NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 A 3.7716 8.2644 123.5479 51.5659 20.7181 177.9527 10 R 3.8283 7.6920 119.0222 58.0283 29.7692 177.2588 11 F 4.2390 8.9339 115.2918 60.3188 37.7443 176.8259 12 R 4.1156 6.9048 116.4065 58.2008 29.9962 178.4144 13 K 4.1101 7.8997 118.1122 57.2779 32.2499 177.1749 14 V 4.1785 6.8499 118.2829 60.3064 32.7868 176.3309 15 D 4.6191 8.4364 124.3041 52.5406 39.9237 176.4180 16 V 4.0138 8.1498 124.2440 64.7948 32.2410 177.7627 17 D 4.5562 8.1039 119.1645 57.4267 41.0051 178.1280 18 E 3.7163 8.0034 118.1883 58.8713 29.3811 177.4114 19 Y 4.5982 7.0022 112.9061 57.4277 38.1879 174.9790 20 D 4.5279 7.9525 121.0933 54.0469 41.5486 176.5555 21 E 4.1283 8.8921 126.1714 58.8991 30.0514 176.9312 22 N 4.7879 8.7082 117.7449 52.9867 38.4741 173.5217 23 K 4.6449 7.6594 119.0623 54.4934 35.3201 173.7855 24 F 4.8925 8.4869 120.5933 56.2331 41.7245 174.5459 25 V 4.0714 6.7203 125.4309 60.8023 34.3318 174.5276 26 D 4.1628 8.2194 126.6828 54.2268 41.3091 175.9755 27 E 4.1997 8.4871 122.3329 55.7004 29.3347 175.9177 28 D 4.7261 8.2481 123.2873 52.6456 43.1362 176.1975 *35 A 4.1413 8.2269 120.8501 49.7051 19.7443 177.0135 36 G 4.2104 7.7932 107.7347 45.4002 0.0000 171.0324 37 P 4.5767 0.0000 0.0000 62.1607 32.4925 176.9510 38 D 4.7089 8.1536 117.6394 52.4993 40.5781 176.1020 39 E 3.9811 8.5208 125.6940 59.1402 29.2540 179.2435 40 G 3.4917 8.0430 104.7930 47.8904 0.0000 174.9864 41 E 4.1395 10.1074 122.9826 58.8262 29.4732 179.2355 42 V 3.5389 8.1504 118.3483 66.1163 31.6627 177.5318 43 D 4.3577 8.5348 118.9474 58.1981 40.6433 178.2220 44 S 4.0824 9.3702 113.7549 61.5369 62.1955 175.5470 45 C 3.9146 8.5790 119.0408 63.2197 28.0895 176.6269 46 L 4.0395 8.3285 122.8751 58.5250 41.1678 180.2859 47 R 3.9564 8.5101 119.9330 61.3138 29.3523 180.2772 48 Q 4.4656 8.2873 115.1423 57.0537 28.9413 176.9594 49 G 3.9113 8.1152 108.1491 45.5125 0.0000 174.5710 50 N 4.7296 8.0126 119.4751 51.2310 37.4200 175.2435 51 M 3.9300 7.9749 122.6989 58.7927 32.6102 179.5354 52 T 4.0978 8.0854 114.2899 66.4773 68.6710 176.0766 53 A 4.0146 8.0191 122.7783 53.8412 19.3259 179.2068 54 A 4.0564 8.2057 118.6644 54.9507 18.2895 179.5067 55 L 3.8665 7.9744 118.4348 58.6209 42.0850 179.0632 56 Q 3.9754 7.5152 116.0290 58.9946 28.4347 178.9079 57 A 4.1144 7.7838 121.0817 55.2725 18.2777 179.6324 58 A 3.9510 7.5230 117.8523 54.7810 18.5489 179.0026 59 L 4.2039 7.8982 115.1734 54.5057 42.2059 176.9001 60 K 4.1586 7.2420 120.8159 56.7442 33.4625 176.2198 61 N 4.1976 8.8090 122.3006 53.7359 35.6936 172.9306 62 P 4.5562 0.0000 0.0000 62.2221 32.7591 177.1872 63 P 4.6115 0.0000 0.0000 62.0834 30.2992 178.1064 64 I 3.9010 7.8792 119.1965 63.4695 37.1507 176.5556 65 N 4.9800 7.7991 114.9698 52.4201 39.7405 174.1336 66 T 4.0947 7.9856 113.2341 61.5264 69.4253 176.5213 67 K 4.0841 8.7579 128.1624 57.1637 31.6672 174.0249 68 S 4.5793 7.3889 109.7462 57.8511 63.5238 174.9563 69 Q 4.1357 8.6952 124.5368 58.7611 28.7563 178.1891 70 A 4.1739 8.3492 123.0267 54.6372 17.7468 179.8129 71 V 3.6083 7.8264 116.7344 64.9619 31.2051 178.6475 72 K 4.0151 7.5147 119.3527 59.4072 31.8104 178.8256 73 D 4.4071 8.8468 121.9541 58.2028 40.7274 179.9651 74 R 3.9828 8.1293 120.5187 61.5370 29.5950 180.7690 75 A 4.2641 7.7694 121.1096 54.8848 18.3142 179.9356 76 G 3.6607 8.8490 104.7135 48.1348 0.0000 176.1839 77 S 4.0932 8.2977 117.6372 61.2914 62.3333 176.6812 78 I 3.4699 7.7371 122.5686 64.4527 36.9408 178.6560 79 V 3.3697 7.3928 118.6534 65.3995 31.3464 177.8691 80 L 3.7248 7.7514 120.3890 57.9170 41.9728 178.8581 81 K 3.9098 8.7392 120.6712 59.3840 31.8214 179.0281 82 V 3.6790 7.0293 116.9539 65.8963 31.5720 177.7278 83 L 3.6152 7.1421 117.2333 57.5907 41.5637 179.3408 84 I 4.0387 7.5847 119.3037 64.4684 36.8426 178.4772 85 S 4.3810 7.8300 110.7087 58.6242 62.5263 174.0292 86 F 4.6844 7.7689 120.7940 55.8664 40.8472 175.2736 87 K 4.4450 8.1729 121.7373 54.9491 33.1498 178.1843 88 A 4.1728 8.7488 123.2829 53.1236 17.8331 177.1497 89 N 4.9140 9.1618 115.4607 54.1392 40.6671 174.5754 90 D 4.8861 7.8655 115.9345 55.0168 