Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4kkx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NE PRO 93.A O no hydrogen 2.941 N/A ARG 3.A NH1 ASP 124.A OD1 no hydrogen 2.769 N/A TYR 4.A OH SER 125.A OG no hydrogen 2.651 N/A ASN 6.A N GLU 2.A O no hydrogen 2.908 N/A LEU 7.A N ARG 3.A O no hydrogen 3.035 N/A PHE 8.A N TYR 4.A O no hydrogen 2.882 N/A ALA 9.A N GLU 5.A O no hydrogen 2.775 N/A GLN 10.A N ASN 6.A O no hydrogen 3.073 N/A LEU 11.A N LEU 7.A O no hydrogen 2.848 N/A ASN 12.A N PHE 8.A O no hydrogen 2.952 N/A ASP 13.A N ALA 9.A O no hydrogen 3.158 N/A ARG 14.A N GLN 10.A O no hydrogen 3.098 N/A ARG 14.A NH2 GLU 16.A OE2 no hydrogen 2.938 N/A ARG 15.A N ASN 12.A O no hydrogen 2.937 N/A GLU 16.A N LEU 11.A O no hydrogen 2.892 N/A GLY 17.A N SER 266.A O no hydrogen 2.840 N/A ALA 18.A N ALA 229.A O no hydrogen 2.804 N/A PHE 19.A N ASP 46.A OD2 no hydrogen 2.761 N/A VAL 20.A N ALA 231.A O no hydrogen 2.998 N/A PHE 22.A N SER 233.A O no hydrogen 2.755 N/A VAL 23.A N GLU 49.A O no hydrogen 3.240 N/A THR 24.A OG1 ASN 68.A OD1 no hydrogen 3.531 N/A LEU 25.A N GLY 51.A O no hydrogen 2.670 N/A GLY 26.A N SER 33.A OG no hydrogen 3.018 N/A ASP 27.A N THR 24.A O no hydrogen 3.257 N/A SER 33.A N GLY 29.A O no hydrogen 2.895 N/A LEU 34.A N ILE 30.A O no hydrogen 2.945 N/A LYS 35.A N GLU 31.A O no hydrogen 3.111 N/A ILE 36.A N GLN 32.A O no hydrogen 2.827 N/A ILE 37.A N SER 33.A O no hydrogen 2.910 N/A ASP 38.A N LEU 34.A O no hydrogen 3.198 N/A THR 39.A N LYS 35.A O no hydrogen 2.949 N/A THR 39.A OG1 LYS 35.A O no hydrogen 3.238 N/A LEU 40.A N ILE 36.A O no hydrogen 2.843 N/A ILE 41.A N ILE 37.A O no hydrogen 2.956 N/A ASP 42.A N ASP 38.A O no hydrogen 2.826 N/A ALA 43.A N THR 39.A O no hydrogen 2.945 N/A GLY 44.A N ILE 41.A O no hydrogen 3.043 N/A ALA 45.A N LEU 40.A O no hydrogen 3.042 N/A ASP 46.A N PHE 19.A O no hydrogen 2.961 N/A LEU 48.A N PRO 96.A O no hydrogen 2.995 N/A GLU 49.A N PRO 21.A O no hydrogen 2.966 N/A LEU 50.A N GLY 98.A O no hydrogen 2.829 N/A GLY 51.A N VAL 23.A O no hydrogen 2.883 N/A SER 55.A OG ASP 56.A OD1 no hydrogen 2.582 N/A ALA 59.A N TYR 102.A OH no hydrogen 2.942 N/A ASP 60.A N PRO 57.A O no hydrogen 3.319 N/A GLY 61.A N THR 183.A O no hydrogen 3.159 N/A GLY 61.A N THR 183.A OG1 no hydrogen 3.106 N/A GLN 65.A N GLY 61.A O no hydrogen 2.970 N/A GLN 65.A NE2 ASP 60.A O no hydrogen 2.899 N/A ASN 66.A N PRO 62.A O no hydrogen 2.856 N/A ALA 67.A N THR 63.A O no hydrogen 3.106 N/A ASN 