Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4uqi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 6.A N MET 2.A O no hydrogen 3.116 N/A VAL 7.A N ARG 3.A O no hydrogen 3.021 N/A PHE 8.A N GLY 4.A O no hydrogen 3.112 N/A ILE 9.A N LEU 5.A O no hydrogen 3.062 N/A SER 10.A N ALA 6.A O no hydrogen 2.782 N/A SER 10.A OG ALA 6.A O no hydrogen 3.014 N/A SER 10.A OG VAL 7.A O no hydrogen 3.048 N/A ASP 11.A N VAL 7.A O no hydrogen 2.722 N/A ILE 12.A N PHE 8.A O no hydrogen 2.812 N/A ARG 13.A N ILE 9.A O no hydrogen 3.117 N/A ASN 14.A N SER 10.A O no hydrogen 3.092 N/A ASN 14.A N ASP 11.A O no hydrogen 3.147 N/A CYS 15.A N ILE 12.A O no hydrogen 3.035 N/A CYS 15.A SG ASP 11.A O no hydrogen 3.445 N/A ALA 20.A N SER 17.A OG no hydrogen 2.974 N/A GLU 21.A N SER 17.A O no hydrogen 3.055 N/A ILE 22.A N LYS 18.A O no hydrogen 2.893 N/A LYS 23.A N GLU 19.A O no hydrogen 3.045 N/A ARG 24.A N ALA 20.A O no hydrogen 3.020 N/A ARG 24.A NE ASP 11.A OD2 no hydrogen 3.156 N/A ARG 24.A NH1 ARG 24.A O no hydrogen 3.403 N/A ARG 24.A NH1 GLU 28.A OE2 no hydrogen 3.077 N/A ARG 24.A NH2 ASP 11.A OD2 no hydrogen 2.732 N/A ILE 25.A N GLU 21.A O no hydrogen 3.071 N/A ASN 26.A N ILE 22.A O no hydrogen 3.148 N/A LYS 27.A N LYS 23.A O no hydrogen 3.043 N/A GLU 28.A N ARG 24.A O no hydrogen 3.148 N/A LEU 29.A N ILE 25.A O no hydrogen 2.966 N/A ALA 30.A N ASN 26.A O no hydrogen 2.899 N/A ASN 31.A N LYS 27.A O no hydrogen 3.059 N/A ILE 32.A N GLU 28.A O no hydrogen 2.833 N/A ARG 33.A N LEU 29.A O no hydrogen 2.856 N/A SER 34.A N ALA 30.A O no hydrogen 2.813 N/A SER 34.A OG ALA 30.A O no hydrogen 2.688 N/A LYS 35.A N ASN 31.A O no hydrogen 3.050 N/A LYS 35.A NZ ASN 31.A OD1 no hydrogen 2.892 N/A LYS 35.A NZ TYR 50.A OH no hydrogen 3.289 N/A PHE 36.A N ILE 32.A O no hydrogen 2.860 N/A LYS 37.A N ARG 33.A O no hydrogen 2.816 N/A GLY 38.A N LYS 35.A O no hydrogen 3.356 N/A SER 46.A N ASP 43.A O no hydrogen 2.911 N/A SER 46.A OG ASP 43.A OD1 no hydrogen 2.766 N/A LYS 47.A N ASP 43.A O no hydrogen 3.160 N/A LYS 48.A N GLY 44.A O no hydrogen 2.731 N/A LYS 48.A NZ THR 81.A OG1 no hydrogen 3.248 N/A LYS 49.A N TYR 45.A O no hydrogen 3.057 N/A TYR 50.A N SER 46.A O no hydrogen 2.900 N/A VAL 51.A N LYS 47.A O no hydrogen 2.925 N/A CYS 52.A N LYS 48.A O no hydrogen 3.113 N/A LYS 53.A N LYS 49.A O no hydrogen 2.710 N/A LYS 53.A NZ GLY 4.A O no hydrogen 3.341 N/A LYS 53.A NZ GLU 28.A OE1 no hydrogen 2.914 N/A LEU 54.A N TYR 50.A O no hydrogen 2.915 N/A LEU 55.A N VAL 51.A O no hydrogen 3.092 N/A PHE 56.A N CYS 52.A O no hydrogen 3.200 N/A ILE 57.A N LYS 53.A O no hydrogen 3.161 N/A PHE 58.A N LEU 54.A O no hydrogen 2.882 N/A LEU 59.A N LEU 55.A O no hydrogen 2.903 N/A LEU 60.A N PHE 56.A O no hydrogen 2.986 N/A LEU 60.A N ILE 57.A O no hydrogen 2.966 N/A GLY 61.A N PHE 58.A O no hydrogen 3.126 N/A HIS 62.A N ILE 57.A O no hydrogen 3.356 N/A GLU 70.A N GLY 67.A O no hydrogen 2.998 N/A GLU 70.A N GLU 70.A OE1 no hydrogen 2.718 N/A ALA 71.A N GLY 67.A O no hydrogen 3.154 N/A VAL 72.A N HIS 68.A O no hydrogen 3.036 N/A ASN 73.A N MET 69.A O no hydrogen 3.195 N/A LEU 74.A N GLU 70.A O no hydrogen 3.169 N/A LEU 75.A N VAL 72.A O no hydrogen 3.147 N/A SER 76.A N ASN 73.A O no hydrogen 2.948 N/A SER 77.A N LEU 74.A O no hydrogen 3.021 N/A SER 77.A OG GLU 82.A OE1 no hydrogen 2.575 N/A ARG 79.A N SER 77.A OG no hydrogen 2.935 N/A GLU 82.A N ARG 79.A O no hydrogen 2.984 N/A LYS 83.A N