Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4xqf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 5.A N ASP 1.A O no hydrogen 2.833 N/A ARG 6.A N PRO 2.A O no hydrogen 3.108 N/A ARG 6.A NE GLU 10.A OE2 no hydrogen 3.492 N/A ALA 7.A N ASP 3.A O no hydrogen 2.921 N/A ILE 8.A N GLN 4.A O no hydrogen 2.868 N/A ILE 9.A N PHE 5.A O no hydrogen 2.945 N/A GLU 10.A N ARG 6.A O no hydrogen 3.095 N/A SER 11.A N ILE 8.A O no hydrogen 3.103 N/A SER 11.A OG ILE 8.A O no hydrogen 2.676 N/A GLU 13.A N SER 11.A OG no hydrogen 3.044 N/A GLY 14.A N SER 11.A O no hydrogen 2.951 N/A GLY 16.A N GLU 13.A O no hydrogen 2.946 N/A HIS 17.A N GLY 14.A O no hydrogen 2.896 N/A HIS 17.A ND1 GLU 13.A O no hydrogen 2.946 N/A VAL 18.A N ALA 15.A O no hydrogen 3.460 N/A TYR 20.A N ARG 31.A O no hydrogen 2.837 N/A GLN 21.A NE2 THR 26.A O no hydrogen 3.576 N/A GLN 21.A NE2 SER 28.A O no hydrogen 2.762 N/A ARG 24.A N GLN 21.A O no hydrogen 3.160 N/A ASN 25.A N TYR 22.A O no hydrogen 2.745 N/A ASN 25.A ND2 SER 28.A OG no hydrogen 2.979 N/A GLY 27.A N ASN 25.A OD1 no hydrogen 3.262 N/A SER 28.A N ASN 25.A O no hydrogen 2.996 N/A ARG 31.A N TYR 20.A O no hydrogen 2.854 N/A ARG 31.A NH1 GLU 39.A OE2 no hydrogen 2.866 N/A ARG 31.A NH2 GLU 39.A OE2 no hydrogen 2.862 N/A MET 32.A N ASP 35.A OD2 no hydrogen 2.815 N/A VAL 33.A N VAL 18.A O no hydrogen 2.750 N/A SER 34.A N ALA 15.A O no hydrogen 3.082 N/A ASP 35.A N MET 32.A O no hydrogen 2.940 N/A VAL 36.A N VAL 33.A O no hydrogen 2.894 N/A LEU 37.A N VAL 33.A O no hydrogen 3.006 N/A ASP 38.A N SER 34.A O no hydrogen 2.871 N/A GLU 39.A N VAL 36.A O no hydrogen 3.046 N/A ARG 40.A N LEU 37.A O no hydrogen 3.282 N/A ARG 40.A NE LEU 37.A O no hydrogen 2.816 N/A ARG 40.A NH1 ASP 45.A OD2 no hydrogen 2.931 N/A ARG 40.A NH2 LEU 37.A O no hydrogen 3.342 N/A ARG 40.A NH2 ASP 45.A OD1 no hydrogen 3.551 N/A ARG 40.A NH2 ASP 45.A OD2 no hydrogen 3.156 N/A SER 42.A N ASP 45.A OD2 no hydrogen 3.014 N/A LEU 43.A N THR 83.A O no hydrogen 2.955 N/A ASP 45.A N SER 42.A O no hydrogen 3.021 N/A PHE 46.A N LEU 43.A O no hydrogen 2.939 N/A HIS 47.A ND1 ILE 55.A O no hydrogen 2.781 N/A HIS 47.A NE2 SER 63.A OG no hydrogen 2.753 N/A CYS 48.A SG PHE 46.A O no hydrogen 3.998 N/A CYS 48.A SG ASP 49.A O no hydrogen 3.741 N/A ASP 49.A N ASN 53.A O no hydrogen 2.822 N/A SER 51.A N ASP 49.A OD1 no hydrogen 2.858 N/A GLY 52.A N ASP 49.A O no hydrogen 2.892 N/A ASN 53.A N ASP 49.A OD1 no hydrogen 2.917 N/A ILE 55.A N HIS 47.A O no hydrogen 2.889 N/A VAL 61.A N GLY 58.A O no hydrogen 3.009 N/A SER 63.A N TYR 91.A O no hydrogen 2.833 N/A SER 63.A OG HIS 47.A NE2 no hydrogen 2.753 N/A SER 63.A OG TYR 91.A O no hydrogen 3.552 N/A ARG 64.A N ASP 62.A OD1 no hydrogen 3.051 N/A ARG 64.A NE SER 94.A OG no hydrogen 2.722 N/A TYR 66.A N SER 63.A O no hydrogen 3.120 N/A LEU 67.A N SER 63.A O no hydrogen 3.063 N/A GLN 68.A N ARG 64.A O no hydrogen 2.892 N/A GLN 68.A NE2 GLN 68.A O no hydrogen 3.562 N/A GLN 68.A NE2 ASP 72.A OD1 no hydrogen 2.944 N/A GLN 68.A NE2 GLN 108.A O no hydrogen 2.944 N/A ALA 69.A N GLN 65.A O no hydrogen 2.934 N/A ALA 70.A N TYR 66.A O no hydrogen 3.049 N/A ILE 71.A N LEU 67.A O no hydrogen 2.985 N/A ASP 72.A N GLN 68.A O no hydrogen 2.865 N/A TYR 73.A N ALA 69.A O no hydrogen 2.948 N/A VAL 74.A N ALA 70.A O no hydrogen 2.966 N/A SER 75.A N ILE 71.A O no hydrogen 2.923 N/A SER 76.A N ASP 72.A O no hydrogen 3.110 N/A SER 76.A OG TYR 73.A O no hydrogen 2.587 N/A ASN 77.A N VAL 74.A O no hydrogen 3.023 N/A GLY 78.A N SER 75.A O no hydrogen 2.977 N/A GLY 79.A N VAL 74.A O no hydrogen 3.060 N/A GLY 80.A N ASN 112.A O no hydrogen 2.928 N/A ILE 82.A N ASN 114.A O no hydrogen 2.919 N/A THR 83.A N VAL 41.A O no hydrogen 3.083 N/A ILE 84.A N ASN 116.A O no hydrogen 2.911 N/A TRP 90.A N ARG 120.A O no hydrogen 2.773 N/A TRP 90.A NE1 PRO 85.A O