# 149 INDX RES C NUM NC M L S N FC H_RES H_THEOR H_OBSER DELTA_H DKL(O|T) DKL(O|R) FODMIR 1 ARG A 2 5 0 0 0 0 -2 0.272 0.00347 0.00299 0.00048 -0.00064 -0.00349 FODMIR 2 SER A 3 4 0 0 0 0 -1 0.422 0.00314 0.00630 -0.00316 0.00633 -0.00057 FODMIR 3 LEU A 4 6 1 0 0 0 0 0.783 0.00488 0.00888 -0.00400 0.00768 0.00359 FODMIR 4 ALA A 5 4 0 0 0 0 -1 0.572 0.00250 0.00595 -0.00344 0.00743 -0.00104 FODMIR 5 ASN A 6 4 0 0 0 0 -2 0.278 0.00224 0.00404 -0.00180 0.00343 -0.00296 FODMIR 6 ALA A 7 4 0 0 0 0 0 0.572 0.00506 0.00856 -0.00349 0.00648 0.00300 FODMIR 7 PRO A 8 4 0 0 0 0 +1 0.300 0.00735 0.00707 0.00028 -0.00040 0.00052 FODMIR 8 ILE A 9 6 1 0 0 0 +2 0.883 0.01150 0.01122 0.00028 -0.00040 0.00832 FODMIR 9 MET A 10 6 1 0 1 0 +2 0.828 0.01304 0.01137 0.00167 -0.00225 0.00865 FODMIR 10 ILE A 11 7 1 0 0 0 +2 0.883 0.01566 0.01131 0.00435 -0.00531 0.00852 FODMIR 11 LEU A 12 6 1 0 0 0 +2 0.783 0.01560 0.00889 0.00671 -0.00722 0.00360 FODMIR 12 ASN A 13 4 0 0 0 0 0 0.278 0.01438 0.00541 0.00897 -0.00763 -0.00168 FODMIR 13 GLY A 14 4 0 0 0 0 +2 0.550 0.01127 0.00902 0.00225 -0.00290 0.00385 FODMIR 14 PRO A 15 4 0 0 0 0 0 0.300 0.00784 0.00618 0.00166 -0.00212 -0.00074 FODMIR 15 ASN A 16 4 0 0 0 0 -1 0.278 0.00538 0.00303 0.00235 -0.00251 -0.00348 FODMIR 16 LEU A 17 5 0 0 0 0 +1 0.783 0.00972 0.00728 0.00243 -0.00303 0.00086 FODMIR 17 ASN A 18 4 0 0 0 0 -1 0.278 0.00452 0.00366 0.00087 -0.00112 -0.00320 FODMIR 18 LEU A 19 5 0 0 0 0 -1 0.783 0.00314 0.00623 -0.00309 0.00615 -0.00067 FODMIR 19 LEU A 20 6 1 0 0 0 +1 0.783 0.00604 0.00824 -0.00220 0.00369 0.00245 FODMIR 20 GLY A 21 4 0 0 0 0 0 0.550 0.00275 0.00793 -0.00518 0.01212 0.00192 FODMIR 21 GLN A 22 4 0 0 0 0 -2 0.250 0.00171 0.00389 -0.00218 0.00463 -0.00306 FODMIR 22 ALA A 23 3 0 0 0 0 -1 0.572 0.00238 0.00552 -0.00314 0.00671 -0.00155 FODMIR 23 GLN A 24 3 0 0 0 0 -2 0.250 0.00251 0.00377 -0.00125 0.00220 -0.00314 FODMIR 24 PRO A 25 3 0 0 0 0 -1 0.300 0.00178 0.00445 -0.00267 0.00588 -0.00264 FODMIR 25 GLU A 26 3 0 0 0 0 -2 0.083 0.00147 0.00259 -0.00112 0.00211 -0.00356 FODMIR 26 ILE A 27 4 0 0 0 0 -1 0.883 0.00336 0.00639 -0.00303 0.00592 -0.00045 FODMIR 27 TYR A 28 4 0 0 0 0 0 0.700 0.00599 0.00642 -0.00043 0.00065 -0.00041 FODMIR 28 GLY A 29 3 0 0 0 0 -1 0.550 0.00327 0.00592 -0.00265 0.00506 -0.00107 FODMIR 29 SER A 30 3 0 0 0 0 -2 0.422 0.00205 0.00431 -0.00226 0.00462 -0.00275 FODMIR 30 ASP A 31 3 0 0 