144.A ND2 LYS 198.A O no hydrogen 3.091 N/A ASN 145.A N GLU 141.A O no hydrogen 3.305 N/A ASN 145.A N VAL 142.A O no hydrogen 3.256 N/A ASN 145.A ND2 GLN 110.A OE1 no hydrogen 3.045 N/A CYS 146.A N VAL 143.A O no hydrogen 3.034 N/A CYS 146.A SG VAL 142.A O no hydrogen 3.318 N/A CYS 146.A SG VAL 143.A O no hydrogen 3.364 N/A VAL 147.A N ASN 144.A O no hydrogen 3.373 N/A LEU 150.A N CYS 146.A O no hydrogen 3.057 N/A LYS 151.A N VAL 147.A O no hydrogen 2.710 N/A GLN 152.A N PRO 148.A O no hydrogen 2.875 N/A GLN 152.A NE2 LEU 117.A O no hydrogen 3.015 N/A PHE 153.A N VAL 149.A O no hydrogen 2.841 N/A ARG 154.A N LEU 150.A O no hydrogen 2.769 N/A GLU 155.A N LYS 151.A O no hydrogen 2.857 N/A ASN 156.A N GLN 152.A O no hydrogen 3.345 N/A LEU 157.A N ARG 154.A O no hydrogen 3.194 N/A GLN 159.A N ASN 156.A O no hydrogen 3.072 N/A TYR 160.A N ASN 156.A O no hydrogen 3.045 N/A ALA 161.A N LEU 157.A O no hydrogen 3.305 N/A ASP 163.A N TYR 160.A O no hydrogen 3.129 N/A VAL 165.A N ASP 163.A OD1 no hydrogen 3.289 N/A LYS 166.A NZ ASP 123.A OD2 no hydrogen 2.767 N/A THR 168.A N TYR 164.A O no hydrogen 2.891 N/A THR 168.A OG1 TYR 164.A O no hydrogen 2.860 N/A ALA 169.A N VAL 165.A O no hydrogen 2.919 N/A VAL 170.A N LYS 166.A O no hydrogen 3.140 N/A ASN 171.A N GLY 167.A O no hydrogen 3.129 N/A GLU 172.A N THR 168.A O no hydrogen 2.829 N/A LEU 173.A N ALA 169.A O no hydrogen 3.004 N/A ILE 174.A N VAL 170.A O no hydrogen 2.974 N/A LYS 175.A N ASN 171.A O no hydrogen 2.828 N/A GLY 176.A N GLU 172.A O no hydrogen 2.903 N/A ILE 177.A N LEU 173.A O no hydrogen 3.434 N/A GLU 178.A N ILE 174.A O no hydrogen 2.995 N/A PHE 179.A N LYS 175.A O no hydrogen 3.035 N/A ASP 180.A N GLY 176.A O no hydrogen 3.142 N/A PHE 181.A N ILE 177.A O no hydrogen 2.988 N/A SER 182.A N GLU 178.A O no hydrogen 2.952 N/A SER 182.A OG GLU 178.A O no hydrogen 3.002 N/A SER 182.A OG PHE 179.A O no hydrogen 3.314 N/A GLY 183.A N PHE 179.A O no hydrogen 3.319 N/A ALA 184.A N ASP 180.A O no hydrogen 3.128 N/A ALA 184.A N PHE 181.A O no hydrogen 3.305 N/A ALA 185.A N PHE 181.A O no hydrogen 3.260 N/A THR 192.A N ASP 189.A O no hydrogen 3.144 N/A THR 192.A OG1 ASP 189.A O no hydrogen 2.758 N/A TYR 196.A N MET 193.A O no hydrogen 3.138 N/A GLY 197.A N TYR 236.A O no hydrogen 2.829 N/A LYS 198.A N TRP 195.A O no hydrogen 2.772 N/A ILE 203.A N ILE 199.A O no hydrogen 2.829 N/A ASN 204.A N ASP 200.A O no hydrogen 2.813 N/A GLU 205.A N PRO 201.A O no hydrogen 3.246 N/A GLU 205.A N PHE 202.A O no hydrogen 2.991 N/A LEU 206.A N PHE 202.A O no hydrogen 3.249 N/A LEU 206.A N ILE 203.A O no hydrogen 2.979 N/A LYS 207.A N ILE 203.A O no hydrogen 3.167 N/A LYS 207.A NZ ASP 242.A OD1 no hydrogen 3.230 N/A LYS 207.A NZ ASP 242.A OD2 no hydrogen 2.732 N/A ALA 208.A N ASN 204.A O no hydrogen 3.207 N/A LEU 209.A N GLU 205.A O no hydrogen 3.285 N/A GLY 210.A N LEU 206.A O no hydrogen 2.717 N/A LEU 211.A N LYS 207.A O no hydrogen 2.697 N/A TYR 212.A N LEU 209.A O no hydrogen 3.236 N/A GLY 213.A