no hydrogen 3.248 N/A LEU 92.A N HIS 122.A O.A no hydrogen 2.851 N/A LEU 92.A N HIS 122.A O.B no hydrogen 2.932 N/A GLY 93.A N ASP 62.A OD1 no hydrogen 2.851 N/A SER 94.A OG ASP 62.A OD2 no hydrogen 2.606 N/A TYR 95.A OH PRO 131.A O no hydrogen 2.582 N/A GLY 96.A N GLY 105.A O no hydrogen 2.994 N/A ALA 101.A N GLY 98.A O no hydrogen 2.926 N/A HIS 103.A N ILE 100.A O no hydrogen 2.896 N/A HIS 103.A NE2 ASN 140.A O no hydrogen 2.828 N/A SER 104.A N ALA 101.A O no hydrogen 3.174 N/A GLY 105.A N ILE 100.A O no hydrogen 2.993 N/A ILE 106.A N GLN 133.A O no hydrogen 2.912 N/A ILE 107.A N VAL 134.A O no hydrogen 2.848 N/A GLN 108.A N GLN 68.A OE1 no hydrogen 2.811 N/A LEU 109.A N VAL 136.A O no hydrogen 2.899 N/A ARG 110.A NE ASP 72.A OD1 no hydrogen 2.841 N/A ARG 110.A NH2 ASP 72.A OD1 no hydrogen 3.247 N/A ASN 112.A N GLU 150.A O no hydrogen 2.893 N/A VAL 113.A N ARG 110.A O no hydrogen 3.180 N/A ASN 114.A N GLY 80.A O no hydrogen 2.831 N/A LEU 115.A N HIS 153.A O no hydrogen 2.879 N/A ASN 116.A N ILE 82.A O no hydrogen 2.874 N/A ILE 117.A N TYR 155.A O no hydrogen 2.759 N/A GLU 118.A N ILE 84.A O no hydrogen 3.023 N/A GLY 119.A N ILE 84.A O no hydrogen 3.024 N/A ARG 120.A N TYR 88.A O no hydrogen 3.068 N/A ARG 120.A NE HIS 122.A NE2.A no hydrogen 2.959 N/A ARG 120.A NH2 HIS 122.A NE2.A no hydrogen 3.178 N/A ILE 121.A N VAL 159.A O no hydrogen 2.826 N/A HIS 122.A N.A TRP 90.A O no hydrogen 2.977 N/A HIS 122.A N.B TRP 90.A O no hydrogen 2.982 N/A LEU 123.A N ASP 161.A O no hydrogen 3.077 N/A SER 124.A N LEU 92.A O no hydrogen 2.983 N/A SER 124.A OG LEU 92.A O no hydrogen 3.455 N/A PHE 127.A N SER 124.A O no hydrogen 3.078 N/A ASP 128.A N PRO 125.A O no hydrogen 3.020 N/A LYS 130.A N PHE 127.A O no hydrogen 2.998 N/A LYS 130.A NZ PHE 126.A O no hydrogen 2.748 N/A GLN 133.A N SER 104.A O no hydrogen 2.990 N/A GLN 133.A NE2 HIS 103.A O no hydrogen 3.011 N/A VAL 134.A N ASN 175.A O no hydrogen 3.015 N/A PHE 135.A N GLY 176.A O no hydrogen 2.878 N/A VAL 136.A N ILE 107.A O no hydrogen 2.825 N/A GLY 137.A N ALA 178.A O no hydrogen 2.782 N/A ASP 139.A N SER 146.A OG no hydrogen 2.976 N/A ASP 142.A N ASN 140.A OD1 no hydrogen 2.829 N/A ALA 144.A N ASP 142.A OD1 no hydrogen 2.898 N/A SER 145.A N ASP 142.A O no hydrogen 2.944 N/A SER 145.A OG ASP 142.A OD2 no hydrogen 3.365 N/A SER 146.A N PRO 143.A O no hydrogen 3.177 N/A SER 146.A OG ASP 139.A OD1 no hydrogen 3.219 N/A SER 146.A OG GLY 147.A O no hydrogen 2.773 N/A GLY 147.A N ASP 139.A OD1 no hydrogen 2.859 N/A ASN 148.A ND2 GLU 150.A OE2 no hydrogen 3.387 N/A LEU 149.A N ARG 181.A O no hydrogen 2.941 N/A GLU 150.A N SER 111.A OG no hydrogen 2.871 N/A ASN 151.A N TYR 183.A O no hydrogen 2.928 N/A ASN 151.A ND2 ASN 112.A OD1 no hydrogen 2.974 N/A CYS 152.A SG VAL 113.A O no hydrogen 3.473 N/A HIS 153.A N ASN 114.A OD1 no hydrogen 2.816 N/A HIS 153.A ND1 SER 186.A OG no hydrogen 2.642 N/A ILE 154.A N SER 186.A O no hydrogen 2.864 N/A TYR 155.A N LEU 115.A O no hydrogen 2.989 N/A GLY 156.A N THR 188.A O no hydrogen 3.130 N/A HIS 157.A N GLU 118.A OE2 no hydrogen 3.129 N/A HIS 157.A ND1 GLU 118.A OE1 no hydrogen 2.894 N/A GLY 158.A N ILE 117.A O no hydrogen 2.955 N/A VAL 159.A N GLY 119.A O no hydrogen 3.194 N/A VAL 160.A N THR 191.A O no hydrogen 2.814 N/A ASP 161.A N ILE 121.A O no hydrogen 2.803 N/A PHE 162.A N GLN 193.A O no hydrogen 3.048 N/A GLY 163.A N ASP 161.A OD1 no hydrogen 2.845 N/A GLY 164.A N ASN 194.A O.A no hydrogen 3.067 N/A GLY 164.A N ASN 194.A O.B no hydrogen 2.643 N/A TYR 165.A OH LEU 123.A O no hydrogen 3.086 N/A PHE 167.A N ASP 196.A OD2 no hydrogen 2.905 N/A GLY 168.A N GLN 172.A OE1 no hydrogen 2.944 N/A ALA 169.A N GLN 172.A OE1 no hydrogen 3.149 N/A SER 170.A OG.A VAL 227.A O no hydrogen 2.696 N/A GLN 172.A N ALA 169.A O no hydrogen 3.043 N/A GLN 172.A NE2 LEU 129.A O no