Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5dgy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 5.A N ASN 1.A O no hydrogen 2.875 N/A LEU 6.A N ILE 2.A O no hydrogen 3.097 N/A ARG 7.A N PHE 3.A O no hydrogen 3.076 N/A ARG 7.A NH1 SER 441.A OG no hydrogen 2.836 N/A ILE 8.A N GLU 4.A O no hydrogen 3.142 N/A ASP 9.A N MET 5.A O no hydrogen 3.025 N/A GLU 10.A N LEU 6.A O no hydrogen 2.858 N/A ARG 13.A N GLY 27.A O no hydrogen 3.436 N/A TYR 17.A N THR 25.A O no hydrogen 3.348 N/A ASP 19.A N TYR 23.A O no hydrogen 3.466 N/A GLY 22.A N ASP 19.A O no hydrogen 2.927 N/A GLY 22.A N ASP 19.A OD1 no hydrogen 3.121 N/A TYR 23.A N ASP 19.A OD1 no hydrogen 2.797 N/A TYR 24.A OH PRO 36.A O no hydrogen 2.864 N/A THR 25.A N TYR 17.A O no hydrogen 3.155 N/A THR 25.A OG1 TYR 23.A O no hydrogen 3.177 N/A ILE 26.A N HIS 30.A O no hydrogen 2.430 N/A GLY 27.A N ARG 13.A O no hydrogen 3.102 N/A HIS 30.A ND1 ASP 69.A OD1 no hydrogen 2.702 N/A HIS 30.A ND1 ASP 69.A OD2 no hydrogen 3.211 N/A LEU 32.A N TYR 24.A O no hydrogen 2.882 N/A THR 33.A N TYR 24.A O no hydrogen 3.483 N/A SER 35.A N THR 33.A OG1 no hydrogen 3.288 N/A LYS 42.A N LEU 38.A O no hydrogen 2.995 N/A SER 43.A N ASN 39.A O no hydrogen 2.825 N/A GLU 44.A N ALA 40.A O no hydrogen 3.318 N/A LEU 45.A N ALA 41.A O no hydrogen 3.010 N/A ASP 46.A N LYS 42.A O no hydrogen 2.727 N/A LYS 47.A N SER 43.A O no hydrogen 3.163 N/A LYS 47.A NZ GLU 44.A OE1 no hydrogen 3.380 N/A ALA 48.A N GLU 44.A O no hydrogen 2.986 N/A ILE 49.A N LEU 45.A O no hydrogen 2.809 N/A GLY 50.A N ASP 46.A O no hydrogen 2.793 N/A ARG 51.A NE GLU 61.A OE2 no hydrogen 3.018 N/A ARG 51.A NH2 GLU 61.A OE2 no hydrogen 3.321 N/A THR 53.A OG1 ASP 46.A OD1 no hydrogen 2.635 N/A VAL 56.A N THR 53.A O no hydrogen 3.094 N/A THR 58.A N GLU 61.A OE1 no hydrogen 3.341 N/A GLU 61.A N THR 58.A OG1 no hydrogen 3.040 N/A ALA 62.A N THR 58.A O no hydrogen 3.022 N/A GLU 63.A N LYS 59.A O no hydrogen 3.018 N/A LYS 64.A N ASP 60.A O no hydrogen 3.062 N/A LEU 65.A N GLU 61.A O no hydrogen 2.946 N/A PHE 66.A N ALA 62.A O no hydrogen 2.941 N/A ASN 67.A N GLU 63.A O no hydrogen 2.880 N/A GLN 68.A N LYS 64.A O no hydrogen 2.985 N/A ASP 69.A N LEU 65.A O no hydrogen 3.144 N/A VAL 70.A N PHE 66.A O no hydrogen 2.804 N/A ASP 71.A N ASN 67.A O no hydrogen 2.954 N/A ALA 72.A N GLN 68.A O no hydrogen 2.844 N/A ALA 73.A N ASP 69.A O no hydrogen 2.783 N/A VAL 74.A N VAL 70.A O no hydrogen 2.976 N/A ARG 75.A N ASP 71.A O no hydrogen 3.097 N/A GLY 76.A N ALA 72.A O no hydrogen 3.037 N/A ILE 77.A N ALA 73.A O no hydrogen 2.852 N/A LEU 78.A N VAL 74.A O no hydrogen 3.072 N/A ARG 79.A N ARG 75.A O no hydrogen 3.002 N/A ASN 80.A N GLY 76.A O no hydrogen 3.303 N/A ASN 80.A ND2 GLU 107.A OE2 no hydrogen 2.791 N/A LYS 82.A N ASN 80.A OD1 no hydrogen 2.742 N/A LEU 83.A N ASN 80.A OD1 no hydrogen 3.354 N/A LYS 84.A N ASN 80.A O no hydrogen 3.220 N/A LYS 84.A NZ ASP 88.A OD2 no hydrogen 3.154 N/A TYR 87.A N LEU 83.A O no hydrogen 2.921 N/A ASP 88.A N LYS 84.A O no hydrogen 2.947 N/A SER 89.A N PRO 85.A O no hydrogen 3.032 N/A LEU 90.A N VAL 86.A O no hydrogen 3.109 N/A ARG 94.A N ASP 91.A OD2 no hydrogen 3.432 N/A ARG 94.A NE PHE 152.A O no hydrogen 2.848 N/A ARG 94.A NH1 ASP 91.A OD2 no hydrogen 3.556 N/A ARG 94.A NH2 PHE 152.A O no hydrogen 3.203 N/A ARG 94.A NH2 ARG 153.A O no hydrogen 3.257 N/A ARG 95.A N ASP 91.A O no hydrogen 2.868 N/A ARG 95.A NE TYR 87.A O no hydrogen 2.674 N/A ARG 95.A NH2 ASP 88.A O no hydrogen 3.165 N/A ALA 96.A N ALA 92.A O no hydrogen 3.139 N/A ALA 97.A N VAL 93.A O no hydrogen 3.094 N/A LEU 98.A N ARG 94.A O no hydrogen 3.039 N/A ILE 99.A N ARG 95.A O no hydrogen 2.942 N/A ASN 100.A N ALA 96.A O no hydrogen 3.063 N/A ASN 100.A ND2 ASP 9.A OD2 no hydrogen 2.827 N/A MET 101.A N ALA 97.A O no hydrogen 3.280 