Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1avc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 1.A OH ILE 5.A O no hydrogen 2.656 N/A ARG 2.A NE ASP 279.A OD1 no hydrogen 3.181 N/A ARG 2.A NE ASP 279.A OD2 no hydrogen 3.213 N/A ARG 2.A NH2 ASP 279.A OD1 no hydrogen 3.297 N/A ARG 2.A NH2 GLU 282.A OE2 no hydrogen 3.478 N/A SER 4.A N SER 273.A O no hydrogen 2.800 N/A SER 4.A OG SER 273.A O no hydrogen 3.035 N/A SER 4.A OG LEU 311.A O no hydrogen 2.564 N/A ILE 5.A N SER 273.A O no hydrogen 3.149 N/A PHE 8.A N GLN 45.A OE1 no hydrogen 2.864 N/A ASN 12.A ND2 GLN 15.A OE1 no hydrogen 2.654 N/A SER 14.A OG ASN 52.A OD1 no hydrogen 2.604 N/A ASP 16.A N ASN 12.A O no hydrogen 2.875 N/A ALA 17.A N PRO 13.A O no hydrogen 2.988 N/A GLU 18.A N SER 14.A O no hydrogen 3.179 N/A THR 19.A N GLN 15.A O no hydrogen 2.735 N/A THR 19.A OG1 GLN 15.A O no hydrogen 2.801 N/A LEU 20.A N ASP 16.A O no hydrogen 2.892 N/A TYR 21.A N ALA 17.A O no hydrogen 3.015 N/A ASN 22.A N GLU 18.A O no hydrogen 2.943 N/A ALA 23.A N THR 19.A O no hydrogen 2.959 N/A MET 24.A N LEU 20.A O no hydrogen 3.367 N/A LYS 25.A N ASN 22.A O no hydrogen 3.161 N/A ASP 30.A N ALA 23.A O no hydrogen 2.658 N/A LYS 31.A NZ SER 29.A OG no hydrogen 3.117 N/A ALA 33.A N ASP 30.A O no hydrogen 2.823 N/A ALA 33.A N ASP 30.A OD1 no hydrogen 3.301 N/A ILE 34.A N ASP 30.A O no hydrogen 3.029 N/A ILE 35.A N LYS 31.A O no hydrogen 2.969 N/A ASN 36.A N GLU 32.A O no hydrogen 3.349 N/A ASN 36.A ND2 GLU 32.A O no hydrogen 3.089 N/A LEU 37.A N ALA 33.A O no hydrogen 2.984 N/A ILE 38.A N ILE 34.A O no hydrogen 3.093 N/A THR 39.A N ILE 35.A O no hydrogen 2.943 N/A SER 40.A N LEU 37.A O no hydrogen 2.628 N/A SER 40.A OG ASN 36.A O no hydrogen 2.555 N/A ARG 41.A N ILE 38.A O no hydrogen 3.435 N/A ARG 41.A NE ASP 16.A OD2 no hydrogen 2.932 N/A ARG 41.A NH1 SER 40.A O no hydrogen 3.020 N/A ARG 41.A NH2 ASP 16.A OD1 no hydrogen 2.890 N/A SER 42.A N GLN 45.A OE1 no hydrogen 3.008 N/A SER 42.A OG ASP 7.A OD1 no hydrogen 2.747 N/A ASN 43.A N GLU 274.A OE1 no hydrogen 3.432 N/A ASN 43.A N GLU 274.A OE2 no hydrogen 3.171 N/A ASN 43.A ND2 ARG 82.A O no hydrogen 3.028 N/A LYS 44.A NZ ASP 7.A OD2 no hydrogen 3.025 N/A GLN 45.A NE2 PHE 8.A O no hydrogen 2.901 N/A ARG 46.A N SER 42.A O no hydrogen 2.786 N/A ARG 46.A NE ILE 38.A O no hydrogen 2.873 N/A ARG 46.A NE ARG 41.A O no hydrogen 2.825 N/A ARG 46.A NH1 LEU 80.A O no hydrogen 2.788 N/A GLN 47.A N ASN 43.A O no hydrogen 3.092 N/A GLU 48.A N LYS 44.A O no hydrogen 3.196 N/A ILE 49.A N GLN 45.A O no hydrogen 2.858 N/A CYS 50.A N ARG 46.A O no hydrogen 2.838 N/A GLN 51.A N GLN 47.A O no hydrogen 2.966 N/A GLN 51.A N GLU 48.A O no hydrogen 2.869 N/A ASN 52.A N GLU 48.A O no hydrogen 2.818 N/A ASN 52.A ND2 GLU 48.A O no hydrogen 3.237 N/A TYR 53.A N ILE 49.A O no hydrogen 2.968 N/A TYR 53.A OH ASP 64.A OD2 no hydrogen 2.560 N/A LYS 54.A N CYS 50.A O no hydrogen 3.347 N/A SER 55.A N GLN 51.A O no hydrogen 3.348 N/A SER 55.A OG ASN 52.A O no hydrogen 3.101 N/A LEU 56.A N ASN 52.A O no hydrogen 2.723 N/A TYR 57.A N TYR 53.A O no hydrogen 3.132 N/A LYS 59.A NZ ASP 64.A OD1 no hydrogen 3.276 N/A LYS 59.A NZ ASP 64.A OD2 no hydrogen 2.821 N/A ILE 62.A N ASP 60.A OD1 no hydrogen 3.040 N/A ALA 63.A N ASP 60.A OD1 no hydrogen 3.321 N/A ASP 64.A N ASP 60.A O no hydrogen 2.686 N/A LEU 65.A N LEU 61.A O no hydrogen 2.855 N/A LYS 66.A N ILE 62.A O no hydrogen 2.895 N/A TYR 67.A N ALA 63.A O no hydrogen 3.299 N/A TYR 67.A N ASP 64.A O no hydrogen 3.129 N/A GLU 68.A N ASP 64.A O no hydrogen 3.086 N/A LEU 69.A N LEU 65.A O no hydrogen 2.980 N/A LYS 72.A NZ ASP 262.A OD1 no hydrogen 3.278 N/A LYS 72.A NZ ASP 262.A OD2 no hydrogen 3.227 N/A GLU 74.A N GLY 71.A O no hydrogen 2.920 N/A ARG 75.A N GLY 71.A O no hydrogen 3.356 N/A ARG 75.A NH1 GLU 91.A OE1 no hydrogen 3.520 N/A LEU 76.A N LYS 72.A O no hydrogen 3.040 N/A ILE 77.A N PHE 