hydrogen 2.969 N/A ARG 174.A N THR 198.A OG1 no hydrogen 3.120 N/A ARG 174.A NE LYS 130.A O no hydrogen 2.873 N/A ARG 174.A NH1 TYR 165.A O no hydrogen 2.858 N/A ARG 174.A NH1 ASP 196.A O no hydrogen 2.906 N/A ARG 174.A NH2 LYS 130.A O no hydrogen 3.010 N/A ARG 174.A NH2 GLU 166.A O no hydrogen 2.874 N/A ASN 175.A N PHE 132.A O no hydrogen 2.937 N/A ASN 175.A ND2 GLN 133.A OE1 no hydrogen 3.117 N/A ASN 175.A ND2 VAL 177.A O no hydrogen 3.695 N/A ASN 175.A ND2 THR 202.A OG1 no hydrogen 3.119 N/A VAL 177.A N ALA 200.A O no hydrogen 2.799 N/A ALA 178.A N PHE 135.A O no hydrogen 2.749 N/A PHE 179.A N THR 202.A O no hydrogen 3.151 N/A ARG 181.A NH1 PRO 143.A O no hydrogen 3.048 N/A ARG 181.A NH1 ALA 144.A O no hydrogen 3.257 N/A SER 182.A OG GLY 180.A O no hydrogen 3.385 N/A TYR 183.A N LEU 149.A O no hydrogen 2.901 N/A ASN 184.A N SER 210.A O no hydrogen 2.874 N/A ASN 184.A ND2 ASN 151.A OD1 no hydrogen 2.904 N/A CYS 185.A SG LEU 149.A O no hydrogen 3.626 N/A CYS 185.A SG TYR 183.A O no hydrogen 3.780 N/A SER 186.A N CYS 152.A O no hydrogen 3.091 N/A SER 186.A OG HIS 153.A ND1 no hydrogen 2.642 N/A VAL 187.A N TYR 213.A O no hydrogen 2.941 N/A THR 188.A N ILE 154.A O no hydrogen 2.870 N/A GLY 189.A N ARG 215.A O no hydrogen 3.147 N/A THR 191.A N GLY 158.A O no hydrogen 3.206 N/A PHE 192.A N ARG 218.A O no hydrogen 2.857 N/A GLN 193.A N VAL 160.A O no hydrogen 2.948 N/A GLN 193.A NE2 ASP 161.A OD2 no hydrogen 2.923 N/A ASN 194.A N.A ILE 220.A O no hydrogen 3.062 N/A ASN 194.A N.B ILE 220.A O no hydrogen 3.089 N/A ASN 194.A ND2.A ASP 161.A OD2 no hydrogen 3.086 N/A ASN 194.A ND2.B ASP 161.A OD1 no hydrogen 2.907 N/A GLY 195.A N ASN 221.A O no hydrogen 2.889 N/A VAL 197.A N LEU 222.A O no hydrogen 2.945 N/A THR 198.A N ARG 174.A O no hydrogen 2.872 N/A TRP 199.A N ARG 174.A O no hydrogen 3.069 N/A ALA 200.A N THR 233.A O no hydrogen 2.741 N/A ILE 201.A N THR 233.A O no hydrogen 3.120 N/A THR 202.A N VAL 177.A O no hydrogen 2.794 N/A LEU 203.A N TYR 235.A O.A no hydrogen 2.837 N/A LEU 203.A N TYR 235.A O.B no hydrogen 2.797 N/A GLY 204.A N SER 182.A OG no hydrogen 2.996 N/A TRP 205.A N TYR 208.A O no hydrogen 3.143 N/A GLY 207.A N ASN 237.A O no hydrogen 2.970 N/A TYR 208.A N TRP 205.A O no hydrogen 2.847 N/A SER 210.A N SER 182.A O no hydrogen 2.912 N/A ASN 211.A ND2 TYR 240.A O no hydrogen 3.256 N/A CYS 212.A N SER 241.A OG no hydrogen 2.968 N/A CYS 212.A SG SER 182.A O no hydrogen 3.124 N/A CYS 212.A SG SER 182.A OG no hydrogen 3.232 N/A CYS 212.A SG SER 210.A O no hydrogen 3.605 N/A TYR 213.A N CYS 185.A O no hydrogen 3.101 N/A VAL 214.A N GLY 242.A O no hydrogen 3.019 N/A ARG 215.A N VAL 187.A O no hydrogen 3.018 N/A ARG 215.A NE GLU 244.A OE2 no hydrogen 2.893 N/A LYS 216.A N GLU 244.A O no hydrogen 3.253 N/A CYS 217.A SG VAL 187.A O no hydrogen 3.547 N/A CYS 217.A SG ARG 215.A O no hydrogen 3.726 N/A ARG 218.A N ILE 190.A O no hydrogen 2.981 N/A ARG 218.A NE THR 191.A OG1 no hydrogen 2.975 N/A ARG 218.A NH2 THR 191.A OG1 no hydrogen 3.271 N/A PHE 219.A N TYR 247.A O no hydrogen 2.825 N/A ILE 220.A N PHE 192.A O no hydrogen 2.877 N/A ASN 221.A N SER 249.A O no hydrogen 2.795 N/A ASN 224.A N ASP 196.A OD1 no hydrogen 2.894 N/A ASN 224.A ND2 GLY 164.A O no hydrogen 3.030 N/A SER 225.A N ASP 196.A OD1 no hydrogen 3.231 N/A SER 225.A OG ASP 196.A OD2 no hydrogen 2.574 N/A VAL 227.A N SER 225.A OG no hydrogen 3.059 N/A ASN 228.A ND2 ASP 196.A OD1 no hydrogen 2.978 N/A ASN 228.A ND2 VAL 197.A O no hydrogen 3.101 N/A ASP 230.A N ASN 228.A OD1 no hydrogen 3.275 N/A HIS 231.A ND1 VAL 197.A O no hydrogen 2.858 N/A HIS 231.A NE2 THR 233.A OG1 no hydrogen 2.721 N/A SER 232.A N THR 198.A O no hydrogen 2.837 N/A SER 232.A OG GLN 263.A OE1.B no hydrogen 2.809 N/A THR 233.A N CYS 260.A O no hydrogen 2.928 N/A THR 233.A OG1 HIS 231.A NE2 no hydrogen 2.721 