NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.3691 8.3301 115.2949 58.0601 62.4195 172.1167 3 A 4.8061 7.9594 127.8565 49.0100 21.7337 175.0431 4 L 4.3953 9.1600 122.1035 55.1691 44.4079 174.5895 5 T 4.8011 8.9097 118.9043 62.3904 70.1225 174.0160 6 Q 5.3728 8.8249 124.5213 51.9030 33.0239 173.7016 7 P 4.3800 0.0000 0.0000 62.5985 32.3856 177.2383 8 A 4.2078 8.6148 122.5767 54.7717 19.7930 177.3515 9 S 5.1262 7.6348 108.6548 55.9389 66.5240 173.2818 *11 V 4.5465 8.5713 125.2987 63.0442 32.6398 174.0737 12 S 5.1286 8.3708 120.6367 57.2026 66.5861 172.7101 13 G 4.1010 8.3752 105.9388 45.7431 0.0000 172.8417 14 S 4.9568 9.0757 116.7746 56.6630 64.6456 172.6763 15 P 4.5367 0.0000 0.0000 64.6256 31.6206 176.5529 16 G 4.0025 9.1483 111.5200 45.4083 0.0000 173.5875 17 Q 4.4828 7.8180 118.3032 56.1857 30.4162 175.2374 18 T 4.9256 8.2886 116.5369 61.9187 71.1263 173.4762 19 I 4.5254 8.4374 126.0464 59.3786 41.7517 174.0843 20 T 4.9477 8.2381 121.6880 61.7427 72.1867 173.2384 21 I 4.5632 8.5385 126.7301 59.5153 39.4579 175.1799 22 S 5.1967 8.7014 121.5177 57.6054 65.9008 174.1610 23 C 4.9356 9.2530 121.3400 55.5847 44.5877 172.0385 24 N 5.1470 9.5786 125.5806 52.3111 39.4924 174.1527 25 G 4.3734 9.1312 114.4110 45.4900 0.0000 170.3471 26 T 4.8885 9.2792 111.3402 59.6214 71.7526 174.7457 27 S 4.1521 8.5472 114.6091 60.6303 63.3590 175.4450 27A S 4.7362 8.0135 114.9598 58.2212 64.2745 174.4734 27B D 5.5086 7.9230 117.9024 53.6140 40.8540 177.4948 27C V 3.5949 9.1309 117.0697 65.5092 32.4257 177.0444 28 G 3.9906 7.8065 106.4288 46.7188 0.0000 174.7523 29 G 3.4065 7.7544 107.3744 46.2730 0.0000 173.5476 30 F 4.8770 7.7633 116.0711 56.1184 43.7026 174.3624 31 D 4.9533 8.5535 121.4956 54.6215 40.0927 177.1434 32 S 5.3849 7.6276 110.8991 57.9715 64.1250 175.8657 33 V 4.7354 7.8534 120.1826 61.6667 33.3128 175.1225 34 S 5.3690 8.8380 121.9240 56.3146 66.7638 172.8387 35 W 5.3928 8.9461 120.5922 55.2190 32.7189 174.0854 36 Y 5.2927 9.4638 120.8939 56.2990 41.3835 174.1217 37 Q 4.4504 9.1351 124.8708 54.1960 31.8860 173.9865 38 Q 4.7346 8.9534 127.2617 54.5541 31.8317 174.2572 39 S 5.0380 8.5505 123.1229 56.3729 65.1292 172.3633 40 P 4.4139 0.0000 0.0000 64.3514 31.2777 176.7869 41 G 3.9424 9.0172 109.8605 45.5061 0.0000 172.9323 42 K 4.6110 7.7904 117.8814 53.7863 34.8619 176.1523 43 A 4.1706 8.2969 124.3491 51.4120 19.0194 175.9181 44 P 4.9139 0.0000 0.0000 62.6557 32.4330 176.0502 45 K 4.8110 9.0202 120.5413 54.9930 36.1141 176.0386 46 V 3.8448 8.7364 116.7228 62.2813 31.5639 175.3510 47 M 4.4028 9.1179 124.7752 56.4041 33.9259 176.6257 48 V 4.9341 7.5960 116.4467 61.3469 35.7630 173.8198 49 F 5.2903 9.0226 120.0113 55.1785 41.8410 173.4377 50 D 4.7027 9.7106 115.9978 54.5343 38.3841 173.9302 51 V 3.7745 8.1222 123.5528 63.1504 31.9572 172.6651 52 S 4.7084 7.6680 110.2464 57.9538 64.1233 173.2958 53 H 4.4197 7.7807 119.3955 54.7621 29.5849 174.2142 54 R 4.8415 8.0000 121.8243 53.7008 32.0034 174.6369 55 P 4.8177 0.0000 0.0000 61.9399 32.2959 175.7934 56 S 4.1974 8.3621 116.1873 60.1893 63.0277 175.3764 57 G 3.9814 9.0486 113.1795 45.1765 0.0000 173.1489 58 I 4.1414 7.0646 121.2330 59.7632 38.2366 175.8297 59 S 4.2738 8.7711 119.9389 58.4790 62.6513 174.6345 60 N 4.6106 8.7222 123.3288 55.0111 37.3916 176.1238 61 R 4.1442 7.8617 118.2294 57.8230 31.3373 176.0898 62 F 4.9943 7.9577 118.2689 56.0787 39.9276 175.7396 63 S 4.7198 9.1590 118.6930 56.3642 66.3966 173.2616 64 G 4.7786 8.5332 108.0626 44.0227 0.0000 171.9109 65 S 4.8805 8.9165 115.4631 56.7992 66.6339 172.5589 66 K 5.2262 8.4365 123.7368 55.0237 35.5711 175.9225 67 S 4.4251 9.4170 121.8212 57.6043 65.5969 175.1599 68 G 3.8079 