NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 L 4.1744 8.1849 120.6315 54.5023 43.5242 176.6273 *2 N 4.9128 7.9315 115.3712 53.2574 40.3372 174.4446 3 I 5.0963 8.7600 116.4600 59.1127 41.8635 174.1508 4 I 4.8083 8.3330 123.3942 59.5971 40.2360 174.7224 5 I 4.5932 8.5675 127.3884 59.6665 39.3524 174.5464 6 A 4.8643 8.1610 130.7622 50.5065 20.4206 175.2104 7 T 5.5780 9.0600 116.2708 61.8323 71.5955 172.2946 8 T 4.7744 8.7097 115.6497 60.3318 72.4407 172.1114 9 K 3.8542 8.3817 121.9859 56.5964 31.5446 177.7354 10 S 4.0106 8.6771 119.1494 61.5286 62.6882 177.1861 11 W 4.2321 7.3637 119.7478 59.2396 27.9541 178.0296 12 N 4.4481 7.3070 116.8854 56.0445 38.0206 177.3064 13 I 3.6500 7.5951 121.2560 64.1227 37.2250 178.2307 14 K 3.8256 8.0551 120.4428 59.8521 31.9729 178.6135 15 N 4.1110 8.0750 116.2286 55.8122 38.1521 177.4370 16 A 3.9282 7.6797 122.5006 55.1401 18.5255 179.6652 17 Q 3.9499 8.2128 116.7911 58.8991 28.6858 178.9702 18 K 3.9115 8.0758 120.6109 59.5010 32.3343 178.6094 19 F 4.0253 8.3938 121.0513 61.0545 38.7191 176.9520 20 K 4.1151 8.7700 122.0997 60.0953 31.8253 179.5707 21 K 4.2175 7.8352 122.5410 60.0321 31.7821 180.6002 22 E 4.3263 8.2760 118.7628 57.9594 29.4642 177.6244 23 N 4.8085 7.4805 115.2633 52.7190 39.2336 176.1589 24 E 3.9190 7.5683 121.9701 59.7532 29.6839 179.1993 25 S 4.2348 7.8943 111.8644 60.3261 63.6773 175.1131 26 K 4.0110 7.7182 118.8135 57.3212 32.7400 176.1392 27 Y 5.0446 7.5677 114.4120 56.0735 41.4368 175.3365 28 N 4.7599 8.9404 121.9798 52.9419 40.2653 173.4577 29 T 5.0375 8.5629 123.6891 62.4110 70.3730 174.2936 30 T 4.5562 8.7454 123.8126 61.9558 70.7757 173.5670 31 I 4.7757 8.3711 127.3272 59.8523 39.0175 175.0352 32 I 4.8620 8.7797 128.3723 59.7937 39.6018 176.2791 33 T 5.3113 9.3487 114.5700 60.1498 70.2936 173.5549 34 N 4.9861 8.1671 120.0409 51.0031 42.1304 174.7527 35 K 3.5036 7.5289 124.1910 59.4989 31.9894 178.0973 36 D 4.4274 7.6290 115.6155 55.5281 39.6159 176.9036 37 E 4.1334 8.1453 118.6866 57.8234 30.0517 177.1640 38 L 4.4969 7.5549 122.5058 53.4820 40.7189 175.5634 39 T 4.7888 7.3312 112.3082 58.9947 73.3070 174.6552 40 F 4.4114 8.8643 124.1782 62.0019 39.1545 177.4643 41 E 3.7588 8.1052 116.4440 59.0989 29.0806 179.0114 42 K 4.0729 7.8555 118.3576 59.2786 32.3596 179.6181 43 V 3.4188 8.1144 119.2538 65.6211 31.5418 178.1948 44 K 4.1081 7.8766 118.5963 59.8855 32.0466 179.0702 45 L 4.1186 7.3039 118.4140 57.1086 41.5763 178.8058 46 I 3.8381 7.3318 118.9777 61.3178 38.3037 175.3717 47 N 4.2391 7.5306 115.7532 53.8843 37.4493 172.3101 48 P 4.6167 0.0000 0.0000 62.8031 32.7521 176.5571 49 E 4.1679 9.2165 122.6544 58.9638 30.3734 176.5530 50 Y 5.0159 7.9141 115.1712 56.1479 42.9361 174.4182 51 I 4.7850 9.0186 123.7984 59.5690 40.0705 174.3730 52 L 4.9936 8.6937 127.8219 53.1168 43.9267 175.8840 53 F 5.3934 9.2830 123.1915 53.9505 39.0004 173.9294 54 P 4.1460 0.0000 0.0000 65.4383 32.3517 176.3658 55 H 4.8534 8.3536 119.1576 54.8940 33.4566 172.6160 56 W 5.4119 8.4830 134.8266 56.0381 33.7357 174.5750 57 S 3.8702 7.3284 120.8753 59.3559 62.8325 174.4438 58 W 4.7899 6.6515 118.1255 54.3478 30.9717 175.8049 59 I 3.8614 8.3782 121.2474 61.7597 36.9384 176.0870 60 I 4.3019 8.4150 126.4762 59.9298 37.7727 174.7560 61 P 4.4091 0.0000 0.0000 62.5297 33.1716 177.2976 62 K 2.4800 8.4924 124.1500 59.8343 32.0022 179.7702 63 E 3.5834 7.7862 116.7413 60.4121 29.8291 180.7073 64 I 4.5470 7.3398 118.2828 64.7253 37.5186 178.0575 65 F 4.5695 7.6674 113.3445 59.2652 37.9045 176.5384 66 E 4.2821 7.7407 117.9968 57.4967 29.5868 176.5425 67 N 4.6597 7.7745 113.6258 52.7363 40.3727 174.4156 68 F 4.8007 7.5998 115.1710 55.7641 43.2187 174.4209 69 T 4.3136 8.5541 120.1060 63.7678 69.1202 173.1070 70 C 5.2951 8.8301 125.0360 58.1501 30.7572 173.0885 71 V 4.7153 9.3580 124.2780 61.3211 33.2634 174.4164 72 V 4.5684 8.4395 128.4732 61.5818 33.8554 174.9044 