N TYR 254.A OH no hydrogen 2.825 N/A ASN 214.A N TYR 212.A O no hydrogen 2.950 N/A THR 216.A N THR 219.A OG1 no hydrogen 3.235 N/A ALA 218.A N THR 216.A OG1 no hydrogen 3.349 N/A TRP 221.A NE1 ALA 161.A O no hydrogen 2.985 N/A ALA 222.A N THR 219.A O no hydrogen 3.227 N/A SER 223.A OG LEU 209.A O no hydrogen 2.827 N/A ASP 224.A N GLU 220.A O no hydrogen 3.018 N/A VAL 225.A N TRP 221.A O no hydrogen 2.835 N/A GLY 226.A N ALA 222.A O no hydrogen 2.984 N/A ILE 227.A N SER 223.A O no hydrogen 2.944 N/A TYR 228.A N ASP 224.A O no hydrogen 2.877 N/A TYR 229.A N VAL 225.A O no hydrogen 2.954 N/A LEU 230.A N GLY 226.A O no hydrogen 2.838 N/A SER 231.A N ILE 227.A O no hydrogen 3.050 N/A SER 231.A OG ASP 270.A OD2 no hydrogen 2.646 N/A LYS 232.A N TYR 228.A O no hydrogen 3.260 N/A LYS 232.A NZ ASP 270.A OD1 no hydrogen 3.170 N/A PHE 233.A N TYR 229.A O no hydrogen 2.968 N/A GLY 234.A N LEU 230.A O no hydrogen 2.985 N/A LEU 235.A N LYS 232.A O no hydrogen 3.421 N/A TYR 236.A N PHE 233.A O no hydrogen 2.974 N/A SER 237.A N GLY 234.A O no hydrogen 3.242 N/A SER 237.A OG ASN 239.A O no hydrogen 3.461 N/A ASN 239.A N SER 237.A OG no hydrogen 3.424 N/A ARG 240.A NH1 ASN 241.A OD1 no hydrogen 2.785 N/A ARG 240.A NH1 GLY 275.A O no hydrogen 3.069 N/A ARG 240.A NH2 TYR 271.A O no hydrogen 3.315 N/A ARG 240.A NH2 ILE 274.A O no hydrogen 2.700 N/A ASP 242.A N ASN 239.A OD1 no hydrogen 3.148 N/A VAL 244.A N ARG 240.A O no hydrogen 3.176 N/A GLN 245.A N ASN 241.A O no hydrogen 2.772 N/A SER 246.A N ASP 242.A O no hydrogen 3.291 N/A SER 246.A OG ASP 242.A O no hydrogen 3.468 N/A LEU 247.A N ILE 243.A O no hydrogen 2.946 N/A GLU 248.A N VAL 244.A O no hydrogen 2.743 N/A LYS 249.A N GLN 245.A O no hydrogen 2.897 N/A ALA 250.A N SER 246.A O no hydrogen 2.992 N/A VAL 251.A N LEU 247.A O no hydrogen 3.260 N/A ASP 252.A N GLU 248.A O no hydrogen 3.206 N/A MET 253.A N LYS 249.A O no hydrogen 2.903 N/A TYR 254.A N ALA 250.A O no hydrogen 3.107 N/A TYR 254.A OH GLY 210.A O no hydrogen 2.739 N/A ALA 260.A N GLY 257.A O no hydrogen 3.094 N/A PHE 261.A N GLY 257.A O no hydrogen 3.439 N/A VAL 262.A N LYS 258.A O no hydrogen 3.089 N/A ALA 263.A N ILE 259.A O no hydrogen 3.014 N/A MET 264.A N ALA 260.A O no hydrogen 3.006 N/A GLU 265.A N PHE 261.A O no hydrogen 2.897 N/A ARG 266.A N VAL 262.A O no hydrogen 2.797 N/A ARG 266.A NH1 ASP 270.A OD2 no hydrogen 2.685 N/A ILE 267.A N ALA 263.A O no hydrogen 3.036 N/A THR 268.A N MET 264.A O no hydrogen 3.185 N/A THR 268.A OG1 MET 264.A O no hydrogen 3.182 N/A THR 268.A OG1 GLU 265.A O no hydrogen 3.056 N/A TRP 269.A N GLU 265.A O no hydrogen 3.002 N/A ASP 270.A N ARG 266.A O no hydrogen 2.910 N/A TYR 271.A N ILE 267.A O no hydrogen 3.057 N/A TYR 271.A OH SER 231.A O no hydrogen 2.758 N/A GLY 273.A N ILE 267.A O no hydrogen 2.890 N/A ILE 274.A N TYR 271.A O no hydrogen 3.001 N/A GLY 275.A N LYS 279.A O no hydrogen 3.018 N/A SER 276.A N GLU 248.A OE2 no hydrogen 3.192 N/A SER 276.A OG GLU 248.A OE1 no hydrogen 2.541 