8.3938 117.7470 47.1566 0.0000 173.5281 69 N 4.8679 8.9526 122.8340 52.9235 38.8623 173.4524 70 T 5.1806 8.0267 116.1611 61.6810 71.6078 173.0431 71 A 5.3740 9.1060 127.4212 50.4236 22.6001 175.3514 72 S 5.2217 9.6198 115.3708 56.6815 67.6866 172.8629 73 L 4.5155 8.3250 125.6351 53.3143 44.1695 174.9564 74 T 4.8255 8.8362 123.2205 61.7091 71.5770 173.3915 75 I 4.3626 8.3564 126.9953 59.4366 39.5610 174.9834 76 S 4.6806 8.3177 122.8554 55.9353 65.3438 174.1366 77 G 4.2440 8.2363 107.9173 45.6012 0.0000 173.8604 78 L 3.7969 7.7881 118.8151 55.7921 43.1015 175.2742 79 H 5.1884 9.3443 125.1515 53.7336 32.6772 174.4166 80 I 3.7886 8.0204 118.0627 63.7432 37.3573 177.2437 81 E 4.3507 8.4354 116.6577 57.4775 29.7623 176.7989 82 D 4.9270 8.3286 119.4505 55.1963 41.5624 176.7883 83 E 4.3108 7.9736 120.0679 55.3993 30.1682 177.5833 84 G 3.9727 7.4983 109.4859 45.4345 0.0000 169.9474 85 D 5.3228 8.0492 119.6112 53.0662 42.9354 175.5517 86 Y 4.9212 8.9120 121.2450 56.2228 40.8220 174.6535 87 F 5.6564 9.8036 123.3238 55.8548 42.3694 172.2153 88 C 4.3255 8.9784 117.9749 54.4675 44.9077 172.3998 89 S 4.9512 8.6710 114.7281 56.8507 66.0164 172.4926 90 S 5.1543 8.7085 118.3171 55.4571 66.2981 172.7990 91 L 4.4667 8.3623 126.2289 55.3129 43.3785 175.7140 92 T 5.1269 8.2876 121.4033 61.6205 71.1104 175.4594 93 D 4.8763 9.0220 122.9163 55.5615 39.4775 177.2701 94 R 4.3066 7.8212 117.5956 55.8114 30.5440 176.5143 95 S 3.8100 7.9168 112.9433 59.5760 60.7646 170.0919 95A H 4.7839 7.7879 118.5641 55.0058 31.0418 173.8312 96 R 4.9961 8.3389 117.2008 54.6242 33.0606 175.5751 97 I 4.5728 8.6578 123.8737 59.5768 40.4086 174.8723 98 F 5.1351 8.8343 124.5518 55.7813 42.0958 175.5799 99 G 4.3535 9.0717 109.5900 45.1989 0.0000 174.3607 100 G 3.8300 8.7830 108.3744 46.7709 0.0000 175.0472 101 G 3.6178 8.5317 105.7822 45.1535 0.0000 172.9181 102 T 4.9139 8.1076 116.3446 60.1158 72.3723 173.0236 103 K 4.7618 8.8894 128.4106 55.2037 33.7687 175.3882 104 V 4.5798 9.1829 128.4293 61.7406 33.5968 174.2922 105 T 4.7651 8.4836 124.7238 61.7899 71.2549 173.7117 106 V 4.2274 8.7133 126.8874 60.8075 32.1567 174.7096 106A L 4.1846 8.5785 128.3438 55.5722 41.8525 177.7693 107 G 4.0952 9.0678 112.0578 44.9762 0.0000 171.8463 108 Q 4.4984 7.4923 115.8102 54.0718 30.9100 172.1083 109 P 4.4858 0.0000 0.0000 62.3620 31.9731 176.3862 110 K 4.6867 8.6893 119.9380 56.9724 32.9190 176.1450 111 A 4.8815 9.1141 124.7405 50.0386 22.2389 175.5550 112 A 4.6133 8.7755 124.0513 50.9180 19.5141 175.5691 113 P 4.8012 0.0000 0.0000 62.9545 32.9078 175.6376 114 S 4.7117 9.0091 117.8097 57.1891 64.7163 173.2388 115 V 4.7293 8.3713 124.7857 61.3597 33.3856 174.6302 116 T 4.4116 8.9806 124.8808 61.5696 71.4288 172.5586 117 L 4.9122 8.3048 128.7101 53.3356 44.0378 175.1320 118 F 4.9916 9.4120 126.1115 55.2241 41.0037 174.2911 119 P 4.6562 0.0000 0.0000 61.2822 32.7531 174.0851 120 P 4.4501 0.0000 0.0000 61.8695 31.7328 177.1491 121 S 4.3717 8.5028 118.1045 57.7350 64.1377 175.4110 122 S 4.1961 8.5728 116.8838 61.5489 62.4127 176.5421 123 E 3.9242 8.0256 121.2834 59.2369 29.5552 178.3776 124 E 4.0207 7.9943 118.8369 59.2516 29.7892 178.7176 125 L 4.2188 7.7460 120.3835 57.4030 41.4835 179.3871 126 Q 4.1831 8.0470 116.0938 57.6140 28.6944 177.2192 127 A 4.4398 7.6577 120.7032 50.7066 19.3136 176.0689 128 N 4.1647 8.0090 115.3800 55.1322 37.9030 173.8210 129 K 4.8491 7.6341 112.6680 54.5935 37.4630 175.5991 130 A 4.5296 8.1000 121.6761 51.1626 22.8513 175.6257 131 T 4.7686 8.2492 118.2874 61.8291 73.1135 172.7815 132 L 4.5888 8.5634 126.9951 53.5651 43.7010 175.7024 133 V 4.6284 8.8054 124.1090 61.3243 34.0654 173.2908 134 C 5.2447 9.4079 129.4110 55.0541 