73 F 4.8839 8.4216 125.0945 56.3734 39.8101 174.4295 74 H 5.1156 9.1434 130.7276 55.4612 32.8070 173.4302 *76 T 4.6344 8.3442 106.3236 61.6970 70.0063 174.2046 77 D 4.6879 8.3294 122.5049 52.6833 39.6382 175.1822 78 L 4.3793 7.8092 121.7175 54.0561 42.7625 175.9704 79 P 4.5263 0.0000 0.0000 63.1287 31.7829 175.7344 80 F 4.2317 7.7839 123.1501 59.5196 39.5674 174.8359 81 G 2.0000 7.4080 116.1496 45.6309 0.0000 173.8124 82 R 3.6388 7.1279 118.7185 56.7947 30.7508 175.7250 83 G 3.9556 7.8359 106.7587 44.7333 0.0000 173.3430 84 G 3.8223 8.6408 108.5856 45.0815 0.0000 173.7239 85 S 3.7810 8.5501 113.0069 58.5324 60.3069 172.2212 86 P 4.3757 0.0000 0.0000 65.8621 31.3935 177.9053 87 L 3.8451 7.9281 119.5414 58.1604 42.0264 178.8912 88 Q 3.7691 7.8519 117.4255 58.9494 28.4085 178.3158 89 N 3.9255 8.1004 117.6748 55.8869 38.2991 177.5967 90 L 4.0689 7.9914 120.7239 57.8765 41.7186 179.5863 91 I 3.5972 7.7589 119.8227 64.3825 36.7965 178.0674 92 E 3.8187 7.9268 118.4068 59.7532 29.3821 178.4067 93 R 4.1627 7.5471 114.2684 55.9919 29.9487 176.8241 94 G 3.8676 8.0893 105.8304 46.3522 0.0000 173.8417 95 I 4.1146 7.5892 120.3022 60.3721 37.9493 176.0447 96 K 4.3029 8.4496 122.4482 56.1895 34.2105 175.6760 97 K 4.9890 7.8145 120.3314 55.1951 35.4670 174.9030 98 T 4.8167 9.0880 120.6942 60.6537 71.2875 171.9529 99 K 4.9948 8.6600 118.8729 54.7929 36.0508 176.0485 100 I 4.4725 8.9986 124.4920 60.5009 38.8680 174.8466 101 S 5.1834 9.2132 124.3231 56.8010 64.9990 173.2572 102 A 4.4310 8.4973 127.9867 51.0271 19.5673 176.1676 103 I 4.9838 8.5282 116.2072 58.9203 41.8253 174.5404 104 K 4.9272 8.6389 125.9953 55.3994 33.1573 176.1807 105 V 3.7883 8.5357 129.0980 63.0363 31.9789 175.3392 106 D 4.5546 8.1224 124.5725 52.5762 40.3749 176.5983 107 G 3.7776 7.2105 109.8711 45.7224 0.0000 174.6519 108 G 3.8923 7.2346 106.6243 43.8789 0.0000 174.1859 109 I 3.8228 7.9402 120.4082 61.3966 35.5420 175.6463 110 D 4.2664 8.1750 127.6908 55.4074 38.3065 174.9342 111 T 4.2351 7.6249 107.4023 61.6112 69.7933 174.5970 112 G 4.1232 7.4279 109.2591 45.0322 0.0000 173.3462 113 D 4.6174 8.5215 120.5338 54.6575 42.3694 175.4419 114 I 4.4649 8.4120 123.3199 60.1997 38.5485 176.6640 115 F 4.2524 9.3675 127.5572 59.2466 39.4142 175.4140 116 F 4.7519 7.0656 111.1897 56.7714 40.1655 172.0671 117 K 5.4088 9.0636 117.1301 54.9024 35.9969 176.2847 118 R 4.8824 8.8211 120.0037 54.4096 34.6129 174.7651 119 D 5.0101 8.7900 121.6617 54.6411 42.0913 175.7222 120 L 4.6831 8.6832 123.1375 53.8293 45.6018 174.9181 121 D 5.0612 8.9008 126.1508 53.6950 42.0686 176.1528 122 L 4.7265 8.4836 121.7632 54.7851 42.4709 176.6173 123 Y 4.1900 8.2917 115.8772 58.4007 38.9838 176.4372 124 G 3.7841 8.7404 108.4139 44.7546 0.0000 173.6566 125 T 4.2589 8.2645 109.0318 60.4978 71.1970 175.2420 126 A 3.3870 8.3564 123.9096 55.2917 18.0147 179.5755 127 E 3.4729 7.5404 115.5410 59.5250 29.7152 178.6223 128 E 3.9339 7.6228 117.0478 59.3772 29.6917 179.2146 129 I 3.8292 7.6055 119.8432 64.0719 37.0477 179.4811 130 F 4.8262 7.8717 117.2804 57.8444 38.7636 177.3424 *132 R 4.1449 8.0287 120.4199 56.4088 31.8343 177.3073 133 A 4.0604 8.3530 119.7226 55.2196 18.2726 179.4394 134 S 4.1971 8.5128 111.9926 61.5683 62.4647 176.2937 135 K 4.0655 8.1680 121.7483 59.6638 32.0554 178.6341 136 I 3.7691 7.7548 119.6190 64.3683 36.7826 178.5571 137 I 3.4279 7.7514 119.7957 64.4285 36.9728 178.2534 138 F 4.1314 8.3296 117.5108 59.9836 38.8972 177.0891 139 N 4.8255 8.4428 114.8910 54.2641 39.2731 175.8652 140 D 4.8055 7.9453 116.7700 54.3087 42.0129 177.0986 *142 I 3.9578 7.4420 118.9782 61.6119 39.2888 175.8226 143 P 4.4057 0.0000 0.0000 65.6650 31.0918 178.2485 144 E 3.8493 8.1705 117.4860 59.1356 29.6132 178.2816 145 L 3.9706 8.1655 119.8687 58.5886 41.8422 178.9877 146 L 3.7768 7.7235 116.9109 57.3503 41.5042 179.3609 147 T 4.2498 7.6465 115.1077 66.3858 68.8887 176.9436 