N/A SER 276.A OG GLU 248.A OE2 no hydrogen 3.393 N/A LYS 279.A N ASN 277.A OD1 no hydrogen 3.116 N/A VAL 281.A N GLY 273.A O no hydrogen 2.931 N/A PHE 286.A N ASP 282.A O no hydrogen 3.377 N/A LEU 287.A N HIS 283.A O no hydrogen 3.213 N/A ASP 288.A N ASP 284.A O no hydrogen 2.829 N/A ASP 289.A N LYS 285.A O no hydrogen 2.768 N/A ALA 290.A N PHE 286.A O no hydrogen 2.839 N/A GLU 291.A N LEU 287.A O no hydrogen 2.878 N/A LYS 292.A N ASP 288.A O no hydrogen 3.257 N/A HIS 293.A N ASP 289.A O no hydrogen 3.075 N/A TYR 294.A N ALA 290.A O no hydrogen 3.259 N/A TYR 294.A N GLU 291.A O no hydrogen 3.128 N/A TYR 294.A OH TYR 256.A O no hydrogen 2.240 N/A LEU 295.A N GLU 291.A O no hydrogen 2.607 N/A LYS 297.A N ALA 310.A O no hydrogen 3.078 N/A TYR 299.A N ILE 308.A O no hydrogen 2.755 N/A THR 300.A N GLN 595.A OE1 no hydrogen 3.015 N/A PHE 301.A N PHE 306.A O no hydrogen 2.822 N/A ASP 302.A N SER 594.A OG no hydrogen 3.133 N/A ASN 303.A N LYS 593.A O no hydrogen 2.860 N/A GLY 304.A N PHE 301.A O no hydrogen 2.887 N/A THR 305.A N ASP 302.A O no hydrogen 3.035 N/A THR 305.A OG1 ASP 302.A O no hydrogen 2.623 N/A PHE 306.A N PHE 301.A O no hydrogen 3.326 N/A ILE 307.A N LEU 352.A O no hydrogen 2.970 N/A ILE 308.A N TYR 299.A O no hydrogen 2.849 N/A ARG 309.A N MET 354.A O no hydrogen 2.800 N/A ARG 309.A NH2 LEU 295.A O no hydrogen 3.352 N/A ALA 310.A N LYS 297.A O no hydrogen 2.830 N/A GLY 311.A N ILE 356.A O no hydrogen 2.999 N/A LYS 313.A N ASN 358.A OD1 no hydrogen 2.811 N/A VAL 314.A N GLY 311.A O no hydrogen 3.322 N/A GLU 317.A N SER 315.A OG no hydrogen 3.217 N/A LYS 318.A NZ GLU 391.A OE1 no hydrogen 3.382 N/A LYS 318.A NZ GLU 391.A OE2 no hydrogen 2.793 N/A ILE 319.A N SER 315.A O no hydrogen 3.429 N/A LYS 320.A N GLU 316.A O no hydrogen 3.227 N/A ARG 321.A N GLU 317.A O no hydrogen 2.915 N/A LEU 322.A N LYS 318.A O no hydrogen 2.808 N/A TYR 323.A N ILE 319.A O no hydrogen 3.181 N/A TYR 323.A OH ASP 302.A OD1 no hydrogen 2.631 N/A TYR 323.A OH ASP 302.A OD2 no hydrogen 3.337 N/A TYR 323.A OH HIS 665.A NE2 no hydrogen 3.043 N/A TRP 324.A N LYS 320.A O no hydrogen 3.111 N/A ALA 325.A N ARG 321.A O no hydrogen 2.662 N/A SER 326.A N LEU 322.A O no hydrogen 3.108 N/A SER 326.A OG TYR 323.A O no hydrogen 2.631 N/A ARG 327.A N TYR 323.A O no hydrogen 3.257 N/A ARG 327.A NH2 ASP 302.A OD1 no hydrogen 3.545 N/A ARG 327.A NH2 ASP 302.A OD2 no hydrogen 3.165 N/A GLU 328.A N TRP 324.A O no hydrogen 3.289 N/A GLU 328.A N ALA 325.A O no hydrogen 3.074 N/A VAL 329.A N ALA 325.A O no hydrogen 3.245 N/A LYS 330.A N SER 326.A O no hydrogen 2.869 N/A LYS 330.A NZ TYR 417.A OH no hydrogen 3.128 N/A SER 331.A N ARG 327.A O no hydrogen 3.242 N/A SER 331.A OG ARG 327.A O no hydrogen 3.428 N/A SER 331.A OG GLU 328.A O no hydrogen 2.653 N/A GLN 332.A N GLU 328.A O no hydrogen 2.996 N/A PHE 333.A N VAL 329.A O no hydrogen 2.839 N/A HIS 334.A N LYS 330.A O no hydrogen 2.879 N/A HIS 334.A ND1 ASN 339.A O no hydrogen 2.884 N/A ARG 335.A N SER 331.A O no