68.A N ILE 64.A O no hydrogen 2.928 N/A ASN 68.A ND2 PHE 54.A O no hydrogen 3.094 N/A LEU 69.A N GLN 65.A O no hydrogen 2.921 N/A ARG 70.A N ASN 66.A O no hydrogen 2.889 N/A ARG 70.A NE ASP 27.A OD1 no hydrogen 2.715 N/A ARG 70.A NH2 ASP 27.A OD1 no hydrogen 3.463 N/A ARG 70.A NH2 ASP 27.A OD2 no hydrogen 2.948 N/A ALA 71.A N ALA 67.A O no hydrogen 3.000 N/A PHE 72.A N ASN 68.A O no hydrogen 2.943 N/A ALA 73.A N LEU 69.A O no hydrogen 2.948 N/A ALA 74.A N ARG 70.A O no hydrogen 3.106 N/A ALA 74.A N ALA 71.A O no hydrogen 3.114 N/A GLY 75.A N PHE 72.A O no hydrogen 2.770 N/A VAL 76.A N ALA 71.A O no hydrogen 3.040 N/A GLN 80.A N THR 77.A OG1 no hydrogen 3.099 N/A CYS 81.A N THR 77.A O no hydrogen 2.983 N/A CYS 81.A SG THR 77.A O no hydrogen 3.446 N/A PHE 82.A N PRO 78.A O no hydrogen 2.991 N/A GLU 83.A N ALA 79.A O no hydrogen 3.125 N/A MET 84.A N GLN 80.A O no hydrogen 2.977 N/A LEU 85.A N CYS 81.A O no hydrogen 2.840 N/A ALA 86.A N PHE 82.A O no hydrogen 3.175 N/A LEU 87.A N GLU 83.A O no hydrogen 3.354 N/A ILE 88.A N MET 84.A O no hydrogen 2.851 N/A ARG 89.A N LEU 85.A O no hydrogen 2.958 N/A ARG 89.A NE GLY 122.A O no hydrogen 3.015 N/A ARG 89.A NH1 ILE 95.A O no hydrogen 3.013 N/A ARG 89.A NH1 GLY 122.A O no hydrogen 2.841 N/A ARG 89.A NH2 HIS 92.A O no hydrogen 2.765 N/A ARG 89.A NH2 ILE 95.A O no hydrogen 2.751 N/A GLU 90.A N ALA 86.A O no hydrogen 2.925 N/A LYS 91.A N LEU 87.A O no hydrogen 3.176 N/A LYS 91.A N ILE 88.A O no hydrogen 3.000 N/A LYS 91.A NZ ASP 38.A OD1 no hydrogen 3.255 N/A LYS 91.A NZ ASP 38.A OD2 no hydrogen 2.835 N/A HIS 92.A N ILE 88.A O no hydrogen 2.976 N/A HIS 92.A N ARG 89.A O no hydrogen 3.259 N/A HIS 92.A NE2 ASP 38.A OD1 no hydrogen 2.726 N/A ILE 97.A N ASP 124.A OD2 no hydrogen 2.869 N/A GLY 98.A N LEU 48.A O no hydrogen 2.899 N/A LEU 99.A N SER 125.A O no hydrogen 2.929 N/A LEU 100.A N LEU 50.A O no hydrogen 2.884 N/A MET 101.A N LEU 127.A O no hydrogen 2.887 N/A TYR 102.A OH ASP 60.A OD2 no hydrogen 2.824 N/A ALA 103.A N ASP 130.A OD1 no hydrogen 2.736 N/A LEU 105.A N TYR 102.A O no hydrogen 3.046 N/A VAL 106.A N ALA 103.A O no hydrogen 3.031 N/A PHE 107.A N ALA 103.A O no hydrogen 2.859 N/A GLY 110.A N PHE 107.A O no hydrogen 3.122 N/A PHE 114.A N GLY 110.A O no hydrogen 3.041 N/A TYR 115.A N ILE 111.A O no hydrogen 3.220 N/A ALA 116.A N ASP 112.A O no hydrogen 2.881 N/A ARG 117.A N.A ALA 113.A O no hydrogen 3.041 N/A ARG 117.A N.B ALA 113.A O no hydrogen 3.025 N/A CYS 118.A N