148 K 4.1289 8.5679 118.7154 56.5139 33.4202 177.2622 149 R 4.0115 8.0332 117.4620 56.6150 27.9606 174.4468 150 P 4.5608 0.0000 0.0000 62.5150 32.7575 176.5018 151 V 4.1358 8.2674 120.7133 61.9100 31.9440 174.0033 152 P 4.4783 0.0000 0.0000 62.7313 32.3848 175.4015 153 Q 4.6967 9.0132 122.9172 54.2146 31.6055 176.0266 154 K 4.4293 8.6178 125.9427 54.8076 32.3607 175.2644 155 Q 4.0863 8.7277 124.8222 56.1783 29.3718 176.4384 156 E 4.5734 8.6559 117.1534 55.1015 33.4048 173.4136 157 G 3.8982 8.8137 108.1235 43.3058 0.0000 172.9707 158 E 4.0264 8.4670 116.7221 56.1189 30.1699 176.2099 159 A 4.8912 8.2736 123.3904 51.0423 21.2874 176.2301 160 T 4.6422 8.2814 115.4883 61.6721 72.6650 173.5493 161 V 4.6892 8.1677 117.0634 59.6593 34.2596 175.3817 162 F 5.0316 9.5304 125.3585 56.9371 40.7787 174.8493 163 Q 4.7400 8.4213 119.7849 53.8635 31.2612 175.5128 164 R 4.0886 8.5203 122.8254 56.5908 30.7450 176.2619 165 R 4.5056 8.9265 126.0949 55.4664 31.4179 176.4880 166 K 4.5241 9.6357 121.8828 54.6793 33.8425 176.1399 167 P 4.3782 0.0000 0.0000 66.1793 31.0199 178.8564 168 E 4.3428 8.3349 116.5666 59.1665 29.1811 178.2474 169 Q 4.4943 7.8378 115.7660 56.6741 29.2735 177.4665 170 S 4.5400 8.3547 117.3130 59.0956 62.9040 173.2039 171 E 3.3928 7.1789 124.4769 55.6752 29.8064 176.1534 172 I 3.5762 8.2786 128.8412 60.5062 38.3592 175.7255 173 S 4.1611 5.8100 121.3614 56.5404 63.3616 173.1065 174 P 4.2848 0.0000 0.0000 64.8242 31.2163 176.6432 175 D 4.6353 7.7970 118.0070 54.6568 41.2851 176.8164 176 F 4.4838 7.6275 119.1576 57.1442 39.5345 175.5659 177 D 4.6663 8.4668 124.7875 52.7567 41.5175 177.2499 178 L 3.9465 8.3208 120.6820 58.3143 41.9434 178.4180 179 E 3.9614 8.1721 118.8549 59.0501 29.5555 178.5413 180 K 3.9162 8.5754 119.9156 59.3049 32.1668 178.7849 181 I 3.7855 7.9696 120.2208 64.6158 37.0120 177.5089 182 Y 4.0955 8.2045 120.2282 60.9362 38.3549 177.9659 183 D 4.2561 8.2777 118.4373 57.6157 41.0417 178.0681 184 Y 4.0119 8.1836 115.9379 61.1386 37.7540 178.6491 185 I 4.0054 7.9753 120.7610 64.1833 37.2221 180.4564 186 R 4.5837 7.7028 116.5119 56.1712 29.0697 177.7702 *188 L 4.1812 7.7740 117.1984 55.2983 43.6791 177.4212 189 D 4.6651 7.1549 120.8849 51.9299 39.8316 175.1261 190 G 4.3911 7.8732 111.1458 43.9130 0.0000 169.9632 191 E 4.1737 9.2778 121.5862 58.1241 29.6304 177.5633 192 G 3.7935 9.1483 114.3932 45.4546 0.0000 172.2142 193 Y 4.4456 7.7324 117.2669 55.4644 39.4710 173.8421 194 P 4.5084 0.0000 0.0000 62.0448 31.4490 176.5500 195 R 4.1372 8.6159 122.3934 55.8851 30.8244 176.5272 196 A 4.7699 8.6526 122.2925 52.7329 19.6789 176.5297 197 F 6.3000 9.4567 115.5379 55.1612 42.0962 173.2929 198 I 4.8677 8.7379 112.2728 59.1673 41.0783 174.1448 199 K 5.1159 8.6970 122.2150 55.6164 33.9315 176.3398 200 Y 4.6475 9.1963 125.0427 56.5306 41.1255 175.6966 201 G 3.6983 8.2741 122.7060 47.3218 0.0000 174.9335 202 K 4.0968 8.3807 125.2566 55.7811 31.9791 174.9806 203 Y 4.8966 8.2485 118.9758 59.0491 39.7159 175.2361 204 R 5.1416 8.7386 122.6428 55.1710 32.8056 175.0665 205 L 4.8975 9.1872 125.0352 52.3728 43.6354 175.2077 206 E 5.1139 8.7747 124.6749 54.6871 31.5827 175.4273 207 F 5.5608 8.9492 123.2294 56.1750 41.8322 174.8106 208 S 4.4982 9.2821 115.3381 56.9189 66.5735 173.4472 209 R 3.7234 9.1863 117.8958 57.3771 28.4781 175.4523 210 A 4.5017 7.5932 118.3268 52.6014 19.8900 178.8158 211 S 4.4489 8.8542 114.7453 57.5675 66.2401 172.1572 *213 K 4.4817 8.4983 116.7976 56.0680 34.1597 174.4903 214 N 4.2346 8.6162 119.5110 55.1062 38.6426 174.9957 215 G 3.9605 9.9345 113.8602 45.5158 0.0000 172.2874 216 K 4.5206 7.5512 116.9079 55.7248 35.5282 174.7565 217 I 4.6933 8.1198 120.2824 59.7111 39.5332 175.0423 218 I 4.5297 8.6223 127.3960 59.9578 38.9080 174.8058 219 A 5.3587 8.3012 126.7268 50.3424 22.8661 174.6788 220 D 4.9598 9.2456 119.4962 53.6302 42.6618 176.5966 221 V 4.7739 8.2063 120.2943 