Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3nme_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 4.A N GLU 4.A OE1 no hydrogen 2.700 N/A LEU 5.A N ARG 2.A O no hydrogen 3.436 N/A GLY 6.A N HIS 3.A O no hydrogen 3.038 N/A ASN 9.A N VAL 17.A O no hydrogen 2.991 N/A ILE 11.A N LEU 15.A O no hydrogen 2.878 N/A ARG 12.A N LEU 15.A O no hydrogen 3.318 N/A ARG 12.A NE ASP 14.A OD2 no hydrogen 3.367 N/A ARG 12.A NH1 TYR 126.A OH no hydrogen 2.760 N/A LEU 15.A N ARG 12.A O no hydrogen 3.043 N/A ILE 16.A N THR 103.A O no hydrogen 2.914 N/A VAL 17.A N ASN 9.A O no hydrogen 3.041 N/A GLY 18.A N VAL 105.A O no hydrogen 2.998 N/A SER 19.A N ASN 7.A O no hydrogen 2.776 N/A SER 19.A OG ASN 7.A O no hydrogen 3.183 N/A CYS 20.A N THR 108.A O no hydrogen 3.218 N/A CYS 20.A SG TYR 1.A OH no hydrogen 3.505 N/A CYS 20.A SG THR 108.A O no hydrogen 3.548 N/A GLN 22.A N ASP 26.A OD2 no hydrogen 2.958 N/A THR 23.A N ASP 26.A OD2 no hydrogen 3.461 N/A ASP 26.A N THR 23.A O no hydrogen 3.020 N/A VAL 27.A N PRO 24.A O no hydrogen 3.086 N/A LYS 29.A N GLU 25.A O no hydrogen 3.285 N/A LYS 29.A NZ ASP 26.A OD1 no hydrogen 2.750 N/A LEU 30.A N ASP 26.A O no hydrogen 3.177 N/A ARG 31.A N VAL 27.A O no hydrogen 2.845 N/A ARG 31.A NE ASP 66.A OD1 no hydrogen 2.803 N/A ARG 31.A NH2 ASP 66.A OD1 no hydrogen 3.218 N/A LYS 32.A N ASP 28.A O no hydrogen 3.013 N/A GLY 34.A N ARG 31.A O no hydrogen 3.283 N/A VAL 35.A N LEU 30.A O no hydrogen 3.021 N/A LYS 36.A N VAL 102.A O no hydrogen 2.742 N/A LYS 36.A NZ ASP 66.A O no hydrogen 3.197 N/A ILE 38.A N GLN 68.A O no hydrogen 2.756 N/A PHE 39.A N TYR 104.A O no hydrogen 2.749 N/A CYS 40.A N ILE 70.A O no hydrogen 2.749 N/A CYS 40.A SG GLN 42.A OE1 no hydrogen 3.842 N/A LEU 41.A N HIS 106.A O no hydrogen 3.014 N/A GLN 42.A NE2 THR 108.A OG1 no hydrogen 3.128 N/A GLN 43.A N ASP 46.A OD2 no hydrogen 2.876 N/A ASP 46.A N GLN 43.A O no hydrogen 3.018 N/A LEU 47.A N GLN 43.A O no hydrogen 3.362 N/A GLU 48.A N ASP 44.A O no hydrogen 2.920 N/A TYR 49.A N PRO 45.A O no hydrogen 3.257 N/A PHE 50.A N LEU 47.A O no hydrogen 3.249 N/A GLY 51.A N GLU 48.A O no hydrogen 3.414 N/A VAL 52.A N LEU 47.A O no hydrogen 2.931 N/A SER 56.A OG ASP 53.A OD2 no hydrogen 2.984 N/A ILE 57.A N ASP 53.A O no hydrogen 3.429 N/A GLN 58.A N ILE 54.A O no hydrogen 2.792 N/A ALA 59.A N SER 55.A O no hydrogen 2.908 N/A TYR 60.A N SER 56.A O no