N/A VAL 102.A N LEU 98.A O no hydrogen 2.892 N/A PHE 103.A N ILE 99.A O no hydrogen 2.749 N/A GLN 104.A N ASN 100.A O no hydrogen 3.384 N/A MET 105.A N MET 101.A O no hydrogen 3.324 N/A VAL 110.A N GLY 106.A O no hydrogen 3.349 N/A ALA 111.A N GLU 107.A O no hydrogen 2.883 N/A PHE 113.A N VAL 110.A O no hydrogen 3.219 N/A THR 114.A OG1 GLY 112.A O no hydrogen 3.524 N/A ARG 118.A N THR 114.A O no hydrogen 3.099 N/A MET 119.A N ASN 115.A O no hydrogen 3.048 N/A LEU 120.A N SER 116.A O no hydrogen 2.768 N/A GLN 121.A N LEU 117.A O no hydrogen 3.064 N/A GLN 122.A N ARG 118.A O no hydrogen 2.963 N/A LYS 123.A N LEU 120.A O no hydrogen 3.346 N/A ARG 124.A N MET 119.A O no hydrogen 2.680 N/A ALA 129.A N TRP 125.A O no hydrogen 3.166 N/A VAL 130.A N ASP 126.A O no hydrogen 2.950 N/A ASN 131.A N GLU 127.A O no hydrogen 2.933 N/A LEU 132.A N ALA 128.A O no hydrogen 2.845 N/A ALA 133.A N ALA 129.A O no hydrogen 2.896 N/A LYS 134.A N VAL 130.A O no hydrogen 3.171 N/A SER 135.A N LEU 132.A O no hydrogen 3.389 N/A SER 135.A OG LEU 132.A O no hydrogen 2.609 N/A ARG 136.A NH1 ASN 139.A OD1 no hydrogen 2.649 N/A GLN 140.A N ARG 136.A O no hydrogen 2.714 N/A THR 141.A N TRP 137.A O no hydrogen 3.129 N/A ARG 144.A NE ASN 100.A OD1 no hydrogen 3.211 N/A ARG 144.A NH1 GLU 10.A OE1 no hydrogen 2.730 N/A ARG 144.A NH2 ASN 100.A OD1 no hydrogen 2.723 N/A ALA 145.A N THR 141.A O no hydrogen 2.765 N/A LYS 146.A N PRO 142.A O no hydrogen 3.084 N/A ARG 147.A NE ASP 9.A OD1 no hydrogen 3.093 N/A ARG 147.A NH2 ASP 9.A OD1 no hydrogen 3.236 N/A VAL 148.A N ARG 144.A O no hydrogen 3.242 N/A ILE 149.A N ALA 145.A O no hydrogen 2.818 N/A THR 150.A N LYS 146.A O no hydrogen 3.203 N/A THR 150.A OG1 LYS 146.A O no hydrogen 2.727 N/A THR 151.A N ARG 147.A O no hydrogen 3.203 N/A THR 151.A OG1 ARG 147.A O no hydrogen 2.695 N/A PHE 152.A N VAL 148.A O no hydrogen 3.084 N/A ARG 153.A N ILE 149.A O no hydrogen 3.262 N/A THR 154.A N THR 150.A O no hydrogen 3.019 N/A THR 154.A OG1 THR 150.A O no hydrogen 2.941 N/A THR 154.A OG1 THR 156.A O no hydrogen 3.464 N/A THR 154.A OG1 THR 156.A OG1 no hydrogen 3.424 N/A GLY 155.A N THR 151.A O no hydrogen 2.918 N/A THR 156.A N THR 154.A OG1 no hydrogen 3.292 N/A THR 156.A OG1 THR 154.A OG1 no hydrogen 3.424 N/A TYR 160.A OH ASP 9.A OD2 no hydrogen 2.766 N/A THR 164.A N VAL 171.A O no hydrogen 2.784 N/A THR 164.A OG1 PHE 173.A O no hydrogen 2.617 N/A VAL 171.A N THR 164.A O no hydrogen 3.175 N/A ALA 176.A N SER 174.A OG no hydrogen 3.302 N/A VAL 180.A N ASN 175.A OD1 no hydrogen 3.190 N/A PHE 184.A N SER 182.A OG no hydrogen 3.339 N/A GLU 185.A N SER 182.A O no hydrogen 3.222 N/A TYR 186.A N SER 182.A O no hydrogen 2.982 N/A GLN 188.A N GLY 261.A O no hydrogen 3.262 N/A GLN 188.A NE2 ARG 181.A O no hydrogen 3.334 N/A GLN 188.A NE2 TYR 186.A O no hydrogen 3.077 N/A TYR 190.A OH ARG 181.A O no hydrogen 3.239 N/A LEU 191.A N GLN 188.A O no hydrogen 3.344 N/A GLN 196.A N GLU 193.A O no hydrogen 3.072 N/A PHE 197.A N PRO 194.A O no hydrogen 3.139 N/A SER 198.A N PRO 194.A O no hydrogen 3.319 N/A MET 199.A N TRP 195.A O no hydrogen 2.917 N/A LEU 200.A N GLN 196.A O no hydrogen 3.051 N/A ALA 201.A N PHE 197.A O no hydrogen 3.019 N/A ALA 202.A N SER 198.A O no hydrogen 2.899 N/A TYR 203.A N MET 199.A O no hydrogen 2.814 N/A TYR 203.A OH SER 457.A OG no hydrogen 2.695 N/A MET 204.A N LEU 200.A O no hydrogen 2.934 N/A PHE 205.A N ALA 201.A O no hydrogen 3.029 N/A LEU 206.A N ALA 202.A O no hydrogen 3.084 N/A LEU 207.A N TYR 203.A O no hydrogen 3.067 N/A ILE 208.A N MET 204.A O no hydrogen 3.106 N/A VAL 209.A N PHE 205.A O no hydrogen 3.029 N/A LEU 210.A N LEU 206.A O no hydrogen 3.041 N/A GLY 211.A N LEU 207.A O no hydrogen 2.770 N/A PHE 212.A N ILE 208.A O no hydrogen 3.166 N/A ASN 215.A N GLY 211.A O no hydrogen 3.376 