73.A O no hydrogen 3.183 N/A VAL 78.A N GLU 74.A O no hydrogen 2.786 N/A GLY 79.A N ARG 75.A O no hydrogen 2.793 N/A LEU 80.A N LEU 76.A O no hydrogen 2.893 N/A LEU 80.A N ILE 77.A O no hydrogen 3.071 N/A MET 81.A N VAL 78.A O no hydrogen 3.079 N/A ARG 82.A N VAL 78.A O no hydrogen 3.343 N/A TYR 86.A OH ASP 127.A OD1 no hydrogen 2.586 N/A ALA 87.A N PRO 83.A O no hydrogen 2.814 N/A ASP 88.A N PRO 84.A O no hydrogen 3.214 N/A ALA 89.A N ALA 85.A O no hydrogen 3.201 N/A LYS 90.A N TYR 86.A O no hydrogen 3.295 N/A LYS 90.A NZ ASP 94.A OD1 no hydrogen 3.262 N/A GLU 91.A N ALA 87.A O no hydrogen 3.142 N/A ILE 92.A N ASP 88.A O no hydrogen 2.924 N/A LYS 93.A N ALA 89.A O no hydrogen 2.878 N/A ASP 94.A N LYS 90.A O no hydrogen 2.933 N/A ALA 95.A N GLU 91.A O no hydrogen 3.047 N/A ILE 96.A N ILE 92.A O no hydrogen 3.069 N/A THR 101.A OG1 GLY 100.A O no hydrogen 2.771 N/A ASP 102.A N ALA 95.A O no hydrogen 3.229 N/A CYS 105.A N ASP 102.A OD1 no hydrogen 3.314 N/A CYS 105.A SG GLU 91.A O no hydrogen 3.845 N/A LEU 106.A N ASP 102.A O no hydrogen 3.204 N/A ILE 107.A N GLU 103.A O no hydrogen 2.785 N/A GLU 108.A N LYS 104.A O no hydrogen 3.025 N/A ILE 109.A N CYS 105.A O no hydrogen 3.010 N/A LEU 110.A N LEU 106.A O no hydrogen 3.112 N/A ALA 111.A N ILE 107.A O no hydrogen 3.023 N/A SER 112.A N ILE 109.A O no hydrogen 3.038 N/A SER 112.A OG GLU 108.A O no hydrogen 2.643 N/A SER 112.A OG ILE 109.A O no hydrogen 3.253 N/A ARG 113.A N ILE 109.A O no hydrogen 2.925 N/A ARG 113.A NE ASP 88.A OD1 no hydrogen 3.402 N/A ARG 113.A NE ASP 88.A OD2 no hydrogen 2.843 N/A ARG 113.A NH2 ASP 88.A OD1 no hydrogen 2.763 N/A THR 114.A N GLN 117.A OE1 no hydrogen 2.649 N/A THR 114.A OG1 GLN 117.A OE1 no hydrogen 3.251 N/A ASN 115.A ND2 ARG 157.A O no hydrogen 2.777 N/A GLN 117.A N THR 114.A OG1 no hydrogen 3.386 N/A ILE 118.A N THR 114.A O no hydrogen 2.765 N/A HIS 119.A N ASN 115.A O no hydrogen 3.016 N/A HIS 119.A NE2 GLN 154.A O no hydrogen 3.050 N/A GLN 120.A N GLU 116.A O no hydrogen 2.839 N/A VAL 122.A N ILE 118.A O no hydrogen 3.010 N/A ALA 123.A N HIS 119.A O no hydrogen 3.181 N/A ALA 124.A N GLN 120.A O no hydrogen 3.089 N/A TYR 125.A N LEU 121.A O no hydrogen 3.011 N/A TYR 125.A OH ASP 136.A OD2 no hydrogen 2.784 N/A LYS 126.A N VAL 122.A O no hydrogen 3.219 N/A ASP 127.A N ALA 123.A O no hydrogen 3.040 N/A ALA 128.A N ALA 124.A O no hydrogen 2.839 N/A TYR 129.A N TYR 125.A O no hydrogen 2.882 N/A ARG 131.A NE ASP 136.A OD2 no hydrogen 2.890 N/A ARG 131.A NH2 ASP 136.A OD1 no hydrogen 2.783 N/A GLU 134.A N ASP 132.A OD1 no hydrogen 3.168 N/A ASP 136.A N ASP 132.A O no hydrogen 2.956 N/A ILE 137.A N LEU 133.A O no hydrogen 2.801 N/A THR 138.A N GLU 134.A O no hydrogen 2.727 N/A THR 138.A OG1 GLU 134.A O no hydrogen 2.755 N/A GLY 139.A N ALA 135.A O no hydrogen 2.963 N/A GLY 139.A N ASP 136.A O no hydrogen 3.270 N/A ASP 140.A N ILE 137.A O no hydrogen 2.922 N/A THR 141.A OG1 ILE 137.A O no hydrogen 2.803 N/A LYS 147.A N GLY 143.A O no hydrogen 3.209 N/A MET 148.A N HIS 144.A O no hydrogen 2.846 N/A LEU 149.A N PHE 145.A O no hydrogen 3.090 N/A VAL 150.A N ARG 146.A O no hydrogen 2.970 N/A VAL 151.A N LYS 147.A O no hydrogen 2.869 N/A LEU 152.A N MET 148.A O no hydrogen 2.974 N/A LEU 153.A N LEU 149.A O no hydrogen 2.913 N/A LEU 153.A N VAL 150.A O no hydrogen 3.014 N/A GLN 154.A N VAL 150.A O no hydrogen 3.226 N/A GLN 154.A NE2 GLU 134.A OE2 no hydrogen 2.869 N/A GLN 154.A NE2 VAL 150.A O no hydrogen 2.872 N/A ARG 157.A N ASN 115.A OD1 no hydrogen 3.330 N/A ARG 157.A NH1 ARG 197.A O no hydrogen 2.603 N/A ARG 157.A NH2 LEU 194.A O no hydrogen 3.307 N/A GLU 158.A N ASN 196.A O no hydrogen 2.857 N/A LEU 167.A N SER 164.A O no hydrogen 2.675 N/A LEU 167.A N SER 164.A OG no hydrogen 3.373 N/A VAL 168.A N SER 164.A O no hydrogen 3.019 N/A GLN 169.A N GLU 165.A O no hydrogen 3.167 N/A GLN 169.A NE2 GLU 208.A OE2 no hydrogen 