hydrogen 3.011 N/A TYR 60.A OH ASP 28.A OD1 no hydrogen 2.950 N/A TYR 60.A OH ASP 28.A OD2 no hydrogen 2.731 N/A ALA 61.A N ILE 57.A O no hydrogen 3.067 N/A LYS 62.A N GLN 58.A O no hydrogen 2.980 N/A TYR 64.A N ALA 61.A O no hydrogen 3.186 N/A TYR 64.A OH TYR 60.A OH no hydrogen 3.189 N/A GLN 68.A N LYS 36.A O no hydrogen 3.119 N/A GLN 68.A NE2 GLU 283.A OE2 no hydrogen 2.899 N/A ILE 70.A N ILE 38.A O no hydrogen 2.792 N/A ARG 71.A NH1 ASP 44.A OD2 no hydrogen 2.869 N/A ARG 71.A NH2 GLN 42.A O no hydrogen 3.060 N/A ARG 71.A NH2 ASP 44.A OD2 no hydrogen 3.092 N/A CYS 72.A N CYS 40.A O no hydrogen 2.921 N/A CYS 72.A SG GLU 281.A OE2 no hydrogen 3.595 N/A ILE 74.A N LEU 41.A O no hydrogen 3.012 N/A ARG 75.A N ASP 81.A OD2 no hydrogen 2.884 N/A ASP 81.A N ASP 78.A OD1 no hydrogen 3.227 N/A LEU 82.A N ASP 78.A O no hydrogen 3.120 N/A ARG 83.A N ALA 79.A O no hydrogen 3.188 N/A ARG 83.A NE ASP 152.A OD2 no hydrogen 2.763 N/A ARG 83.A NH1 GLU 206.A O no hydrogen 2.797 N/A ARG 83.A NH2 ASP 152.A OD1 no hydrogen 2.786 N/A ARG 83.A NH2 ASP 152.A OD2 no hydrogen 3.374 N/A ARG 83.A NH2 GLU 206.A O no hydrogen 2.748 N/A ARG 84.A NE GLU 73.A O no hydrogen 2.816 N/A ARG 84.A NH1 GLU 281.A OE1 no hydrogen 2.741 N/A ARG 84.A NH1 GLU 281.A OE2 no hydrogen 3.344 N/A ARG 84.A NH2 GLU 73.A O no hydrogen 2.835 N/A ARG 84.A NH2 GLU 281.A OE2 no hydrogen 3.154 N/A LEU 85.A N LEU 82.A O no hydrogen 3.171 N/A VAL 88.A N ARG 84.A O no hydrogen 2.861 N/A VAL 89.A N LEU 85.A O no hydrogen 2.747 N/A GLY 90.A N PRO 86.A O no hydrogen 3.067 N/A THR 91.A N ALA 87.A O no hydrogen 2.944 N/A THR 91.A OG1 ALA 87.A O no hydrogen 2.580 N/A LEU 92.A N VAL 88.A O no hydrogen 2.882 N/A TYR 93.A N VAL 89.A O no hydrogen 2.762 N/A LYS 94.A N GLY 90.A O no hydrogen 3.290 N/A LYS 94.A NZ GLU 277.A O no hydrogen 3.142 N/A LYS 94.A NZ SER 280.A OG no hydrogen 2.791 N/A ALA 95.A N THR 91.A O no hydrogen 3.358 N/A VAL 96.A N LEU 92.A O no hydrogen 3.091 N/A LYS 97.A N TYR 93.A O no hydrogen 3.140 N/A ARG 98.A N LYS 94.A O no hydrogen 3.244 N/A ARG 98.A NH1 GLU 283.A OE2 no hydrogen 3.225 N/A ARG 98.A NH2 GLU 283.A OE1 no hydrogen 2.450 N/A ARG 98.A NH2 GLU 283.A OE2 no hydrogen 3.391 N/A ASN 99.A N ALA 95.A O no hydrogen 2.745 N/A ASN 99.A ND2 THR 37.A OG1 no hydrogen 2.950 N/A ASN 99.A ND2 GLN 68.A OE1 no hydrogen 2.966 N/A GLY 100.A N VAL 96.A O no hydrogen 2.785 N/A VAL 102.A N GLY 