NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 G 3.9301 8.3431 109.7365 45.0962 0.0000 174.2136 4 G 3.9599 7.9577 108.0710 44.4684 0.0000 173.0797 5 G 4.0963 7.7219 103.9707 44.5925 0.0000 172.6473 6 T 4.0855 7.7526 111.5907 61.3322 70.6506 175.0947 7 V 3.8588 8.1072 121.2155 65.5364 31.5058 177.9594 8 K 3.9707 8.0024 117.9043 59.2989 31.9234 179.0335 9 K 3.9999 7.9909 119.4841 59.5002 32.1782 178.7197 10 D 4.3578 7.9896 118.9802 57.2538 40.5241 178.5935 11 L 4.1430 8.0627 118.9077 57.8519 41.6777 179.4435 12 K 4.1508 8.2100 118.3944 59.3476 31.7460 179.3504 13 K 3.9905 7.8797 118.8747 59.1065 32.4470 178.3541 14 A 4.2657 8.0687 120.5057 54.1297 18.2452 178.9453 15 I 3.6690 7.5177 118.9047 65.0687 37.3264 178.0809 16 Q 3.8816 8.0843 117.7870 59.2362 28.5951 178.5119 17 Y 3.9220 7.9461 119.9011 60.9343 38.8757 177.4782 18 Y 4.0950 8.1340 116.7526 59.9221 38.0630 178.1104 19 V 3.3650 7.8430 120.3190 65.6167 31.5308 178.0894 20 K 3.8009 7.7297 117.7106 59.4159 31.8497 178.9702 21 A 3.7952 7.4504 120.9411 55.3696 18.2060 178.9318 22 C 4.2260 8.3186 116.8233 59.9481 43.5531 175.6259 23 E 3.8618 8.0562 118.9155 58.8179 29.0572 178.3459 24 L 4.3966 7.6164 116.2794 53.3301 42.0245 175.7927 25 N 4.2074 7.9628 116.1110 54.3725 38.1782 174.1604 26 E 4.1462 8.2254 114.9573 55.2374 30.2780 176.3810 27 M 3.7630 8.3948 120.9633 57.3806 32.5361 176.4592 28 F 4.1912 8.7230 122.3449 58.4451 37.2624 177.1528 29 G 3.7197 8.4379 109.0940 48.3882 0.0000 175.7115 30 C 4.3081 8.1876 119.4293 59.0482 40.5062 175.6343 31 L 3.3124 7.8677 121.6256 58.3066 41.3951 179.1380 32 S 3.8792 7.8744 113.7745 61.3088 62.8178 176.4764 33 L 4.0904 7.4273 121.9225 57.8196 41.1874 179.6533 34 V 3.5730 7.6601 117.2560 65.6831 31.4687 177.3136 35 S 4.6400 7.6285 112.0713 57.8314 63.4111 173.7749 36 N 4.6068 7.7489 122.6601 51.7406 37.7931 175.5037 37 S 4.2508 8.4945 121.0280 60.4763 63.1186 175.2477 38 Q 4.2443 8.3687 119.0318 56.2863 28.8750 175.3484 39 I 4.3610 7.4830 120.5685 59.4830 38.2879 176.0886 40 N 4.6089 8.4263 123.5577 52.2891 39.5690 176.1250 41 K 3.8158 8.3141 120.6014 59.3580 31.9441 179.4586 42 Q 3.9238 8.0051 119.5375 59.1197 29.1370 178.1458 43 K 3.5269 8.5578 119.8618 59.2089 32.0329 178.7720 44 L 3.9842 7.9480 120.6720 58.4198 41.9074 178.8998 45 F 3.3055 8.2239 120.3074 60.9142 39.1470 176.8789 46 Q 3.7865 7.8722 119.2125 59.3170 28.8787 177.8767 47 Y 4.3211 7.9619 118.0702 61.2635 37.9431 178.5090 48 L 4.0356 8.4855 120.1734 57.6431 41.6343 179.8316 49 S 3.7477 7.7445 115.3875 61.2773 62.6944 176.5848 50 K 4.2165 8.3740 123.5114 58.8195 31.9355 178.7290 51 A 3.9450 8.0220 121.1105 55.3749 18.3289 178.8268 52 C 4.2471 8.6307 117.3778 59.8382 40.6715 175.6179 53 E 3.8635 8.3266 120.1467 58.8393 28.6803 178.1422 54 L 4.4403 7.5020 117.2819 53.8566 41.9927 176.1600 55 N 4.1482 8.0072 114.8383 54.3366 36.5867 174.5042 56 S 4.4501 8.1252 113.6865 57.2537 63.2345 174.6505 57 G 3.6322 8.8739 115.2842 48.0773 0.0000 174.6370 58 N 4.5953 8.9149 119.9047 55.9771 38.5356 177.6672 59 G 3.7028 8.0344 106.8162 48.1917 0.0000 175.0619 60 C 4.2002 8.2919 119.4343 59.5630 39.9714 176.2432 61 R 3.9943 7.9359 119.3467 59.6054 29.7885 178.3515 62 F 4.4893 8.3872 117.6235 60.2616 38.9752 177.5596 63 L 4.0843 8.3886 120.5134 57.9572 