41.6772 177.9797 91 I 3.3610 7.4236 121.5326 63.9398 37.2301 177.3392 92 E 3.7167 8.0008 119.6408 59.3962 28.9841 179.1701 93 K 3.9307 7.8757 118.1593 59.2900 32.6367 178.3094 94 A 4.2108 7.5750 120.4298 55.0725 18.4173 179.4585 95 V 3.6088 7.8368 117.0041 66.3982 31.4139 177.9895 96 Q 4.2062 7.7481 113.9197 57.4737 28.5074 176.9448 97 S 4.6534 8.1529 112.4879 57.8268 63.5240 173.7847 98 L 4.7386 7.6954 121.2556 53.0690 43.6994 176.0714 99 D 4.7074 8.2999 121.1736 52.3331 40.9464 177.3143 100 K 3.8321 8.8334 119.1109 60.2000 31.9205 178.8022 101 N 4.3778 8.3944 115.8204 56.3809 38.3948 177.4779 102 G 3.5978 8.2113 106.8276 47.8485 0.0000 175.6199 103 V 3.6278 7.8821 121.0351 65.7622 31.4675 177.2528 104 D 4.3940 8.3216 118.5855 57.6643 40.7498 178.8330 105 L 3.8869 8.0707 120.3715 57.9084 42.0658 178.5629 106 L 3.9960 8.5767 120.6370 58.6298 42.0438 178.5029 107 M 4.1208 8.3850 118.2371 58.8419 31.5511 178.2425 108 K 3.9580 7.9122 118.2813 59.8241 32.1178 178.9549 109 Y 4.1999 7.8247 116.9015 60.8703 37.5990 178.1869 110 I 3.3910 8.1773 121.3416 64.6244 36.9624 178.1022 111 Y 3.9104 7.8861 116.2795 60.5905 37.9444 178.2326 112 K 4.3100 7.8308 119.2774 59.3379 32.1388 179.4944 113 G 3.5755 8.2513 106.2580 47.8114 0.0000 175.6082 114 F 4.6938 7.4253 118.7692 59.8491 38.9612 176.5207 115 E 4.4788 8.0326 116.3329 56.4506 30.9517 176.6293 116 S 4.7390 7.8704 114.2270 55.7612 63.3803 172.2389 117 P 4.3775 0.0000 0.0000 62.3686 32.1924 176.2076 118 S 4.5873 8.1440 117.7978 57.4030 64.9276 173.1800 119 D 4.1171 8.0556 117.8242 57.2487 40.1307 173.2702 120 N 5.1750 7.8858 111.4828 50.7500 40.3798 178.2778 121 S 4.3029 8.3227 115.2541 63.1451 62.0978 176.7692 122 S 4.3114 8.1412 117.6063 61.0883 62.4992 176.2234 123 A 4.0995 8.2588 123.8263 54.8850 18.3341 179.5658 124 V 3.9318 7.8131 117.1204 64.5795 31.9247 178.3390 125 L 4.1076 8.4202 119.9542 57.7557 41.3190 179.3047 126 L 4.3148 8.1484 117.7599 57.0993 41.5278 179.3701 127 Q 4.0426 8.4582 119.1730 58.3896 28.7231 178.2514 128 W 3.7993 8.1387 119.4710 60.0212 29.1673 177.7360 129 H 4.0283 8.6715 118.4617 59.3438 29.2576 176.7994 130 E 3.9731 8.0497 120.8742 59.1128 29.4737 179.0588 131 K 3.8519 8.0010 118.2133 59.4466 32.2142 178.9724 132 A 4.0364 8.6478 121.4782 55.2924 18.1144 179.4744 133 L 3.9215 8.1634 118.3568 58.3836 42.0389 179.0646 134 A 3.5237 7.7834 118.9127 54.7556 18.2518 178.8979 135 A 4.3462 7.8955 118.4392 54.5898 19.3941 179.3882 136 G 3.7608 8.8335 103.9395 44.3973 0.0000 175.2283 137 G 4.0874 8.7274 107.2835 45.0372 0.0000 174.6064 138 V 3.7850 8.2221 118.0441 64.4765 31.1278 178.4762 139 G 3.6904 8.1031 105.9710 47.0634 0.0000 175.5076 140 S 4.3667 7.9621 116.0095 61.1993 63.3852 176.1827 141 I 3.9135 7.5655 123.1682 63.8428 37.1152 177.9741 142 V 3.5423 7.7928 119.2056 66.1800 31.4558 178.0700 143 R 4.5654 7.9412 117.9604 57.5431 29.6847 179.0726 144 V 3.6174 7.4596 118.3579 65.8897 31.6207 177.6705 145 L 4.0655 7.6739 117.3977 57.3653 41.9190 178.5283 146 T 4.2787 7.9760 107.9592 61.1731 69.0940 174.4761 147 A 4.2636 6.9956 124.9035 52.5714 18.6703 177.5684 148 R 4.2489 8.6055 122.3246 57.3276 30.9145 176.8908 149 K 4.3849 7.7748 117.0037 54.2739 31.8872 174.8239 150 T 4.5166 7.6421 116.6452 59.3676 70.2283 174.5964 151 V 3.7346 7.9640 116.3288 61.6611 31.4701 176.4572 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 9 A 8.26 3.77 1.17 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 0.00 0.00 10 R 7.69 3.83 0.00 1.96 1.95 0.00 3.22 0.00 0.00 3.41 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.75 0.00 11 F 8.93 4.24 0.00 3.32 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 R 6.90 4.12 0.00 1.47 1.91 0.00 2.78 0.00 0.00 3.09 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.01 0.00 13 K 7.90 4.11 0.00 1.80 1.86 0.00 1.66 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.59 7.81 14 V 6.85 4.18 2.14 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 0.78 0.00 0.00 1.05 0.00 0.00 15 D 8.44 4.62 0.00 2.79 2.62 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 16 V 8.15 4.01 