N/A ASN 215.A ND2 GLY 211.A O no hydrogen 2.770 N/A PHE 216.A N PHE 212.A O no hydrogen 2.933 N/A LEU 217.A N PRO 213.A O no hydrogen 2.803 N/A THR 218.A N ILE 214.A O no hydrogen 3.057 N/A THR 218.A OG1 ILE 214.A O no hydrogen 2.646 N/A LEU 219.A N ASN 215.A O no hydrogen 3.281 N/A TYR 220.A N PHE 216.A O no hydrogen 2.830 N/A VAL 221.A N LEU 217.A O no hydrogen 2.786 N/A THR 222.A N THR 218.A O no hydrogen 3.225 N/A THR 222.A OG1 THR 218.A O no hydrogen 2.616 N/A VAL 223.A N LEU 219.A O no hydrogen 3.011 N/A GLN 224.A N TYR 220.A O no hydrogen 3.217 N/A HIS 225.A N VAL 221.A O no hydrogen 2.981 N/A THR 230.A OG1 LEU 228.A O no hydrogen 3.251 N/A ASN 233.A N THR 230.A O no hydrogen 2.753 N/A ASN 233.A ND2 LEU 228.A O no hydrogen 2.820 N/A TYR 234.A N THR 230.A O no hydrogen 3.232 N/A TYR 234.A N PRO 231.A O no hydrogen 3.030 N/A LEU 237.A N ASN 233.A O no hydrogen 2.779 N/A ASN 238.A N TYR 234.A O no hydrogen 2.990 N/A LEU 239.A N ILE 235.A O no hydrogen 3.114 N/A ALA 240.A N LEU 236.A O no hydrogen 3.254 N/A VAL 241.A N LEU 237.A O no hydrogen 3.072 N/A ALA 242.A N ASN 238.A O no hydrogen 2.969 N/A ASP 243.A N LEU 239.A O no hydrogen 3.070 N/A LEU 244.A N ALA 240.A O no hydrogen 3.097 N/A PHE 245.A N VAL 241.A O no hydrogen 3.160 N/A MET 246.A N ALA 242.A O no hydrogen 3.292 N/A VAL 247.A N ASP 243.A O no hydrogen 3.164 N/A LEU 248.A N LEU 244.A O no hydrogen 2.995 N/A GLY 249.A N PHE 245.A O no hydrogen 2.932 N/A GLY 250.A N MET 246.A O no hydrogen 3.157 N/A PHE 251.A N MET 246.A O no hydrogen 2.948 N/A THR 252.A N VAL 247.A O no hydrogen 3.174 N/A THR 252.A OG1 VAL 247.A O no hydrogen 3.383 N/A THR 254.A N GLY 250.A O no hydrogen 3.056 N/A THR 254.A OG1 GLY 250.A O no hydrogen 2.649 N/A LEU 255.A N PHE 251.A O no hydrogen 2.787 N/A TYR 256.A N THR 252.A O no hydrogen 3.170 N/A THR 257.A N SER 253.A O no hydrogen 3.122 N/A THR 257.A OG1 SER 253.A O no hydrogen 3.240 N/A THR 257.A OG1 THR 254.A O no hydrogen 2.906 N/A THR 257.A OG1 CYS 345.A O no hydrogen 3.505 N/A SER 258.A N THR 254.A O no hydrogen 2.927 N/A SER 258.A OG THR 254.A O no hydrogen 3.014 N/A SER 258.A OG LEU 255.A O no hydrogen 2.704 N/A LEU 259.A N LEU 255.A O no hydrogen 3.140 N/A HIS 260.A N TYR 256.A O no hydrogen 3.477 N/A HIS 260.A ND1 TYR 256.A O no hydrogen 2.969 N/A GLY 261.A N THR 257.A O no hydrogen 2.743 N/A CYS 270.A N GLY 266.A O no hydrogen 2.959 N/A CYS 270.A SG TYR 338.A O no hydrogen 3.901 N/A ASN 271.A N PRO 267.A O no hydrogen 3.028 N/A LEU 272.A N THR 268.A O no hydrogen 3.184 N/A GLN 273.A N GLY 269.A O no hydrogen 2.938 N/A GLN 273.A NE2 GLY 250.A O no hydrogen 3.130 N/A GLY 274.A N CYS 270.A O no hydrogen 2.999 N/A PHE 275.A N ASN 271.A O no hydrogen 2.938 N/A PHE 276.A N LEU 272.A O no hydrogen 3.098 N/A ALA 277.A N GLN 273.A O no hydrogen 2.928 N/A THR 278.A N GLY 274.A O no hydrogen 3.026 N/A THR 278.A OG1 GLY 274.A O no hydrogen 2.714 N/A THR 278.A OG1 TYR 338.A OH no hydrogen 3.361 N/A LEU 279.A N PHE 275.A O no hydrogen 2.842 N/A GLY 280.A N PHE 276.A O no hydrogen 2.830 N/A GLY 281.A N ALA 277.A O no hydrogen 3.128 N/A GLU 282.A N THR 278.A O no hydrogen 2.784 N/A ILE 283.A N LEU 279.A O no hydrogen 2.932 N/A ALA 284.A N GLY 280.A O no hydrogen 3.193 N/A LEU 285.A N GLY 281.A O no hydrogen 2.983 N/A TRP 286.A N GLU 282.A O no hydrogen 2.962 N/A SER 287.A N ILE 283.A O no hydrogen 2.931 N/A SER 287.A OG ILE 283.A O no hydrogen 2.652 N/A LEU 288.A N ALA 284.A O no hydrogen 3.275 N/A VAL 289.A N LEU 285.A O no hydrogen 3.126 N/A VAL 290.A N TRP 286.A O no hydrogen 2.969 N/A LEU 291.A N SER 287.A O no hydrogen 2.860 N/A ALA 292.A N LEU 288.A O no hydrogen 2.979 N/A ILE 293.A N VAL 289.A O no hydrogen 2.988 N/A GLU 294.A N VAL 290.A O no hydrogen 2.806 N/A ARG 295.A N LEU 291.A O no hydrogen 2.947 N/A ARG 295.A