PHE 114.A O no hydrogen 3.022 N/A CYS 118.A SG PHE 114.A O no hydrogen 3.439 N/A GLU 119.A N TYR 115.A O no hydrogen 2.994 N/A GLN 120.A N ALA 116.A O no hydrogen 2.914 N/A VAL 121.A N.A ARG 117.A O.A no hydrogen 3.158 N/A VAL 121.A N.A ARG 117.A O.B no hydrogen 3.209 N/A VAL 121.A N.B ARG 117.A O.A no hydrogen 3.170 N/A VAL 121.A N.B ARG 117.A O.B no hydrogen 3.222 N/A GLY 122.A N CYS 118.A O no hydrogen 3.070 N/A GLY 122.A N GLU 119.A O no hydrogen 3.140 N/A VAL 123.A N CYS 118.A O no hydrogen 3.069 N/A ASP 124.A N ILE 97.A O no hydrogen 2.744 N/A SER 125.A N ILE 97.A O no hydrogen 3.271 N/A SER 125.A OG TYR 4.A OH no hydrogen 2.651 N/A VAL 126.A N ALA 149.A O no hydrogen 2.957 N/A LEU 127.A N LEU 99.A O no hydrogen 2.873 N/A ALA 129.A N MET 101.A O no hydrogen 2.955 N/A VAL 131.A N VAL 128.A O no hydrogen 3.264 N/A GLU 134.A N GLU 134.A OE1 no hydrogen 2.815 N/A GLU 135.A N PRO 132.A O no hydrogen 2.937 N/A SER 136.A N VAL 133.A O no hydrogen 3.122 N/A SER 136.A OG VAL 133.A O no hydrogen 2.779 N/A ARG 140.A N SER 136.A O no hydrogen 2.861 N/A ARG 140.A NE SER 136.A OG no hydrogen 2.839 N/A GLN 141.A N ALA 137.A O no hydrogen 3.016 N/A ALA 142.A N PRO 138.A O no hydrogen 3.092 N/A ALA 143.A N PHE 139.A O no hydrogen 2.884 N/A LEU 144.A N ARG 140.A O no hydrogen 3.000 N/A ARG 145.A N GLN 141.A O no hydrogen 3.083 N/A ARG 145.A NH2 ASP 112.A OD1 no hydrogen 2.865 N/A HIS 146.A N ALA 142.A O no hydrogen 3.220 N/A HIS 146.A N ALA 143.A O no hydrogen 3.012 N/A HIS 146.A NE2 ASP 112.A OD1 no hydrogen 3.094 N/A HIS 146.A NE2 ASP 112.A OD2 no hydrogen 3.042 N/A ASN 147.A N LEU 144.A O no hydrogen 3.161 N/A ASN 147.A ND2 GLU 119.A OE2 no hydrogen 2.900 N/A ILE 148.A N ALA 143.A O no hydrogen 2.932 N/A ALA 149.A N ASP 124.A O no hydrogen 2.858 N/A ILE 151.A N VAL 126.A O no hydrogen 3.055 N/A CYS 154.A N TYR 175.A O no hydrogen 2.792 N/A ALA 158.A N PRO 155.A O no hydrogen 3.115 N/A LEU 162.A N ASP 159.A OD1 no hydrogen 2.976 N/A LEU 163.A N ASP 159.A O no hydrogen 3.027 N/A ARG 164.A N ASP 160.A O no hydrogen 3.027 N/A ARG 164.A NE ASP 160.A OD2 no hydrogen 2.814 N/A GLN 165.A N ASP 161.A O no hydrogen 2.951 N/A VAL 166.A N LEU 162.A O no hydrogen 2.774 N/A ALA 167.A N LEU 163.A O no hydrogen 2.910 N/A SER 168.A N ARG 164.A O no hydrogen 2.939 N/A TYR 169.A N GLN 165.A O no hydrogen 2.755 N/A GLY 170.A N VAL 166.A O no hydrogen 3.077 N/A ARG 171.A N PRO 150.A O no hydrogen 2.932 N/A ARG 171.A NH1 SER 168.A O no hydrogen 