ARG 79.A O no hydrogen 3.131 N/A LYS 83.A NZ LEU 75.A O no hydrogen 3.059 N/A LYS 83.A NZ SER 77.A O no hydrogen 3.007 N/A LYS 83.A NZ ASP 111.A OD1 no hydrogen 2.869 N/A GLN 84.A N TYR 80.A O no hydrogen 2.865 N/A ILE 85.A N THR 81.A O no hydrogen 3.386 N/A GLY 86.A N GLU 82.A O no hydrogen 2.995 N/A TYR 87.A N LYS 83.A O no hydrogen 2.696 N/A TYR 87.A OH ASP 111.A OD2 no hydrogen 2.503 N/A LEU 88.A N GLN 84.A O no hydrogen 2.813 N/A PHE 89.A N ILE 85.A O no hydrogen 3.045 N/A ILE 90.A N GLY 86.A O no hydrogen 3.390 N/A SER 91.A N TYR 87.A O no hydrogen 3.160 N/A SER 91.A OG TYR 87.A O no hydrogen 2.666 N/A VAL 92.A N LEU 88.A O no hydrogen 3.013 N/A LEU 93.A N PHE 89.A O no hydrogen 2.666 N/A GLU 99.A N ASN 97.A OD1 no hydrogen 2.689 N/A LEU 100.A N ASN 97.A OD1 no hydrogen 3.102 N/A ILE 101.A N ASN 97.A O no hydrogen 3.069 N/A ARG 102.A N SER 98.A O no hydrogen 3.375 N/A ARG 102.A NE GLU 99.A OE1 no hydrogen 3.329 N/A ARG 102.A NH2 GLU 99.A OE2 no hydrogen 3.218 N/A LEU 103.A N GLU 99.A O no hydrogen 2.970 N/A ILE 104.A N LEU 100.A O no hydrogen 2.671 N/A ASN 105.A N ILE 101.A O no hydrogen 2.959 N/A ASN 106.A N ARG 102.A O no hydrogen 3.257 N/A ALA 107.A N LEU 103.A O no hydrogen 3.303 N/A ILE 108.A N ILE 104.A O no hydrogen 3.002 N/A LYS 109.A N ASN 105.A O no hydrogen 2.955 N/A ASN 110.A N ASN 106.A O no hydrogen 3.062 N/A ASP 111.A N ALA 107.A O no hydrogen 3.190 N/A LEU 112.A N ILE 108.A O no hydrogen 2.808 N/A ALA 113.A N LYS 109.A O no hydrogen 2.817 N/A SER 114.A N ASN 110.A O no hydrogen 2.641 N/A SER 114.A OG ASP 111.A O no hydrogen 2.529 N/A ASN 116.A N SER 114.A OG no hydrogen 3.196 N/A THR 118.A N ASN 116.A OD1 no hydrogen 2.757 N/A PHE 119.A N ASN 116.A OD1 no hydrogen 3.192 N/A MET 120.A N ASN 116.A O no hydrogen 2.691 N/A GLY 121.A N PRO 117.A O no hydrogen 2.838 N/A LEU 122.A N THR 118.A O no hydrogen 3.150 N/A ALA 123.A N PHE 119.A O no hydrogen 3.182 N/A LEU 124.A N MET 120.A O no hydrogen 2.884 N/A HIS 125.A N GLY 121.A O no hydrogen 2.933 N/A HIS 125.A NE2 SER 159.A OG no hydrogen 3.025 N/A CYS 126.A N LEU 122.A O no hydrogen 2.977 N/A ILE 127.A N ALA 123.A O no hydrogen 2.937 N/A ALA 128.A N LEU 124.A O no hydrogen 3.004 N/A ASN 129.A N HIS 125.A O no hydrogen 2.633 N/A VAL 130.A N CYS 126.A O no hydrogen 2.831 N/A SER 132.A OG GLU 134.A OE1 no hydrogen 2.796 N/A ARG 133.A NE GLU 137.A OE2 no hydrogen 3.327 N/A ARG 133.A NH1 ASP 173.A OD1 no hydrogen 2.999 N/A ARG 133.A NH2 ASP 173.A OD2 no hydrogen 2.737 N/A GLU 134.A N GLU 134.A OE1 no hydrogen 2.818 N/A MET 135.A N SER 132.A OG no hydrogen 3.376 N/A ALA 136.A N SER 132.A O no hydrogen 2.803 N/A GLU 137.A N ARG 133.A O no hydrogen 2.774 N/A ALA 138.A N GLU 134.A O no hydrogen 3.035 N/A PHE 139.A N MET 135.A O no hydrogen 3.081 N/A PHE 139.A N ALA 136.A O no hydrogen 3.100 N/A ALA 140.A N ALA 136.A O no hydrogen 2.675 N/A GLU 142.A N PHE 139.A O no hydrogen 2.716 N/A ILE 143.A N PHE 139.A O no hydrogen 3.130 N/A ILE 146.A N GLU 142.A O no hydrogen 3.111 N/A LEU 147.A N ILE 143.A O no hydrogen 2.953 N/A VAL 148.A N PRO 144.A O no hydrogen 2.951 N/A ALA 149.A N LYS 145.A O no hydrogen 3.003 N/A ASP 151.A N ASP 151.A OD1 no hydrogen 2.492 N/A THR 152.A OG1 ILE 146.A O no hydrogen 2.599 N/A THR 152.A OG1 ALA 149.A O no hydrogen 3.124 N/A LYS 157.A N MET 153.A O no hydrogen 2.940 N/A LYS 157.A NZ ASP 154.A OD1 no hydrogen 3.295 N/A LYS 157.A NZ ASP 190.A OD2 no hydrogen 