59.9928 34.7786 174.3413 222 E 4.5141 8.9837 123.1564 54.8446 31.7265 175.1374 223 I 4.4019 8.3817 126.2682 60.1763 37.9578 174.7991 224 I 4.6231 8.6994 129.4546 59.2570 39.2673 175.2591 225 E 4.4702 8.9229 125.4244 55.5763 30.9835 176.7701 226 G 3.7196 7.5847 107.3014 46.5799 0.0000 173.3272 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 0 L 8.18 4.17 0.00 1.66 1.79 0.89 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 *2 N 7.93 4.91 0.00 2.83 2.82 0.00 0.00 6.49 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 3 I 8.76 5.10 1.82 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.82 0.90 0.00 0.00 4 I 8.33 4.81 1.65 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.51 0.68 0.00 0.00 5 I 8.57 4.59 1.87 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 0.99 0.75 0.95 0.00 0.00 6 A 8.16 4.86 -0.09 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 7 T 9.06 5.58 4.38 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 1.32 0.00 0.00 8 T 8.71 4.77 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 1.14 0.00 0.00 9 K 8.38 3.85 0.00 0.79 0.74 0.00 1.30 0.00 0.00 1.50 0.00 0.00 2.60 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.92 0.76 7.81 10 S 8.68 4.01 0.00 4.02 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 11 W 7.36 4.23 0.00 3.61 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 12 N 7.31 4.45 0.00 2.90 3.01 0.00 0.00 7.16 7.33 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 13 I 7.60 3.65 1.93 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 1.42 0.67 0.90 0.00 0.00 14 K 8.06 3.83 0.00 1.83 2.04 0.00 1.65 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.41 1.48 7.81 15 N 8.08 4.11 0.00 2.20 1.57 0.00 0.00 6.98 6.52 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 16 A 7.68 3.93 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 Q 8.21 3.95 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.51 0.00 18 K 8.08 3.91 0.00 1.98 1.94 0.00 1.75 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.44 1.32 7.81 19 F 8.39 4.03 0.00 3.35 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 20 K 8.77 4.12 0.00 1.98 2.03 0.00 1.83 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.53 7.81 21 K 7.84 4.22 0.00 1.91 1.71 0.00 1.87 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.39 1.35 7.81 22 E 8.28 4.33 0.00 1.78 1.95 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 2.31 2.42 0.00 23 N 7.48 4.81 0.00 2.50 2.62 0.00 0.00 6.80 7.74 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 24 E 7.57 3.92 0.00 2.09 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 2.35 2.55 0.00 25 S 7.89 4.23 0.00 3.90 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 26 K 7.72 4.01 0.00 0.79 0.74 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.08 1.15 7.81 27 Y 7.57 5.04 0.00 2.93 2.85 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 28 N 8.94 4.76 0.00 2.82 2.92 0.00 0.00 7.07 7.22 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 29 T 8.56 5.04 4.38 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 1.35 0.00 0.00 30 T 8.75 4.56 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 1.18 0.00 0.00 31 I 8.37 4.78 1.89 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.58 0.95 0.00 0.00 32 I 8.78 4.86 1.73 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.92 1.06 0.00 0.00 33 T 9.35 5.31 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 1.29 0.00 0.00 34 N 8.17 4.99 0.00 2.91 2.67 0.00 0.00 6.69 7.39 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 35 K 7.53 3.50 0.00 0.79 0.92 0.00 0.61 0.00 0.00 1.30 0.00 0.00 2.83 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.14 0.90 7.81 36 D 7.63 4.43 0.00 2.76 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 37 E 8.15 4.13 0.00 2.22 2.07 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 2.35 2.25 0.00 38 L 7.55 4.50 0.00 1.74 