2.955 N/A ARG 171.A NH1 GLY 170.A O no hydrogen 3.144 N/A THR 174.A N PRO 207.A O no hydrogen 2.685 N/A THR 174.A OG1 ALA 206.A O no hydrogen 2.745 N/A TYR 175.A N PHE 152.A O no hydrogen 3.066 N/A LEU 176.A N LEU 209.A O no hydrogen 2.758 N/A LEU 177.A N CYS 154.A O no hydrogen 3.166 N/A SER 178.A N GLY 211.A O no hydrogen 2.901 N/A SER 178.A OG GLY 211.A O no hydrogen 3.347 N/A SER 178.A OG PHE 212.A O no hydrogen 2.569 N/A ARG 179.A NE ASN 187.A O no hydrogen 2.753 N/A ARG 179.A NH1 SER 180.A O no hydrogen 2.782 N/A ARG 179.A NH1 VAL 182.A O no hydrogen 2.786 N/A ARG 179.A NH2 VAL 182.A O no hydrogen 2.934 N/A ARG 179.A NH2 GLY 184.A O no hydrogen 3.149 N/A ARG 179.A NH2 ASN 187.A O no hydrogen 3.268 N/A THR 183.A N ALA 59.A O no hydrogen 3.046 N/A THR 183.A OG1 ASP 60.A OD1 no hydrogen 2.733 N/A ARG 188.A NE ALA 185.A O no hydrogen 2.983 N/A GLY 189.A N GLY 213.A O no hydrogen 3.357 N/A LEU 196.A N LEU 193.A O no hydrogen 3.179 N/A ILE 197.A N LEU 193.A O no hydrogen 3.179 N/A GLU 198.A N HIS 194.A O no hydrogen 3.010 N/A LYS 199.A N HIS 195.A O no hydrogen 3.103 N/A LYS 199.A NZ GLU 202.A OE1 no hydrogen 2.668 N/A LYS 199.A NZ TYR 203.A OH no hydrogen 3.491 N/A LEU 200.A N LEU 196.A O no hydrogen 2.832 N/A LYS 201.A N ILE 197.A O no hydrogen 3.122 N/A LYS 201.A NZ GLY 227.A O no hydrogen 3.156 N/A GLU 202.A N GLU 198.A O no hydrogen 2.845 N/A TYR 203.A N LYS 199.A O no hydrogen 2.968 N/A TYR 203.A OH ASP 160.A OD1 no hydrogen 2.489 N/A TYR 203.A OH ASP 160.A OD2 no hydrogen 3.331 N/A HIS 204.A N LYS 201.A O no hydrogen 3.105 N/A ALA 205.A N LEU 200.A O no hydrogen 2.945 N/A LEU 209.A N THR 174.A O no hydrogen 2.875 N/A GLN 210.A N GLY 230.A O no hydrogen 2.873 N/A GLN 210.A NE2 ALA 190.A O no hydrogen 2.947 N/A GLY 211.A N LEU 176.A O no hydrogen 3.077 N/A SER 215.A N GLN 219.A OE1 no hydrogen 2.967 N/A SER 215.A OG ALA 185.A O no hydrogen 2.886 N/A SER 216.A OG GLN 219.A OE1 no hydrogen 2.969 N/A GLU 218.A N GLU 218.A OE1 no hydrogen 2.655 N/A GLN 219.A N SER 216.A O no hydrogen 2.821 N/A GLN 219.A NE2 GLY 213.A O no hydrogen 2.962 N/A VAL 220.A N SER 216.A O no hydrogen 3.331 N/A SER 221.A N PRO 217.A O no hydrogen 3.027 N/A SER 221.A OG GLU 218.A O no hydrogen 3.489 N/A ALA 222.A N GLU 218.A O no hydrogen 3.042 N/A ALA 223.A N GLN 219.A O no hydrogen 2.984 N/A VAL 224.A N VAL 220.A O no hydrogen 3.177 N/A ARG 225.A N SER 221.A O no hydrogen 2.910 N/A ARG 225.A NH1 SER 221.A OG no hydrogen 2.678 N/A ALA 226.A N