3.305 N/A GLN 158.A N ASP 154.A O no hydrogen 2.815 N/A SER 159.A N SER 155.A O no hydrogen 2.977 N/A SER 159.A OG HIS 125.A NE2 no hydrogen 3.025 N/A SER 159.A OG SER 155.A O no hydrogen 3.395 N/A ALA 160.A N VAL 156.A O no hydrogen 2.714 N/A ALA 161.A N LYS 157.A O no hydrogen 2.906 N/A LEU 162.A N GLN 158.A O no hydrogen 3.318 N/A CYS 163.A N SER 159.A O no hydrogen 3.119 N/A CYS 163.A SG LEU 124.A O no hydrogen 3.570 N/A LEU 164.A N ALA 160.A O no hydrogen 2.844 N/A LEU 165.A N ALA 161.A O no hydrogen 2.952 N/A ARG 166.A N LEU 162.A O no hydrogen 2.839 N/A ARG 166.A NH2 VAL 130.A O no hydrogen 3.366 N/A LEU 167.A N CYS 163.A O no hydrogen 2.838 N/A TYR 168.A N LEU 164.A O no hydrogen 2.890 N/A ARG 169.A N LEU 165.A O no hydrogen 2.941 N/A THR 170.A N ARG 166.A O no hydrogen 2.891 N/A THR 170.A OG1 ARG 166.A O no hydrogen 3.515 N/A SER 171.A N LEU 167.A O no hydrogen 2.624 N/A LEU 174.A N SER 171.A O no hydrogen 2.804 N/A VAL 175.A N PRO 172.A O no hydrogen 2.527 N/A THR 181.A OG1 GLY 178.A O no hydrogen 3.476 N/A THR 181.A OG1 GLU 213.A OE2 no hydrogen 2.824 N/A ARG 183.A NH2 ASP 179.A O no hydrogen 3.262 N/A VAL 184.A N TRP 180.A O no hydrogen 3.069 N/A VAL 185.A N THR 181.A O no hydrogen 2.970 N/A HIS 186.A N SER 182.A O no hydrogen 2.775 N/A LEU 187.A N VAL 184.A O no hydrogen 3.047 N/A LEU 188.A N VAL 185.A O no hydrogen 2.955 N/A ASN 189.A N HIS 186.A O no hydrogen 2.854 N/A ASP 190.A N LEU 187.A O no hydrogen 2.713 N/A HIS 192.A N ASP 190.A OD1 no hydrogen 2.791 N/A VAL 196.A N HIS 192.A O no hydrogen 3.109 N/A THR 197.A N LEU 193.A O no hydrogen 2.720 N/A THR 197.A OG1 LEU 193.A O no hydrogen 2.907 N/A ALA 198.A N GLY 194.A O no hydrogen 3.139 N/A ALA 199.A N VAL 195.A O no hydrogen 2.996 N/A THR 200.A N VAL 196.A O no hydrogen 3.165 N/A THR 200.A OG1 VAL 196.A O no hydrogen 2.599 N/A SER 201.A N THR 197.A O no hydrogen 3.354 N/A LEU 202.A N ALA 198.A O no hydrogen 3.274 N/A ILE 203.A N ALA 199.A O no hydrogen 2.953 N/A THR 204.A N THR 200.A O no hydrogen 3.007 N/A THR 204.A OG1 THR 200.A O no hydrogen 2.544 N/A THR 205.A N SER 201.A O no hydrogen 3.410 N/A THR 205.A OG1 SER 201.A O no hydrogen 3.382 N/A LEU 206.A N LEU 202.A O no hydrogen 2.907 N/A ALA 207.A N ILE 203.A O no hydrogen 2.551 N/A GLN 208.A N THR 205.A O no hydrogen 3.061 N/A ASN 210.A N LEU 206.A O no hydrogen 3.007 N/A ASN 210.A ND2 LEU 206.A O no hydrogen 3.158 N/A PHE 214.A N PRO 211.A O no hydrogen 3.083 N/A LYS 215.A N GLU 212.A O no hydrogen 3.483 N/A SER 217.A N PHE 214.A O no hydrogen 2.884 N/A SER 217.A OG PHE 214.A O no hydrogen 2.606 N/A VAL 218.A N LYS 215.A O no hydrogen 3.408 N/A ALA 221.A N SER 217.A O no hydrogen 2.662 N/A VAL 222.A N VAL 218.A O no hydrogen 2.811 N/A SER 223.A N SER 219.A O no hydrogen 3.073 N/A ARG 224.A N LEU 220.A O no hydrogen 3.070 N/A ARG 224.A NE LEU 188.A O no hydrogen 2.692 N/A ARG 224.A NH2 LEU 188.A O no hydrogen 3.506 N/A LEU 225.A N ALA 221.A O no hydrogen 3.110 N/A SER 226.A N VAL 222.A O no hydrogen 3.141 N/A SER 226.A OG SER 223.A O no hydrogen 3.404 N/A ARG 227.A N SER 223.A O no hydrogen 3.170 N/A ARG 227.A NH2 SER 223.A OG no hydrogen 3.357 N/A ILE 228.A N ARG 224.A O no hydrogen 2.864 N/A VAL 229.A N LEU 225.A O no hydrogen 3.017 N/A THR 230.A OG1 SER 226.A O no hydrogen 3.095 N/A SER 231.A N ILE 228.A O no hydrogen 3.268 N/A SER 231.A OG ILE 228.A O no hydrogen 2.699 N/A ALA 232.A N ASP 235.A OD2 no hydrogen 