43.9090 172.1350 135 L 5.0750 9.3265 127.6542 53.1463 43.8018 175.5744 136 I 5.0460 8.8646 125.6003 59.6112 39.6630 175.0447 137 S 5.1021 8.9493 120.9260 56.5319 67.3895 173.2343 138 D 4.5968 9.1882 117.0771 55.2891 38.7591 173.9722 139 F 5.2433 7.8329 111.7328 56.1260 40.6007 174.5631 140 Y 4.8413 8.8238 120.2154 56.2447 42.3868 172.5063 141 P 3.8012 0.0000 0.0000 61.1721 32.4173 177.1583 142 G 2.7926 7.1327 110.2685 43.8475 0.0000 174.3227 143 A 4.5988 7.4673 119.6161 50.9916 22.4669 176.2298 144 V 4.6866 8.1196 115.1031 60.0373 36.4106 174.7479 145 T 4.5855 8.6090 118.9518 61.7884 71.1226 173.4222 146 V 4.7758 8.4758 125.6813 60.9651 33.8433 174.4229 147 A 4.8919 8.8906 129.1325 49.9578 22.4664 174.5714 148 W 5.2747 8.9323 120.5036 54.9509 32.6430 175.0720 149 K 5.1156 9.2352 121.3020 54.6693 35.9827 175.0969 150 A 4.3659 8.9464 126.5735 50.4059 20.8989 177.3212 151 D 4.4467 8.8732 126.4153 56.1316 39.4254 177.3350 152 S 4.6398 8.9321 124.1826 58.9720 64.7487 174.3123 153 S 4.4032 7.6353 117.6055 56.9400 63.6742 172.1141 154 P 4.8796 0.0000 0.0000 62.6328 31.9997 176.0758 155 V 4.4194 8.5356 113.2011 59.9465 33.7885 175.7838 156 K 4.3456 8.7272 123.9785 57.1778 33.3021 177.2533 157 A 4.0772 7.8709 121.4507 52.9908 19.1059 177.4116 158 G 3.8078 8.8301 109.2027 45.6975 0.0000 172.4585 159 V 4.5949 7.4891 119.0739 61.3814 33.0643 175.1456 160 E 4.7813 9.1931 126.4937 55.1536 33.2969 174.5083 161 T 5.3045 8.7426 121.0590 61.8825 71.6115 174.1618 162 T 4.5006 8.8741 116.2773 61.2183 70.5857 174.3430 163 T 4.3833 8.3443 119.1178 62.0728 69.5260 173.2707 164 P 4.9685 0.0000 0.0000 63.5187 32.1777 175.6844 165 S 5.0385 8.9458 116.5973 54.9576 66.7866 173.5239 166 K 3.7963 8.5156 120.7658 55.7428 32.4025 177.6801 167 Q 4.4326 7.8206 121.6587 55.2451 27.9787 175.5221 168 S 3.8136 7.7342 122.2838 60.4806 63.8170 174.5150 165 N 5.3085 9.0358 119.5973 49.7576 41.8866 174.1239 166 N 4.2163 8.6256 119.0658 52.6428 38.2025 176.2801 167 K 4.4126 7.7906 122.2587 55.7451 31.6787 176.1221 168 Y 3.8936 7.5442 126.8838 60.0806 37.8171 175.8149 174 A 5.1101 7.8860 120.3552 51.2335 22.4814 175.0758 175 A 4.9634 9.6922 121.0174 51.1107 23.6175 175.3290 176 S 5.0668 8.9840 112.6315 56.9994 66.9368 173.1729 177 S 5.1887 8.8550 115.4520 56.9271 66.2452 172.1204 178 Y 5.2527 9.3909 123.3478 56.0642 41.7354 174.3681 179 L 4.4812 8.0320 125.2564 53.1541 44.1886 175.1431 180 S 4.8130 8.4670 123.5456 57.9030 64.0240 173.9622 181 L 5.1089 8.7368 123.6514 53.0979 46.5609 175.9296 182 T 4.5282 8.7558 110.2160 60.2995 70.0432 174.3804 183 P 4.4162 0.0000 0.0000 65.6602 31.2473 179.0143 184 E 4.0498 8.1753 117.3146 59.4859 29.0533 179.0039 185 Q 4.1380 8.0753 117.7177 58.7600 28.5782 178.5840 186 W 4.3194 7.9312 128.1658 60.5856 30.8408 177.6766 187 K 3.9497 7.8098 116.2051 58.1706 31.8004 178.9198 188 S 4.2412 7.8090 114.3286 59.5687 63.1657 173.7475 189 H 4.8402 7.0687 120.1157 54.0810 30.8926 175.4967 190 K 4.0832 8.3957 124.0425 57.3990 31.9152 177.2851 191 S 4.9618 7.2615 110.9291 57.7613 66.6768 172.9418 192 Y 5.3592 9.2070 117.0319 56.6139 42.3260 174.8936 193 S 5.1558 9.6969 118.5109 56.9481 67.8798 172.0644 194 C 4.1298 8.6240 123.4948 54.5267 45.4785 172.0937 195 Q 4.8366 8.8361 128.5435 54.3115 30.9931 174.0568 196 V 4.6534 8.7685 127.3133 61.3612 34.2322 174.1111 197 T 4.9965 8.8479 125.0280 62.0803 70.9185 173.1097 198 H 4.7653 8.9178 126.4718 54.8301 32.8433 173.0002 199 E 3.5590 9.4963 126.5376 57.5110 26.8207 176.2679 200 G 3.8757 7.8434 106.2270 46.3622 0.0000 173.6998 *203 S 4.6265 7.4501 114.4388 58.8415 64.6999 172.8524 204 T 5.1071 8.3419 117.5553 61.7996 72.0028 173.3978 205 V 4.4032 8.5765 