NH1 TYR 417.A OH no hydrogen 3.143 N/A TYR 296.A N ALA 292.A O no hydrogen 3.079 N/A VAL 297.A N ILE 293.A O no hydrogen 3.032 N/A VAL 298.A N GLU 294.A O no hydrogen 2.865 N/A VAL 299.A N ARG 295.A O no hydrogen 3.298 N/A CYS 300.A N TYR 296.A O no hydrogen 3.150 N/A CYS 300.A SG TYR 296.A O no hydrogen 3.249 N/A LYS 301.A N VAL 297.A O no hydrogen 3.254 N/A SER 304.A N LYS 301.A O no hydrogen 3.420 N/A SER 304.A OG VAL 297.A O no hydrogen 2.712 N/A SER 304.A OG LYS 301.A O no hydrogen 2.611 N/A ASN 305.A N PRO 302.A O no hydrogen 3.306 N/A ASN 305.A ND2 VAL 298.A O no hydrogen 3.197 N/A ASN 305.A ND2 PRO 302.A O no hydrogen 3.052 N/A PHE 306.A N MET 303.A O no hydrogen 3.198 N/A PHE 308.A N SER 304.A O no hydrogen 3.006 N/A GLY 309.A N ARG 307.A O no hydrogen 2.837 N/A ALA 313.A N GLY 309.A O no hydrogen 3.471 N/A ILE 314.A N GLU 310.A O no hydrogen 2.845 N/A MET 315.A N ASN 311.A O no hydrogen 3.049 N/A GLY 316.A N HIS 312.A O no hydrogen 3.062 N/A VAL 317.A N ALA 313.A O no hydrogen 3.016 N/A ALA 318.A N ILE 314.A O no hydrogen 2.762 N/A PHE 319.A N MET 315.A O no hydrogen 2.858 N/A THR 320.A N GLY 316.A O no hydrogen 3.040 N/A THR 320.A OG1 GLY 316.A O no hydrogen 2.683 N/A TRP 321.A N VAL 317.A O no hydrogen 3.050 N/A TRP 321.A NE1 ASN 238.A OD1 no hydrogen 2.842 N/A VAL 322.A N ALA 318.A O no hydrogen 2.838 N/A MET 323.A N PHE 319.A O no hydrogen 2.951 N/A ALA 324.A N THR 320.A O no hydrogen 3.058 N/A LEU 325.A N TRP 321.A O no hydrogen 2.906 N/A ALA 326.A N VAL 322.A O no hydrogen 2.786 N/A CYS 327.A N MET 323.A O no hydrogen 3.358 N/A CYS 327.A N ALA 324.A O no hydrogen 3.296 N/A CYS 327.A SG MET 323.A O no hydrogen 3.263 N/A CYS 327.A SG ALA 324.A O no hydrogen 3.243 N/A CYS 327.A SG HIS 371.A NE2 no hydrogen 2.960 N/A ALA 328.A N ALA 324.A O no hydrogen 2.845 N/A ALA 329.A N LEU 325.A O no hydrogen 3.067 N/A LEU 332.A N ALA 329.A O no hydrogen 2.950 N/A ALA 333.A N ALA 329.A O no hydrogen 3.270 N/A TRP 335.A NE1 SER 362.A OG no hydrogen 2.896 N/A SER 336.A N VAL 358.A O no hydrogen 2.777 N/A ARG 337.A NE ASP 350.A OD2 no hydrogen 2.858 N/A ARG 337.A NH2 ASP 350.A OD2 no hydrogen 3.148 N/A TYR 338.A OH THR 278.A OG1 no hydrogen 3.361 N/A TYR 338.A OH ALA 328.A O no hydrogen 2.893 N/A ILE 339.A N GLY 348.A O no hydrogen 3.026 N/A GLU 341.A N SER 346.A O no hydrogen 2.797 N/A GLN 344.A N GLU 341.A O no hydrogen 3.254 N/A GLN 344.A NE2 TYR 170.A O no hydrogen 3.018 N/A GLN 344.A NE2 GLY 342.A O no hydrogen 3.285 N/A CYS 345.A SG LEU 343.A O no hydrogen 3.723 N/A CYS 347.A N GLN 273.A OE1 no hydrogen 3.129 N/A GLY 348.A N ILE 339.A O no hydrogen 2.953 N/A ASP 350.A N ARG 337.A O no hydrogen 3.202 N/A TYR 352.A OH PRO 340.A O no hydrogen 3.424 N/A THR 353.A N ASP 350.A OD1 no hydrogen 3.166 N/A GLU 357.A N GLU 357.A OE1 no hydrogen 2.629 N/A VAL 358.A N LYS 355.A O no hydrogen 3.303 N/A ASN 359.A N LYS 355.A O no hydrogen 3.006 N/A ASN 360.A ND2 THR 353.A O no hydrogen 2.596 N/A SER 362.A OG ASN 359.A O no hydrogen 3.308 N/A VAL 364.A N ASN 360.A O no hydrogen 2.826 N/A ILE 365.A N GLU 361.A O no hydrogen 3.074 N/A TYR 366.A N SER 362.A O no hydrogen 2.861 N/A MET 367.A N PHE 363.A O no hydrogen 2.754 N/A PHE 368.A N VAL 364.A O no hydrogen 2.888 N/A VAL 369.A N ILE 365.A O no hydrogen 2.925 N/A VAL 370.A N TYR 366.A O no hydrogen 3.036 N/A HIS 371.A N MET 367.A O no hydrogen 2.747 N/A PHE 372.A N PHE 368.A O no hydrogen 3.057 N/A THR 373.A N VAL 369.A O no hydrogen 3.141 N/A THR 373.A OG1 VAL 369.A O no hydrogen 2.680 N/A ILE 374.A N VAL 370.A O no hydrogen 3.004 N/A MET 376.A N PHE 372.A O no hydrogen 3.097 N/A ILE 377.A N THR 373.A O no hydrogen 2.746 N/A ILE 378.A N ILE 374.A O no hydrogen 2.880 N/A ILE 379.A N PRO 375.A O no hydrogen 2.722 N/A PHE 380.A N MET 376.A O no hydrogen 3.114 N/A PHE 