1.84 0.73 0.83 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 39 T 7.33 4.79 4.29 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 1.29 0.00 0.00 40 F 8.86 4.41 0.00 3.11 3.18 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 41 E 8.11 3.76 0.00 1.95 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 0.00 2.37 2.35 0.00 42 K 7.86 4.07 0.00 1.85 1.79 0.00 1.65 0.00 0.00 1.55 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.41 7.81 43 V 8.11 3.42 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 0.23 0.00 0.00 0.89 0.00 0.00 44 K 7.88 4.11 0.00 1.97 1.72 0.00 1.14 0.00 0.00 0.96 0.00 0.00 2.81 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.36 1.31 7.81 45 L 7.30 4.12 0.00 1.74 1.72 0.87 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.33 3.84 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 1.49 0.65 0.83 0.00 0.00 47 N 7.53 4.24 0.00 2.92 2.84 0.00 0.00 7.25 7.57 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 48 P 0.00 4.62 0.00 2.29 1.92 0.00 3.28 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.52 0.00 49 E 9.22 4.17 0.00 2.28 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 0.00 2.32 2.16 0.00 50 Y 7.91 5.02 0.00 2.79 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 I 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.56 1.03 0.00 0.00 60 I 8.42 4.30 1.97 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.50 1.08 0.00 0.00 61 P 0.00 4.41 0.00 2.18 2.01 0.00 3.78 0.00 0.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.25 0.00 62 K 8.49 2.48 0.00 1.59 1.53 0.00 1.72 0.00 0.00 1.85 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.12 1.07 7.81 63 E 7.79 3.58 0.00 2.11 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 0.00 2.23 1.98 0.00 64 I 7.34 4.55 2.16 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.09 1.14 0.00 0.00 65 F 7.67 4.57 0.00 3.14 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 66 E 7.74 4.28 0.00 1.81 1.90 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 2.33 2.00 0.00 67 N 7.77 4.66 0.00 2.56 2.20 0.00 0.00 6.73 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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8.33 4.69 0.00 2.75 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 78 L 7.81 4.38 0.00 1.79 1.73 0.87 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.53 0.00 2.18 2.35 0.00 3.72 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.16 0.00 80 F 7.78 4.23 0.00 2.91 3.18 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 81 G 7.41 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 0.00 0.00 0.00 0.00 0.00 0.00 82 R 7.13 3.64 0.00 1.85 1.84 0.00 2.99 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 83 G 7.84 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 0.00 0.00 0.00 84 G 8.64 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 0.00 0.00 0.00 85 S 8.55 3.78 0.00 3.95 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 86 P 0.00 4.38 0.00 2.37 2.49 0.00 3.84 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.11 0.00 87 L 7.93 3.85 0.00 1.65 1.59 0.69 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 88 Q 7.85 3.77 0.00 2.04 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.68 0.00 0.00 0.00 0.00 0.00 2.32 2.30 0.00 89 N 8.10 3.93 0.00 2.09 1.42 0.00 0.00 7.04 7.08 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 90 L 7.99 4.07 0.00 1.81 1.74 1.05 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 91 I 7.76 3.60 1.69 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.67 0.78 0.00 0.00 92 E 7.93 3.82 0.00 2.02 1.96 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 2.27 2.22 0.00 93 R 7.55 4.16 0.00 1.99 2.03 0.00 3.51 0.00 0.00 3.55 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.62 0.00 94 G 8.09 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 I 7.59 4.11 2.04 