125.1031 60.9831 34.4291 173.8235 206 E 5.0285 8.6687 127.4990 54.4174 32.2856 174.5231 207 K 4.7169 8.6541 126.0630 54.9770 35.1837 175.3616 208 T 5.2579 8.4084 118.8999 61.9454 71.8656 173.7066 209 V 4.7914 9.0799 118.0133 59.5464 35.6138 174.5060 210 A 4.9679 8.5427 123.8657 49.1808 22.2723 174.2287 211 P 3.9483 0.0000 0.0000 63.0067 31.5368 176.9027 212 T 4.2127 8.6224 112.8595 61.6739 68.8882 174.2415 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 S 8.33 4.37 0.00 3.87 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 A 7.96 4.81 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 9.16 4.40 0.00 1.66 1.60 0.89 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 5 T 8.91 4.80 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 6 Q 8.82 5.37 0.00 1.96 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.96 0.00 0.00 0.00 0.00 0.00 2.61 2.23 0.00 7 P 0.00 4.38 0.00 2.22 2.19 0.00 3.85 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.98 0.00 8 A 8.61 4.21 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 S 7.63 5.13 0.00 3.80 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *11 V 8.57 4.55 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.94 0.00 0.00 12 S 8.37 5.13 0.00 3.88 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 G 8.38 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 9.08 4.96 0.00 3.78 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 P 0.00 4.54 0.00 2.02 1.98 0.00 3.67 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 16 G 9.15 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 Q 7.82 4.48 0.00 2.20 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.70 0.00 0.00 0.00 0.00 0.00 2.35 2.32 0.00 18 T 8.29 4.93 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 19 I 8.44 4.53 1.75 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.52 0.74 0.00 0.00 20 T 8.24 4.95 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 21 I 8.54 4.56 1.58 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.62 1.13 0.00 0.00 22 S 8.70 5.20 0.00 3.97 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 C 9.25 4.94 0.00 3.12 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 N 9.58 5.15 0.00 2.67 2.75 0.00 0.00 6.39 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 9.13 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 T 9.28 4.89 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 27 S 8.55 4.15 0.00 3.98 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27A S 8.01 4.74 0.00 4.45 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27B D 7.92 5.51 0.00 2.90 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27C V 9.13 3.59 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.93 0.00 0.00 28 G 7.81 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 G 7.75 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 F 7.76 4.88 0.00 2.93 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 D 8.55 4.95 0.00 2.85 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 S 7.63 5.38 0.00 3.73 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.85 4.74 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.96 0.00 0.00 34 S 8.84 5.37 0.00 3.75 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 W 8.95 5.39 0.00 3.24 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 Y 9.46 5.29 0.00 3.25 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 Q 9.14 4.45 0.00 1.79 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.74 0.00 0.00 0.00 0.00 0.00 1.96 1.45 0.00 38 Q 8.95 4.73 0.00 2.24 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.65 0.00 0.00 0.00 0.00 0.00 2.30 2.49 0.00 39 S 8.55 5.04 0.00 3.83 