ALA 222.A O no hydrogen 2.980 N/A GLY 227.A N VAL 224.A O no hydrogen 2.924 N/A ALA 228.A N ALA 223.A O no hydrogen 3.056 N/A ALA 229.A N ALA 208.A O no hydrogen 2.680 N/A ALA 231.A N ALA 18.A O no hydrogen 3.075 N/A ILE 232.A N GLN 210.A O no hydrogen 2.762 N/A SER 233.A N VAL 20.A O no hydrogen 3.132 N/A SER 233.A OG ILE 214.A O no hydrogen 2.737 N/A ILE 237.A N GLY 234.A O no hydrogen 2.875 N/A VAL 238.A N GLY 234.A O no hydrogen 2.936 N/A LYS 239.A N SER 235.A O no hydrogen 2.835 N/A LYS 239.A NZ GLU 186.A OE2 no hydrogen 3.349 N/A ILE 240.A N ILE 237.A O no hydrogen 2.959 N/A ILE 241.A N ILE 237.A O no hydrogen 3.301 N/A GLU 242.A N VAL 238.A O no hydrogen 2.847 N/A LYS 243.A N LYS 239.A O no hydrogen 2.794 N/A LYS 243.A NZ GLU 254.A OE1 no hydrogen 3.509 N/A LYS 243.A NZ GLU 254.A OE2 no hydrogen 3.191 N/A ASN 244.A N ILE 240.A O no hydrogen 3.259 N/A ASN 244.A N ILE 241.A O no hydrogen 3.239 N/A ASN 244.A ND2 ILE 240.A O no hydrogen 2.784 N/A ASN 244.A ND2 GLU 254.A OE1 no hydrogen 3.091 N/A SER 247.A N ASN 244.A O no hydrogen 2.955 N/A GLN 250.A N SER 247.A OG no hydrogen 3.316 N/A GLN 250.A NE2 GLU 254.A OE2 no hydrogen 3.337 N/A MET 251.A N SER 247.A O no hydrogen 2.776 N/A LEU 252.A N PRO 248.A O no hydrogen 3.052 N/A ALA 253.A N LYS 249.A O no hydrogen 3.234 N/A GLU 254.A N GLN 250.A O no hydrogen 3.066 N/A LEU 255.A N MET 251.A O no hydrogen 2.935 N/A ARG 256.A N LEU 252.A O no hydrogen 2.878 N/A ARG 256.A NH1 ASP 42.A OD2 no hydrogen 2.470 N/A ARG 256.A NH2 ASP 42.A OD2 no hydrogen 2.671 N/A SER 257.A N ALA 253.A O no hydrogen 2.986 N/A PHE 258.A N GLU 254.A O no hydrogen 2.992 N/A VAL 259.A N LEU 255.A O no hydrogen 2.899 N/A SER 260.A N ARG 256.A O no hydrogen 2.925 N/A SER 260.A OG ALA 43.A O no hydrogen 3.367 N/A SER 260.A OG ARG 256.A O no hydrogen 2.665 N/A ALA 261.A N SER 257.A O no hydrogen 3.137 N/A MET 262.A N PHE 258.A O no hydrogen 2.802 N/A LYS 263.A N VAL 259.A O no hydrogen 2.746 N/A LYS 263.A NZ GLU 16.A OE2 no hydrogen 2.721 N/A LYS 263.A NZ GLY 17.A O no hydrogen 2.931 N/A LYS 263.A NZ ASP 46.A OD1 no hydrogen 3.485 N/A LYS 263.A NZ ASP 46.A OD2 no hydrogen 2.664 N/A LYS 263.A NZ SER 266.A OG no hydrogen 2.851 N/A ALA 264.A N SER 260.A O no hydrogen 2.846 N/A ALA 265.A N ALA 261.A O no hydrogen 3.230 N/A SER 266.A N LYS 263.A O no hydrogen 2.978 N/A SER 266.A OG GLY 17.A O no hydrogen 3.100 N/A SER 266.A OG LYS 263.A O no hydrogen 2.658 N/A ARG 267.A N ALA 264.A O no hydrogen 3.014 N/A