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 1.28 0.77 0.95 0.00 0.00 96 K 8.45 4.30 0.00 1.53 1.56 0.00 0.61 0.00 0.00 1.09 0.00 0.00 2.48 0.00 0.00 2.58 0.00 0.00 0.00 0.00 1.19 1.06 7.81 97 K 7.81 4.99 0.00 1.98 1.61 0.00 1.83 0.00 0.00 1.63 0.00 0.00 2.83 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.31 0.99 7.81 98 T 9.09 4.82 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 1.25 0.00 0.00 99 K 8.66 4.99 0.00 1.69 1.71 0.00 1.83 0.00 0.00 1.76 0.00 0.00 2.79 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.50 1.46 7.81 100 I 9.00 4.47 1.98 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.04 1.08 0.00 0.00 101 S 9.21 5.18 0.00 3.75 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 0.00 102 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 T 7.62 4.24 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 0.00 112 G 7.43 4.12 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 0.00 0.00 0.00 113 D 8.52 4.62 0.00 2.35 2.36 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.41 4.46 1.83 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.74 0.98 0.00 0.00 115 F 9.37 4.25 0.00 2.69 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 0.00 116 F 7.07 4.75 0.00 3.16 3.19 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 0.00 117 K 9.06 5.41 0.00 1.70 1.78 0.00 1.74 0.00 0.00 1.75 0.00 0.00 2.81 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.50 7.81 118 R 8.82 4.88 0.00 1.80 1.85 0.00 3.48 0.00 0.00 3.29 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.92 0.00 119 D 8.79 5.01 0.00 2.60 2.64 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 0.00 120 L 8.68 4.68 0.00 1.78 1.49 0.95 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 121 D 8.90 5.06 0.00 2.68 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 0.00 122 L 8.48 4.73 0.00 1.42 1.49 0.95 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 123 Y 8.29 4.19 0.00 2.93 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 G 8.74 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 0.00 0.00 0.00 125 T 8.26 4.26 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 1.18 0.00 0.00 126 A 8.36 3.39 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 0.00 127 E 7.54 3.47 0.00 1.97 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 2.13 1.67 0.00 128 E 7.62 3.93 0.00 2.11 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 2.27 2.26 0.00 129 I 7.61 3.83 1.53 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.63 0.68 0.00 0.00 130 F 7.87 4.83 0.00 2.63 3.08 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 *132 R 8.03 4.14 0.00 1.95 2.13 0.00 3.32 0.00 0.00 3.36 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 133 A 8.35 4.06 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 S 8.51 4.20 0.00 4.45 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 0.00 135 K 8.17 4.07 0.00 1.93 2.01 0.00 1.81 0.00 0.00 1.85 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.57 1.61 7.81 136 I 7.75 3.77 2.08 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.00 0.98 0.00 0.00 137 I 7.75 3.43 1.68 0.00 0.00 0.72 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 0.44 -0.53 0.00 0.00 138 F 8.33 4.13 0.00 3.14 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 0.00 139 N 8.44 4.83 0.00 2.91 2.95 0.00 0.00 6.75 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 0.00 140 D 7.95 4.81 0.00 2.80 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *142 I 7.44 3.96 1.56 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.02 0.30 0.00 0.00 143 P 0.00 4.41 0.00 2.26 2.27 0.00 3.73 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.49 0.00 144 E 8.17 3.85 0.00 1.99 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 0.00 1.47 2.09 0.00 145 L 8.17 3.97 0.00 1.80 1.63 0.17 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 0.00 0.00 0.00 0.00 146 L 7.72 3.78 0.00 1.64 