34.A O no hydrogen 3.157 N/A THR 103.A N ASP 14.A O no hydrogen 2.928 N/A TYR 104.A N THR 37.A O no hydrogen 2.763 N/A TYR 104.A OH SER 19.A O no hydrogen 2.669 N/A VAL 105.A N ILE 16.A O no hydrogen 2.896 N/A HIS 106.A N PHE 39.A O no hydrogen 3.043 N/A HIS 106.A ND1 SER 107.A O no hydrogen 2.957 N/A ARG 112.A NH1 ASP 46.A OD2 no hydrogen 2.847 N/A ARG 112.A NH1 ILE 74.A O no hydrogen 2.909 N/A ARG 112.A NH2 ASP 46.A OD2 no hydrogen 3.527 N/A ARG 112.A NH2 THR 108.A OG1 no hydrogen 2.996 N/A ALA 113.A N SER 107.A OG no hydrogen 3.220 N/A ALA 115.A N GLY 111.A O no hydrogen 3.311 N/A VAL 116.A N ARG 112.A O no hydrogen 2.934 N/A ALA 117.A N ALA 113.A O no hydrogen 2.994 N/A LEU 118.A N PRO 114.A O no hydrogen 2.832 N/A THR 119.A N ALA 115.A O no hydrogen 2.918 N/A THR 119.A OG1 ALA 115.A O no hydrogen 2.458 N/A TYR 120.A N VAL 116.A O no hydrogen 2.797 N/A TRP 122.A N THR 119.A O no hydrogen 2.699 N/A TRP 122.A NE1 THR 150.A OG1 no hydrogen 2.997 N/A VAL 123.A N TYR 120.A O no hydrogen 2.930 N/A GLN 124.A N TYR 120.A O no hydrogen 3.337 N/A ALA 130.A N LYS 127.A O no hydrogen 3.056 N/A HIS 131.A N LEU 128.A O no hydrogen 2.957 N/A LEU 133.A N GLU 129.A O no hydrogen 3.159 N/A LEU 134.A N ALA 130.A O no hydrogen 3.005 N/A SER 135.A OG LEU 133.A O no hydrogen 2.849 N/A LYS 136.A N LEU 134.A O no hydrogen 3.158 N/A ARG 137.A N LEU 134.A O no hydrogen 2.946 N/A ARG 137.A NH1 ALA 109.A O no hydrogen 3.521 N/A ARG 137.A NH1 GLY 110.A O no hydrogen 2.797 N/A ARG 137.A NH2 ASN 7.A OD1 no hydrogen 2.432 N/A CYS 139.A SG ARG 137.A O no hydrogen 3.534 N/A LYS 142.A NZ PHE 140.A O no hydrogen 3.194 N/A ILE 146.A N LYS 142.A O no hydrogen 3.247 N/A ARG 147.A N LEU 143.A O no hydrogen 2.920 N/A ARG 147.A NE GLU 260.A O no hydrogen 2.922 N/A ARG 147.A NH2 GLU 260.A O no hydrogen 3.158 N/A ASN 148.A N ASP 144.A O no hydrogen 3.081 N/A ALA 149.A N ALA 145.A O no hydrogen 3.093 N/A THR 150.A N ILE 146.A O no hydrogen 3.081 N/A THR 150.A OG1 ILE 146.A O no hydrogen 2.822 N/A ILE 151.A N ARG 147.A O no hydrogen 3.213 N/A ASP 152.A N ASN 148.A O no hydrogen 2.804 N/A ILE 153.A N ALA 149.A O no hydrogen 3.050 N/A LEU 154.A N THR 150.A O no hydrogen 3.103 N/A THR 155.A N ILE 151.A O no hydrogen 2.844 N/A THR 155.A OG1 ILE 151.A O no hydrogen 2.864 N/A LYS 160.A N LEU 204.A O no hydrogen 2.718 N/A LYS 160.A NZ VAL 243.A O no hydrogen 2.597 N/A LYS 160.A