2.835 N/A ASP 235.A N ALA 232.A O no hydrogen 3.206 N/A GLN 237.A N GLN 237.A OE1 no hydrogen 2.602 N/A TYR 239.A N LEU 236.A O no hydrogen 3.069 N/A TYR 239.A OH HIS 192.A NE2 no hydrogen 3.357 N/A THR 240.A N GLN 237.A O no hydrogen 3.362 N/A THR 240.A OG1 LEU 236.A O no hydrogen 2.526 N/A TYR 241.A N VAL 244.A O no hydrogen 3.033 N/A VAL 244.A N TYR 241.A O no hydrogen 3.025 N/A ALA 246.A N TYR 239.A O no hydrogen 2.706 N/A SER 250.A N ALA 246.A O no hydrogen 3.021 N/A SER 250.A OG ALA 246.A O no hydrogen 2.660 N/A VAL 251.A N PRO 247.A O no hydrogen 2.971 N/A LYS 252.A N TRP 248.A O no hydrogen 2.996 N/A LYS 252.A NZ THR 197.A O no hydrogen 3.377 N/A LYS 252.A NZ SER 201.A OG no hydrogen 2.387 N/A LEU 253.A N LEU 249.A O no hydrogen 2.696 N/A LEU 254.A N SER 250.A O no hydrogen 2.914 N/A ARG 255.A N VAL 251.A O no hydrogen 2.878 N/A ARG 255.A NH1 GLU 304.A OE2 no hydrogen 3.184 N/A LEU 256.A N LYS 252.A O no hydrogen 2.971 N/A LEU 257.A N LEU 253.A O no hydrogen 3.205 N/A GLN 258.A N ARG 255.A O no hydrogen 3.020 N/A GLN 258.A NE2 LEU 254.A O no hydrogen 3.251 N/A GLN 258.A NE2 GLU 304.A OE2 no hydrogen 3.033 N/A CYS 259.A N LEU 256.A O no hydrogen 3.000 N/A CYS 259.A SG THR 204.A O no hydrogen 3.914 N/A CYS 259.A SG LEU 256.A O no hydrogen 3.257 N/A TYR 260.A N LEU 257.A O no hydrogen 3.386 N/A TYR 260.A OH PRO 211.A O no hydrogen 2.671 N/A ALA 267.A N ASP 265.A OD1 no hydrogen 3.164 N/A ARG 269.A N ASP 265.A O no hydrogen 3.046 N/A ARG 269.A NE PRO 263.A O no hydrogen 3.494 N/A GLY 270.A N PRO 266.A O no hydrogen 3.022 N/A ARG 271.A N ALA 267.A O no hydrogen 3.008 N/A LEU 272.A N VAL 268.A O no hydrogen 2.950 N/A THR 273.A N ARG 269.A O no hydrogen 3.019 N/A THR 273.A OG1 ARG 269.A O no hydrogen 2.770 N/A THR 273.A OG1 GLU 315.A OE1 no hydrogen 2.733 N/A GLU 274.A N GLY 270.A O no hydrogen 3.024 N/A CYS 275.A N ARG 271.A O no hydrogen 2.834 N/A LEU 276.A N LEU 272.A O no hydrogen 2.777 N/A GLU 277.A N THR 273.A O no hydrogen 2.914 N/A THR 278.A N GLU 274.A O no hydrogen 2.933 N/A THR 278.A OG1 GLU 274.A O no hydrogen 2.778 N/A ILE 279.A N CYS 275.A O no hydrogen 3.159 N/A LEU 280.A N LEU 276.A O no hydrogen 2.978 N/A ASN 281.A N GLU 277.A O no hydrogen 2.875 N/A LYS 282.A N THR 278.A O no hydrogen 3.034 N/A ALA 283.A N ILE 279.A O no hydrogen 3.278 N/A ALA 283.A N LEU 280.A O no hydrogen 3.190 N/A GLN 284.A N ASN 281.A O no hydrogen 2.865 N/A GLU 285.A N LYS 282.A O no hydrogen 3.062 N/A LYS 288.A N HIS 294.A NE2 no hydrogen 3.411 N/A LYS 291.A N SER 289.A OG no hydrogen 2.941 N/A HIS 294.A N LYS 291.A O no hydrogen 3.216 N/A HIS 294.A ND1 TYR 242.A O no hydrogen 2.610 N/A SER 295.A OG VAL 292.A O no hydrogen 3.074 N/A ASN 296.A N VAL 292.A O no hydrogen 3.046 N/A ALA 297.A N GLN 293.A O no hydrogen 3.030 N/A LYS 298.A N HIS 294.A O no hydrogen 2.928 N/A LYS 298.A NZ LYS 282.A O no hydrogen 3.459 N/A LYS 298.A NZ GLU 285.A O no hydrogen 3.432 N/A ASN 299.A N SER 295.A O no hydrogen 2.768 N/A ALA 300.A N ASN 296.A O no hydrogen 2.880 N/A LEU 302.A N LYS 298.A O no hydrogen 2.990 N/A PHE 303.A N ASN 299.A O no hydrogen 2.647 N/A GLU 304.A N ALA 300.A O no hydrogen 3.024 N/A ALA 305.A N VAL 301.A O no hydrogen 3.079 N/A ILE 306.A N LEU 302.A O no hydrogen 2.976 N/A SER 307.A N PHE 303.A O no hydrogen 3.036 N/A SER 307.A OG PHE 303.A O no hydrogen 3.340 N/A LEU 308.A N GLU 304.A O no hydrogen 3.149 N/A ILE 309.A N ALA 305.A O no