41.7556 179.1471 64 G 3.4461 8.2369 105.8406 47.8814 0.0000 175.3098 65 D 4.7632 8.0088 122.3562 56.7453 40.7511 178.8154 66 F 4.0976 8.6160 118.3065 60.9220 38.8568 177.3283 67 Y 4.1891 8.1772 115.8436 60.7906 37.6125 177.6249 68 E 4.1027 8.3321 119.7145 59.4291 28.9065 178.3689 69 N 4.5732 8.8892 117.1788 54.6634 38.4337 176.7761 70 G 4.2869 8.1047 106.4638 46.4920 0.0000 174.6591 71 K 3.8269 7.3983 120.0040 57.8834 32.3815 177.0652 72 Y 4.5863 7.4074 112.6272 57.9961 39.0348 175.2697 73 V 4.3451 6.9590 112.0806 59.6090 35.7044 172.9844 74 K 4.3493 8.3424 123.0996 55.7227 32.6334 176.6519 75 K 4.1070 8.6125 127.0351 57.1168 32.4836 175.9941 76 D 4.6230 9.3524 126.1516 51.7074 42.4075 175.1700 77 L 4.1284 8.5747 127.3425 57.6741 41.7086 179.4581 78 R 4.4587 7.9394 118.9518 58.6574 30.2592 178.8102 79 K 3.9304 8.8419 120.7777 58.4119 31.9797 178.6335 80 A 3.9724 8.3655 121.5182 55.2460 18.2712 179.5011 81 A 4.1271 7.9798 119.0860 55.3974 18.0330 179.6895 82 Q 3.8439 7.9631 116.5575 59.4215 28.6288 179.0276 83 Y 4.3040 7.4581 117.0335 61.3172 37.5969 177.8292 84 Y 4.4011 7.9505 117.8845 61.1340 37.8351 178.6995 85 S 4.2055 8.6602 114.6975 61.1753 62.5171 176.0984 86 K 3.9512 8.2871 122.3061 59.3265 31.9362 178.6237 87 A 4.0056 8.4804 121.4953 55.4126 18.3870 178.7820 88 C 4.3438 8.7724 117.5932 59.8200 43.4918 176.0071 89 G 3.5538 8.3768 106.6991 47.2800 0.0000 174.4961 90 L 4.4582 7.5061 119.2219 53.9055 41.9755 176.1702 91 N 4.1608 7.9853 114.7625 54.3438 36.5145 174.0379 92 D 4.5783 8.1007 118.4553 53.3163 42.1342 176.1459 93 Q 4.0007 8.9730 127.8835 59.7809 29.0226 178.2296 94 D 4.4814 8.2026 119.3166 56.9563 40.8689 178.6918 95 G 3.7098 8.6775 106.7957 48.2493 0.0000 175.1577 96 C 4.3337 8.3420 119.3115 59.2071 34.4263 175.8002 97 L 4.1814 8.0187 121.9819 58.4680 41.7350 179.0428 98 I 3.5946 8.0634 119.9788 64.2961 36.8799 178.0365 99 L 4.0633 8.1066 121.2775 58.3097 41.8993 179.3492 100 G 2.6903 8.2146 105.6501 47.6116 0.0000 175.2651 101 Y 4.1429 8.2244 118.5507 60.9003 37.7764 178.8437 102 K 4.1340 8.2652 119.4953 59.6348 32.1561 179.4849 103 Q 3.9757 8.4242 118.6928 59.1092 28.3623 178.2316 104 Y 3.8388 8.1523 119.6043 59.9305 38.9703 176.7983 105 A 4.5426 8.0882 119.5249 51.3402 19.5820 177.1368 106 G 3.8561 8.1472 104.5929 46.4602 0.0000 174.1007 107 K 4.1813 8.4116 123.1012 55.6941 31.7722 177.0197 108 G 3.9919 9.6050 114.7682 45.6234 0.0000 171.6008 109 V 4.7623 7.1593 111.6329 59.2034 36.0436 174.1543 110 V 3.8519 8.1183 121.3436 62.9473 32.0762 175.4209 111 K 4.1924 8.5550 129.0257 56.7036 32.7882 176.3016 112 N 4.7096 9.3686 127.2548 51.1742 40.1820 174.3551 113 E 3.5035 8.5074 125.4112 58.6209 29.5875 178.8257 114 K 3.9196 7.9489 118.0935 59.4990 32.1264 178.9328 115 Q 3.8889 8.4401 119.4877 59.0175 28.8891 177.9216 116 A 3.7485 8.0297 122.0026 55.2366 18.4021 179.5953 117 V 3.7601 8.1234 116.8759 66.3981 31.6620 178.4353 118 K 4.2929 7.8214 119.0560 59.2377 31.8643 179.5093 119 T 3.8459 8.0339 116.3181 66.6155 68.2258 176.6973 120 F 4.4926 8.1605 120.0062 60.6636 38.5886 177.4915 121 E 4.0247 8.5231 118.3355 59.3348 29.1637 179.3990 122 K 4.0485 8.1237 119.2223 59.3950 32.1909 178.8170 123 A 4.0214 8.2649 121.2098 55.1795 18.2957 178.8397 124 C 4.4339 8.6566 117.4243 59.9955 43.5462 