1.62 0.14 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 147 T 7.65 4.25 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 1.26 0.00 0.00 148 K 8.57 4.13 0.00 1.77 1.88 0.00 1.90 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.46 1.53 7.81 149 R 8.03 4.01 0.00 2.05 2.15 0.00 3.35 0.00 0.00 3.40 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.78 0.00 150 P 0.00 4.56 0.00 2.44 2.19 0.00 4.00 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.26 0.00 151 V 8.27 4.14 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 0.81 0.00 0.00 0.99 0.00 0.00 152 P 0.00 4.48 0.00 1.40 0.49 0.00 3.67 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.23 0.00 153 Q 9.01 4.70 0.00 1.89 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.83 6.95 0.00 0.00 0.00 0.00 0.00 2.26 2.42 0.00 154 K 8.62 4.43 0.00 1.54 1.62 0.00 1.71 0.00 0.00 2.36 0.00 0.00 2.86 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.37 0.91 7.81 155 Q 8.73 4.09 0.00 1.98 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.67 0.00 0.00 0.00 0.00 0.00 2.31 2.39 0.00 156 E 8.66 4.57 0.00 1.93 1.65 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 2.11 1.83 0.00 157 G 8.81 3.90 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 0.00 0.00 0.00 158 E 8.47 4.03 0.00 2.36 1.98 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 2.27 1.88 0.00 159 A 8.27 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 0.00 160 T 8.28 4.64 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 0.89 0.00 0.00 161 V 8.17 4.69 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 0.65 0.00 0.00 0.92 0.00 0.00 162 F 9.53 5.03 0.00 2.95 2.88 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 0.00 163 Q 8.42 4.74 0.00 1.93 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.92 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 164 R 8.52 4.09 0.00 2.11 1.86 0.00 3.34 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.23 0.00 165 R 8.93 4.51 0.00 1.81 1.85 0.00 3.17 0.00 0.00 3.12 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.55 0.00 166 K 9.64 4.52 0.00 1.91 1.94 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.41 1.27 7.81 167 P 0.00 4.38 0.00 2.20 2.16 0.00 3.64 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.22 0.00 168 E 8.33 4.34 0.00 2.14 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 0.00 2.47 2.57 0.00 169 Q 7.84 4.49 0.00 2.28 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.95 0.00 0.00 0.00 0.00 0.00 2.46 2.46 0.00 170 S 8.35 4.54 0.00 4.51 4.42 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 0.00 171 E 7.18 3.39 0.00 1.43 1.60 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 1.93 1.56 0.00 172 I 8.28 3.58 1.65 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 1.10 0.68 0.54 0.00 0.00 173 S 5.81 4.16 0.00 3.43 2.63 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 0.00 174 P 0.00 4.28 0.00 2.15 2.09 0.00 3.61 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.92 0.00 175 D 7.80 4.64 0.00 2.71 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 0.00 176 F 7.63 4.48 0.00 2.86 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 0.00 177 D 8.47 4.67 0.00 2.94 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 0.00 178 L 8.32 3.95 0.00 1.76 1.69 0.90 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 179 E 8.17 3.96 0.00 2.05 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 2.41 2.40 0.00 180 K 8.58 3.92 0.00 1.90 1.77 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.43 1.35 7.81 181 I 7.97 3.79 2.04 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.68 0.79 0.00 0.00 182 Y 8.20 4.10 0.00 3.04 3.19 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 0.00 183 D 8.28 4.26 0.00 2.89 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 0.00 184 Y 8.18 4.01 0.00 3.16 3.15 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 