hydrogen 2.929 N/A ARG 335.A NH1 ASP 626.A OD1 no hydrogen 3.444 N/A ARG 335.A NH2 ASP 626.A OD1 no hydrogen 3.187 N/A ARG 335.A NH2 ALA 645.A O no hydrogen 3.096 N/A VAL 336.A N GLN 332.A O no hydrogen 3.202 N/A VAL 337.A N PHE 333.A O no hydrogen 2.902 N/A GLY 338.A N HIS 334.A O no hydrogen 2.864 N/A ASN 339.A ND2 LYS 341.A O no hydrogen 2.981 N/A LYS 341.A N ASN 339.A OD1 no hydrogen 2.985 N/A LEU 343.A N ARG 416.A O no hydrogen 3.310 N/A ASN 347.A ND2 GLU 344.A OE1 no hydrogen 3.173 N/A VAL 351.A N ALA 348.A O no hydrogen 2.909 N/A LEU 352.A N THR 305.A O no hydrogen 3.040 N/A THR 353.A N GLY 385.A O no hydrogen 3.186 N/A MET 354.A N ILE 307.A O no hydrogen 2.735 N/A LYS 355.A N PHE 387.A O no hydrogen 2.907 N/A LYS 355.A NZ GLU 291.A OE2 no hydrogen 2.893 N/A ILE 356.A N ARG 309.A O no hydrogen 2.887 N/A PHE 357.A N THR 389.A O no hydrogen 2.863 N/A ASN 358.A ND2 ASP 312.A OD1 no hydrogen 3.198 N/A ASN 358.A ND2 GLU 362.A OE1 no hydrogen 2.731 N/A SER 359.A OG GLU 361.A OE1 no hydrogen 2.986 N/A GLU 361.A N GLU 361.A OE1 no hydrogen 2.581 N/A TYR 363.A N SER 359.A O no hydrogen 2.889 N/A TYR 363.A OH ASN 376.A OD1 no hydrogen 2.664 N/A LYS 364.A N PRO 360.A O no hydrogen 3.280 N/A LYS 364.A N GLU 361.A O no hydrogen 3.123 N/A PHE 365.A N GLU 362.A O no hydrogen 3.371 N/A ASN 366.A N TYR 363.A O no hydrogen 2.935 N/A THR 367.A N LYS 364.A O no hydrogen 3.315 N/A THR 367.A OG1 VAL 372.A O no hydrogen 2.954 N/A ASN 368.A N PHE 365.A O no hydrogen 3.104 N/A ILE 369.A N PHE 365.A O no hydrogen 2.914 N/A ASN 370.A N ASN 366.A O no hydrogen 2.599 N/A ASN 370.A ND2 GLU 291.A OE2 no hydrogen 3.081 N/A ASN 370.A ND2 ASN 366.A OD1 no hydrogen 2.710 N/A ASP 375.A N SER 373.A OG no hydrogen 3.316 N/A ASN 376.A ND2 SER 373.A O no hydrogen 3.180 N/A LEU 379.A N TYR 388.A O no hydrogen 2.868 N/A ILE 381.A N THR 386.A O no hydrogen 2.598 N/A ARG 384.A N ILE 381.A O no hydrogen 3.267 N/A ARG 384.A NH1 ASN 370.A O no hydrogen 3.086 N/A ARG 384.A NH1 TYR 388.A OH no hydrogen 2.976 N/A ARG 384.A NH2 ASN 370.A O no hydrogen 3.300 N/A GLY 385.A N GLU 382.A O no hydrogen 2.788 N/A THR 386.A N ILE 381.A O no hydrogen 2.786 N/A THR 386.A OG1 ARG 384.A O no hydrogen 2.800 N/A PHE 387.A N THR 353.A O no hydrogen 2.954 N/A TYR 388.A N LEU 379.A O no hydrogen 2.879 N/A THR 389.A N LYS 355.A O no hydrogen 2.821 N/A THR 389.A OG1 GLY 377.A O no hydrogen 2.920 N/A GLU 391.A N PHE 357.A O no hydrogen 2.703 N/A ARG 392.A N GLU 391.A OE1 no hydrogen 2.850 N/A ARG 392.A NH1 TYR 390.A O no hydrogen 2.364 N/A ARG 392.A NH2 GLY 377.A O no hydrogen 2.778 N/A ARG 392.A NH2 THR 389.A OG1 no hydrogen 2.858 N/A THR 393.A N GLN 396.A OE1 no hydrogen 2.797 N/A GLN 395.A N THR 393.A OG1 no hydrogen 3.317 N/A GLN 396.A N THR 393.A OG1 no hydrogen 3.157 N/A SER 397.A N THR 393.A O no hydrogen 3.467 N/A SER 397.A OG PHE 399.A O no hydrogen 2.834 N/A SER 400.A OG GLU 403.A OE2 no hydrogen 3.418 N/A LEU 404.A N SER 400.A O no hydrogen 2.973 N/A PHE 405.A N LEU 401.A