2.876 N/A GLN 170.A N ASP 166.A O no hydrogen 3.170 N/A ASP 171.A N LEU 167.A O no hydrogen 2.860 N/A VAL 172.A N VAL 168.A O no hydrogen 2.954 N/A GLN 173.A N GLN 169.A O no hydrogen 3.203 N/A GLN 173.A NE2 GLN 169.A OE1 no hydrogen 2.974 N/A ASP 174.A N GLN 170.A O no hydrogen 3.058 N/A LEU 175.A N ASP 171.A O no hydrogen 2.848 N/A TYR 176.A N VAL 172.A O no hydrogen 2.969 N/A GLU 177.A N GLN 173.A O no hydrogen 2.820 N/A ALA 178.A N ASP 174.A O no hydrogen 2.979 N/A GLY 179.A N TYR 176.A O no hydrogen 3.370 N/A LEU 181.A N TYR 176.A O no hydrogen 3.058 N/A LYS 182.A N GLY 179.A O no hydrogen 2.752 N/A GLY 184.A N GLU 224.A OE1 no hydrogen 3.140 N/A THR 185.A OG1 GLU 224.A O no hydrogen 2.975 N/A ASP 186.A N ALA 178.A O no hydrogen 2.901 N/A GLN 189.A N ASP 186.A O no hydrogen 2.907 N/A GLN 189.A N ASP 186.A OD1 no hydrogen 3.347 N/A PHE 190.A N ASP 186.A O no hydrogen 3.091 N/A ILE 191.A N GLU 187.A O no hydrogen 2.925 N/A TYR 192.A N ALA 188.A O no hydrogen 3.369 N/A ILE 193.A N GLN 189.A O no hydrogen 3.243 N/A LEU 194.A N PHE 190.A O no hydrogen 2.880 N/A ASN 196.A N ILE 193.A O no hydrogen 3.290 N/A ASN 196.A ND2 TYR 192.A O no hydrogen 2.722 N/A ARG 197.A N ILE 193.A O no hydrogen 3.150 N/A ARG 197.A NE ASP 171.A OD2 no hydrogen 2.566 N/A GLN 200.A N ASP 160.A OD1 no hydrogen 3.407 N/A GLN 200.A NE2 ASP 161.A O no hydrogen 2.931 N/A HIS 201.A N SER 198.A OG no hydrogen 3.246 N/A HIS 201.A NE2 ASP 171.A OD2 no hydrogen 2.860 N/A LEU 202.A N SER 198.A O no hydrogen 2.893 N/A ARG 203.A N LYS 199.A O no hydrogen 2.923 N/A VAL 205.A N HIS 201.A O no hydrogen 2.940 N/A PHE 206.A N LEU 202.A O no hydrogen 2.667 N/A ASP 207.A N ARG 203.A O no hydrogen 3.160 N/A GLU 208.A N LEU 204.A O no hydrogen 2.996 N/A TYR 209.A N VAL 205.A O no hydrogen 2.783 N/A TYR 209.A OH SER 220.A OG no hydrogen 2.696 N/A LEU 210.A N PHE 206.A O no hydrogen 3.160 N/A LYS 211.A N ASP 207.A O no hydrogen 3.221 N/A LYS 211.A NZ GLU 208.A OE1 no hydrogen 3.056 N/A THR 212.A N GLU 208.A O no hydrogen 2.898 N/A THR 212.A OG1 GLU 208.A O no hydrogen 3.226 N/A GLY 214.A N LEU 210.A O no hydrogen 2.927 N/A LYS 215.A NZ GLU 180.A OE1 no hydrogen 3.257 N/A LYS 215.A NZ GLU 180.A OE2 no hydrogen 3.081 N/A ALA 219.A N PRO 216.A O no hydrogen 2.830 N/A SER 220.A N ILE 217.A O no hydrogen 3.013 N/A SER 220.A OG GLU 180.A OE1 no hydrogen 2.893 N/A SER 220.A OG TYR 209.A OH no hydrogen 2.696 N/A ILE 221.A N ILE 217.A O no hydrogen 3.190 N/A ILE 221.A N GLU 218.A O no hydrogen 3.158 N/A ARG 222.A N GLU 218.A O no hydrogen 2.837 N/A GLY 223.A N GLU 230.A OE1 no hydrogen 3.083 N/A GLY 223.A N GLU 230.A OE2 no hydrogen 3.109 N/A GLU 224.A N ILE 221.A O no hydrogen 2.784 N/A LEU 225.A N GLU 230.A OE1 no hydrogen 3.207 N/A GLU 230.A N GLY 227.A O no hydrogen 3.113 N/A LYS 231.A NZ GLU 103.A OE1 no hydrogen 3.547 N/A LYS 231.A NZ ASP 228.A OD1 no hydrogen 3.181 N/A LEU 232.A N ASP 228.A O no hydrogen 2.813 N/A MET 233.A N PHE 229.A O no hydrogen 2.788 N/A LEU 234.A N GLU 230.A O no hydrogen 2.880 N/A ALA 235.A N LYS 231.A O no hydrogen 2.876 N/A VAL 236.A N LEU 232.A O no hydrogen 2.967 N/A VAL 237.A N MET 233.A O no hydrogen 3.412 N/A LYS 238.A N LEU 234.A O no hydrogen 3.246 N/A LYS 238.A NZ GLU 249.A OE1 no hydrogen 3.190 N/A LYS 238.A NZ GLU 249.A OE2 no hydrogen 3.085 N/A CYS 239.A N ALA 235.A O no hydrogen 2.912 N/A CYS 239.A SG ALA 235.A O no hydrogen 3.318 N/A ILE 240.A N VAL 236.A O no hydrogen 2.871 N/A ARG 241.A N VAL 237.A O no hydrogen 2.941 N/A ARG 241.A NH1 GLU 218.A OE1 no hydrogen 2.883 N/A ARG 241.A NH1 GLU 218.A OE2 no hydrogen 2.748 N/A ARG 241.A NH2 GLU 218.A OE2 no hydrogen 2.610 N/A SER 242.A N LYS 238.A O no hydrogen 2.675 N/A SER 242.A OG GLU 319.A OE2 no hydrogen 2.695 N/A THR 243.A OG1 ASP 276.A OD2 no hydrogen 3.515 N/A TYR 246.A N SER 242.A O no hydrogen 3.140 N/A PHE 247.A N THR 243.A O no hydrogen 2.964 