N/A THR 233.A OG1 TYR 279.A OH no hydrogen 2.645 N/A VAL 234.A N SER 261.A O no hydrogen 3.055 N/A TYR 235.A N.A ILE 201.A O no hydrogen 2.905 N/A TYR 235.A N.B ILE 201.A O no hydrogen 2.917 N/A TYR 235.A OH.B GLU 291.A OE2 no hydrogen 2.542 N/A VAL 236.A N GLN 263.A O.A no hydrogen 2.804 N/A VAL 236.A N GLN 263.A O.B no hydrogen 2.767 N/A ASN 237.A N LEU 203.A O no hydrogen 2.709 N/A CYS 238.A SG SER 241.A OG no hydrogen 3.399 N/A TYR 240.A N HIS 267.A O no hydrogen 3.263 N/A SER 241.A N ASP 268.A O no hydrogen 3.258 N/A SER 241.A OG CYS 238.A O no hydrogen 3.487 N/A SER 241.A OG PRO 239.A O no hydrogen 2.740 N/A GLY 242.A N CYS 212.A O no hydrogen 3.007 N/A VAL 243.A N PHE 270.A O no hydrogen 2.891 N/A GLU 244.A N VAL 214.A O no hydrogen 2.911 N/A SER 245.A N ARG 272.A O.A no hydrogen 3.082 N/A SER 245.A N ARG 272.A O.B no hydrogen 2.998 N/A CYS 246.A N SER 274.A OG no hydrogen 3.075 N/A CYS 246.A SG VAL 214.A O no hydrogen 3.684 N/A CYS 246.A SG GLU 244.A O no hydrogen 3.543 N/A TYR 247.A N CYS 217.A O no hydrogen 2.949 N/A PHE 248.A N THR 275.A O no hydrogen 2.805 N/A SER 249.A N PHE 219.A O no hydrogen 2.806 N/A MET 250.A N ASN 277.A O no hydrogen 2.959 N/A SER 251.A OG ASN 221.A OD1 no hydrogen 2.983 N/A SER 252.A OG.B VAL 223.A O no hydrogen 2.978 N/A PHE 254.A N SER 252.A OG.A no hydrogen 3.200 N/A ALA 255.A N SER 252.A OG.B no hydrogen 3.105 N/A ARG 256.A N SER 253.A O no hydrogen 3.048 N/A ASN 257.A N PHE 254.A O no hydrogen 3.014 N/A ILE 258.A N PHE 254.A O no hydrogen 2.976 N/A ALA 259.A N ALA 255.A O no hydrogen 2.882 N/A CYS 260.A N HIS 231.A O no hydrogen 2.856 N/A CYS 260.A SG VAL 262.A O no hydrogen 3.383 N/A SER 261.A N ARG 281.A O no hydrogen 3.098 N/A SER 261.A OG TYR 271.A OH no hydrogen 2.691 N/A SER 261.A OG GLY 282.A O no hydrogen 2.611 N/A VAL 262.A N GLY 282.A O no hydrogen 3.122 N/A GLN 263.A N.A VAL 234.A O no hydrogen 2.874 N/A GLN 263.A N.B VAL 234.A O no hydrogen 2.872 N/A LEU 264.A N TYR 284.A O no hydrogen 2.778 N/A HIS 265.A N VAL 236.A O no hydrogen 2.924 N/A HIS 265.A ND1 GLU 291.A OE1 no hydrogen 2.402 N/A GLN 266.A NE2 ASN 237.A OD1 no hydrogen 2.753 N/A GLN 266.A NE2 GLU 291.A O no hydrogen 3.137 N/A HIS 267.A ND1 ASP 268.A OD2 no hydrogen 2.702 N/A ASP 268.A N TYR 300.A O no hydrogen 2.799 N/A THR 269.A N ASN 301.A O no hydrogen 3.156 N/A THR 269.A OG1 GLN 266.A O no hydrogen 2.860 N/A PHE 270.A N SER 241.A O no hydrogen 3.213 N/A TYR 271.A N GLN 303.A O no hydrogen 2.798 N/A TYR 271.A OH SER 261.A OG no hydrogen 2.691 N/A ARG 272.A N.A VAL 243.A O no hydrogen 2.920 N/A ARG 272.A N.B VAL 243.A O no hydrogen 2.951 N/A ARG 272.A NE.B GLU 305.A OE2.B no hydrogen 2.821 N/A ARG 272.A NH1.A GLN 303.A OE1 no hydrogen 3.205 N/A ARG 272.A NH1.B GLU 244.A OE1 no hydrogen 3.305 N/A ARG 272.A NH2.A GLU 244.A OE1 no hydrogen 2.546 N/A ARG 272.A NH2.B GLN 303.A OE1 no hydrogen 2.448 N/A GLY 273.A N GLU 305.A O.A no hydrogen 3.030 N/A GLY 273.A N GLU 305.A O.B no hydrogen 3.066 N/A SER 274.A N ASN 307.A OD1 no hydrogen 2.873 N/A SER 274.A OG ARG 272.A O.A no hydrogen 2.981 N/A SER 274.A OG ARG 272.A O.B no hydrogen 3.199 N/A THR 275.A N CYS 246.A O no hydrogen 2.994 N/A VAL 276.A N ILE 308.A O no hydrogen 2.871 N/A ASN 277.A N PHE 248.A O no hydrogen 2.835 N/A GLY 278.A N VAL 310.A O no hydrogen 3.103 N/A TYR 279.A OH THR 233.A OG1 no hydrogen 2.645 N/A ARG 281.A N ALA 259.A O no hydrogen 2.888 N/A ARG 281.A NE GLN 314.A OE1 no hydrogen 2.713 N/A GLY 282.A N GLN 314.A O no hydrogen 3.163 N/A ALA 283.A N PHE 315.A O no hydrogen 2.772 N/A TYR 284.A N VAL 262.A O no hydrogen 2.968 N/A VAL 285.A N ILE 317.A O no hydrogen 2.745 N/A VAL 286.A N LEU 264.A O no hydrogen 3.060 N/A MET 287.A N.A GLY 319.A O no hydrogen 3.330 N/A MET 287.A N.B GLY 319.A O no hydrogen 3.299 N/A ALA 289.A N ASP 321.A O no hydrogen 3.373 