175.8622 125 R 3.8894 8.1033 118.8013 59.3070 29.7785 178.3005 126 L 4.3357 7.8568 115.8063 55.1173 41.7425 177.6468 127 G 3.9817 7.9011 107.6916 45.2399 0.0000 174.3721 128 S 4.5043 8.5592 115.6255 57.2039 62.8071 174.4000 129 E 3.9641 8.6951 129.9830 59.6240 29.4022 178.7183 130 D 4.3721 8.2402 118.2059 57.5068 40.8611 178.8469 131 A 3.7880 7.8153 120.9706 55.3659 18.2144 179.0396 132 C 4.3575 8.0125 114.0374 60.1608 40.3199 176.3767 133 G 3.5245 8.3629 106.8685 47.5111 0.0000 175.3928 134 I 3.6294 7.7286 121.7975 64.2318 37.1529 176.6137 135 L 4.2644 7.5805 122.6855 54.9773 41.6431 176.7731 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 3 G 8.34 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 0.00 0.00 0.00 4 G 7.96 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 5 G 7.72 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 6 T 7.75 4.09 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 1.21 0.00 0.00 7 V 8.11 3.86 2.08 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 1.28 0.00 0.00 0.93 0.00 0.00 8 K 8.00 3.97 0.00 1.84 1.85 0.00 1.72 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.53 1.50 7.81 9 K 7.99 4.00 0.00 1.85 1.97 0.00 1.63 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.48 7.81 10 D 7.99 4.36 0.00 2.92 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 11 L 8.06 4.14 0.00 1.76 1.97 0.95 0.87 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 12 K 8.21 4.15 0.00 1.98 1.88 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.70 7.81 13 K 7.88 3.99 0.00 1.85 2.05 0.00 1.79 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.45 7.81 14 A 8.07 4.27 1.59 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 0.00 0.00 15 I 7.52 3.67 2.00 0.00 0.00 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 1.60 1.07 0.92 0.00 0.00 16 Q 8.08 3.88 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.90 0.00 0.00 0.00 0.00 0.00 2.46 2.37 0.00 17 Y 7.95 3.92 0.00 2.90 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 18 Y 8.13 4.10 0.00 3.09 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 19 V 7.84 3.37 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 0.76 0.00 0.00 -0.06 0.00 0.00 20 K 7.73 3.80 0.00 1.74 1.64 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.35 1.51 7.81 21 A 7.45 3.80 1.09 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 22 C 8.32 4.23 0.00 3.07 3.24 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 23 E 8.06 3.86 0.00 2.06 1.97 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 2.32 2.49 0.00 24 L 7.62 4.40 0.00 1.56 1.64 0.86 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 25 N 7.96 4.21 0.00 2.82 2.84 0.00 0.00 7.13 6.94 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 26 E 8.23 4.15 0.00 2.12 1.83 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 2.29 2.19 0.00 27 M 8.39 3.76 0.00 1.77 1.81 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.94 0.00 28 F 8.72 4.19 0.00 3.39 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 29 G 8.44 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 30 C 8.19 4.31 0.00 3.11 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 31 L 7.87 3.31 0.00 1.84 1.91 0.90 1.07 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 32 S 7.87 3.88 0.00 