hydrogen 3.000 N/A ILE 310.A N ILE 306.A O no hydrogen 2.963 N/A HIS 311.A N SER 307.A O no hydrogen 2.734 N/A HIS 311.A NE2 TYR 260.A O no hydrogen 3.216 N/A HIS 312.A N LEU 308.A O no hydrogen 2.892 N/A ASP 313.A N ILE 309.A O no hydrogen 2.858 N/A LEU 318.A N GLU 315.A O no hydrogen 2.932 N/A LEU 319.A N GLU 315.A O no hydrogen 3.233 N/A VAL 320.A N PRO 316.A O no hydrogen 3.094 N/A ARG 321.A N ASN 317.A O no hydrogen 3.104 N/A ARG 321.A NH1 GLU 277.A OE1 no hydrogen 3.257 N/A ARG 321.A NH1 ASN 281.A OD1 no hydrogen 3.260 N/A ARG 321.A NH2 ASN 281.A OD1 no hydrogen 2.897 N/A ALA 322.A N LEU 318.A O no hydrogen 2.858 N/A CYS 323.A N LEU 319.A O no hydrogen 2.941 N/A CYS 323.A SG LEU 319.A O no hydrogen 3.763 N/A ASN 324.A N VAL 320.A O no hydrogen 2.964 N/A GLN 325.A N ARG 321.A O no hydrogen 3.009 N/A LEU 326.A N ALA 322.A O no hydrogen 3.029 N/A GLY 327.A N CYS 323.A O no hydrogen 2.805 N/A GLN 328.A N ASN 324.A O no hydrogen 3.028 N/A GLN 328.A N GLN 325.A O no hydrogen 3.086 N/A PHE 329.A N GLN 325.A O no hydrogen 3.255 N/A PHE 329.A N LEU 326.A O no hydrogen 3.061 N/A GLU 334.A N HIS 332.A ND1 no hydrogen 3.029 N/A LEU 337.A N GLU 334.A O no hydrogen 3.150 N/A ARG 338.A N GLU 334.A O no hydrogen 3.069 N/A ARG 338.A NE HIS 332.A O no hydrogen 2.743 N/A ARG 338.A NH1 GLU 372.A OE1 no hydrogen 2.665 N/A ARG 338.A NH2 HIS 332.A O no hydrogen 2.775 N/A TYR 339.A N THR 335.A O no hydrogen 2.827 N/A LEU 340.A N ASN 336.A O no hydrogen 3.096 N/A ALA 341.A N LEU 337.A O no hydrogen 2.959 N/A LEU 342.A N ARG 338.A O no hydrogen 3.068 N/A GLU 343.A N TYR 339.A O no hydrogen 3.196 N/A SER 344.A N LEU 340.A O no hydrogen 2.911 N/A MET 345.A N ALA 341.A O no hydrogen 2.938 N/A CYS 346.A N LEU 342.A O no hydrogen 2.933 N/A CYS 346.A SG LEU 342.A O no hydrogen 3.409 N/A THR 347.A N SER 344.A O no hydrogen 3.143 N/A THR 347.A OG1 GLU 343.A O no hydrogen 3.361 N/A THR 347.A OG1 SER 344.A O no hydrogen 3.383 N/A LEU 348.A N SER 344.A O no hydrogen 3.259 N/A ALA 349.A N MET 345.A O no hydrogen 2.971 N/A SER 350.A N THR 347.A O no hydrogen 3.012 N/A SER 350.A OG THR 347.A O no hydrogen 3.187 N/A SER 351.A N LEU 348.A O no hydrogen 3.263 N/A SER 351.A OG ASP 313.A OD1 no hydrogen 3.070 N/A SER 351.A OG SER 354.A OG no hydrogen 3.191 N/A GLU 352.A N GLU 352.A OE1 no hydrogen 2.740 N/A SER 354.A N SER 351.A O no hydrogen 3.104 N/A SER 354.A OG LEU 348.A O no hydrogen 2.387 N/A SER 354.A OG SER 351.A O no hydrogen 3.311 N/A HIS 355.A N SER 351.A O no hydrogen 2.711 N/A HIS 355.A ND1 ALA 349.A O no hydrogen 2.770 N/A VAL 358.A N SER 354.A O no hydrogen 3.195 N/A LYS 359.A N HIS 355.A O no hydrogen 3.191 N/A LYS 359.A NZ ASP 390.A OD1 no hydrogen 3.480 N/A LYS 359.A NZ ASP 390.A OD2 no hydrogen 2.722 N/A LYS 359.A NZ SER 392.A OG no hydrogen 3.312 N/A THR 360.A N GLU 356.A O no hydrogen 3.232 N/A THR 360.A N ALA 357.A O no hydrogen 2.991 N/A HIS 361.A N VAL 358.A O no hydrogen 2.875 N/A HIS 361.A NE2 ASN 324.A OD1 no hydrogen 3.013 N/A ILE 362.A N LYS 359.A O no hydrogen 3.279 N/A THR 364.A N HIS 361.A O no hydrogen 2.849 N/A THR 364.A OG1 HIS 361.A O no hydrogen 3.394 N/A VAL 365.A N HIS 361.A O no hydrogen 3.097 N/A ILE 366.A N ILE 362.A O no hydrogen 3.133 N/A ASN 367.A N GLU 363.A O no hydrogen 2.942 N/A ALA 368.A N THR 364.A O no hydrogen 2.919 N/A LEU 369.A N VAL 365.A O no hydrogen 2.968 N/A LYS 370.A N ILE 366.A O no hydrogen 3.144 N/A THR 371.A N ALA 