N/A GLU 291.A N HIS 288.A O no hydrogen 3.020 N/A ALA 292.A N ALA 289.A O no hydrogen 3.349 N/A GLY 294.A N ASN 206.A O no hydrogen 2.786 N/A GLY 296.A N ALA 292.A O no hydrogen 3.191 N/A ALA 299.A N HIS 329.A O no hydrogen 2.972 N/A ASN 301.A ND2 ASP 268.A OD1 no hydrogen 2.882 N/A MET 302.A N.A ASP 332.A O no hydrogen 3.015 N/A MET 302.A N.B ASP 332.A O no hydrogen 3.029 N/A GLN 303.A N THR 269.A O no hydrogen 3.030 N/A VAL 304.A N ILE 334.A O no hydrogen 2.910 N/A GLU 305.A N.A TYR 271.A O no hydrogen 2.953 N/A GLU 305.A N.B TYR 271.A O no hydrogen 2.971 N/A ASN 306.A N SER 336.A O.A no hydrogen 2.948 N/A ASN 306.A N SER 336.A O.B no hydrogen 2.896 N/A ASN 307.A N ASN 338.A OD1 no hydrogen 2.965 N/A ASN 307.A ND2 TYR 271.A O no hydrogen 3.214 N/A ASN 307.A ND2 ASN 338.A OD1 no hydrogen 3.021 N/A ILE 308.A N SER 274.A O no hydrogen 2.834 N/A ALA 309.A N ILE 339.A O no hydrogen 2.938 N/A VAL 310.A N VAL 276.A O no hydrogen 2.890 N/A ILE 311.A N SER 341.A O no hydrogen 3.007 N/A TYR 312.A N TYR 279.A O no hydrogen 2.956 N/A GLY 313.A N CYS 280.A O no hydrogen 2.773 N/A GLN 314.A NE2 PHE 352.A O no hydrogen 2.952 N/A PHE 315.A N ALA 354.A O no hydrogen 2.763 N/A VAL 316.A N PHE 355.A O no hydrogen 2.902 N/A ILE 317.A N ALA 283.A O no hydrogen 2.962 N/A LEU 318.A N ASP 357.A O no hydrogen 2.899 N/A GLY 319.A N VAL 285.A O no hydrogen 3.205 N/A SER 320.A N GLN 363.A OE1 no hydrogen 2.957 N/A SER 320.A OG GLY 328.A O no hydrogen 3.399 N/A ASP 321.A N MET 287.A O.B no hydrogen 3.278 N/A THR 323.A N VAL 326.A O no hydrogen 2.593 N/A THR 323.A OG1 VAL 326.A O no hydrogen 3.265 N/A THR 325.A N THR 323.A OG1 no hydrogen 3.359 N/A VAL 326.A N THR 323.A OG1 no hydrogen 2.641 N/A GLY 328.A N ASP 321.A O no hydrogen 3.323 N/A HIS 329.A N SER 297.A O no hydrogen 2.910 N/A HIS 329.A ND1 ASP 364.A OD2 no hydrogen 2.831 N/A LEU 330.A N ASP 364.A O no hydrogen 2.916 N/A ASN 331.A N ALA 299.A O no hydrogen 3.055 N/A ASN 331.A ND2 ASP 332.A OD2 no hydrogen 3.102 N/A VAL 333.A N ARG 367.A O no hydrogen 2.956 N/A ILE 334.A N MET 302.A O.A no hydrogen 2.886 N/A ILE 334.A N MET 302.A O.B no hydrogen 2.913 N/A VAL 335.A N LEU 369.A O no hydrogen 2.819 N/A SER 336.A N.A VAL 304.A O no hydrogen 3.019 N/A SER 336.A N.B VAL 304.A O no hydrogen 3.045 N/A SER 336.A OG.A GLU 305.A OE2.A no hydrogen 2.896 N/A SER 336.A OG.B THR 371.A O no hydrogen 2.928 N/A GLY 337.A N GLY 372.A O no hydrogen 3.073 N/A ASN 338.A N ASN 373.A OD1 no hydrogen 3.020 N/A ASN 338.A ND2 VAL 304.A O no hydrogen 3.070 N/A ASN 338.A ND2 ASN 373.A OD1 no hydrogen 2.872 N/A ILE 339.A N ASN 307.A O no hydrogen 2.928 N/A VAL 340.A N SER 374.A O.A no hydrogen 3.020 N/A VAL 340.A N SER 374.A O.B no hydrogen 2.872 N/A SER 341.A N ALA 309.A O no hydrogen 2.872 N/A ILE 342.A N TYR 376.A O no hydrogen 2.915 N/A GLY 343.A N ILE 311.A O no hydrogen 2.841 N/A ARG 345.A NE TYR 312.A O no hydrogen 2.852 N/A ARG 345.A NH1 ALA 346.A O no hydrogen 3.120 N/A ARG 345.A NH1 ASP 383.A OD1 no hydrogen 3.366 N/A ARG 345.A NH1 ASP 383.A OD2 no hydrogen 2.903 N/A ARG 345.A NH2 TYR 312.A O no hydrogen 2.908 N/A ARG 345.A NH2 ASP 383.A OD2 no hydrogen 2.933 N/A PHE 348.A N ASP 383.A OD1 no hydrogen 2.745 N/A PHE 348.A N ASP 383.A OD2 no hydrogen 3.303 N/A SER 349.A N ALA 346.A O no hydrogen 3.292 N/A SER 349.A OG ALA 346.A O no hydrogen 2.634 N/A GLY 353.A N ASP 383.A O no hydrogen 2.808 N/A ALA 354.A N GLY 313.A O no hydrogen 3.006 N/A PHE 355.A N ALA 385.A O no hydrogen 3.011 N/A ILE 356.A N ALA 386.A O no hydrogen 2.927 N/A ASP 357.A N VAL 316.A O no hydrogen 2.831 N/A ILE 358.A N THR 388.A O no hydrogen 2.947 N/A GLY 359.A N LEU 318.A O no hydrogen 3.367 N/A GLN 363.A N ASN 361.A O no hydrogen 2.487 N/A GLN 363.A NE2 SER 320.A O no hydrogen 2.948 N/A ASP 364.A N SER 320.A OG no hydrogen 3.126 N/A GLN 366.A N LEU 