381.A N ILE 377.A O no hydrogen 2.976 N/A CYS 382.A N ILE 378.A O no hydrogen 2.723 N/A CYS 382.A SG ILE 378.A O no hydrogen 3.048 N/A TYR 383.A N ILE 379.A O no hydrogen 2.941 N/A GLY 384.A N PHE 380.A O no hydrogen 2.904 N/A GLN 385.A N PHE 381.A O no hydrogen 2.899 N/A LEU 386.A N CYS 382.A O no hydrogen 2.911 N/A VAL 387.A N TYR 383.A O no hydrogen 3.013 N/A PHE 388.A N GLY 384.A O no hydrogen 2.945 N/A THR 389.A N GLN 385.A O no hydrogen 2.893 N/A THR 389.A OG1 GLN 385.A O no hydrogen 2.610 N/A VAL 390.A N LEU 386.A O no hydrogen 2.909 N/A LYS 391.A N VAL 387.A O no hydrogen 2.820 N/A LYS 391.A NZ GLU 407.A OE2 no hydrogen 2.861 N/A GLU 392.A N PHE 388.A O no hydrogen 3.145 N/A ALA 393.A N THR 389.A O no hydrogen 2.916 N/A ALA 394.A N VAL 390.A O no hydrogen 2.740 N/A ALA 395.A N LYS 391.A O no hydrogen 3.035 N/A GLN 396.A N GLU 392.A O no hydrogen 3.053 N/A GLN 396.A N ALA 393.A O no hydrogen 3.240 N/A GLN 397.A NE2 ASP 558.A O no hydrogen 3.634 N/A GLN 397.A NE2 LEU 559.A O no hydrogen 3.478 N/A SER 400.A OG THR 403.A OG1 no hydrogen 3.245 N/A THR 403.A OG1 GLN 397.A OE1 no hydrogen 3.539 N/A THR 403.A OG1 SER 400.A OG no hydrogen 3.245 N/A GLN 404.A NE2 ALA 394.A O no hydrogen 3.008 N/A GLN 404.A NE2 GLN 397.A O no hydrogen 3.679 N/A LYS 405.A N ALA 401.A O no hydrogen 3.173 N/A LYS 405.A NZ ASP 638.A OD2 no hydrogen 3.144 N/A ALA 406.A N THR 402.A O no hydrogen 3.188 N/A GLU 407.A N THR 403.A O no hydrogen 2.857 N/A LYS 408.A N GLN 404.A O no hydrogen 3.018 N/A GLU 409.A N LYS 405.A O no hydrogen 3.044 N/A VAL 410.A N ALA 406.A O no hydrogen 2.786 N/A THR 411.A N GLU 407.A O no hydrogen 3.044 N/A THR 411.A OG1 GLU 407.A O no hydrogen 2.715 N/A THR 411.A OG1 GLU 407.A OE2 no hydrogen 3.049 N/A ARG 412.A N LYS 408.A O no hydrogen 3.037 N/A ARG 412.A NH2 GLU 409.A OE2 no hydrogen 2.774 N/A MET 413.A N GLU 409.A O no hydrogen 3.161 N/A VAL 414.A N VAL 410.A O no hydrogen 2.915 N/A ILE 415.A N THR 411.A O no hydrogen 3.116 N/A ILE 416.A N ARG 412.A O no hydrogen 3.238 N/A TYR 417.A N MET 413.A O no hydrogen 2.778 N/A VAL 418.A N VAL 414.A O no hydrogen 3.078 N/A ILE 419.A N ILE 415.A O no hydrogen 3.052 N/A ALA 420.A N ILE 416.A O no hydrogen 2.928 N/A PHE 421.A N TYR 417.A O no hydrogen 3.089 N/A LEU 422.A N VAL 418.A O no hydrogen 2.948 N/A ILE 423.A N ILE 419.A O no hydrogen 2.998 N/A CYS 424.A N ALA 420.A O no hydrogen 3.145 N/A TRP 425.A N PHE 421.A O no hydrogen 3.130 N/A VAL 426.A N LEU 422.A O no hydrogen 2.949 N/A TYR 428.A OH GLU 341.A OE2 no hydrogen 3.292 N/A ALA 429.A N TRP 425.A O no hydrogen 3.142 N/A SER 430.A N VAL 426.A O no hydrogen 2.769 N/A SER 430.A OG VAL 426.A O no hydrogen 2.733 N/A SER 430.A OG PRO 427.A O no hydrogen 3.026 N/A VAL 431.A N PRO 427.A O no hydrogen 3.094 N/A ALA 432.A N TYR 428.A O no hydrogen 2.943 N/A PHE 433.A N ALA 429.A O no hydrogen 2.941 N/A TYR 434.A N SER 430.A O no hydrogen 2.886 N/A ILE 435.A N VAL 431.A O no hydrogen 2.842 N/A PHE 436.A N ALA 432.A O no hydrogen 3.072 N/A THR 437.A N PHE 433.A O no hydrogen 2.993 N/A THR 437.A OG1 PHE 433.A O no hydrogen 3.124 N/A THR 437.A OG1 TYR 434.A O no hydrogen 3.009 N/A THR 437.A OG1 HIS 438.A ND1 no hydrogen 3.168 N/A HIS 438.A N TYR 434.A O no hydrogen 2.928 N/A HIS 438.A ND1 THR 437.A OG1 no hydrogen 3.168 N/A GLN 439.A NE2 TYR 352.A O no hydrogen 3.362 N/A THR 449.A N PRO 445.A O no hydrogen 3.191 N/A THR 449.A N ILE 446.A O no hydrogen 3.110 N/A THR 449.A OG1 PRO 445.A O no hydrogen 2.641 N/A ILE 450.A N ILE 446.A O no hydrogen 3.289 N/A PHE 453.A N THR 449.A O no hydrogen 2.892 N/A PHE 454.A N ILE 450.A O no hydrogen 3.385 N/A ALA 455.A N PRO 451.A O no hydrogen 3.022 N/A LYS 456.A N ALA 452.A O no hydrogen 3.134 N/A SER 457.A N PHE 453.A O no hydrogen 2.978 N/A SER 457.A OG TYR 203.A OH no hydrogen 