0.00 185 I 7.98 4.01 1.79 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.02 1.02 0.00 0.00 186 R 7.70 4.58 0.00 1.76 1.63 0.00 2.74 0.00 0.00 2.40 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.51 0.00 *188 L 7.77 4.18 0.00 1.81 2.04 0.98 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 189 D 7.15 4.67 0.00 2.77 2.64 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 0.00 190 G 7.87 4.39 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 0.00 191 E 9.28 4.17 0.00 2.53 2.33 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 2.31 2.35 0.00 192 G 9.15 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 0.00 0.00 0.00 193 Y 7.73 4.45 0.00 3.36 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 0.00 194 P 0.00 4.51 0.00 2.30 2.15 0.00 4.04 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.07 0.00 195 R 8.62 4.14 0.00 1.93 2.20 0.00 3.67 0.00 0.00 3.53 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.65 0.00 196 A 8.65 4.77 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 F 9.46 6.30 0.00 3.34 3.19 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 0.00 198 I 8.74 4.87 1.95 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.50 1.04 0.00 0.00 199 K 8.70 5.12 0.00 1.78 1.89 0.00 1.81 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 3.34 0.00 0.00 0.00 0.00 1.67 1.71 7.81 200 Y 9.20 4.65 0.00 2.99 2.95 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 0.00 201 G 8.27 3.70 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 0.00 0.00 0.00 202 K 8.38 4.10 0.00 1.70 1.82 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.44 1.03 7.81 203 Y 8.25 4.90 0.00 3.25 2.95 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 0.00 204 R 8.74 5.14 0.00 1.49 1.77 0.00 3.23 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.44 0.00 205 L 9.19 4.90 0.00 1.55 1.11 1.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 206 E 8.77 5.11 0.00 1.84 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 0.00 2.28 2.21 0.00 207 F 8.95 5.56 0.00 2.97 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 0.00 208 S 9.28 4.50 0.00 4.14 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 0.00 209 R 9.19 3.72 0.00 1.98 1.97 0.00 3.11 0.00 0.00 3.19 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 210 A 7.59 4.50 1.20 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 0.00 0.00 211 S 8.85 4.45 0.00 3.92 3.75 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 *213 K 8.50 4.48 0.00 1.83 1.78 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.80 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.43 1.39 7.81 214 N 8.62 4.23 0.00 2.64 2.73 0.00 0.00 6.93 7.98 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 0.00 215 G 9.93 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 0.00 0.00 0.00 216 K 7.55 4.52 0.00 1.77 1.73 0.00 1.56 0.00 0.00 1.70 0.00 0.00 2.85 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.33 1.40 7.81 217 I 8.12 4.69 1.87 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.67 1.01 0.00 0.00 218 I 8.62 4.53 1.91 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 1.18 0.73 0.94 0.00 0.00 219 A 8.30 5.36 1.34 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 0.00 0.00 0.00 220 D 9.25 4.96 0.00 2.74 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 V 8.21 4.77 2.07 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 0.72 0.00 0.00 0.39 0.00 0.00 222 E 8.98 4.51 0.00 1.84 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 0.00 2.21 2.23 0.00 223 I 8.38 4.40 1.78 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.42 0.68 0.00 0.00 224 I 8.70 4.62 1.97 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 1.28 0.90 0.91 0.00 0.00 225 E 8.92 4.47 0.00 1.95 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 2.30 2.32 0.00 226 G 7.58 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.