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 4.41 0.00 2.21 2.13 0.00 3.88 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.03 0.00 41 G 9.02 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 K 7.79 4.61 0.00 1.88 1.71 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.39 7.81 43 A 8.30 4.17 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 P 0.00 4.91 0.00 1.94 2.04 0.00 3.57 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.00 0.00 45 K 9.02 4.81 0.00 1.80 1.88 0.00 1.29 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.29 1.37 7.81 46 V 8.74 3.84 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 1.01 0.00 0.00 47 M 9.12 4.40 0.00 1.57 2.13 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.70 0.00 48 V 7.60 4.93 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.95 0.00 0.00 49 F 9.02 5.29 0.00 3.09 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 D 9.71 4.70 0.00 2.84 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.12 3.77 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 1.00 0.00 0.00 52 S 7.67 4.71 0.00 3.84 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 H 7.78 4.42 0.00 1.95 2.46 0.00 5.78 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 R 8.00 4.84 0.00 1.79 1.88 0.00 3.53 0.00 0.00 3.57 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.61 0.00 55 P 0.00 4.82 0.00 2.25 2.07 0.00 3.72 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 56 S 8.36 4.20 0.00 3.89 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 G 9.05 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 I 7.06 4.14 2.03 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.42 0.92 0.00 0.00 59 S 8.77 4.27 0.00 3.99 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 N 8.72 4.61 0.00 2.87 2.95 0.00 0.00 6.14 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 R 7.86 4.14 0.00 1.55 1.94 0.00 3.33 0.00 0.00 3.23 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.43 0.00 62 F 7.96 4.99 0.00 3.05 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 S 9.16 4.72 0.00 3.76 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.53 4.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 S 8.92 4.88 0.00 3.84 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 K 8.44 5.23 0.00 1.82 1.64 0.00 1.99 0.00 0.00 1.81 0.00 0.00 2.79 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.36 1.58 7.81 67 S 9.42 4.43 0.00 3.94 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 8.39 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 N 8.95 4.87 0.00 2.77 2.94 0.00 0.00 6.62 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.03 5.18 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 71 A 9.11 5.37 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 9.62 5.22 0.00 3.67 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.32 4.52 0.00 0.27 0.13 0.61 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 74 T 8.84 4.83 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 75 I 8.36 4.36 1.53 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.61 0.23 0.00 0.00 76 S 8.32 4.68 0.00 3.76 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 G 8.24 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.79 3.80 0.00 1.78 1.57 0.94 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 79 H 9.34 5.19 0.00 3.16 3.22 0.00 5.65 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 I 8.02 3.79 1.90 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.38 0.94 0.00 0.00 81 E 8.44 4.35 0.00 2.19 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 82 D 8.33 4.93 0.00 2.87 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 7.97 4.31 0.00 2.18 