368.A O no hydrogen 3.229 N/A THR 371.A OG1 ASN 367.A O no hydrogen 3.162 N/A GLU 372.A N LEU 369.A O no hydrogen 3.130 N/A ASP 374.A N GLU 372.A OE2 no hydrogen 3.072 N/A SER 376.A N ASP 374.A OD2 no hydrogen 3.180 N/A SER 376.A OG ASP 374.A OD2 no hydrogen 2.722 N/A VAL 377.A N ASP 374.A OD2 no hydrogen 3.379 N/A ARG 378.A N ASP 374.A O no hydrogen 3.090 N/A ARG 378.A NE GLU 372.A O no hydrogen 3.263 N/A ARG 378.A NH1 ASP 409.A OD2 no hydrogen 3.328 N/A ARG 378.A NH2 ARG 373.A O no hydrogen 3.126 N/A GLN 379.A N VAL 375.A O no hydrogen 2.968 N/A GLN 379.A NE2 GLU 415.A OE1 no hydrogen 2.931 N/A GLN 379.A NE2 GLU 415.A OE2 no hydrogen 3.515 N/A ARG 380.A N SER 376.A O no hydrogen 3.194 N/A ARG 380.A NH1 TYR 339.A OH no hydrogen 3.134 N/A ALA 381.A N VAL 377.A O no hydrogen 2.944 N/A VAL 382.A N ARG 378.A O no hydrogen 3.047 N/A ASP 383.A N GLN 379.A O no hydrogen 3.078 N/A LEU 384.A N ARG 380.A O no hydrogen 3.013 N/A LEU 385.A N ALA 381.A O no hydrogen 3.089 N/A TYR 386.A N VAL 382.A O no hydrogen 3.068 N/A ALA 387.A N ASP 383.A O no hydrogen 2.998 N/A MET 388.A N LEU 384.A O no hydrogen 3.047 N/A CYS 389.A N LEU 385.A O no hydrogen 3.114 N/A CYS 389.A N TYR 386.A O no hydrogen 3.362 N/A SER 392.A N ASP 390.A OD1 no hydrogen 3.272 N/A SER 392.A OG ASP 390.A OD1 no hydrogen 2.768 N/A ASN 393.A N ASP 390.A OD1 no hydrogen 3.224 N/A ASN 393.A ND2 MET 388.A O no hydrogen 2.426 N/A ALA 394.A N ASP 390.A O no hydrogen 2.861 N/A ILE 397.A N ASN 393.A O no hydrogen 2.948 N/A VAL 398.A N ALA 394.A O no hydrogen 2.941 N/A ALA 399.A N GLN 395.A O no hydrogen 2.914 N/A GLU 400.A N GLN 396.A O no hydrogen 2.947 N/A MET 401.A N ILE 397.A O no hydrogen 2.756 N/A LEU 402.A N VAL 398.A O no hydrogen 3.059 N/A SER 403.A N ALA 399.A O no hydrogen 2.918 N/A TYR 404.A N GLU 400.A O no hydrogen 2.890 N/A LEU 405.A N MET 401.A O no hydrogen 2.879 N/A GLU 406.A N LEU 402.A O no hydrogen 3.250 N/A GLU 406.A N SER 403.A O no hydrogen 3.085 N/A THR 407.A N TYR 404.A O no hydrogen 3.153 N/A ALA 408.A N LEU 405.A O no hydrogen 3.286 N/A ARG 413.A NH1 ILE 444.A O no hydrogen 3.396 N/A VAL 417.A N ARG 413.A O no hydrogen 2.964 N/A LEU 418.A N GLU 414.A O no hydrogen 3.383 N/A LYS 419.A N GLU 415.A O no hydrogen 3.062 N/A VAL 420.A N ILE 416.A O no hydrogen 2.779 N/A ALA 421.A N VAL 417.A O no hydrogen 3.219 N/A ILE 422.A N LEU 418.A O no hydrogen 3.186 N/A LEU 423.A N LYS 419.A O no hydrogen 2.974 N/A ALA 424.A N VAL 420.A O no hydrogen 2.843 N/A GLU 425.A N ALA 421.A O no hydrogen 3.101 N/A LYS 426.A N ILE 422.A O no hydrogen 2.967 N/A TYR 427.A N LEU 423.A O no hydrogen 3.078 N/A ALA 428.A N ALA 424.A O no hydrogen 2.944 N/A TYR 434.A N ASP 430.A O no hydrogen 3.165 N/A VAL 435.A N TYR 431.A O no hydrogen 2.926 N/A ASP 436.A N THR 432.A O no hydrogen 2.781 N/A THR 437.A N TRP 433.A O no hydrogen 2.865 N/A THR 437.A OG1 TRP 433.A O no hydrogen 2.655 N/A ILE 438.A N TYR 434.A O no hydrogen 2.965 N/A LEU 439.A N VAL 435.A O no hydrogen 3.140 N/A ASN 440.A N ASP 436.A O no hydrogen 3.318 N/A ASN 440.A ND2 ASP 436.A O no hydrogen 2.939 N/A LEU 441.A N THR 437.A O no hydrogen 2.684 N/A ILE 442.A N ILE 438.A O no hydrogen 2.654 N/A ARG 443.A N LEU 439.A O no hydrogen 2.816 N/A ARG 443.A NH1 ASN 440.A OD1 no hydrogen 2.590 N/A ARG 443.A NH2 ASN 440.A OD1 no hydrogen 2.846 N/A ILE 444.A N ASN 440.A O no hydrogen 2.874 N/A ILE 444.A N LEU 441.A O no hydrogen 3.143 N/A ALA 445.A