330.A O no hydrogen 3.119 N/A ARG 367.A NE ASP 332.A OD1 no hydrogen 2.883 N/A ARG 367.A NH2 ASP 332.A OD2 no hydrogen 2.883 N/A LEU 369.A N VAL 333.A O no hydrogen 2.857 N/A VAL 370.A N THR 397.A O no hydrogen 2.725 N/A THR 371.A N VAL 335.A O no hydrogen 2.912 N/A THR 371.A OG1 ILE 399.A O no hydrogen 2.856 N/A GLY 372.A N ILE 399.A O no hydrogen 3.375 N/A GLY 372.A N ALA 400.A O no hydrogen 2.945 N/A ASN 373.A N ASN 401.A OD1 no hydrogen 3.030 N/A ASN 373.A ND2 VAL 335.A O no hydrogen 3.000 N/A ASN 373.A ND2 ASN 401.A OD1 no hydrogen 2.882 N/A SER 374.A N.A ASN 338.A O no hydrogen 2.891 N/A SER 374.A N.B ASN 338.A O no hydrogen 2.913 N/A PHE 375.A N ASN 402.A O no hydrogen 2.957 N/A TYR 376.A N VAL 340.A O no hydrogen 3.031 N/A ALA 377.A N ASP 404.A O no hydrogen 2.954 N/A ASN 380.A ND2 ARG 345.A O no hydrogen 2.899 N/A ILE 381.A N PRO 378.A O no hydrogen 2.950 N/A ASP 383.A N ASP 383.A OD1 no hydrogen 2.694 N/A SER 384.A N THR 382.A O no hydrogen 2.966 N/A SER 384.A OG ILE 381.A O no hydrogen 2.719 N/A ALA 385.A N GLY 353.A O no hydrogen 2.962 N/A ALA 386.A N TYR 407.A O no hydrogen 3.016 N/A ILE 387.A N MET 408.A O no hydrogen 2.966 N/A THR 388.A N ILE 356.A O no hydrogen 2.966 N/A THR 388.A OG1 ASP 357.A OD1 no hydrogen 2.645 N/A LEU 389.A N TYR 410.A O no hydrogen 2.871 N/A ARG 390.A N ILE 358.A O no hydrogen 3.081 N/A ARG 390.A NE ASP 357.A OD1 no hydrogen 2.728 N/A ARG 390.A NH2 ASP 357.A OD2 no hydrogen 2.941 N/A LEU 393.A N VAL 419.A O no hydrogen 3.032 N/A ASN 394.A N ILE 365.A O no hydrogen 2.792 N/A ASN 394.A ND2 ASP 364.A OD1 no hydrogen 3.020 N/A CYS 396.A N ASN 422.A O no hydrogen 3.133 N/A THR 397.A N VAL 368.A O no hydrogen 2.741 N/A PHE 398.A N VAL 424.A O no hydrogen 2.771 N/A ILE 399.A N VAL 370.A O no hydrogen 2.957 N/A ALA 400.A N SER 428.A OG no hydrogen 2.898 N/A ASN 401.A N ASN 429.A OD1 no hydrogen 3.147 N/A ASN 401.A ND2 VAL 370.A O no hydrogen 2.952 N/A ASN 401.A ND2 ASN 429.A OD1 no hydrogen 2.902 N/A ASN 402.A N ASN 373.A O no hydrogen 2.884 N/A ASN 402.A ND2 VAL 430.A O no hydrogen 3.298 N/A PHE 403.A N VAL 430.A O no hydrogen 2.881 N/A ASP 404.A N PHE 375.A O no hydrogen 2.823 N/A CYS 405.A SG TYR 407.A O no hydrogen 3.233 N/A ARG 406.A N SER 384.A OG no hydrogen 3.066 N/A ARG 406.A NE HIS 435.A ND1 no hydrogen 2.970 N/A ARG 406.A NH1 GLN 442.A OE1 no hydrogen 2.979 N/A ARG 406.A NH2 ALA 379.A O no hydrogen 2.925 N/A TYR 407.A N SER 384.A O no hydrogen 2.852 N/A MET 408.A N LEU 444.A O no hydrogen 2.830 N/A TYR 410.A N ILE 387.A O no hydrogen 2.975 N/A ASN 411.A ND2 THR 416.A O no hydrogen 3.159 N/A ASN 411.A ND2 THR 416.A OG1 no hydrogen 3.247 N/A ASN 411.A ND2 GLN 448.A O no hydrogen 2.998 N/A THR 415.A OG1 ALA 412.A O no hydrogen 2.540 N/A THR 416.A OG1 ARG 390.A O no hydrogen 2.910 N/A VAL 419.A N ASN 392.A OD1 no hydrogen 2.856 N/A VAL 420.A N SER 451.A O no hydrogen 2.942 N/A GLN 421.A N LEU 393.A O no hydrogen 2.855 N/A ASN 422.A N VAL 453.A O no hydrogen 3.071 N/A ASN 422.A ND2 ASN 394.A O no hydrogen 2.950 N/A LEU 423.A N SER 455.A OG no hydrogen 3.109 N/A VAL 424.A N CYS 396.A O no hydrogen 2.921 N/A TRP 425.A N THR 456.A O no hydrogen 2.761 N/A ASP 426.A N PHE 398.A O no hydrogen 3.061 N/A LYS 427.A N GLU 458.A OE1 no hydrogen 2.960 N/A LYS 427.A NZ GLN 460.A OE1 no hydrogen 2.213 N/A SER 428.A N ASP 426.A OD2 no hydrogen 2.957 N/A SER 428.A OG ASP 426.A OD2 no hydrogen 2.723 N/A ASN 429.A N ASP 426.A O no hydrogen 3.122 N/A ASN 429.A ND2 PHE 398.A O no hydrogen 2.976 N/A ASN 429.A ND2 ASP 426.A O no hydrogen 2.870 N/A VAL 430.A N ASN 401.A O no hydrogen 2.827 N/A GLY 432.A N PHE 403.A O no hydrogen 2.890 N/A THR 434.A N ASP 404.A OD1 no hydrogen 2.892 N/A THR 434.A OG1 ASP 404.A OD1 no hydrogen 3.260 N/A THR 434.A OG1 ASP 404.A OD2 no hydrogen 2.585 N/A HIS 435.A NE2 ALA 377.A O no hydrogen 