O no hydrogen 2.846 N/A ARG 406.A N GLU 402.A O no hydrogen 2.742 N/A ARG 406.A NE ALA 446.A O no hydrogen 3.150 N/A HIS 407.A N GLU 403.A O no hydrogen 3.303 N/A HIS 407.A NE2 GLU 439.A OE2 no hydrogen 3.059 N/A GLU 408.A N LEU 404.A O no hydrogen 3.008 N/A TYR 409.A N PHE 405.A O no hydrogen 2.653 N/A THR 410.A N HIS 407.A O no hydrogen 3.276 N/A THR 410.A OG1 ARG 406.A O no hydrogen 3.067 N/A THR 410.A OG1 HIS 407.A O no hydrogen 3.484 N/A HIS 411.A N GLU 408.A O no hydrogen 2.930 N/A HIS 411.A ND1 GLN 414.A OE1 no hydrogen 3.030 N/A LEU 413.A N TYR 409.A O no hydrogen 3.156 N/A GLN 414.A N THR 410.A O no hydrogen 2.774 N/A GLN 414.A NE2 ASP 438.A O no hydrogen 3.330 N/A ALA 415.A N HIS 411.A O no hydrogen 3.109 N/A ARG 416.A N TYR 412.A O no hydrogen 3.049 N/A ARG 416.A N LEU 413.A O no hydrogen 3.210 N/A ARG 416.A NE TYR 417.A OH no hydrogen 3.117 N/A ARG 416.A NH1 ASP 349.A OD1 no hydrogen 2.851 N/A ARG 416.A NH1 ASP 350.A OD1 no hydrogen 2.693 N/A TYR 417.A N LEU 413.A O no hydrogen 2.856 N/A LEU 418.A N GLN 414.A O no hydrogen 3.070 N/A VAL 419.A N GLN 414.A O no hydrogen 2.868 N/A TRP 423.A N GLU 382.A OE2 no hydrogen 3.254 N/A GLN 425.A N LEU 422.A O no hydrogen 2.944 N/A TYR 429.A N GLY 426.A O no hydrogen 2.946 N/A TYR 429.A OH ASP 438.A OD2 no hydrogen 2.678 N/A GLU 430.A N PRO 427.A O no hydrogen 3.411 N/A ARG 433.A NE ASP 523.A OD1 no hydrogen 3.204 N/A ARG 433.A NE ASP 523.A OD2 no hydrogen 3.052 N/A ARG 433.A NH2 ASP 523.A OD2 no hydrogen 3.009 N/A THR 435.A OG1 ASN 432.A OD1 no hydrogen 2.249 N/A ASP 438.A N LEU 434.A O no hydrogen 2.706 N/A GLU 439.A N THR 435.A O no hydrogen 3.418 N/A GLY 440.A N TRP 436.A O no hydrogen 2.508 N/A THR 441.A N PHE 437.A O no hydrogen 2.668 N/A THR 441.A OG1 PHE 437.A O no hydrogen 2.857 N/A ALA 442.A N ASP 438.A O no hydrogen 3.416 N/A GLU 443.A N GLU 439.A O no hydrogen 3.207 N/A PHE 444.A N GLY 440.A O no hydrogen 3.158 N/A PHE 445.A N THR 441.A O no hydrogen 2.698 N/A ALA 446.A N ALA 442.A O no hydrogen 3.131 N/A GLY 447.A N PHE 444.A O no hydrogen 2.755 N/A SER 448.A N PHE 445.A O no hydrogen 2.999 N/A SER 448.A OG PHE 445.A O no hydrogen 2.744 N/A THR 449.A N GLY 453.A O no hydrogen 3.128 N/A THR 449.A OG1 GLY 453.A O no hydrogen 3.088 N/A ARG 450.A NH1 LEU 643.A O no hydrogen 2.865 N/A VAL 454.A N TYR 500.A OH no hydrogen 3.145 N/A LEU 455.A N GLY 447.A O no hydrogen 3.138 N/A ARG 457.A NE GLU 443.A O no hydrogen 3.389 N/A ARG 457.A NH2 GLU 443.A OE1 no hydrogen 3.430 N/A LYS 458.A N GLY 554.A O no hydrogen 2.942 N/A ILE 460.A N ARG 457.A O no hydrogen 2.962 N/A LEU 461.A N ARG 457.A O no hydrogen 3.331 N/A GLY 462.A N LYS 458.A O no hydrogen 2.813 N/A TYR 463.A N LEU 459.A O no hydrogen 3.207 N/A LEU 464.A N ILE 460.A O no hydrogen 3.306 N/A ALA 465.A N GLY 462.A O no hydrogen 3.293 N/A ARG 472.A NH1 GLN 544.A OE1 no hydrogen 3.000 N/A ARG 472.A NH2 GLN 544.A OE1 no hydrogen 2.945 N/A TYR 473.A OH ASP 485.A OD1 no hydrogen 2.657 N/A LEU 475.A N ASN 536.A OD1 no