N LEU 441.A O no hydrogen 2.791 N/A TYR 448.A N ALA 445.A O no hydrogen 3.172 N/A VAL 449.A N GLY 446.A O no hydrogen 3.009 N/A TRP 454.A N SER 450.A O no hydrogen 3.326 N/A TYR 455.A N GLU 451.A O no hydrogen 2.881 N/A ARG 456.A N GLU 452.A O no hydrogen 2.950 N/A VAL 457.A N VAL 453.A O no hydrogen 3.281 N/A ILE 458.A N TRP 454.A O no hydrogen 3.219 N/A GLN 459.A N TYR 455.A O no hydrogen 3.153 N/A GLN 459.A N ARG 456.A O no hydrogen 2.920 N/A ILE 460.A N ARG 456.A O no hydrogen 3.072 N/A VAL 461.A N VAL 457.A O no hydrogen 3.321 N/A ILE 462.A N ILE 458.A O no hydrogen 3.409 N/A ASN 463.A N GLN 459.A O no hydrogen 2.965 N/A ASN 463.A ND2 PHE 597.A O no hydrogen 3.257 N/A ASN 463.A ND2 GLU 599.A OE2 no hydrogen 2.597 N/A ARG 464.A N ILE 460.A O no hydrogen 2.953 N/A ARG 464.A NE ASN 463.A O no hydrogen 2.858 N/A ARG 464.A NH2 ASN 463.A O no hydrogen 3.534 N/A GLN 468.A N ASP 465.A O no hydrogen 3.364 N/A GLN 468.A NE2 VAL 461.A O no hydrogen 3.112 N/A TYR 470.A OH ASP 436.A OD1 no hydrogen 2.681 N/A ALA 471.A N VAL 467.A O no hydrogen 2.759 N/A ALA 472.A N GLN 468.A O no hydrogen 2.948 N/A LYS 473.A N GLY 469.A O no hydrogen 3.199 N/A THR 474.A N TYR 470.A O no hydrogen 3.042 N/A THR 474.A OG1 TYR 470.A O no hydrogen 2.863 N/A VAL 475.A N ALA 471.A O no hydrogen 3.088 N/A PHE 476.A N ALA 472.A O no hydrogen 2.981 N/A GLU 477.A N LYS 473.A O no hydrogen 2.903 N/A ALA 478.A N THR 474.A O no hydrogen 2.886 N/A LEU 479.A N VAL 475.A O no hydrogen 2.594 N/A ALA 481.A N ALA 478.A O no hydrogen 3.175 N/A HIS 485.A NE2 ILE 444.A O no hydrogen 3.021 N/A LEU 488.A N HIS 485.A O no hydrogen 2.930 N/A LYS 490.A N GLU 486.A O no hydrogen 3.016 N/A VAL 491.A N ASN 487.A O no hydrogen 2.877 N/A GLY 492.A N LEU 488.A O no hydrogen 2.540 N/A GLY 493.A N VAL 489.A O no hydrogen 2.906 N/A TYR 494.A N LYS 490.A O no hydrogen 3.163 N/A ILE 495.A N VAL 491.A O no hydrogen 3.024 N/A LEU 496.A N GLY 492.A O no hydrogen 3.057 N/A GLY 497.A N GLY 493.A O no hydrogen 3.072 N/A GLU 498.A N TYR 494.A O no hydrogen 3.183 N/A PHE 499.A N ILE 495.A O no hydrogen 2.673 N/A GLY 500.A N LEU 496.A O no hydrogen 2.752 N/A LEU 502.A N PHE 499.A O no hydrogen 2.941 N/A ILE 503.A N GLY 500.A O no hydrogen 3.062 N/A ALA 504.A N GLY 500.A O no hydrogen 2.848 N/A ASP 506.A N ILE 503.A O no hydrogen 3.053 N/A SER 509.A N ASP 506.A O no hydrogen 3.344 N/A SER 509.A OG ILE 503.A O no hydrogen 2.568 N/A ILE 513.A N SER 510.A OG no hydrogen 3.412 N/A GLN 514.A N SER 510.A O no hydrogen 2.799 N/A GLN 514.A NE2 GLY 500.A O no hydrogen 3.304 N/A GLN 514.A NE2 SER 509.A O no hydrogen 3.065 N/A PHE 515.A N PRO 511.A O no hydrogen 3.081 N/A ASN 516.A N LEU 512.A O no hydrogen 2.963 N/A LEU 517.A N ILE 513.A O no hydrogen 3.022 N/A LEU 518.A N GLN 514.A O no hydrogen 3.107 N/A HIS 519.A N PHE 515.A O no hydrogen 2.748 N/A SER 520.A N ASN 516.A O no hydrogen 2.958 N/A SER 520.A N LEU 517.A O no hydrogen 3.160 N/A SER 520.A OG LEU 517.A O no hydrogen 2.780 N/A LYS 521.A N LEU 518.A O no hydrogen 2.745 N/A LYS 521.A NZ LEU 479.A O no hydrogen 3.001 N/A LYS 521.A NZ ALA 481.A O no hydrogen 3.301 N/A PHE 522.A N LEU 518.A O no hydrogen 3.100 N/A LEU 524.A N LYS 521.A O no hydrogen 2.760 N/A CYS 525.A N PHE 522.A O no hydrogen 2.859 N/A CYS 525.A SG LYS 521.A O no hydrogen 3.182 N/A SER 526.A N GLU 486.A OE2 no hydrogen 3.156 N/A SER 526.A OG GLU 486.A OE2 no hydrogen 3.084 N/A SER 526.A OG THR 