N/A ALA 248.A N ALA 244.A O no hydrogen 2.924 N/A GLU 249.A N GLU 245.A O no hydrogen 3.093 N/A ARG 250.A N TYR 246.A O no hydrogen 2.812 N/A LEU 251.A N PHE 247.A O no hydrogen 2.912 N/A PHE 252.A N ALA 248.A O no hydrogen 3.292 N/A LYS 253.A N GLU 249.A O no hydrogen 2.833 N/A LYS 253.A NZ GLU 614.A O no hydrogen 3.150 N/A LYS 253.A NZ ASP 617.A OD1 no hydrogen 3.210 N/A LYS 253.A NZ ASP 617.A OD2 no hydrogen 3.543 N/A ALA 254.A N ARG 250.A O no hydrogen 3.278 N/A ALA 254.A N LEU 251.A O no hydrogen 2.878 N/A MET 255.A N PHE 252.A O no hydrogen 3.204 N/A LYS 256.A NZ TYR 616.A O no hydrogen 3.341 N/A THR 260.A OG1 ASP 299.A OD2 no hydrogen 2.454 N/A ARG 261.A N ALA 254.A O no hydrogen 2.862 N/A ARG 261.A NH2 LYS 253.A O no hydrogen 3.001 N/A ARG 261.A NH2 LYS 256.A O no hydrogen 2.804 N/A THR 264.A N ARG 261.A O no hydrogen 2.713 N/A LEU 265.A N ARG 261.A O no hydrogen 3.158 N/A ILE 266.A N ASP 262.A O no hydrogen 2.809 N/A ARG 267.A N ASN 263.A O no hydrogen 3.355 N/A ARG 267.A NE GLU 108.A OE1 no hydrogen 3.148 N/A ARG 267.A NE GLU 108.A OE2 no hydrogen 3.201 N/A ARG 267.A NH1 GLU 91.A OE1 no hydrogen 3.225 N/A ARG 267.A NH2 GLU 108.A OE1 no hydrogen 3.081 N/A ILE 268.A N THR 264.A O no hydrogen 2.927 N/A MET 269.A N LEU 265.A O no hydrogen 2.893 N/A VAL 270.A N ILE 266.A O no hydrogen 2.958 N/A SER 271.A N ARG 267.A O no hydrogen 3.014 N/A SER 271.A OG ARG 267.A O no hydrogen 2.525 N/A SER 271.A OG ILE 268.A O no hydrogen 3.316 N/A ARG 272.A N ILE 268.A O no hydrogen 3.019 N/A ARG 272.A NE ASP 276.A OD1 no hydrogen 3.290 N/A ARG 272.A NH2 ASP 276.A OD2 no hydrogen 2.913 N/A SER 273.A OG VAL 270.A O no hydrogen 2.831 N/A LEU 275.A N ARG 272.A O no hydrogen 3.450 N/A LEU 278.A N ARG 2.A O no hydrogen 2.873 N/A ILE 280.A N ASP 276.A O no hydrogen 2.898 N/A ARG 281.A N MET 277.A O no hydrogen 3.074 N/A ARG 281.A NH1 CYS 312.A O no hydrogen 2.838 N/A GLU 282.A N LEU 278.A O no hydrogen 3.040 N/A ILE 283.A N ASP 279.A O no hydrogen 2.871 N/A PHE 284.A N ILE 280.A O no hydrogen 2.703 N/A ARG 285.A N ARG 281.A O no hydrogen 2.982 N/A THR 286.A OG1 GLU 282.A O no hydrogen 2.882 N/A LYS 287.A N ILE 283.A O no hydrogen 2.727 N/A LYS 287.A NZ GLU 245.A OE2 no hydrogen 2.700 N/A LYS 287.A NZ GLU 249.A OE1 no hydrogen 3.552 N/A TYR 288.A N PHE 284.A O no hydrogen 2.763 N/A LYS 290.A N GLU 289.A OE1 no hydrogen 2.860 N/A LYS 290.A NZ ASN 298.A OD1 no hydrogen 3.502 N/A SER 291.A OG SER 294.A OG no hydrogen 3.242 N/A SER 294.A N SER 291.A OG no hydrogen 3.137 N/A SER 294.A OG SER 291.A OG no hydrogen 3.242 N/A MET 295.A N SER 291.A O no hydrogen 2.924 N/A ILE 296.A N LEU 292.A O no hydrogen 3.009 N/A LYS 297.A N TYR 293.A O no hydrogen 2.916 N/A ASN 298.A N SER 294.A O no hydrogen 3.077 N/A ASP 299.A N MET 295.A O no hydrogen 3.120 N/A ASP 299.A N ILE 296.A O no hydrogen 3.223 N/A THR 300.A N ILE 296.A O no hydrogen 2.985 N/A THR 300.A OG1 ILE 296.A O no hydrogen 2.715 N/A TYR 304.A OH ASP 262.A OD1 no hydrogen 3.137 N/A LYS 305.A N SER 301.A O no hydrogen 3.158 N/A LYS 305.A NZ LYS 297.A O no hydrogen 3.549 N/A LYS 306.A N GLY 302.A O no hydrogen 3.241 N/A LYS 306.A NZ GLU 32.A OE1 no hydrogen 3.091 N/A THR 307.A N GLU 303.A O no hydrogen 2.713 N/A THR 307.A OG1 GLU 303.A O no hydrogen 2.617 N/A LEU 308.A N TYR 304.A O no hydrogen 3.160 N/A LEU 309.A N LYS 305.A O no hydrogen 2.855 N/A LYS 310.A N LYS 306.A O no hydrogen 3.036 N/A LYS 310.A N THR 307.A O no hydrogen 2.957 N/A LEU 311.A N THR 307.A O no hydrogen 2.831 N/A CYS 312.A N LEU 308.A O no hydrogen 2.899 N/A GLY 313.A N LEU 309.A O no hydrogen 3.221 N/A GLN 315.A NE2 ASN 542.A OD1 no hydrogen 2.900 N/A PHE 316.A N ASN 542.A O no hydrogen 3.250 N/A ALA 321.A N PHE 317.A O no hydrogen 2.830 N/A GLN 322.A N PRO 318.A O no hydrogen 3.368 N/A GLN 322.A NE2 ARG 241.A O no hydrogen 3.603 N/A VAL 323.A N GLU 319.A O no hydrogen 3.101 N/A ALA 324.A N