hydrogen 3.055 N/A LYS 477.A N SER 474.A OG no hydrogen 3.226 N/A THR 478.A N SER 474.A O no hydrogen 2.926 N/A THR 478.A OG1 SER 474.A O no hydrogen 2.698 N/A LEU 479.A N LEU 475.A O no hydrogen 3.315 N/A ASN 480.A N LYS 476.A O no hydrogen 3.354 N/A SER 484.A OG ASP 483.A O no hydrogen 2.732 N/A PHE 488.A N ASP 485.A O no hydrogen 2.881 N/A TYR 491.A N MET 487.A O no hydrogen 3.041 N/A GLY 492.A N PHE 488.A O no hydrogen 2.913 N/A PHE 493.A N TYR 489.A O no hydrogen 3.098 N/A ALA 494.A N ASN 490.A O no hydrogen 3.338 N/A VAL 495.A N TYR 491.A O no hydrogen 2.968 N/A ALA 496.A N GLY 492.A O no hydrogen 3.149 N/A HIS 497.A N PHE 493.A O no hydrogen 2.842 N/A HIS 497.A NE2 GLU 501.A OE1 no hydrogen 3.250 N/A TYR 498.A N ALA 494.A O no hydrogen 2.924 N/A TYR 498.A OH GLU 538.A OE1 no hydrogen 2.444 N/A LEU 499.A N VAL 495.A O no hydrogen 2.774 N/A TYR 500.A N ALA 496.A O no hydrogen 3.067 N/A GLU 501.A N HIS 497.A O no hydrogen 2.799 N/A LYS 502.A N TYR 498.A O no hydrogen 2.770 N/A LYS 502.A NZ GLU 545.A OE1 no hydrogen 2.794 N/A ASP 503.A N LEU 499.A O no hydrogen 2.892 N/A THR 506.A N ASP 503.A OD1 no hydrogen 3.336 N/A THR 506.A OG1 ASP 503.A OD1 no hydrogen 2.904 N/A THR 506.A OG1 ASP 503.A OD2 no hydrogen 2.889 N/A PHE 507.A N ASP 503.A O no hydrogen 3.315 N/A ILE 508.A N MET 504.A O no hydrogen 2.795 N/A LYS 509.A N PRO 505.A O no hydrogen 3.021 N/A MET 510.A N THR 506.A O no hydrogen 2.893 N/A ASN 511.A N PHE 507.A O no hydrogen 3.293 N/A ASN 511.A ND2 PHE 507.A O no hydrogen 2.575 N/A LYS 512.A N ILE 508.A O no hydrogen 2.992 N/A ALA 513.A N LYS 509.A O no hydrogen 3.151 N/A ILE 514.A N MET 510.A O no hydrogen 3.119 N/A LEU 515.A N ASN 511.A O no hydrogen 2.787 N/A ASN 516.A N LYS 512.A O no hydrogen 2.776 N/A THR 517.A N ILE 514.A O no hydrogen 2.919 N/A ASP 518.A N ALA 513.A O no hydrogen 2.889 N/A SER 521.A OG ASP 518.A OD2 no hydrogen 2.669 N/A TYR 522.A N ASP 518.A O no hydrogen 3.198 N/A TYR 522.A OH ARG 433.A O no hydrogen 2.905 N/A ASP 523.A N VAL 519.A O no hydrogen 2.896 N/A GLU 524.A N LYS 520.A O no hydrogen 3.061 N/A ILE 525.A N SER 521.A O no hydrogen 3.102 N/A ILE 526.A N TYR 522.A O no hydrogen 2.977 N/A LYS 527.A N ASP 523.A O no hydrogen 2.778 N/A LYS 528.A N GLU 524.A O no hydrogen 2.902 N/A LEU 529.A N ILE 525.A O no hydrogen 2.952 N/A SER 530.A N ILE 526.A O no hydrogen 3.029 N/A SER 530.A OG ASN 480.A OD1 no hydrogen 3.335 N/A SER 530.A OG ILE 526.A O no hydrogen 3.201 N/A ASP 531.A N LYS 527.A O no hydrogen 2.767 N/A ASP 532.A N LYS 528.A O no hydrogen 3.098 N/A LYS 535.A N ASP 532.A OD1 no hydrogen 2.788 N/A LYS 535.A NZ ASP 503.A OD2 no hydrogen 3.351 N/A ASN 536.A N ALA 533.A O no hydrogen 3.242 N/A THR 537.A N ALA 533.A O no hydrogen 3.237 N/A THR 537.A OG1 ALA 533.A O no hydrogen 3.433 N/A THR 537.A OG1 ASN 534.A O no hydrogen 2.687 N/A GLU 538.A N ASN 534.A O no hydrogen 2.975 N/A TYR 539.A N LYS 535.A O no hydrogen 3.130 N/A TYR 539.A OH TYR 491.A O no hydrogen 2.947 N/A GLN 540.A N ASN 