2.695 N/A SER 457.A OG PHE 453.A O no hydrogen 2.631 N/A ALA 458.A N PHE 454.A O no hydrogen 3.076 N/A ALA 459.A N LYS 456.A O no hydrogen 3.160 N/A ILE 460.A N SER 457.A O no hydrogen 2.810 N/A TYR 461.A N SER 457.A O no hydrogen 2.990 N/A TYR 461.A OH ALA 420.A O no hydrogen 3.393 N/A ASN 462.A N ALA 458.A O no hydrogen 2.987 N/A ILE 465.A N TYR 461.A O no hydrogen 3.318 N/A TYR 466.A N ASN 462.A O no hydrogen 2.838 N/A ILE 467.A N PRO 463.A O no hydrogen 3.002 N/A MET 468.A N PRO 463.A O no hydrogen 2.784 N/A MET 469.A N VAL 464.A O no hydrogen 2.735 N/A ASN 470.A N ILE 467.A O no hydrogen 3.255 N/A ASN 470.A ND2 TYR 466.A O no hydrogen 3.629 N/A GLN 472.A NE2 LYS 227.A O no hydrogen 3.376 N/A ARG 474.A N ASN 470.A O no hydrogen 2.900 N/A ASN 475.A N LYS 471.A O no hydrogen 3.271 N/A CYS 476.A N GLN 472.A O no hydrogen 2.844 N/A CYS 476.A SG GLN 472.A O no hydrogen 3.250 N/A MET 477.A N PHE 473.A O no hydrogen 2.886 N/A LEU 478.A N ARG 474.A O no hydrogen 3.036 N/A THR 479.A N ASN 475.A O no hydrogen 3.312 N/A THR 479.A OG1 ASN 475.A O no hydrogen 3.032 N/A THR 480.A N CYS 476.A O no hydrogen 3.215 N/A THR 480.A OG1 CYS 476.A O no hydrogen 3.342 N/A ILE 481.A N MET 477.A O no hydrogen 2.796 N/A CYS 482.A N LEU 478.A O no hydrogen 3.305 N/A CYS 482.A SG LEU 478.A O no hydrogen 3.349 N/A CYS 483.A N THR 480.A O no hydrogen 3.255 N/A GLY 484.A N THR 479.A O no hydrogen 2.720 N/A PHE 489.A N LEU 502.A O no hydrogen 3.219 N/A LYS 491.A N ILE 500.A O no hydrogen 3.000 N/A LYS 491.A NZ ARG 647.A O no hydrogen 2.842 N/A SER 493.A N VAL 498.A O no hydrogen 3.149 N/A SER 493.A OG ASP 495.A OD1 no hydrogen 2.745 N/A SER 493.A OG LYS 643.A O no hydrogen 2.746 N/A SER 493.A OG SER 644.A O no hydrogen 2.900 N/A SER 493.A OG SER 645.A O no hydrogen 3.387 N/A ASP 495.A N LYS 643.A O no hydrogen 3.427 N/A THR 499.A N LEU 522.A O no hydrogen 2.947 N/A ILE 500.A N LYS 491.A O no hydrogen 3.054 N/A TYR 501.A N VAL 520.A O no hydrogen 2.833 N/A LEU 502.A N PHE 489.A O no hydrogen 3.048 N/A LYS 504.A NZ GLU 515.A OE1 no hydrogen 3.162 N/A TYR 507.A N ARG 651.A O no hydrogen 3.041 N/A TYR 507.A OH ASP 518.A OD1 no hydrogen 3.320 N/A ASP 509.A N VAL 653.A O no hydrogen 2.628 N/A GLU 515.A N VAL 508.A O no hydrogen 3.081 N/A VAL 517.A N LEU 596.A O no hydrogen 2.791 N/A GLY 519.A N PHE 594.A O no hydrogen 3.330 N/A VAL 520.A N TYR 501.A O no hydrogen 3.222 N/A VAL 521.A N TYR 592.A O no hydrogen 2.904 N/A LEU 522.A N THR 499.A O no hydrogen 2.902 N/A VAL 523.A N ASN 590.A O no hydrogen 3.137 N/A GLU 526.A N ASP 524.A OD1 no hydrogen 3.225 N/A VAL 528.A N ASP 524.A O no hydrogen 2.965 N/A LYS 531.A NZ LEU 527.A O no hydrogen 3.432 N/A LYS 532.A N SER 630.A O no hydrogen 2.814 N/A LYS 532.A NZ GLN 565.A OE1 no hydrogen 2.926 N/A VAL 533.A N TYR 567.A O no hydrogen 3.189 N/A TYR 534.A N PHE 628.A O no hydrogen 2.953 N/A THR 536.A N LYS 626.A O no hydrogen 2.749 N/A THR 536.A OG1 LYS 626.A O no hydrogen 2.846 N/A LEU 537.A N SER 562.A O no hydrogen 2.522 N/A THR 538.A N GLU 624.A O no hydrogen 3.059 N/A CYS 539.A N TYR 560.A O no hydrogen 2.326 N/A ALA 540.A N ASP 622.A O no hydrogen 3.186 N/A PHE 541.A N ARG 557.A O no hydrogen 3.084 N/A ARG 542.A N GLY 620.A O no hydrogen 3.070 N/A ARG 542.A NE ASP 622.A OD2 no hydrogen 2.917 N/A ARG 542.A NH2 ASP 622.A OD2 no hydrogen 3.445 N/A GLY 544.A N SER 618.A O no hydrogen 3.059 N/A GLY 552.A N ILE 548.A O no hydrogen 3.122 N/A THR 554.A OG1 PHE 555.A O no hydrogen 3.529 N/A ARG 557.A NH2 ALA 393.A O no hydrogen 2.736 N/A TYR 560.A N CYS 539.A O no hydrogen 3.084 N/A SER 562.A N LEU 537.A O no hydrogen 2.661 N/A SER 562.A OG LEU 537.A O no hydrogen 3.517 N/A ARG 563.A NE ASP 634.A OD1 no hydrogen 2.592 N/A ARG 563.A NH1 ASP 634.A OD2 no hydrogen 3.064 N/A VAL 564.A N VAL 535.A O no hydrogen 