ALA 320.A O no hydrogen 3.476 N/A TYR 325.A N ALA 321.A O no hydrogen 3.034 N/A GLN 326.A N GLN 322.A O no hydrogen 2.776 N/A MET 327.A N VAL 323.A O no hydrogen 2.736 N/A TRP 328.A N ALA 324.A O no hydrogen 3.398 N/A TRP 328.A N TYR 325.A O no hydrogen 3.040 N/A TRP 328.A NE1 ASP 544.A OD1 no hydrogen 3.094 N/A GLU 329.A N TYR 325.A O no hydrogen 3.030 N/A LEU 330.A N GLN 326.A O no hydrogen 2.981 N/A SER 331.A N MET 327.A O no hydrogen 3.356 N/A SER 331.A OG LYS 569.A O no hydrogen 3.157 N/A ALA 332.A N TRP 328.A O no hydrogen 2.896 N/A ALA 332.A N GLU 329.A O no hydrogen 3.134 N/A VAL 333.A N GLU 329.A O no hydrogen 2.901 N/A ALA 334.A N LEU 330.A O no hydrogen 2.728 N/A ARG 335.A N GLY 214.A O no hydrogen 2.489 N/A LYS 339.A N ASN 607.A OD1 no hydrogen 2.618 N/A LYS 339.A NZ GLU 337.A OE1 no hydrogen 3.087 N/A THR 341.A N SER 601.A O no hydrogen 2.825 N/A THR 341.A OG1 SER 601.A O no hydrogen 3.367 N/A THR 341.A OG1 ILE 639.A O no hydrogen 2.598 N/A VAL 342.A N SER 601.A O no hydrogen 3.359 N/A ALA 345.A N GLN 382.A OE1 no hydrogen 2.781 N/A ALA 352.A N ASN 349.A OD1 no hydrogen 3.136 N/A ASP 353.A N ASN 349.A O no hydrogen 2.986 N/A ALA 354.A N PRO 350.A O no hydrogen 2.759 N/A LYS 355.A N ASP 351.A O no hydrogen 3.285 N/A LYS 355.A NZ ASP 351.A O no hydrogen 3.221 N/A ALA 356.A N ALA 352.A O no hydrogen 3.130 N/A LEU 357.A N ASP 353.A O no hydrogen 2.909 N/A ARG 358.A N ALA 354.A O no hydrogen 2.899 N/A LYS 359.A N LYS 355.A O no hydrogen 2.860 N/A LYS 359.A NZ ASP 367.A OD2 no hydrogen 3.505 N/A ALA 360.A N ALA 356.A O no hydrogen 3.000 N/A MET 361.A N ARG 358.A O no hydrogen 3.336 N/A LYS 362.A N LYS 359.A O no hydrogen 3.379 N/A THR 370.A N ASP 367.A OD1 no hydrogen 3.270 N/A THR 370.A OG1 ASP 367.A OD2 no hydrogen 2.818 N/A ILE 372.A N GLU 368.A O no hydrogen 2.904 N/A ILE 372.A N ASP 369.A O no hydrogen 3.171 N/A ASP 373.A N ASP 369.A O no hydrogen 2.941 N/A ILE 374.A N THR 370.A O no hydrogen 3.283 N/A ILE 375.A N ILE 371.A O no hydrogen 3.289 N/A THR 376.A N ILE 372.A O no hydrogen 3.108 N/A THR 376.A OG1 ILE 372.A O no hydrogen 2.782 N/A HIS 377.A N ILE 374.A O no hydrogen 2.942 N/A HIS 377.A ND1 ASP 373.A O no hydrogen 2.715 N/A ARG 378.A NE ASP 353.A OD2 no hydrogen 2.673 N/A ARG 378.A NH1 HIS 377.A O no hydrogen 3.334 N/A ARG 378.A NH2 ASP 353.A OD1 no hydrogen 2.673 N/A ARG 378.A NH2 ASP 353.A OD2 no hydrogen 3.164 N/A SER 379.A N GLN 382.A OE1 no hydrogen 3.429 N/A ASN 380.A N GLU 602.A OE2 no hydrogen 2.682 N/A ASN 380.A ND2 MET 419.A O no hydrogen 2.728 N/A GLN 382.A N SER 379.A OG no hydrogen 3.325 N/A GLN 382.A NE2 ALA 345.A O no hydrogen 2.881 N/A ARG 383.A N SER 379.A O no hydrogen 2.858 N/A ARG 383.A NE ILE 375.A O no hydrogen 2.933 N/A ARG 383.A NH1 LEU 417.A O no hydrogen 2.642 N/A ARG 383.A NH2 ILE 375.A O no hydrogen 3.387 N/A GLN 384.A N ASN 380.A O no hydrogen 3.023 N/A GLN 384.A NE2 ASN 380.A O no hydrogen 2.906 N/A GLN 384.A NE2 ASN 380.A OD1 no hydrogen 3.117 N/A GLN 384.A NE2 MET 418.A O no hydrogen 3.029 N/A GLN 385.A N ALA 381.A O no hydrogen 3.094 N/A GLN 385.A N GLN 382.A O no hydrogen 3.040 N/A ILE 386.A N GLN 382.A O no hydrogen 3.021 N/A ARG 387.A N ARG 383.A O no hydrogen 3.026 N/A ARG 387.A NH1 MET 418.A O no hydrogen 3.169 N/A GLN 388.A N GLN 384.A O no hydrogen 3.095 N/A THR 389.A N GLN 385.A O no hydrogen 2.764 N/A THR 389.A OG1 GLN 385.A O no hydrogen 3.096 N/A THR 389.A OG1 GLN 385.A OE1 no hydrogen 2.992 N/A PHE 390.A N ILE 386.A O no hydrogen 2.873 N/A LYS 391.A N ARG 387.A O no hydrogen 2.993 N/A LYS 391.A NZ ASP 397.A OD2 no hydrogen 3.416 N/A SER 392.A N GLN 388.A O no hydrogen 2.840 N/A SER 392.A OG GLN 388.A O no hydrogen 3.219 N/A SER 392.A OG THR 389.A O no hydrogen 3.220 N/A HIS 393.A N PHE 390.A O no hydrogen 3.299 N/A HIS 393.A ND1 SER 392.A O no hydrogen 3.014 N/A HIS 393.A NE2 ASP 351.A OD1 no hydrogen 3.102 N/A PHE 394.A N PHE 