536.A O no hydrogen 2.612 N/A GLN 540.A NE2 TYR 473.A O no hydrogen 2.974 N/A GLN 540.A NE2 ASN 536.A OD1 no hydrogen 3.320 N/A ASN 541.A N THR 537.A O no hydrogen 3.068 N/A HIS 542.A N GLU 538.A O no hydrogen 3.246 N/A ILE 543.A N TYR 539.A O no hydrogen 3.050 N/A GLN 544.A N GLN 540.A O no hydrogen 3.485 N/A GLN 544.A NE2 ASP 548.A OD1 no hydrogen 3.432 N/A GLU 545.A N ASN 541.A O no hydrogen 2.841 N/A LEU 546.A N HIS 542.A O no hydrogen 2.805 N/A VAL 547.A N ILE 543.A O no hydrogen 2.878 N/A ASP 548.A N GLN 544.A O no hydrogen 2.855 N/A LYS 549.A N LEU 546.A O no hydrogen 2.911 N/A ALA 553.A N TYR 550.A O no hydrogen 2.982 N/A VAL 558.A N GLU 402.A OE2 no hydrogen 3.166 N/A TYR 562.A N SER 559.A O no hydrogen 3.071 N/A TYR 562.A OH GLU 328.A OE2 no hydrogen 2.439 N/A LEU 563.A N ASP 560.A O no hydrogen 3.206 N/A HIS 566.A ND1 SER 638.A OG no hydrogen 3.026 N/A LYS 569.A N THR 669.A OG1 no hydrogen 3.017 N/A LYS 569.A NZ GLU 573.A OE1 no hydrogen 3.002 N/A LYS 569.A NZ GLU 577.A OE2 no hydrogen 2.929 N/A ALA 571.A N ASP 670.A OD2 no hydrogen 2.752 N/A VAL 574.A N LYS 570.A O no hydrogen 3.456 N/A TYR 575.A N ALA 571.A O no hydrogen 3.355 N/A SER 576.A N SER 572.A O no hydrogen 3.284 N/A SER 576.A OG SER 572.A O no hydrogen 2.660 N/A GLU 577.A N GLU 573.A O no hydrogen 2.802 N/A ILE 578.A N VAL 574.A O no hydrogen 2.919 N/A SER 579.A N TYR 575.A O no hydrogen 2.665 N/A SER 579.A OG TYR 575.A O no hydrogen 2.958 N/A LYS 580.A N SER 576.A O no hydrogen 2.938 N/A ALA 581.A N GLU 577.A O no hydrogen 3.244 N/A ALA 582.A N ILE 578.A O no hydrogen 2.911 N/A SER 583.A N LYS 580.A O no hydrogen 3.080 N/A LEU 584.A N SER 579.A O no hydrogen 2.805 N/A THR 585.A N THR 605.A O no hydrogen 2.730 N/A SER 588.A N ARG 603.A O no hydrogen 2.996 N/A THR 590.A N THR 601.A O no hydrogen 3.176 N/A GLU 592.A N THR 599.A O no hydrogen 2.767 N/A LYS 593.A N ASN 303.A OD1 no hydrogen 2.806 N/A SER 594.A N PHE 597.A O no hydrogen 2.983 N/A TYR 596.A OH GLU 316.A OE1 no hydrogen 2.912 N/A THR 599.A N GLU 592.A O no hydrogen 2.988 N/A THR 599.A OG1 GLU 592.A O no hydrogen 3.380 N/A PHE 600.A N GLY 666.A O no hydrogen 2.965 N/A THR 601.A N THR 590.A O no hydrogen 2.865 N/A THR 601.A OG1 HIS 665.A ND1 no hydrogen 2.890 N/A LEU 602.A N PHE 664.A O no hydrogen 2.690 N/A ARG 603.A N SER 588.A O no hydrogen 2.800 N/A ARG 603.A NH1 ASP 340.A OD2 no hydrogen 2.903 N/A ARG 603.A NH2 ASP 340.A OD2 no hydrogen 3.304 N/A GLY 604.A N VAL 662.A O no hydrogen 2.873 N/A THR 605.A N THR 585.A O no hydrogen 2.981 N/A TYR 606.A N TYR 660.A O no hydrogen 3.047 N/A GLY 608.A N VAL 658.A O no hydrogen 3.029 N/A SER 611.A N ASN 656.A O no hydrogen 2.741 N/A SER 611.A OG ASP 617.A OD2 no hydrogen 2.533 N/A SER 611.A OG TYR 650.A OH no hydrogen 3.267 N/A LYS 612.A N ASP 617.A OD1 no hydrogen 2.825 N/A LYS 612.A NZ GLU 620.A OE1 no hydrogen 3.237 N/A LYS 612.A NZ GLU 620.A OE2 no hydrogen 3.228 N/A GLY 613.A N SER 611.A OG no hydrogen 3.192 N/A ASP 617.A N GLY 613.A O no