2.572 N/A VAL 566.A N VAL 533.A O no hydrogen 2.954 N/A TYR 567.A N VAL 533.A O no hydrogen 3.282 N/A VAL 575.A N SER 574.A OG no hydrogen 2.735 N/A THR 577.A N GLN 580.A OE1 no hydrogen 3.446 N/A GLN 580.A N THR 577.A OG1 no hydrogen 3.287 N/A GLN 580.A NE2 GLY 519.A O no hydrogen 3.600 N/A GLU 581.A N THR 577.A O no hydrogen 3.206 N/A SER 582.A N GLN 578.A O no hydrogen 3.100 N/A LEU 583.A N LEU 579.A O no hydrogen 2.950 N/A LEU 584.A N GLN 580.A O no hydrogen 2.958 N/A LYS 585.A N GLU 581.A O no hydrogen 3.128 N/A LYS 586.A N SER 582.A O no hydrogen 2.948 N/A LEU 587.A N LEU 583.A O no hydrogen 2.792 N/A THR 591.A OG1 GLY 588.A O no hydrogen 3.544 N/A TYR 592.A N VAL 521.A O no hydrogen 3.148 N/A PHE 594.A N GLY 519.A O no hydrogen 2.939 N/A LEU 596.A N VAL 517.A O no hydrogen 3.049 N/A MET 607.A N LEU 771.A O no hydrogen 2.967 N/A LEU 608.A N CYS 619.A O no hydrogen 3.143 N/A GLN 609.A N ILE 769.A O no hydrogen 2.712 N/A GLN 609.A NE2 ASN 763.A O no hydrogen 3.482 N/A GLN 613.A N GLN 613.A OE1 no hydrogen 2.780 N/A ASP 614.A N ALA 611.A O no hydrogen 3.235 N/A CYS 619.A SG ARG 542.A O no hydrogen 3.280 N/A GLY 620.A N ARG 542.A O no hydrogen 2.960 N/A VAL 621.A N VAL 606.A O no hydrogen 2.707 N/A ASP 622.A N ALA 540.A O no hydrogen 3.099 N/A GLU 624.A N THR 538.A O no hydrogen 2.952 N/A VAL 625.A N LEU 648.A O no hydrogen 3.125 N/A LYS 626.A N THR 536.A O no hydrogen 3.031 N/A ALA 627.A N VAL 646.A O no hydrogen 2.932 N/A PHE 628.A N TYR 534.A O no hydrogen 3.129 N/A SER 630.A N LYS 532.A O no hydrogen 3.042 N/A ILE 632.A N SER 630.A OG no hydrogen 3.333 N/A GLU 636.A N THR 633.A O no hydrogen 3.334 N/A SER 644.A OG ALA 629.A O no hydrogen 3.322 N/A SER 645.A OG PRO 641.A O no hydrogen 2.978 N/A SER 645.A OG LYS 642.A O no hydrogen 3.202 N/A VAL 646.A N ALA 627.A O no hydrogen 2.881 N/A LEU 648.A N VAL 625.A O no hydrogen 2.901 N/A ILE 650.A N PHE 623.A O no hydrogen 3.009 N/A ARG 651.A N ARG 505.A O no hydrogen 3.188 N/A ARG 651.A NH1 GLY 773.A O no hydrogen 2.671 N/A ARG 651.A NH2 ASP 506.A OD2 no hydrogen 2.875 N/A LYS 652.A NZ ASP 509.A OD2 no hydrogen 2.875 N/A LYS 652.A NZ LEU 602.A O no hydrogen 3.174 N/A LYS 652.A NZ PRO 603.A O no hydrogen 3.411 N/A VAL 653.A N TYR 507.A O no hydrogen 3.001 N/A GLN 654.A NE2 ASP 509.A OD2 no hydrogen 2.757 N/A GLN 654.A NE2 ILE 787.A O no hydrogen 3.140 N/A ALA 656.A N HIS 830.A O no hydrogen 2.937 N/A GLU 659.A N GLU 659.A OE1 no hydrogen 1.995 N/A GLN 663.A NE2 LEU 685.A O no hydrogen 3.007 N/A GLN 663.A NE2 SER 686.A O no hydrogen 3.657 N/A ALA 668.A N LEU 681.A O no hydrogen 2.911 N/A TRP 670.A N LEU 679.A O no hydrogen 3.148 N/A GLN 671.A NE2 ASP 676.A O no hydrogen 3.696 N/A PHE 672.A N SER 675.A O no hydrogen 3.316 N/A LEU 679.A N TRP 670.A O no hydrogen 3.002 N/A ASN 680.A ND2 SER 669.A OG no hydrogen 2.763 N/A LEU 681.A N ALA 668.A O no hydrogen 2.932 N/A SER 682.A N THR 701.A O no hydrogen 2.948 N/A SER 682.A OG ALA 666.A O no hydrogen 3.565 N/A VAL 683.A N ALA 666.A O no hydrogen 2.782 N/A SER 684.A OG THR 699.A O no hydrogen 3.008 N/A LEU 685.A N PRO 664.A O no hydrogen 2.991 N/A SER 686.A N TYR 690.A OH no hydrogen 2.976 N/A LYS 687.A N TYR 690.A OH no hydrogen 3.384 N/A LYS 687.A NZ GLU 694.A OE2 no hydrogen 3.458 N/A TYR 690.A N ARG 827.A O no hydrogen 2.870 N/A PHE 691.A N GLU 694.A OE1 no hydrogen 2.818 N/A GLU 694.A N PHE 691.A O no hydrogen 3.355 N/A ILE 696.A N LEU 756.A O no hydrogen 3.008 N/A VAL 698.A N LEU 754.A O no hydrogen 2.812 N/A THR 699.A N SER 684.A O no hydrogen 2.989 N/A THR 701.A N SER 682.A O no hydrogen 2.933 N/A THR 701.A OG1 SER 682.A O no hydrogen 2.624 N/A VAL 702.A N LEU 750.A O no hydrogen 2.965 N/A THR 703.A N ASN 680.A O no hydrogen 3.056 N/A THR 703.A OG1 ASN 680.A O no hydrogen 3.246 N/A ASN 704.A N SER 748.A