0 0 -2 0.167 0.00366 0.00343 0.00023 -0.00032 -0.00332 FODMIR 31 THR A 32 4 0 0 0 0 -1 0.478 0.00414 0.00675 -0.00262 0.00477 0.00006 FODMIR 32 LEU A 33 6 1 0 0 0 +1 0.783 0.00796 0.00730 0.00066 -0.00091 0.00089 FODMIR 33 ALA A 34 5 0 0 0 0 -1 0.572 0.00487 0.00636 -0.00149 0.00245 -0.00049 FODMIR 34 ASP A 35 4 0 0 0 0 -1 0.167 0.00415 0.00437 -0.00022 0.00033 -0.00270 FODMIR 35 VAL A 36 6 1 0 0 0 +2 0.811 0.00930 0.00948 -0.00018 0.00026 0.00473 FODMIR 36 GLU A 37 4 0 0 0 0 0 0.083 0.00778 0.00468 0.00310 -0.00343 -0.00243 FODMIR 37 ALA A 38 5 0 0 0 0 0 0.572 0.00535 0.00750 -0.00214 0.00364 0.00119 FODMIR 38 LEU A 39 7 1 0 1 0 +1 0.783 0.00630 0.00785 -0.00155 0.00250 0.00177 FODMIR 39 CYS A 40 6 1 0 0 0 +2 1.000 0.00968 0.01155 -0.00187 0.00294 0.00906 FODMIR 40 VAL A 41 6 1 0 0 0 +1 0.811 0.00593 0.00834 -0.00242 0.00411 0.00262 FODMIR 41 LYS A 42 4 0 0 0 0 -2 0.000 0.00326 0.00251 0.00074 -0.00094 -0.00356 FODMIR 42 ALA A 43 5 0 0 0 0 0 0.572 0.00547 0.00900 -0.00353 0.00647 0.00380 FODMIR 43 ALA A 44 5 0 0 0 0 0 0.572 0.00578 0.01189 -0.00611 0.01236 0.00980 FODMIR 44 ALA A 45 4 0 0 0 0 0 0.572 0.00315 0.00936 -0.00621 0.01471 0.00448 FODMIR 45 ALA A 46 4 0 0 0 0 0 0.572 0.00223 0.00697 -0.00475 0.01148 0.00039 FODMIR 46 HIS A 47 4 0 0 0 0 -1 0.628 0.00310 0.00653 -0.00343 0.00701 -0.00026 FODMIR 47 GLY A 48 4 0 0 0 0 0 0.550 0.00271 0.00727 -0.00456 0.01034 0.00084 FODMIR 48 GLY A 49 3 0 0 0 0 0 0.550 0.00453 0.00984 -0.00531 0.01100 0.00543 FODMIR 49 THR A 50 3 0 0 0 0 +1 0.478 0.00610 0.00696 -0.00086 0.00132 0.00037 FODMIR 50 VAL A 51 4 0 0 0 0 +1 0.811 0.00923 0.00822 0.00100 -0.00136 0.00241 FODMIR 51 ASP A 52 3 0 0 0 0 0 0.167 0.00941 0.00417 0.00523 -0.00489 -0.00286 FODMIR 52 PHE A 53 4 0 0 0 0 0 0.906 0.01133 0.00607 0.00526 -0.00547 -0.00088 FODMIR 53 ARG A 54 3 0 0 0 0 0 0.272 0.00918 0.00359 0.00559 -0.00486 -0.00324 FODMIR 54 GLN A 55 2 0 1 0 0 0 0.250 0.00805 0.00349 0.00456 -0.00421 -0.00329 FODMIR 55 SER A 56 2 0 1 0 1 0 0.422 0.00675 0.00585 0.00090 -0.00121 -0.00116 FODMIR 56 ASN A 57 2 0 1 0 0 -1 0.278 0.00430 0.00375 0.00054 -0.00073 -0.00315 FODMIR 57 HIS A 58 3 0 0 0 0 -2 0.628 0.00289 0.00355 -0.00066 0.00106 -0.00326 FODMIR 58 GLU A 59 3 0 0 0 0 -1 0.083 0.00419 0.00286 0.00133 -0.00158 -0.00352 FODMIR 59 GLY A 60 4 0 0 0 0 -1 0.550 0.00324 0.00544 -0.00220 0.00406 -0.00165 FODMIR 60 GLU A 61 4 0 0 0 0 -1 0.083 0.00404 