390.A O no hydrogen 2.919 N/A GLY 395.A N LYS 391.A O no hydrogen 2.696 N/A ARG 396.A NE ASP 401.A OD2 no hydrogen 3.172 N/A ARG 396.A NH2 ASP 401.A OD1 no hydrogen 3.361 N/A ALA 400.A N ASP 397.A OD1 no hydrogen 2.954 N/A ASP 401.A N ASP 397.A O no hydrogen 3.179 N/A LEU 402.A N LEU 398.A O no hydrogen 2.699 N/A LYS 403.A N MET 399.A O no hydrogen 2.638 N/A SER 404.A N ALA 400.A O no hydrogen 3.127 N/A GLU 405.A N ASP 401.A O no hydrogen 2.960 N/A LEU 406.A N LEU 402.A O no hydrogen 2.854 N/A ALA 411.A N SER 407.A O no hydrogen 3.430 N/A ARG 412.A N GLY 408.A O no hydrogen 3.125 N/A LEU 413.A N ASP 409.A O no hydrogen 2.748 N/A ILE 414.A N LEU 410.A O no hydrogen 2.758 N/A LEU 415.A N ALA 411.A O no hydrogen 2.975 N/A GLY 416.A N ARG 412.A O no hydrogen 3.000 N/A LEU 417.A N LEU 413.A O no hydrogen 2.969 N/A MET 418.A N ILE 414.A O no hydrogen 3.145 N/A MET 419.A N GLY 416.A O no hydrogen 3.339 N/A HIS 423.A N PRO 420.A O no hydrogen 2.791 N/A HIS 423.A ND1 ASP 465.A OD2 no hydrogen 3.204 N/A TYR 424.A N PRO 420.A O no hydrogen 2.943 N/A ASP 425.A N PRO 421.A O no hydrogen 3.205 N/A ALA 426.A N ALA 422.A O no hydrogen 3.376 N/A LYS 427.A N HIS 423.A O no hydrogen 2.874 N/A GLN 428.A N TYR 424.A O no hydrogen 2.860 N/A GLN 428.A NE2 TYR 424.A O no hydrogen 3.695 N/A LEU 429.A N ASP 425.A O no hydrogen 2.803 N/A LYS 430.A N ALA 426.A O no hydrogen 3.018 N/A LYS 430.A NZ GLU 434.A OE1 no hydrogen 2.973 N/A LYS 431.A N LYS 427.A O no hydrogen 2.957 N/A LYS 431.A NZ GLU 434.A OE1 no hydrogen 3.257 N/A LYS 431.A NZ GLU 434.A OE2 no hydrogen 3.092 N/A ALA 432.A N GLN 428.A O no hydrogen 3.005 N/A MET 433.A N LEU 429.A O no hydrogen 3.276 N/A MET 433.A N LYS 430.A O no hydrogen 3.292 N/A GLU 434.A N LYS 431.A O no hydrogen 3.094 N/A THR 438.A OG1 ASP 477.A O no hydrogen 3.111 N/A THR 438.A OG1 ASP 477.A OD2 no hydrogen 2.477 N/A ASP 439.A N ALA 432.A O no hydrogen 2.978 N/A LYS 441.A NZ GLU 589.A OE1 no hydrogen 3.071 N/A LYS 441.A NZ GLU 589.A OE2 no hydrogen 2.598 N/A LYS 441.A NZ THR 592.A OG1 no hydrogen 2.938 N/A ALA 442.A N ASP 439.A O no hydrogen 2.633 N/A ALA 442.A N ASP 439.A OD1 no hydrogen 3.074 N/A LEU 443.A N ASP 439.A O no hydrogen 3.340 N/A ILE 444.A N GLU 440.A O no hydrogen 3.105 N/A GLU 445.A N LYS 441.A O no hydrogen 3.112 N/A ILE 446.A N ALA 442.A O no hydrogen 3.157 N/A LEU 447.A N LEU 443.A O no hydrogen 2.786 N/A ALA 448.A N ILE 444.A O no hydrogen 2.713 N/A THR 449.A N ILE 446.A O no hydrogen 2.954 N/A ARG 450.A N ILE 446.A O no hydrogen 2.908 N/A ARG 450.A NE ASP 425.A OD2 no hydrogen 3.291 N/A ARG 450.A NH2 ASP 425.A OD1 no hydrogen 3.370 N/A THR 451.A N GLU 454.A OE1 no hydrogen 2.801 N/A ASN 452.A ND2 ARG 494.A O no hydrogen 2.800 N/A ASN 452.A ND2 GLU 496.A OE2 no hydrogen 3.351 N/A GLU 454.A N THR 451.A OG1 no hydrogen 3.237 N/A ILE 455.A N THR 451.A O no hydrogen 2.635 N/A GLN 456.A N ASN 452.A O no hydrogen 2.866 N/A GLN 456.A NE2 GLY 492.A O no hydrogen 2.901 N/A ALA 457.A N ALA 453.A O no hydrogen 2.962 N/A ILE 458.A N GLU 454.A O no hydrogen 2.870 N/A ASN 459.A N ILE 455.A O no hydrogen 2.749 N/A ASN 459.A ND2 ILE 455.A O no hydrogen 2.736 N/A ASN 459.A ND2 ALA 490.A O no hydrogen 3.013 N/A LYS 460.A N GLN 456.A O no hydrogen 3.053 N/A ALA 461.A N ALA 457.A O no hydrogen 2.918 N/A TYR 462.A N ILE 458.A O no hydrogen 2.827 N/A LYS 463.A N ASN 459.A O no hydrogen 3.376 N/A GLU 464.A N LYS 460.A O no hydrogen 3.200 N/A ASP 465.A N ALA 461.A O no hydrogen 3.185 N/A TYR 466.A N TYR 462.A O no hydrogen 2.778 N/A LYS 468.A NZ SER 476.A OG no hydrogen 3.151 N/A ASP 472.A N THR 469.A OG1 no hydrogen 3.096 N/A ALA 473.A N THR 469.A O no hydrogen 3.064 N/A LEU 474.A N LEU 470.A O no hydrogen 3.192 N/A SER 475.A N GLU 471.A O no hydrogen 2.884 N/A SER 475.A OG GLU 471.A O no hydrogen 2.635 N/A SER 475.A OG ASP 472.A O no hydrogen 3.316 N/A SER 476.A N ALA 473.A O no hydrogen 