3.29 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 33 L 7.43 4.09 0.00 1.81 1.73 0.90 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 34 V 7.66 3.57 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 0.74 0.00 0.00 0.54 0.00 0.00 35 S 7.63 4.64 0.00 3.75 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 36 N 7.75 4.61 0.00 2.85 2.83 0.00 0.00 6.88 7.95 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 37 S 8.49 4.25 0.00 4.00 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 38 Q 8.37 4.24 0.00 2.25 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.69 0.00 0.00 0.00 0.00 0.00 2.37 2.66 0.00 39 I 7.48 4.36 2.03 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 1.53 0.62 1.03 0.00 0.00 40 N 8.43 4.61 0.00 2.95 2.92 0.00 0.00 6.23 7.60 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 41 K 8.31 3.82 0.00 1.37 1.24 0.00 0.61 0.00 0.00 1.18 0.00 0.00 2.63 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.05 0.21 7.81 42 Q 8.01 3.92 0.00 2.09 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.89 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 43 K 8.56 3.53 0.00 1.71 1.19 0.00 1.65 0.00 0.00 1.48 0.00 0.00 2.81 0.00 0.00 2.43 0.00 0.00 0.00 0.00 1.53 1.50 7.81 44 L 7.95 3.98 0.00 1.80 2.00 1.01 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 45 F 8.22 3.31 0.00 2.59 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 46 Q 7.87 3.79 0.00 2.19 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.59 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 47 Y 7.96 4.32 0.00 3.07 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 48 L 8.49 4.04 0.00 1.34 1.60 1.11 1.02 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 49 S 7.74 3.75 0.00 3.71 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 50 K 8.37 4.22 0.00 1.82 1.94 0.00 1.71 0.00 0.00 1.97 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.31 7.81 51 A 8.02 3.94 1.37 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 52 C 8.63 4.25 0.00 2.97 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 53 E 8.33 3.86 0.00 2.23 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 0.00 2.34 2.57 0.00 54 L 7.50 4.44 0.00 1.77 1.67 0.90 1.10 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 55 N 8.01 4.15 0.00 2.88 2.92 0.00 0.00 6.80 7.14 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 56 S 8.13 4.45 0.00 4.12 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 57 G 8.87 3.63 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 0.00 58 N 8.91 4.60 0.00 2.97 3.16 0.00 0.00 6.96 7.46 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 59 G 8.03 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 60 C 8.29 4.20 0.00 3.19 3.42 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 61 R 7.94 3.99 0.00 1.80 1.96 0.00 2.62 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.64 0.00 62 F 8.39 4.49 0.00 3.30 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 63 L 8.39 4.08 0.00 1.59 1.43 0.16 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.24 3.45 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 0.00 65 D 8.01 4.76 0.00 3.23 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 66 F 8.62 4.10 0.00 3.21 2.96 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 