0.00388 0.00016 -0.00023 -0.00307 FODMIR 61 LEU A 62 6 1 0 0 0 +1 0.783 0.00859 0.00770 0.00089 -0.00121 0.00153 FODMIR 62 VAL A 63 5 0 0 0 0 0 0.811 0.00499 0.00955 -0.00455 0.00892 0.00485 FODMIR 63 ASP A 64 4 0 0 0 0 -2 0.167 0.00336 0.00384 -0.00047 0.00073 -0.00310 FODMIR 64 TRP A 65 5 0 0 1 0 0 0.856 0.00707 0.00561 0.00146 -0.00187 -0.00145 FODMIR 65 ILE A 66 6 1 0 0 0 +1 0.883 0.00866 0.00790 0.00076 -0.00104 0.00186 FODMIR 66 HIS A 67 5 0 0 0 0 -1 0.628 0.00378 0.00492 -0.00113 0.00186 -0.00221 FODMIR 67 GLU A 68 4 0 0 0 0 -1 0.083 0.00496 0.00222 0.00274 -0.00257 -0.00354 FODMIR 68 ALA A 69 4 0 0 0 0 +1 0.572 0.00749 0.00718 0.00031 -0.00044 0.00070 FODMIR 69 ARG A 70 4 0 0 0 0 -2 0.272 0.00345 0.00392 -0.00047 0.00072 -0.00304 FODMIR 70 LEU A 71 6 1 0 0 0 -2 0.783 0.00290 0.00428 -0.00138 0.00240 -0.00278 FODMIR 71 ASN A 72 4 0 0 0 0 -1 0.278 0.00408 0.00391 0.00017 -0.00024 -0.00305 FODMIR 72 HIS A 73 4 0 0 0 0 +1 0.628 0.00786 0.00926 -0.00139 0.00218 0.00430 FODMIR 73 CYS A 74 5 0 0 0 0 +1 1.000 0.00769 0.01176 -0.00407 0.00720 0.00951 FODMIR 74 GLY A 75 4 0 0 0 0 +2 0.550 0.01131 0.01185 -0.00054 0.00080 0.00972 FODMIR 75 ILE A 76 5 0 0 0 0 +2 0.883 0.01457 0.01146 0.00310 -0.00396 0.00885 FODMIR 76 VAL A 77 5 0 0 0 0 +2 0.811 0.01734 0.01112 0.00623 -0.00713 0.00810 FODMIR 77 ILE A 78 5 0 0 0 0 +2 0.883 0.01774 0.00909 0.00865 -0.00877 0.00397 FODMIR 78 ASN A 79 3 0 0 0 0 0 0.278 0.01662 0.00616 0.01046 -0.00882 -0.00077 FODMIR 79 PRO A 80 3 0 0 0 0 0 0.300 0.01463 0.00633 0.00830 -0.00765 -0.00053 FODMIR 80 ALA A 81 3 0 0 0 0 +1 0.572 0.01190 0.00818 0.00372 -0.00442 0.00233 FODMIR 81 ALA A 82 3 0 0 0 0 +1 0.572 0.00798 0.00729 0.00069 -0.00095 0.00087 FODMIR 82 TYR A 83 3 0 0 0 0 0 0.700 0.00713 0.00618 0.00095 -0.00128 -0.00074 FODMIR 83 SER A 84 2 0 1 0 1 +1 0.422 0.01029 0.00753 0.00276 -0.00339 0.00126 FODMIR 84 HIS A 85 2 0 1 0 0 0 0.628 0.00690 0.00654 0.00036 -0.00050 -0.00024 FODMIR 85 THR A 86 3 0 0 0 0 -1 0.478 0.00447 0.00402 0.00045 -0.00062 -0.00298 FODMIR 86 SER A 87 3 0 0 0 0 0 0.422 0.00573 0.00806 -0.00233 0.00397 0.00213 FODMIR 87 VAL A 88 5 0 0 0 0 0 0.811 0.00327 0.00758 -0.00430 0.00918 0.00132 FODMIR 88 ALA A 89 4 0 0 0 0 0 0.572 0.00398 0.00798 -0.00400 0.00801 0.00199 FODMIR 89 ILE A 90 5 0 0 0 0 +1 0.883 0.00814 0.00962 -0.00148 0.00232 0.00499 FODMIR 90 LEU A 91 6 1 0 0 0 0 0.783 0.00579 0.00946 -0.00367 