NZ ASP 245.A OD1 no hydrogen 2.877 N/A THR 161.A OG1 GLU 203.A OE2 no hydrogen 2.660 N/A VAL 162.A N ARG 202.A O no hydrogen 2.737 N/A LEU 164.A N LEU 200.A O no hydrogen 2.871 N/A THR 165.A N GLU 225.A OE2 no hydrogen 3.072 N/A LEU 166.A N TRP 198.A O no hydrogen 2.901 N/A ASP 168.A N GLY 196.A O no hydrogen 3.046 N/A PHE 171.A N ASP 168.A OD1 no hydrogen 2.968 N/A SER 172.A N ASP 216.A OD1 no hydrogen 3.109 N/A ARG 173.A N ASP 216.A OD1 no hydrogen 2.974 N/A ARG 173.A NE GLU 175.A OE2 no hydrogen 2.855 N/A ARG 173.A NH2 GLU 175.A OE1 no hydrogen 3.450 N/A GLU 175.A N ILE 214.A O no hydrogen 2.952 N/A ILE 176.A N ILE 187.A O no hydrogen 2.841 N/A SER 177.A N LYS 212.A O no hydrogen 3.020 N/A SER 177.A OG GLY 182.A O no hydrogen 3.297 N/A SER 177.A OG GLN 185.A O no hydrogen 2.877 N/A GLY 178.A N GLY 182.A O no hydrogen 3.056 N/A LEU 179.A N GLU 210.A O no hydrogen 2.981 N/A ASP 180.A N ASP 180.A OD2 no hydrogen 2.701 N/A ILE 181.A N GLY 178.A O no hydrogen 2.982 N/A GLY 182.A N GLY 178.A O no hydrogen 3.135 N/A ILE 187.A N ILE 176.A O no hydrogen 2.891 N/A LEU 189.A N VAL 174.A O no hydrogen 2.905 N/A THR 190.A N ILE 199.A O no hydrogen 3.158 N/A GLY 192.A N PHE 197.A O no hydrogen 2.884 N/A GLY 196.A N GLY 192.A O no hydrogen 3.011 N/A PHE 197.A N THR 195.A OG1 no hydrogen 3.294 N/A TRP 198.A N LEU 166.A O no hydrogen 2.690 N/A TRP 198.A NE1 ASP 168.A OD1 no hydrogen 2.868 N/A ILE 199.A N THR 190.A O no hydrogen 2.793 N/A LEU 200.A N LEU 164.A O no hydrogen 2.905 N/A LYS 201.A NZ THR 163.A OG1 no hydrogen 3.254 N/A ARG 202.A N VAL 162.A O no hydrogen 2.916 N/A ARG 202.A NE ASP 180.A OD1 no hydrogen 3.392 N/A ARG 202.A NE ASP 180.A OD2 no hydrogen 2.855 N/A ARG 202.A NH2 ASP 180.A OD1 no hydrogen 3.120 N/A ARG 202.A NH2 ASP 180.A OD2 no hydrogen 3.392 N/A LEU 204.A N LYS 160.A O no hydrogen 2.918 N/A GLY 207.A N VAL 242.A O no hydrogen 3.012 N/A PHE 209.A N ALA 240.A O no hydrogen 2.793 N/A TYR 211.A N ASN 238.A O no hydrogen 2.843 N/A TYR 211.A OH GLU 225.A OE1 no hydrogen 2.738 N/A LYS 212.A N SER 177.A O no hydrogen 3.101 N/A TYR 213.A N THR 220.A O no hydrogen 2.970 N/A TYR 213.A OH GLU 225.A OE1 no hydrogen 2.644 N/A ILE 214.A N GLU 175.A O no hydrogen 2.784 N/A ILE 215.A N GLU 218.A O no hydrogen 2.827 N/A ASP 216.A N ARG 173.A O no hydrogen 2.881 N/A GLU 218.A N ILE 215.A O no hydrogen 2.937 N/A THR 220.A N TYR 213.A O no