2.733 N/A ALA 436.A N GLY 433.A O no hydrogen 2.995 N/A ASN 437.A N ASP 465.A OD1 no hydrogen 2.864 N/A GLN 438.A N HIS 435.A O no hydrogen 2.943 N/A ARG 439.A N SER 467.A OG no hydrogen 2.822 N/A ARG 439.A NE ARG 406.A O no hydrogen 2.692 N/A ARG 439.A NH1 ASP 465.A OD2 no hydrogen 2.874 N/A ARG 439.A NH2 CYS 405.A O no hydrogen 2.910 N/A ARG 439.A NH2 ARG 406.A O no hydrogen 3.327 N/A GLN 442.A N ARG 439.A O no hydrogen 2.892 N/A ASN 443.A ND2 ASP 446.A OD1 no hydrogen 3.189 N/A LEU 444.A N SER 470.A O no hydrogen 3.094 N/A PHE 445.A N CYS 471.A O no hydrogen 2.863 N/A ASP 446.A N VAL 409.A O no hydrogen 2.863 N/A MET 447.A N LEU 473.A O no hydrogen 2.941 N/A GLN 448.A N ASP 446.A O no hydrogen 2.928 N/A GLN 448.A NE2 ASP 446.A OD1 no hydrogen 3.016 N/A PHE 449.A N MET 447.A O no hydrogen 2.958 N/A ALA 450.A N PRO 418.A O no hydrogen 2.815 N/A VAL 452.A N GLN 479.A O no hydrogen 2.808 N/A VAL 453.A N VAL 420.A O no hydrogen 2.930 N/A SER 455.A N SER 483.A OG no hydrogen 3.192 N/A SER 455.A OG VAL 453.A O no hydrogen 2.860 N/A THR 456.A N LEU 423.A O no hydrogen 2.787 N/A ILE 457.A N LYS 484.A O no hydrogen 2.827 N/A GLU 458.A N TRP 425.A O no hydrogen 3.016 N/A VAL 459.A N THR 486.A O no hydrogen 2.811 N/A GLN 460.A NE2 LEU 461.A O no hydrogen 3.025 N/A GLN 460.A NE2 ASP 488.A OD2 no hydrogen 2.955 N/A SER 462.A OG.B ILE 431.A O no hydrogen 2.716 N/A CYS 463.A SG GLU 464.A O no hydrogen 3.970 N/A SER 467.A N ASP 465.A OD1 no hydrogen 2.967 N/A SER 467.A OG ASP 465.A OD1 no hydrogen 2.534 N/A SER 467.A OG ASP 465.A OD2 no hydrogen 3.353 N/A PHE 469.A N GLN 442.A O no hydrogen 2.766 N/A SER 470.A OG ASN 443.A OD1 no hydrogen 2.805 N/A CYS 471.A N THR 498.A O no hydrogen 2.787 N/A ILE 472.A N THR 498.A O no hydrogen 3.211 N/A LEU 473.A N PHE 445.A O no hydrogen 3.059 N/A PHE 474.A N VAL 500.A O no hydrogen 2.864 N/A CYS 478.A N PRO 475.A O no hydrogen 2.952 N/A CYS 478.A SG MET 447.A O no hydrogen 3.935 N/A CYS 478.A SG GLN 479.A O no hydrogen 3.368 N/A GLN 479.A N ALA 450.A O no hydrogen 3.040 N/A GLN 479.A NE2 SER 477.A O no hydrogen 3.697 N/A SER 481.A N VAL 452.A O no hydrogen 3.078 N/A SER 483.A N ASN 510.A O no hydrogen 3.224 N/A SER 483.A OG SER 481.A O no hydrogen 2.865 N/A LYS 484.A N SER 455.A O no hydrogen 2.848 N/A LYS 484.A NZ GLU 458.A OE2 no hydrogen 3.068 N/A ILE 485.A N TYR 512.A O no hydrogen 2.877 N/A THR 486.A N ILE 457.A O no hydrogen 2.876 N/A VAL 487.A N SER 514.A O no hydrogen 2.928 N/A ASP 488.A N VAL 459.A O no hydrogen 2.978 N/A ALA 490.A N ASP 488.A OD2 no hydrogen 3.031 N/A THR 492.A N SER 489.A O no hydrogen 2.930 N/A THR 492.A OG1 SER 489.A O no hydrogen 2.701 N/A MET 495.A N THR 492.A O no hydrogen 2.989 N/A ASN 497.A ND2 PHE 469.A O no hydrogen 3.072 N/A THR 498.A OG1 PRO 516.A O no hydrogen 2.783 N/A ALA 499.A N THR 498.A OG1 no hydrogen 2.857 N/A VAL 500.A N ILE 472.A O no hydrogen 2.903 N/A GLU 502.A N PHE 474.A O no hydrogen 2.812 N/A GLY 503.A N GLN 505.A OE1 no hydrogen 2.880 N/A ASN 504.A N.A PHE 501.A O no hydrogen 3.073 N/A ASN 504.A N.B PHE 501.A O no hydrogen 3.125 N/A GLN 505.A N GLN 505.A OE1 no hydrogen 2.810 N/A GLN 505.A NE2 PHE 474.A O no hydrogen 3.685 N/A GLN 505.A NE2 PRO 475.A O no hydrogen 2.860 N/A GLN 505.A NE2 CYS 478.A O no hydrogen 2.830 N/A GLN 506.A N GLN 506.A OE1 no hydrogen 2.777 N/A GLN 506.A NE2 TYR 515.A OH no hydrogen 3.049 N/A ALA 507.A N ASN 504.A O.A no hydrogen 3.218 N/A ALA 507.A N ASN 504.A O.B no hydrogen 3.203 N/A GLY 508.A N GLN 505.A O no hydrogen 3.154 N/A VAL 511.A N GLY 508.A O no hydrogen 3.177 N/A TYR 512.A N SER 483.A O no hydrogen 2.854 N/A VAL 513.A N.A ARG 592.A O no hydrogen 3.042 N/A VAL 513.A N.B ARG 592.A O no hydrogen 3.063 N/A SER 514.A N ILE 485.A O no hydrogen 3.149 N/A TYR 515.A N LEU 590.A O no hydrogen 2.998 N/A ALA 517.A N LEU 588.A