529.A OG1 no hydrogen 2.808 N/A THR 529.A OG1 GLU 486.A OE2 no hydrogen 2.291 N/A THR 529.A OG1 SER 526.A OG no hydrogen 2.808 N/A ARG 530.A N SER 526.A O no hydrogen 3.014 N/A ARG 530.A NE CYS 525.A O no hydrogen 2.826 N/A ALA 531.A N VAL 527.A O no hydrogen 2.765 N/A LEU 532.A N PRO 528.A O no hydrogen 3.032 N/A LEU 533.A N THR 529.A O no hydrogen 3.123 N/A LEU 534.A N ARG 530.A O no hydrogen 2.819 N/A SER 535.A N ALA 531.A O no hydrogen 3.281 N/A SER 535.A OG TYR 575.A OH no hydrogen 2.822 N/A THR 536.A N LEU 532.A O no hydrogen 2.854 N/A THR 536.A OG1 GLY 493.A O no hydrogen 2.720 N/A THR 536.A OG1 LEU 532.A O no hydrogen 3.284 N/A TYR 537.A N LEU 533.A O no hydrogen 2.708 N/A ILE 538.A N SER 535.A O no hydrogen 3.238 N/A LYS 539.A N SER 535.A O no hydrogen 3.177 N/A LYS 539.A NZ GLU 498.A OE1 no hydrogen 3.204 N/A PHE 540.A N THR 536.A O no hydrogen 3.096 N/A VAL 541.A N TYR 537.A O no hydrogen 3.246 N/A ASN 542.A N ILE 538.A O no hydrogen 3.409 N/A LEU 543.A N LYS 539.A O no hydrogen 2.743 N/A PHE 544.A N PHE 540.A O no hydrogen 2.932 N/A VAL 547.A N PHE 544.A O no hydrogen 3.117 N/A LYS 548.A N PRO 545.A O no hydrogen 3.300 N/A LYS 548.A NZ SER 579.A O no hydrogen 2.669 N/A ILE 551.A N VAL 547.A O no hydrogen 3.421 N/A GLN 552.A N LYS 548.A O no hydrogen 2.911 N/A GLN 552.A NE2 SER 579.A OG no hydrogen 2.941 N/A ASP 553.A N ALA 549.A O no hydrogen 3.086 N/A VAL 554.A N THR 550.A O no hydrogen 3.303 N/A LEU 555.A N ILE 551.A O no hydrogen 3.035 N/A ARG 556.A N GLN 552.A O no hydrogen 2.972 N/A ARG 556.A NH2 GLN 552.A OE1 no hydrogen 3.177 N/A SER 557.A OG SER 559.A OG no hydrogen 3.389 N/A SER 559.A OG SER 557.A OG no hydrogen 3.389 N/A SER 559.A OG GLN 560.A OE1 no hydrogen 3.123 N/A GLN 560.A N SER 557.A O no hydrogen 3.093 N/A LEU 561.A N SER 557.A O no hydrogen 3.066 N/A LYS 562.A N ASP 558.A O no hydrogen 2.925 N/A ASN 563.A N GLN 560.A O no hydrogen 3.416 N/A ASN 563.A ND2 SER 559.A O no hydrogen 2.678 N/A ASP 565.A N ASN 563.A OD1 no hydrogen 2.927 N/A GLN 569.A N ASP 565.A O no hydrogen 3.110 N/A GLN 570.A N VAL 566.A O no hydrogen 2.714 N/A ARG 571.A N GLU 567.A O no hydrogen 2.672 N/A ARG 571.A NE GLU 567.A OE1 no hydrogen 3.154 N/A ARG 571.A NH1 ALA 531.A O no hydrogen 2.634 N/A ARG 571.A NH2 GLU 567.A OE1 no hydrogen 3.490 N/A ALA 572.A N LEU 568.A O no hydrogen 2.909 N/A VAL 573.A N GLN 569.A O no hydrogen 3.312 N/A GLU 574.A N GLN 570.A O no hydrogen 2.968 N/A TYR 575.A N ARG 571.A O no hydrogen 2.735 N/A TYR 575.A OH SER 535.A OG no hydrogen 2.822 N/A LEU 576.A N ALA 572.A O no hydrogen 3.072 N/A ARG 577.A N VAL 573.A O no hydrogen 2.937 N/A LEU 578.A N GLU 574.A O no hydrogen 2.906 N/A SER 579.A N TYR 575.A O no hydrogen 2.927 N/A SER 579.A OG LEU 576.A O no hydrogen 2.812 N/A THR 580.A N LEU 576.A O no hydrogen 2.864 N/A THR 580.A N ARG 577.A O no hydrogen 3.267 N/A THR 580.A OG1 LEU 576.A O no hydrogen 3.194 N/A VAL 581.A N ARG 577.A O no hydrogen 2.796 N/A ALA 582.A N LEU 578.A O no hydrogen 2.925 N/A LEU 587.A N SER 583.A O no hydrogen 2.812 N/A ALA 588.A N THR 584.A O no hydrogen 2.888 N/A THR 589.A N ASP 585.A O no hydrogen 3.202 N/A THR 589.A N ILE 586.A O no hydrogen 2.894 N/A THR 589.A OG1 ASP 585.A O no hydrogen 2.973 N/A VAL 590.A N ILE 586.A O no hydrogen 3.081 N/A LEU 591.A N LEU 587.A O no hydrogen 3.124 N/A MET 594.A N GLU 498.A OE2 no hydrogen 2.730 N/A PHE 597.A N ASN 463.A OD1 no hydrogen 3.027 N/A