0.00671 0.00468 FODMIR 91 ASP A 92 4 0 0 0 0 -1 0.167 0.00319 0.00443 -0.00124 0.00210 -0.00266 FODMIR 92 ALA A 93 4 0 0 0 0 0 0.572 0.00554 0.00953 -0.00400 0.00748 0.00483 FODMIR 93 LEU A 94 6 1 0 0 0 +1 0.783 0.00864 0.00916 -0.00052 0.00077 0.00411 FODMIR 94 ASN A 95 4 0 0 0 0 -1 0.278 0.00385 0.00448 -0.00063 0.00099 -0.00261 FODMIR 95 THR A 96 4 0 0 0 0 -1 0.478 0.00320 0.00546 -0.00226 0.00421 -0.00163 FODMIR 96 CYS A 97 4 0 0 0 0 0 1.000 0.00517 0.00956 -0.00439 0.00848 0.00487 FODMIR 97 ASP A 98 3 0 0 0 0 -2 0.167 0.00222 0.00236 -0.00014 0.00021 -0.00356 FODMIR 98 GLY A 99 3 0 0 0 0 -1 0.550 0.00384 0.00440 -0.00056 0.00086 -0.00268 FODMIR 99 LEU A 100 5 0 0 0 0 +1 0.783 0.00722 0.00873 -0.00151 0.00239 0.00332 FODMIR 100 PRO A 101 4 0 0 0 0 +1 0.300 0.00836 0.00718 0.00118 -0.00158 0.00070 FODMIR 101 VAL A 102 6 1 0 0 0 +2 0.811 0.01185 0.01064 0.00121 -0.00165 0.00707 FODMIR 102 VAL A 103 5 0 0 0 0 +2 0.811 0.01395 0.01056 0.00339 -0.00424 0.00691 FODMIR 103 GLU A 104 4 0 0 0 0 0 0.083 0.01440 0.00587 0.00852 -0.00760 -0.00113 FODMIR 104 VAL A 105 5 0 0 0 0 +2 0.811 0.01582 0.01005 0.00577 -0.00658 0.00585 FODMIR 105 HIS A 106 5 0 0 0 0 +1 0.628 0.01278 0.00697 0.00581 -0.00610 0.00038 FODMIR 106 ILE A 107 6 1 0 0 0 +1 0.883 0.01002 0.00851 0.00151 -0.00200 0.00292 FODMIR 107 SER A 108 4 0 0 0 0 0 0.422 0.00756 0.00657 0.00098 -0.00132 -0.00020 FODMIR 108 ASN A 109 4 0 0 0 0 -1 0.278 0.00449 0.00538 -0.00089 0.00140 -0.00172 FODMIR 109 ILE A 110 5 0 0 0 0 +1 0.883 0.00649 0.00833 -0.00184 0.00301 0.00260 FODMIR 110 HIS A 111 4 0 0 0 0 -1 0.628 0.00381 0.00503 -0.00122 0.00201 -0.00209 FODMIR 111 GLN A 112 3 0 0 0 0 -2 0.250 0.00213 0.00161 0.00052 -0.00065 -0.00332 FODMIR 112 ARG A 113 3 0 0 0 0 -2 0.272 0.00378 0.00267 0.00111 -0.00134 -0.00355 FODMIR 113 GLU A 114 3 0 0 0 0 -2 0.083 0.00235 0.00243 -0.00008 0.00011 -0.00356 FODMIR 114 PRO A 115 3 0 0 0 0 -2 0.300 0.00177 0.00275 -0.00098 0.00175 -0.00354 FODMIR 115 PHE A 116 6 1 0 0 0 -1 0.906 0.00292 0.00468 -0.00176 0.00318 -0.00243 FODMIR 116 ARG A 117 4 0 0 0 0 -1 0.272 0.00512 0.00451 0.00060 -0.00082 -0.00258 FODMIR 117 HIS A 118 4 0 0 0 0 -2 0.628 0.00320 0.00395 -0.00075 0.00121 -0.00302 FODMIR 118 HIS A 119 4 0 0 0 0 -1 0.628 0.00449 0.00380 0.00069 -0.00092 -0.00312 FODMIR 119 SER A 120 3 0 0 0 0 0 0.422 0.00780 0.00675 0.00104 -0.00140 0.00006 FODMIR 120 TYR A 121 5 0 0 0 0 -1 0.700 