2.928 N/A SER 476.A OG ASP 472.A O no hydrogen 3.067 N/A ASP 477.A N ALA 473.A O no hydrogen 3.240 N/A ASP 477.A N LEU 474.A O no hydrogen 3.346 N/A THR 478.A N LEU 474.A O no hydrogen 2.976 N/A THR 478.A OG1 LEU 474.A O no hydrogen 2.593 N/A LYS 483.A N SER 479.A O no hydrogen 3.398 N/A ARG 484.A N GLY 480.A O no hydrogen 3.271 N/A ARG 484.A NH2 HIS 481.A ND1 no hydrogen 3.220 N/A ILE 485.A N HIS 481.A O no hydrogen 2.810 N/A LEU 486.A N PHE 482.A O no hydrogen 3.037 N/A ILE 487.A N LYS 483.A O no hydrogen 2.838 N/A SER 488.A N ARG 484.A O no hydrogen 3.121 N/A LEU 489.A N ILE 485.A O no hydrogen 3.214 N/A ALA 490.A N LEU 486.A O no hydrogen 2.910 N/A THR 491.A N SER 488.A O no hydrogen 3.187 N/A THR 491.A OG1 SER 488.A O no hydrogen 2.684 N/A GLY 492.A N LEU 489.A O no hydrogen 3.201 N/A ARG 494.A N ASN 452.A OD1 no hydrogen 2.872 N/A ARG 494.A NH1 LEU 522.A O no hydrogen 3.035 N/A ARG 494.A NH1 ARG 525.A O no hydrogen 2.766 N/A ARG 494.A NH2 LEU 522.A O no hydrogen 3.435 N/A GLU 495.A N THR 524.A O no hydrogen 2.804 N/A ASP 500.A N ASP 529.A OD1 no hydrogen 3.127 N/A GLU 502.A N ASP 500.A OD1 no hydrogen 3.184 N/A ARG 503.A N ASP 500.A OD2 no hydrogen 2.875 N/A ARG 503.A NH1 GLU 495.A OE1 no hydrogen 3.360 N/A ALA 504.A N ASP 500.A O no hydrogen 2.828 N/A ARG 505.A N ARG 501.A O no hydrogen 3.478 N/A ASP 507.A N ARG 503.A O no hydrogen 2.733 N/A ALA 508.A N ALA 504.A O no hydrogen 2.736 N/A GLN 509.A N ARG 505.A O no hydrogen 3.115 N/A VAL 510.A N GLU 506.A O no hydrogen 3.231 N/A ALA 511.A N ASP 507.A O no hydrogen 3.266 N/A ALA 512.A N ALA 508.A O no hydrogen 3.077 N/A GLU 513.A N GLN 509.A O no hydrogen 2.989 N/A ILE 514.A N VAL 510.A O no hydrogen 3.375 N/A LEU 515.A N ALA 512.A O no hydrogen 3.367 N/A MET 520.A N THR 516.A O no hydrogen 3.029 N/A ILE 521.A N ARG 517.A O no hydrogen 2.847 N/A LEU 522.A N PHE 518.A O no hydrogen 2.861 N/A CYS 523.A N MET 519.A O no hydrogen 2.681 N/A THR 524.A N MET 520.A O no hydrogen 2.572 N/A THR 524.A OG1 MET 520.A O no hydrogen 2.643 N/A ARG 525.A N ILE 521.A O no hydrogen 3.195 N/A SER 526.A OG GLY 497.A O no hydrogen 2.930 N/A TYR 527.A OH SER 567.A OG no hydrogen 2.822 N/A ASP 529.A N SER 526.A OG no hydrogen 3.282 N/A LEU 530.A N SER 526.A O no hydrogen 2.988 N/A ARG 531.A N TYR 527.A O no hydrogen 2.931 N/A ARG 531.A NE SER 331.A OG no hydrogen 2.671 N/A ARG 531.A NE VAL 568.A O no hydrogen 2.912 N/A ARG 532.A NE GLU 499.A OE2 no hydrogen 2.636 N/A VAL 533.A N ASP 529.A O no hydrogen 2.825 N/A PHE 534.A N LEU 530.A O no hydrogen 2.890 N/A GLN 535.A N ARG 531.A O no hydrogen 3.296 N/A GLN 535.A N ARG 532.A O no hydrogen 2.757 N/A GLN 535.A NE2 GLU 329.A OE1 no hydrogen 3.318 N/A GLU 536.A N ARG 532.A O no hydrogen 2.939 N/A PHE 537.A N VAL 533.A O no hydrogen 2.982 N/A VAL 538.A N PHE 534.A O no hydrogen 3.295 N/A LYS 539.A N GLN 535.A O no hydrogen 3.321 N/A LYS 539.A NZ GLU 536.A OE2 no hydrogen 3.176 N/A MET 540.A N PHE 537.A O no hydrogen 3.127 N/A THR 541.A N PHE 537.A O no hydrogen 2.892 N/A THR 541.A OG1 PHE 537.A O no hydrogen 3.060 N/A ASN 542.A N VAL 538.A O no hydrogen 3.095 N/A TYR 543.A N THR 541.A OG1 no hydrogen 3.007 N/A HIS 547.A N ASP 544.A O no hydrogen 2.783 N/A THR 548.A N ASP 544.A O no hydrogen 3.423 N/A ILE 549.A N VAL 545.A O no hydrogen 2.931 N/A LYS 550.A N GLU 546.A O no hydrogen 2.969 N/A LYS 551.A N HIS 547.A O no hydrogen 3.089 N/A GLU 552.A N THR 548.A O no hydrogen 3.062 N/A MET 553.A N ILE 549.A O no hydrogen 2.636 N/A ARG 558.A N SER 554.A O no hydrogen 3.274 N/A ASP 559.A N GLY 555.A O no hydrogen 2.934 N/A VAL 560.A N ASP 556.A O no hydrogen 2.871 N/A VAL 562.A N ARG 558.A O no hydrogen 3.116 N/A ALA 563.A N ASP 559.A O no hydrogen 2.915 N/A ILE 564.A N VAL 560.A O no hydrogen 2.889 N/A VAL 565.A N PHE 561.A O no hydrogen 2.839 N/A GLN 566.A N VAL 562.A O no hydrogen 2.855 N/A SER 567.A N ALA 563.A O no