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.47 0.00 84 G 7.50 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 D 8.05 5.32 0.00 2.67 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 Y 8.91 4.92 0.00 2.91 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 F 9.80 5.66 0.00 3.16 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 C 8.98 4.33 0.00 1.93 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.67 4.95 0.00 3.27 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 S 8.71 5.15 0.00 3.79 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 L 8.36 4.47 0.00 1.60 1.15 0.70 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 92 T 8.29 5.13 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 93 D 9.02 4.88 0.00 2.95 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 R 7.82 4.31 0.00 1.63 1.85 0.00 3.23 0.00 0.00 3.19 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 95 S 7.92 3.81 0.00 4.05 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95A H 7.79 4.78 0.00 3.07 3.22 0.00 5.75 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 R 8.34 5.00 0.00 1.53 1.51 0.00 3.17 0.00 0.00 3.09 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.45 0.00 97 I 8.66 4.57 1.83 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.11 0.96 0.00 0.00 98 F 8.83 5.14 0.00 2.88 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 G 9.07 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 G 8.78 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 G 8.53 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 T 8.11 4.91 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 103 K 8.89 4.76 0.00 1.83 1.65 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.68 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.37 1.23 7.81 104 V 9.18 4.58 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.78 0.00 0.00 105 T 8.48 4.77 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 106 V 8.71 4.23 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 1.01 0.00 0.00 106A L 8.58 4.18 0.00 1.65 1.82 0.94 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 107 G 9.07 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 Q 7.49 4.50 0.00 1.93 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.91 0.00 0.00 0.00 0.00 0.00 1.16 1.55 0.00 109 P 0.00 4.49 0.00 2.24 2.12 0.00 3.71 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 110 K 8.69 4.69 0.00 1.75 1.98 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.52 1.54 7.81 111 A 9.11 4.88 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 A 8.78 4.61 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 P 0.00 4.80 0.00 1.99 1.82 0.00 3.70 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.71 0.00 114 S 9.01 4.71 0.00 3.82 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 V 8.37 4.73 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.83 0.00 0.00 116 T 8.98 4.41 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 117 L 8.30 4.91 0.00 1.51 1.47 1.20 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 118 F 9.41 4.99 0.00 3.09 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 P 0.00 4.66 0.00 2.08 2.30 0.00 3.98 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.16 0.00 120 P 0.00 4.45 0.00 1.37 1.61 0.00 2.20 0.00 0.00 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.12 0.00 121 S 8.50 4.37 0.00 3.97 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 S 8.57 4.20 0.00 4.09 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.03 3.92 0.00 1.93 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 124 E 7.99 4.02 0.00 1.98 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.27 0.00 125 L 7.75 4.22 0.00 1.89 1.74 1.