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 1.03 0.00 0.00 1.07 0.00 0.00 17 D 8.10 4.56 0.00 3.09 2.69 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 18 E 8.00 3.72 0.00 1.32 1.12 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 0.00 2.42 2.22 0.00 19 Y 7.00 4.60 0.00 3.04 2.98 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 20 D 7.95 4.53 0.00 2.75 2.62 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 21 E 8.89 4.13 0.00 2.02 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 2.35 2.30 0.00 22 N 8.71 4.79 0.00 2.82 2.83 0.00 0.00 6.76 7.48 0.00 0.00 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 K 7.66 4.64 0.00 1.78 1.78 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.36 1.41 7.81 24 F 8.49 4.89 0.00 2.96 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 25 V 6.72 4.07 1.82 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 0.74 0.00 0.00 0.80 0.00 0.00 26 D 8.22 4.16 0.00 2.65 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 E 8.49 4.20 0.00 1.93 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 2.20 2.25 0.00 28 D 8.25 4.73 0.00 2.62 2.56 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 *35 A 8.23 4.14 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 36 G 7.79 4.21 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 0.00 0.00 0.00 37 P 0.00 4.58 0.00 2.00 1.99 0.00 3.63 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.19 0.00 38 D 8.15 4.71 0.00 2.68 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 E 8.52 3.98 0.00 2.00 2.01 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 2.39 2.36 0.00 40 G 8.04 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 E 10.11 4.14 0.00 2.08 2.17 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 2.31 2.33 0.00 42 V 8.15 3.54 2.17 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 1.06 0.00 0.00 0.93 0.00 0.00 43 D 8.53 4.36 0.00 2.93 2.71 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 0.00 0.00 0.00 44 S 9.37 4.08 0.00 3.91 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 45 C 8.58 3.91 0.00 3.03 3.02 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 46 L 8.33 4.04 0.00 2.02 1.70 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 47 R 8.51 3.96 0.00 1.86 1.87 0.00 3.26 0.00 0.00 3.22 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 48 Q 8.29 4.47 0.00 2.13 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.79 0.00 0.00 0.00 0.00 0.00 2.37 2.57 0.00 49 G 8.12 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 0.00 0.00 0.00 50 N 8.01 4.73 0.00 2.93 2.78 0.00 0.00 7.00 7.26 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 51 M 7.97 3.93 0.00 0.93 1.84 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 52 T 8.09 4.10 4.31 0.00 0.00 0.00 0.00 0.00 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 53 A 8.02 4.01 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 54 A 8.21 4.06 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 L 7.97 3.87 0.00 1.91 1.78 0.67 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 56 Q 7.52 3.98 0.00 2.16 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.72 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 57 A 7.78 4.11 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 58 A 7.52 3.95 1.13 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 0.00 0.00 0.00 0.00 0.00 0.00 59 L 7.90 4.20 0.00 1.63 1.76 0.94 1.18 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 60 K 7.24 4.16 0.00 1.87 1.89 0.00 1.96 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.43 1.41 7.81 61 N 8.81 4.20 0.00 2.90 2.85 0.00 0.00 7.05 8.02 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 62 P 0.00 4.56 0.00 2.21 2.23 0.00 3.80 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.03 0.00 63 P 0.00 4.61 0.00 2.24 2.12 0.00 3.74 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.26 0.00 64 I 7.88 3.90 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.44 0.93 0.00 0.00 65 N 7.80 4.98 0.00 2.65 2.76 0.00 0.00 7.00 7.54 0.00 0.00 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 