0.00481 0.00578 -0.00097 0.00154 -0.00124 FODMIR 121 VAL A 122 4 0 0 0 0 +1 0.811 0.01074 0.00778 0.00296 -0.00362 0.00165 FODMIR 122 SER A 123 3 0 0 0 0 0 0.422 0.00804 0.00541 0.00263 -0.00309 -0.00168 FODMIR 123 GLN A 124 2 0 1 0 0 -1 0.250 0.00440 0.00200 0.00240 -0.00227 -0.00349 FODMIR 124 ARG A 125 2 0 1 0 1 0 0.272 0.00685 0.00396 0.00289 -0.00313 -0.00302 FODMIR 125 ALA A 126 2 0 1 0 0 +1 0.572 0.00900 0.00828 0.00072 -0.00099 0.00251 FODMIR 126 ASP A 127 2 0 1 0 0 0 0.167 0.00680 0.00387 0.00293 -0.00315 -0.00308 FODMIR 127 GLY A 128 3 0 0 0 0 +1 0.550 0.00909 0.00795 0.00114 -0.00154 0.00194 FODMIR 128 VAL A 129 5 0 0 0 0 +1 0.811 0.00922 0.00750 0.00172 -0.00224 0.00120 FODMIR 129 VAL A 130 5 0 0 0 0 +2 0.811 0.01005 0.00917 0.00088 -0.00122 0.00413 FODMIR 130 ALA A 131 4 0 0 0 0 +1 0.572 0.00770 0.00846 -0.00076 0.00115 0.00283 FODMIR 131 GLY A 132 4 0 0 0 0 +1 0.550 0.00586 0.00891 -0.00305 0.00538 0.00365 FODMIR 132 CYS A 133 5 0 0 0 0 +1 1.000 0.00599 0.01122 -0.00523 0.01017 0.00833 FODMIR 133 GLY A 134 5 0 0 0 0 +1 0.550 0.00750 0.01048 -0.00298 0.00506 0.00673 FODMIR 134 VAL A 135 6 1 0 0 0 +1 0.811 0.00806 0.00755 0.00051 -0.00071 0.00129 FODMIR 135 GLN A 136 4 0 0 0 0 -1 0.250 0.00520 0.00502 0.00018 -0.00025 -0.00210 FODMIR 136 GLY A 137 4 0 0 0 0 +2 0.550 0.01042 0.01099 -0.00056 0.00084 0.00782 FODMIR 137 TYR A 138 5 0 0 0 0 0 0.700 0.01441 0.00658 0.00784 -0.00744 -0.00019 FODMIR 138 VAL A 139 6 1 0 0 0 +1 0.811 0.00789 0.00910 -0.00121 0.00188 0.00401 FODMIR 139 PHE A 140 7 1 0 1 0 +1 0.906 0.00647 0.00702 -0.00055 0.00083 0.00045 FODMIR 140 GLY A 141 5 0 0 0 0 +1 0.550 0.01162 0.00820 0.00343 -0.00413 0.00236 FODMIR 141 VAL A 142 7 1 0 0 0 +2 0.811 0.01025 0.00931 0.00093 -0.00129 0.00440 FODMIR 142 GLU A 143 4 0 0 0 0 -1 0.083 0.00545 0.00340 0.00205 -0.00232 -0.00334 FODMIR 143 ARG A 144 4 0 0 0 0 -1 0.272 0.00548 0.00329 0.00219 -0.00242 -0.00339 FODMIR 144 ILE A 145 6 1 0 0 0 +2 0.883 0.00932 0.01035 -0.00102 0.00155 0.00646 FODMIR 145 ALA A 146 4 0 0 0 0 0 0.572 0.00509 0.00829 -0.00320 0.00583 0.00252 FODMIR 146 ALA A 147 4 0 0 0 0 0 0.572 0.00333 0.00776 -0.00443 0.00948 0.00163 FODMIR 147 LEU A 148 5 0 0 0 0 0 0.783 0.00446 0.00822 -0.00376 0.00725 0.00240 FODMIR 148 ALA A 149 5 0 0 1 0 0 0.572 0.00391 0.00742 -0.00351 0.00685 0.00107 FODMIR 149 GLY A 150 5 0 0 0 0 -2 0.550 0.00191 0.00425 -0.00234 0.00489 -0.00280