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 126 Q 8.05 4.18 0.00 2.24 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.09 0.00 0.00 0.00 0.00 0.00 2.40 2.49 0.00 127 A 7.66 4.44 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 N 8.01 4.16 0.00 2.88 2.87 0.00 0.00 6.84 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 K 7.63 4.85 0.00 1.62 1.54 0.00 1.68 0.00 0.00 1.78 0.00 0.00 2.84 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.37 1.48 7.81 130 A 8.10 4.53 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 T 8.25 4.77 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 132 L 8.56 4.59 0.00 1.21 1.74 0.63 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 133 V 8.81 4.63 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 1.16 0.00 0.00 134 C 9.41 5.24 0.00 3.03 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 9.33 5.08 0.00 1.68 1.64 1.26 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 136 I 8.86 5.05 2.02 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.60 0.63 0.00 0.00 137 S 8.95 5.10 0.00 4.11 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 D 9.19 4.60 0.00 2.85 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 F 7.83 5.24 0.00 2.72 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 Y 8.82 4.84 0.00 3.15 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 P 0.00 3.80 0.00 1.76 1.56 0.00 3.75 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.64 0.00 142 G 7.13 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 A 7.47 4.60 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 V 8.12 4.69 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 0.62 0.00 0.00 145 T 8.61 4.59 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 146 V 8.48 4.78 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.85 0.00 0.00 147 A 8.89 4.89 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 W 8.93 5.27 0.00 3.49 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 K 9.24 5.12 0.00 1.71 1.66 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.41 7.81 150 A 8.95 4.37 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 D 8.87 4.45 0.00 2.78 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 S 8.93 4.64 0.00 3.93 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 S 7.64 4.40 0.00 4.01 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 P 0.00 4.88 0.00 2.25 2.13 0.00 3.72 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 155 V 8.54 4.42 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 1.15 0.00 0.00 156 K 8.73 4.35 0.00 1.77 1.90 0.00 1.78 0.00 0.00 1.75 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.47 7.81 157 A 7.87 4.08 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 G 8.83 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 V 7.49 4.59 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.89 0.00 0.00 160 E 9.19 4.78 0.00 2.04 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.41 0.00 161 T 8.74 5.30 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 162 T 8.87 4.50 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 163 T 8.34 4.38 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 164 P 0.00 4.97 0.00 2.15 2.32 0.00 3.72 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 165 S 8.95 5.04 0.00 3.87 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 K 8.52 3.80 0.00 1.42 1.50 0.00 1.50 0.00 0.00 1.47 0.00 0.00 2.78 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.30 0.74 7.81 167 Q 7.82 4.43 0.00 2.08 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.21 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 168 S 7.73 3.81 0.00 4.15 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 N 9.04 5.31 0.00 2.81 2.85 0.00 0.00 6.88 5.