T 7.99 4.09 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 1.22 0.00 0.00 67 K 8.76 4.08 0.00 1.80 1.78 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.36 1.01 7.81 68 S 7.39 4.58 0.00 3.84 3.74 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.70 4.14 0.00 2.11 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.45 2.37 0.00 70 A 8.35 4.17 1.33 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 0.00 0.00 0.00 71 V 7.83 3.61 2.09 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 0.88 0.00 0.00 0.97 0.00 0.00 72 K 7.51 4.02 0.00 2.20 1.93 0.00 1.90 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.47 1.67 7.81 73 D 8.85 4.41 0.00 2.81 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 R 8.13 3.98 0.00 1.83 1.94 0.00 3.28 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.52 0.00 75 A 7.77 4.26 1.44 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 0.00 0.00 0.00 0.00 0.00 0.00 76 G 8.85 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 0.00 0.00 0.00 77 S 8.30 4.09 0.00 3.98 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 78 I 7.74 3.47 1.86 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.30 0.83 0.00 0.00 79 V 7.39 3.37 1.52 0.00 0.00 0.00 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 0.04 0.00 0.00 80 L 7.75 3.72 0.00 1.81 1.67 0.82 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 81 K 8.74 3.91 0.00 1.82 1.93 0.00 1.67 0.00 0.00 1.55 0.00 0.00 2.86 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.44 7.81 82 V 7.03 3.68 2.05 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 1.07 0.00 0.00 0.94 0.00 0.00 83 L 7.14 3.62 0.00 1.15 0.32 0.13 -1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 84 I 7.58 4.04 1.97 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.82 0.95 0.00 0.00 85 S 7.83 4.38 0.00 4.12 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 86 F 7.77 4.68 0.00 3.57 3.22 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.17 4.45 0.00 2.00 1.71 0.00 1.47 0.00 0.00 1.77 0.00 0.00 2.54 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.40 1.45 7.81 88 A 8.75 4.17 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.16 4.91 0.00 2.50 2.74 0.00 0.00 6.93 8.35 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 90 D 7.87 4.89 0.00 2.68 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.42 3.36 1.37 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.64 -1.18 0.00 0.00 92 E 8.00 3.72 0.00 1.93 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 2.35 2.35 0.00 93 K 7.88 3.93 0.00 1.80 2.04 0.00 1.84 0.00 0.00 1.72 0.00 0.00 3.11 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.52 7.81 94 A 7.57 4.21 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 V 7.84 3.61 2.01 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 1.03 0.00 0.00 0.87 0.00 0.00 96 Q 7.75 4.21 0.00 2.15 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.69 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 97 S 8.15 4.65 0.00 3.98 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 0.00 98 L 7.70 4.74 0.00 1.84 1.64 0.99 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 99 D 8.30 4.71 0.00 2.84 2.81 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 0.00 100 K 8.83 3.83 0.00 1.79 1.94 0.00 1.71 0.00 0.00 1.83 0.00 0.00 2.93 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.55 1.52 7.81 101 N 8.39 4.38 0.00 2.88 2.90 0.00 0.00 6.91 7.58 0.00 0.00 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 G 8.21 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 V 7.88 3.63 2.25 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 1.23 0.00 0.00 0.96 0.00 0.00 104 D 8.32 4.39 0.00 2.98 2.71 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 0.00 0.00 0.00 105 L 8.07 3.89 0.00 1.77 1.88 0.73 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.58 4.00 0.00 1.80 1.95 0.73 1.11 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 M 8.39 4.12 0.00 2.33 2.23 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.78 0.00 108 K 7.91 3.96 0.00 1.84 1.56 0.00 1.57 0.00 0.00 