hydrogen 2.911 N/A THR 220.A OG1 HIS 221.A O no hydrogen 3.100 N/A ASN 222.A N ASN 238.A OD1 no hydrogen 2.702 N/A ASN 222.A ND2 GLU 225.A OE1 no hydrogen 3.279 N/A ALA 224.A N ASN 222.A OD1 no hydrogen 3.198 N/A GLU 225.A N ASN 222.A O no hydrogen 3.314 N/A ILE 228.A N ASN 237.A O no hydrogen 2.985 N/A ASN 231.A N HIS 235.A O no hydrogen 2.761 N/A ASN 231.A ND2 GLU 210.A OE1 no hydrogen 3.012 N/A ASP 233.A N ASN 231.A OD1 no hydrogen 3.152 N/A GLY 234.A N ASN 231.A O no hydrogen 2.820 N/A HIS 235.A N ASN 231.A OD1 no hydrogen 2.655 N/A ASN 237.A N ILE 228.A O no hydrogen 3.074 N/A ASN 238.A ND2 ASN 222.A O no hydrogen 2.682 N/A ASN 238.A ND2 PRO 226.A O no hydrogen 3.130 N/A TYR 239.A N PRO 226.A O no hydrogen 3.227 N/A ALA 240.A N PHE 209.A O no hydrogen 2.903 N/A VAL 242.A N GLY 207.A O no hydrogen 3.002 N/A ASP 244.A N GLU 206.A OE2 no hydrogen 2.890 N/A THR 247.A N ASP 250.A OD1 no hydrogen 2.932 N/A THR 253.A N ASP 250.A O no hydrogen 3.149 N/A THR 253.A OG1 GLU 268.A OE1 no hydrogen 3.515 N/A GLU 255.A N GLU 255.A OE2 no hydrogen 2.709 N/A ARG 256.A N THR 252.A O no hydrogen 3.301 N/A ARG 256.A NE GLU 263.A O no hydrogen 3.126 N/A ARG 256.A NH1 THR 252.A OG1 no hydrogen 2.976 N/A ARG 256.A NH2 GLU 263.A O no hydrogen 3.302 N/A ARG 256.A NH2 GLU 268.A OE1 no hydrogen 2.985 N/A LEU 257.A N THR 253.A O no hydrogen 3.001 N/A SER 258.A OG ARG 254.A O no hydrogen 2.778 N/A SER 259.A OG ARG 256.A O no hydrogen 2.968 N/A SER 259.A OG ASP 261.A O no hydrogen 3.399 N/A GLU 263.A N ARG 256.A O no hydrogen 3.220 N/A LEU 265.A N GLU 268.A OE2 no hydrogen 3.320 N/A ARG 269.A N LEU 265.A O no hydrogen 3.009 N/A ARG 269.A NH1 PHE 121.A O no hydrogen 2.791 N/A ARG 269.A NH2 TYR 126.A O no hydrogen 2.965 N/A SER 270.A N GLU 266.A O no hydrogen 3.028 N/A LYS 271.A N GLU 267.A O no hydrogen 3.101 N/A LEU 272.A N GLU 268.A O no hydrogen 2.885 N/A ILE 273.A N ARG 269.A O no hydrogen 3.117 N/A GLN 274.A N SER 270.A O no hydrogen 3.430 N/A PHE 275.A N LYS 271.A O no hydrogen 2.913 N/A LEU 276.A N LEU 272.A O no hydrogen 2.976 N/A GLU 277.A N ILE 273.A O no hydrogen 3.449 N/A THR 278.A OG1 PHE 275.A O no hydrogen 2.657 N/A CYS 279.A N LEU 276.A O no hydrogen 3.038 N/A CYS 279.A SG PHE 275.A O no hydrogen 3.603 N/A SER 280.A N GLU 277.A O no hydrogen 3.191 N/A SER 280.A OG GLU 277.A O no hydrogen 3.011 N/A GLU 281.A N THR 91.A OG1 no hydrogen 2.949 N/A