O no hydrogen 2.837 N/A VAL 519.A N VAL 586.A O no hydrogen 2.854 N/A LEU 521.A N VAL 584.A O no hydrogen 2.814 N/A THR 522.A N PHE 533.A O no hydrogen 2.864 N/A SER 523.A N ARG 582.A O no hydrogen 2.872 N/A SER 523.A OG TYR 524.A O no hydrogen 2.740 N/A TYR 524.A N PRO 531.A O no hydrogen 3.167 N/A GLN 527.A NE2 GLU 577.A O no hydrogen 3.083 N/A GLY 528.A N ASN 576.A O no hydrogen 2.770 N/A VAL 530.A N GLY 574.A O no hydrogen 3.014 N/A PHE 532.A N GLY 572.A O no hydrogen 2.802 N/A PHE 533.A N THR 522.A O no hydrogen 2.848 N/A SER 534.A N LEU 570.A O no hydrogen 2.893 N/A SER 534.A OG ASP 536.A O no hydrogen 2.675 N/A THR 535.A N ASN 520.A O no hydrogen 2.924 N/A TYR 539.A N GLY 568.A O no hydrogen 2.860 N/A TRP 541.A NE1 ASN 538.A O.A no hydrogen 3.016 N/A TRP 541.A NE1 ASN 538.A O.B no hydrogen 3.108 N/A VAL 542.A N TYR 539.A O no hydrogen 3.063 N/A THR 543.A N GLN 591.A O no hydrogen 2.841 N/A THR 543.A OG1 GLN 591.A O no hydrogen 3.232 N/A SER 544.A N GLN 591.A O no hydrogen 3.278 N/A ALA 545.A N TYR 562.A O no hydrogen 2.988 N/A TYR 546.A N MET 589.A O no hydrogen 3.219 N/A SER 547.A N ALA 560.A O no hydrogen 2.888 N/A SER 547.A OG SER 549.A O no hydrogen 2.862 N/A LEU 548.A N ARG 587.A O no hydrogen 2.667 N/A SER 549.A N SER 547.A OG no hydrogen 3.203 N/A ASN 551.A ND2 PHE 556.A O no hydrogen 2.865 N/A ASN 553.A N ASN 551.A OD1 no hydrogen 3.298 N/A ASN 553.A ND2 ASN 551.A OD1 no hydrogen 2.831 N/A SER 557.A N TYR 575.A O no hydrogen 2.919 N/A TYR 562.A N ALA 545.A O no hydrogen 2.819 N/A THR 563.A N VAL 571.A O no hydrogen 2.880 N/A THR 563.A OG1 THR 543.A O no hydrogen 3.472 N/A ASN 564.A N THR 563.A OG1 no hydrogen 2.786 N/A ASN 564.A ND2 TYR 539.A O no hydrogen 3.026 N/A ASN 564.A ND2 ALA 540.A O no hydrogen 2.818 N/A LYS 565.A N GLN 569.A O no hydrogen 2.869 N/A LYS 565.A NZ GLN 569.A OE1 no hydrogen 2.979 N/A ASN 567.A ND2 GLN 569.A OE1 no hydrogen 2.810 N/A GLY 568.A N LYS 565.A O no hydrogen 2.941 N/A GLN 569.A N ASN 567.A OD1 no hydrogen 2.976 N/A GLN 569.A NE2 SER 534.A O no hydrogen 2.851 N/A LEU 570.A N SER 534.A OG no hydrogen 2.856 N/A VAL 571.A N THR 563.A O no hydrogen 2.882 N/A GLY 572.A N PHE 532.A O no hydrogen 2.986 N/A GLY 574.A N VAL 530.A O no hydrogen 2.818 N/A TYR 575.A N SER 557.A O no hydrogen 2.986 N/A ASN 576.A N GLY 528.A O no hydrogen 2.768 N/A ASN 576.A ND2 ASN 525.A O.B no hydrogen 3.551 N/A ASN 576.A ND2 THR 526.A O no hydrogen 2.955 N/A ASN 576.A ND2 GLY 580.A O no hydrogen 3.077 N/A GLU 577.A N ASP 555.A O no hydrogen 2.861 N/A GLY 580.A N ASN 525.A O.A no hydrogen 2.896 N/A GLY 580.A N ASN 525.A O.B no hydrogen 2.736 N/A ARG 582.A N SER 523.A OG no hydrogen 2.941 N/A ARG 582.A NE ASN 576.A OD1 no hydrogen 2.832 N/A ARG 582.A NH2 ASN 576.A OD1 no hydrogen 3.389 N/A ARG 582.A NH2 ILE 578.A O no hydrogen 2.868 N/A VAL 584.A N LEU 521.A O no hydrogen 2.972 N/A SER 585.A OG.A ASN 520.A OD1 no hydrogen 3.429 N/A VAL 586.A N VAL 519.A O no hydrogen 2.948 N/A ARG 587.A N SER 549.A OG no hydrogen 2.757 N/A ARG 587.A NH1 MET 495.A O no hydrogen 3.340 N/A ARG 587.A NH1 THR 518.A OG1 no hydrogen 2.928 N/A ARG 587.A NH2 THR 492.A O no hydrogen 2.835 N/A ARG 587.A NH2 MET 495.A O no hydrogen 2.990 N/A LEU 588.A N ALA 517.A O no hydrogen 2.820 N/A MET 589.A N TYR 546.A O no hydrogen 2.880 N/A LEU 590.A N TYR 515.A O no hydrogen 2.897 N/A GLN 591.A N SER 544.A O no hydrogen 2.864 N/A GLN 591.A NE2 SER 544.A OG no hydrogen 3.009 N/A ARG 592.A N VAL 513.A O.A no hydrogen 2.744 N/A ARG 592.A N VAL 513.A O.B no hydrogen 2.804 N/A ARG 592.A NE GLY 508.A O no hydrogen 3.229 N/A ARG 592.A NH1 TRP 541.A O no hydrogen 3.022 N/A ARG 592.A NH2 GLY 508.A O no hydrogen 2.755 N/A GLN 593.A N THR 543.A OG1 no hydrogen 2.780 N/A GLN 593.A NE2 ALA 509.A O no hydrogen 2.970 N/A GLN 593.A NE2 VAL 511.A O no hydrogen 3.115 N/A