hydrogen 2.704 N/A TRP 618.A N GLU 614.A O no hydrogen 2.980 N/A TRP 618.A NE1 ARG 335.A O no hydrogen 3.371 N/A ASP 619.A N PHE 615.A O no hydrogen 3.241 N/A GLU 620.A N LYS 616.A O no hydrogen 3.039 N/A MET 621.A N ASP 617.A O no hydrogen 2.694 N/A SER 622.A N TRP 618.A O no hydrogen 2.956 N/A LYS 623.A N ASP 619.A O no hydrogen 3.160 N/A LYS 623.A NZ ASP 619.A OD2 no hydrogen 3.122 N/A LYS 624.A N GLU 620.A O no hydrogen 2.812 N/A LYS 624.A NZ ALA 581.A O no hydrogen 3.379 N/A LEU 625.A N MET 621.A O no hydrogen 2.926 N/A ASP 626.A N SER 622.A O no hydrogen 2.888 N/A GLY 627.A N LYS 623.A O no hydrogen 3.045 N/A THR 628.A N LYS 624.A O no hydrogen 2.977 N/A THR 628.A OG1 ALA 581.A O no hydrogen 3.447 N/A THR 628.A OG1 LYS 624.A O no hydrogen 2.996 N/A LEU 629.A N LEU 625.A O no hydrogen 3.106 N/A GLU 630.A N ASP 626.A O no hydrogen 3.235 N/A SER 631.A N GLY 627.A O no hydrogen 3.072 N/A LEU 632.A N THR 628.A O no hydrogen 3.164 N/A ALA 633.A N LEU 629.A O no hydrogen 3.319 N/A LYS 634.A N SER 631.A O no hydrogen 3.055 N/A ASN 635.A N LEU 632.A O no hydrogen 3.197 N/A TRP 637.A NE1 GLY 567.A O no hydrogen 2.872 N/A SER 638.A OG HIS 566.A ND1 no hydrogen 3.026 N/A TYR 640.A N TRP 637.A O no hydrogen 3.227 N/A TYR 640.A OH GLU 577.A OE1 no hydrogen 2.686 N/A LYS 641.A N SER 638.A O no hydrogen 3.109 N/A THR 642.A N GLY 639.A O no hydrogen 2.938 N/A THR 642.A OG1 GLY 639.A O no hydrogen 2.751 N/A LEU 643.A N TYR 640.A O no hydrogen 3.467 N/A THR 644.A N HIS 665.A O no hydrogen 2.711 N/A THR 644.A OG1 HIS 665.A O no hydrogen 3.360 N/A TYR 646.A N VAL 663.A O no hydrogen 2.880 N/A TYR 646.A OH ASP 340.A OD2 no hydrogen 3.057 N/A THR 648.A N ASP 661.A O no hydrogen 2.772 N/A THR 648.A OG1 ASP 340.A OD1 no hydrogen 3.567 N/A ASN 649.A N GLY 338.A O no hydrogen 3.151 N/A ASN 649.A ND2 ASP 661.A OD2 no hydrogen 3.248 N/A TYR 650.A OH SER 611.A OG no hydrogen 3.267 N/A TYR 650.A OH ASP 617.A OD2 no hydrogen 2.727 N/A ARG 651.A N GLN 659.A O no hydrogen 3.142 N/A ARG 651.A NE GLN 659.A OE1 no hydrogen 3.137 N/A ARG 651.A NH1 ASN 649.A O no hydrogen 3.140 N/A THR 653.A N LYS 657.A O no hydrogen 2.991 N/A ASP 655.A N THR 653.A OG1 no hydrogen 3.237 N/A ASN 656.A N THR 653.A O no hydrogen 2.620 N/A LYS 657.A N THR 653.A OG1 no hydrogen 3.120 N/A VAL 658.A N GLU 609.A O no hydrogen 3.063 N/A GLN 659.A N ARG 651.A O no hydrogen 3.061 N/A GLN 659.A NE2 THR 607.A OG1 no hydrogen 3.138 N/A TYR 660.A N TYR 606.A O no hydrogen 3.159 N/A ASP 661.A N THR 648.A O no hydrogen 2.948 N/A VAL 662.A N GLY 604.A O no hydrogen 2.737 N/A VAL 663.A N TYR 646.A O no hydrogen 2.810 N/A PHE 664.A N LEU 602.A O no hydrogen 2.863 N/A HIS 665.A N THR 644.A O no hydrogen 2.772 N/A HIS 665.A ND1 THR 601.A OG1 no hydrogen 2.890 N/A HIS 665.A NE2 TYR 323.A OH no hydrogen 3.043 N/A GLY 666.A N PHE 600.A O no hydrogen 3.256 N/A VAL 667.A N THR 642.A OG1 no hydrogen 2.845 N/A LEU 668.A N ASN 598.A O no hydrogen 2.847 N/A THR 669.A OG1 GLY 567.A O no hydrogen 2.964 N/A