hydrogen 2.799 N/A SER 567.A OG ALA 448.A O no hydrogen 3.370 N/A SER 567.A OG TYR 527.A OH no hydrogen 2.822 N/A VAL 568.A N ILE 564.A O no hydrogen 2.940 N/A VAL 568.A N VAL 565.A O no hydrogen 3.193 N/A LYS 569.A N VAL 565.A O no hydrogen 2.884 N/A ASN 570.A N GLN 566.A O no hydrogen 2.869 N/A ASN 570.A ND2 GLU 611.A OE2 no hydrogen 2.605 N/A LYS 571.A NZ THR 449.A O no hydrogen 2.737 N/A LEU 573.A N ASN 570.A OD1 no hydrogen 3.116 N/A PHE 574.A N ASN 570.A O no hydrogen 3.071 N/A PHE 575.A N LYS 571.A O no hydrogen 3.151 N/A ALA 576.A N PRO 572.A O no hydrogen 2.951 N/A ASP 577.A N LEU 573.A O no hydrogen 2.742 N/A LYS 578.A N PHE 574.A O no hydrogen 3.114 N/A LEU 579.A N PHE 575.A O no hydrogen 2.748 N/A TYR 580.A N ALA 576.A O no hydrogen 3.022 N/A LYS 581.A N ASP 577.A O no hydrogen 3.208 N/A SER 582.A N LYS 578.A O no hydrogen 3.177 N/A SER 582.A OG LEU 579.A O no hydrogen 2.514 N/A MET 583.A N TYR 580.A O no hydrogen 3.119 N/A LYS 584.A N LYS 581.A O no hydrogen 2.814 N/A LYS 584.A NZ LYS 581.A O no hydrogen 3.540 N/A LYS 584.A NZ LYS 584.A O no hydrogen 2.940 N/A THR 588.A OG1 ASP 627.A OD2 no hydrogen 2.453 N/A GLU 589.A N SER 582.A O no hydrogen 2.876 N/A LYS 591.A NZ ASP 439.A OD2 no hydrogen 2.735 N/A LEU 593.A N GLU 589.A O no hydrogen 2.905 N/A THR 594.A N GLU 590.A O no hydrogen 2.792 N/A THR 594.A OG1 GLU 590.A O no hydrogen 2.624 N/A ARG 595.A N LYS 591.A O no hydrogen 2.841 N/A ARG 595.A NE GLU 445.A OE2 no hydrogen 2.905 N/A ARG 595.A NH2 GLU 445.A OE1 no hydrogen 2.762 N/A ILE 596.A N THR 592.A O no hydrogen 3.026 N/A MET 597.A N LEU 593.A O no hydrogen 3.284 N/A VAL 598.A N THR 594.A O no hydrogen 2.975 N/A SER 599.A N ARG 595.A O no hydrogen 2.925 N/A SER 599.A OG ARG 595.A O no hydrogen 2.587 N/A SER 599.A OG ILE 596.A O no hydrogen 3.320 N/A ARG 600.A N ILE 596.A O no hydrogen 3.132 N/A ARG 600.A NE ASP 604.A OD1 no hydrogen 2.989 N/A ARG 600.A NH2 ASP 604.A OD1 no hydrogen 3.098 N/A ARG 600.A NH2 ASP 604.A OD2 no hydrogen 2.687 N/A SER 601.A N VAL 598.A O no hydrogen 2.901 N/A SER 601.A OG VAL 598.A O no hydrogen 2.753 N/A ILE 603.A N ARG 600.A O no hydrogen 3.110 N/A LEU 606.A N LYS 339.A O no hydrogen 2.943 N/A ASN 607.A ND2 GLU 337.A O no hydrogen 3.218 N/A ILE 608.A N ASP 604.A O no hydrogen 2.959 N/A ARG 609.A N LEU 605.A O no hydrogen 2.832 N/A ARG 609.A NH1 CYS 640.A O no hydrogen 2.708 N/A ARG 609.A NH1 GLY 641.A O no hydrogen 2.869 N/A ARG 610.A N LEU 606.A O no hydrogen 3.235 N/A ARG 610.A N ASN 607.A O no hydrogen 3.181 N/A GLU 611.A N ASN 607.A O no hydrogen 3.202 N/A PHE 612.A N ILE 608.A O no hydrogen 2.983 N/A ILE 613.A N ARG 609.A O no hydrogen 3.263 N/A GLU 614.A N ARG 610.A O no hydrogen 2.909 N/A LYS 615.A N GLU 611.A O no hydrogen 3.328 N/A LYS 615.A NZ ASP 577.A OD1 no hydrogen 2.848 N/A LYS 615.A NZ ASP 577.A OD2 no hydrogen 3.193 N/A LYS 615.A NZ TYR 616.A OH no hydrogen 3.317 N/A TYR 616.A N PHE 612.A O no hydrogen 2.927 N/A TYR 616.A OH ASP 577.A OD1 no hydrogen 2.729 N/A SER 619.A N GLN 622.A OE1 no hydrogen 3.236 N/A HIS 621.A ND1 GLU 625.A OE1 no hydrogen 2.825 N/A GLN 622.A N SER 619.A OG no hydrogen 3.041 N/A ALA 623.A N SER 619.A O no hydrogen 2.890 N/A ILE 624.A N LEU 620.A O no hydrogen 2.741 N/A GLU 625.A N HIS 621.A O no hydrogen 2.663 N/A GLY 626.A N GLN 622.A O no hydrogen 2.982 N/A ASP 627.A N ILE 624.A O no hydrogen 2.960 N/A THR 628.A N ILE 624.A O no hydrogen 2.916 N/A THR 628.A OG1 ILE 624.A O no hydrogen 3.165 N/A LYS 634.A N GLY 630.A O no hydrogen 3.409 N/A LYS 634.A NZ ASP 373.A OD1 no hydrogen 2.956 N/A ALA 635.A N HIS 631.A O no hydrogen 2.977 N/A LEU 636.A N PHE 632.A O no hydrogen 3.164 N/A LEU 637.A N LEU 633.A O no hydrogen 2.916 N/A ALA 638.A N ALA 635.A O no hydrogen 3.009 N/A ILE 639.A N ALA 635.A O no hydrogen 3.238 N/A CYS 640.A N LEU 636.A O no hydrogen 3.012 N/A CYS 640.A SG GLY 642.A O no hydrogen 3.388 N/A