O no hydrogen 3.168 N/A ASN 704.A ND2 LYS 708.A O no hydrogen 3.543 N/A ASN 704.A ND2 VAL 744.A O no hydrogen 3.696 N/A THR 706.A N ASN 704.A OD1 no hydrogen 2.801 N/A THR 706.A OG1 ASN 704.A OD1 no hydrogen 2.645 N/A LYS 711.A N THR 810.A O no hydrogen 2.475 N/A LYS 712.A N THR 810.A O no hydrogen 3.041 N/A LYS 712.A NZ GLU 739.A OE1 no hydrogen 3.266 N/A ILE 713.A N THR 740.A O no hydrogen 3.438 N/A LYS 714.A N LYS 808.A O no hydrogen 2.965 N/A VAL 715.A N GLU 738.A O no hydrogen 2.849 N/A SER 716.A N LYS 806.A O no hydrogen 3.028 N/A SER 716.A OG LYS 806.A O no hydrogen 2.785 N/A VAL 717.A N ALA 736.A O no hydrogen 2.708 N/A GLU 718.A N HIS 804.A O no hydrogen 3.053 N/A GLN 719.A N LYS 733.A O no hydrogen 2.387 N/A ILE 720.A N SER 802.A O no hydrogen 2.953 N/A ALA 721.A N TYR 731.A O no hydrogen 2.313 N/A ASN 722.A N LEU 800.A O no hydrogen 2.877 N/A VAL 723.A N ASP 729.A O no hydrogen 2.671 N/A VAL 724.A N GLY 798.A O no hydrogen 3.118 N/A SER 727.A OG ASP 729.A OD1 no hydrogen 3.530 N/A SER 727.A OG ASP 729.A OD2 no hydrogen 3.210 N/A ASP 729.A N VAL 723.A O no hydrogen 2.862 N/A LYS 733.A N GLN 719.A O no hydrogen 2.825 N/A LYS 733.A NZ ARG 767.A O no hydrogen 3.256 N/A VAL 735.A N VAL 717.A O no hydrogen 2.685 N/A ALA 736.A N VAL 717.A O no hydrogen 3.228 N/A GLU 738.A N VAL 715.A O no hydrogen 2.974 N/A THR 740.A N ILE 713.A O no hydrogen 2.960 N/A SER 748.A OG PRO 746.A O no hydrogen 3.264 N/A LEU 750.A N VAL 702.A O no hydrogen 2.900 N/A LYS 752.A N VAL 700.A O no hydrogen 3.056 N/A LYS 752.A NZ GLU 742.A OE2 no hydrogen 2.971 N/A LEU 754.A N VAL 698.A O no hydrogen 3.152 N/A LEU 756.A N ILE 696.A O no hydrogen 3.058 N/A ASN 763.A ND2 VAL 735.A O no hydrogen 2.935 N/A ASN 763.A ND2 LEU 759.A O no hydrogen 3.078 N/A ARG 764.A NH2 ASP 779.A OD1 no hydrogen 3.149 N/A ARG 766.A NH2 PRO 734.A O no hydrogen 3.517 N/A GLY 768.A N GLN 609.A O no hydrogen 3.253 N/A LEU 771.A N MET 607.A O no hydrogen 2.749 N/A ASP 772.A N ASN 781.A O no hydrogen 3.242 N/A GLY 773.A N SER 605.A O no hydrogen 3.014 N/A THR 780.A OG1 ASP 772.A O no hydrogen 3.228 N/A ASN 781.A N THR 780.A OG1 no hydrogen 2.627 N/A ASN 781.A ND2 HIS 830.A NE2 no hydrogen 3.237 N/A ALA 783.A N ALA 770.A O no hydrogen 3.088 N/A SER 784.A N ASP 772.A OD1 no hydrogen 2.873 N/A SER 784.A OG ASP 772.A OD1 no hydrogen 3.074 N/A SER 784.A OG ASP 772.A OD2 no hydrogen 3.188 N/A SER 785.A N LEU 828.A O no hydrogen 2.969 N/A SER 785.A OG LEU 828.A O no hydrogen 3.474 N/A THR 786.A N VAL 801.A O no hydrogen 2.956 N/A ILE 787.A N GLN 654.A OE1 no hydrogen 2.932 N/A LYS 789.A NZ SER 512.A O no hydrogen 3.131 N/A ARG 794.A NH1 GLU 399.A OE1 no hydrogen 3.121 N/A GLY 798.A N VAL 724.A O no hydrogen 2.806 N/A LEU 800.A N ASN 722.A O no hydrogen 2.892 N/A VAL 801.A N THR 786.A OG1 no hydrogen 3.039 N/A SER 802.A N ILE 720.A O no hydrogen 3.289 N/A TYR 803.A OH ALA 783.A O no hydrogen 2.794 N/A HIS 804.A N GLU 718.A O no hydrogen 3.160 N/A HIS 804.A NE2 GLU 718.A OE1 no hydrogen 2.973 N/A ILE 805.A N VAL 824.A O no hydrogen 2.817 N/A LYS 806.A N SER 716.A O no hydrogen 2.852 N/A VAL 807.A N THR 822.A O no hydrogen 3.083 N/A LYS 808.A N LYS 714.A O no hydrogen 2.784 N/A LEU 809.A N VAL 820.A O no hydrogen 2.740 N/A THR 810.A N LYS 712.A O no hydrogen 3.022 N/A VAL 811.A N SER 818.A O no hydrogen 2.861 N/A SER 812.A OG VAL 709.A O no hydrogen 2.560 N/A SER 812.A OG SER 812.A O no hydrogen 2.534 N/A SER 818.A N VAL 811.A O no hydrogen 3.091 N/A VAL 820.A N LEU 809.A O no hydrogen 3.180 N/A THR 822.A N VAL 807.A O no hydrogen 2.975 N/A VAL 824.A N ILE 805.A O no hydrogen 2.980 N/A PHE 826.A N TYR 803.A O no hydrogen 3.009 N/A ARG 827.A N GLU 688.A O no hydrogen 3.121 N/A LEU 828.A N SER 785.A OG no hydrogen 2.769 N/A MET 829.A N TYR 690.A O no hydrogen 3.391 N/A