1.48 0.00 0.00 2.89 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.36 1.41 7.81 109 Y 7.82 4.20 0.00 3.18 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 0.00 110 I 8.18 3.39 1.94 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.84 0.39 0.00 0.00 111 Y 7.89 3.91 0.00 3.11 3.12 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 0.00 0.00 0.00 0.00 112 K 7.83 4.31 0.00 1.91 1.92 0.00 1.74 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.48 1.64 7.81 113 G 8.25 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 F 7.43 4.69 0.00 3.23 2.99 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 0.00 115 E 8.03 4.48 0.00 2.17 2.04 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 2.40 2.61 0.00 116 S 7.87 4.74 0.00 3.81 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 P 0.00 4.38 0.00 2.06 2.03 0.00 3.70 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.22 0.00 118 S 8.14 4.59 0.00 3.73 3.73 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.06 4.12 0.00 2.74 2.47 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 0.00 0.00 0.00 0.00 120 N 7.89 5.17 0.00 2.58 2.74 0.00 0.00 6.36 7.64 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 0.00 121 S 8.32 4.30 0.00 4.04 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 0.00 122 S 8.14 4.31 0.00 3.96 4.05 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 0.00 0.00 0.00 0.00 123 A 8.26 4.10 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 V 7.81 3.93 2.20 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 1.22 0.00 0.00 1.16 0.00 0.00 125 L 8.42 4.11 0.00 2.05 1.65 0.63 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 126 L 8.15 4.31 0.00 1.82 1.79 0.92 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 127 Q 8.46 4.04 0.00 2.22 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.81 0.00 0.00 0.00 0.00 0.00 2.62 2.54 0.00 128 W 8.14 3.80 0.00 3.51 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 0.00 129 H 8.67 4.03 0.00 3.31 3.43 0.00 5.59 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 E 8.05 3.97 0.00 2.19 2.14 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 2.30 2.37 0.00 131 K 8.00 3.85 0.00 1.83 1.71 0.00 1.55 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.32 1.39 7.81 132 A 8.65 4.04 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 L 8.16 3.92 0.00 1.77 1.89 0.96 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 134 A 7.78 3.52 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.90 4.35 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 0.00 136 G 8.83 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 0.00 0.00 0.00 137 G 8.73 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 0.00 0.00 0.00 0.00 138 V 8.22 3.78 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 0.88 0.00 0.00 0.96 0.00 0.00 139 G 8.10 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 0.00 0.00 0.00 140 S 7.96 4.37 0.00 4.07 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 0.00 141 I 7.57 3.91 2.06 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.66 0.83 0.00 0.00 142 V 7.79 3.54 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 1.01 0.00 0.00 0.92 0.00 0.00 143 R 7.94 4.57 0.00 1.90 1.92 0.00 3.21 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 144 V 7.46 3.62 1.94 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 0.51 0.00 0.00 0.92 0.00 0.00 145 L 7.67 4.07 0.00 1.71 1.64 0.86 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 146 T 7.98 4.28 4.21 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 1.17 0.00 0.00 147 A 7.00 4.26 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.61 4.25 0.00 1.83 2.04 0.00 3.34 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.64 0.00 149 K 7.77 4.38 0.00 1.67 1.92 0.00 1.60 0.00 0.00 1.64 0.00 0.00 3.05 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.43 7.81 150 T 7.64 4.52 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 1.17 0.00 0.00 151 V 7.96 3.73 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.55 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.