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 N 8.63 4.22 0.00 2.41 2.50 0.00 0.00 6.81 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 K 7.79 4.41 0.00 1.80 1.82 0.00 0.61 0.00 0.00 1.76 0.00 0.00 2.13 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.19 1.27 7.81 168 Y 7.54 3.89 0.00 3.29 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 A 7.89 5.11 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 A 9.69 4.96 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 S 8.98 5.07 0.00 3.57 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 S 8.86 5.19 0.00 3.98 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 Y 9.39 5.25 0.00 2.78 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 L 8.03 4.48 0.00 0.27 0.23 0.64 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 180 S 8.47 4.81 0.00 3.71 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 L 8.74 5.11 0.00 1.45 1.52 0.54 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 182 T 8.76 4.53 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 183 P 0.00 4.42 0.00 2.24 2.22 0.00 3.62 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.18 0.00 184 E 8.18 4.05 0.00 2.10 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.50 0.00 185 Q 8.08 4.14 0.00 2.40 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.78 0.00 0.00 0.00 0.00 0.00 2.47 2.44 0.00 186 W 7.93 4.32 0.00 3.15 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 K 7.81 3.95 0.00 1.74 1.81 0.00 1.84 0.00 0.00 1.75 0.00 0.00 3.16 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.44 1.74 7.81 188 S 7.81 4.24 0.00 4.06 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 H 7.07 4.84 0.00 2.56 2.98 0.00 5.66 0.00 0.00 0.00 0.00 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 K 8.40 4.08 0.00 1.79 1.72 0.00 1.82 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.39 1.25 7.81 191 S 7.26 4.96 0.00 3.86 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 Y 9.21 5.36 0.00 3.30 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 S 9.70 5.16 0.00 3.68 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 C 8.62 4.13 0.00 1.80 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 Q 8.84 4.84 0.00 1.97 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.54 0.00 0.00 0.00 0.00 0.00 2.16 2.19 0.00 196 V 8.77 4.65 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.73 0.00 0.00 197 T 8.85 5.00 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 198 H 8.92 4.77 0.00 2.89 3.05 0.00 5.91 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 E 9.50 3.56 0.00 2.04 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 2.08 0.00 200 G 7.84 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *203 S 7.45 4.63 0.00 3.81 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 T 8.34 5.11 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 205 V 8.58 4.40 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.88 0.00 0.00 206 E 8.67 5.03 0.00 1.89 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.22 0.00 207 K 8.65 4.72 0.00 1.62 1.61 0.00 1.61 0.00 0.00 1.60 0.00 0.00 2.81 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.27 1.55 7.81 208 T 8.41 5.26 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 209 V 9.08 4.79 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 1.30 0.00 0.00 210 A 8.54 4.97 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 P 0.00 3.95 0.00 1.68 1.13 0.00 3.46 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.57 0.00 212 T 8.62 4.21 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.