67 Y 8.18 4.19 0.00 3.40 3.32 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 68 E 8.33 4.10 0.00 2.37 2.31 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 2.54 2.53 0.00 69 N 8.89 4.57 0.00 2.80 2.81 0.00 0.00 6.97 8.31 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 70 G 8.10 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 0.00 0.00 0.00 0.00 71 K 7.40 3.83 0.00 1.39 1.14 0.00 1.55 0.00 0.00 1.27 0.00 0.00 2.78 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.30 0.98 7.81 72 Y 7.41 4.59 0.00 3.13 3.05 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 73 V 6.96 4.35 1.85 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 0.32 0.00 0.00 0.54 0.00 0.00 74 K 8.34 4.35 0.00 1.73 1.77 0.00 1.81 0.00 0.00 1.67 0.00 0.00 2.76 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.47 1.44 7.81 75 K 8.61 4.11 0.00 1.78 1.77 0.00 1.83 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.49 1.67 7.81 76 D 9.35 4.62 0.00 2.78 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 77 L 8.57 4.13 0.00 1.78 1.78 0.97 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 78 R 7.94 4.46 0.00 1.97 1.92 0.00 3.39 0.00 0.00 3.21 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.54 0.00 79 K 8.84 3.93 0.00 1.65 1.47 0.00 1.20 0.00 0.00 1.41 0.00 0.00 2.79 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.30 0.54 7.81 80 A 8.37 3.97 1.62 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 81 A 7.98 4.13 1.46 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 0.00 0.00 82 Q 7.96 3.84 0.00 1.74 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.77 0.00 0.00 0.00 0.00 0.00 2.22 2.50 0.00 83 Y 7.46 4.30 0.00 3.03 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 84 Y 7.95 4.40 0.00 3.17 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 85 S 8.66 4.21 0.00 3.93 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 86 K 8.29 3.95 0.00 1.94 2.03 0.00 1.74 0.00 0.00 1.79 0.00 0.00 3.09 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.49 7.81 87 A 8.48 4.01 1.54 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 0.00 0.00 88 C 8.77 4.34 0.00 3.11 3.29 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 89 G 8.38 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 L 7.51 4.46 0.00 1.82 1.71 1.02 1.07 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 N 7.99 4.16 0.00 2.90 2.93 0.00 0.00 6.80 7.36 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 92 D 8.10 4.58 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 93 Q 8.97 4.00 0.00 2.17 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.69 0.00 0.00 0.00 0.00 0.00 2.46 2.49 0.00 94 D 8.20 4.48 0.00 2.80 2.58 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 95 G 8.68 3.71 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 0.00 0.00 0.00 96 C 8.34 4.33 0.00 3.03 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 97 L 8.02 4.18 0.00 1.88 1.90 1.27 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 98 I 8.06 3.59 1.38 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.36 -0.20 0.00 0.00 99 L 8.11 4.06 0.00 1.88 1.83 0.98 0.94 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 0.00 100 G 8.21 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 0.00 0.00 0.00 101 Y 8.22 4.14 0.00 3.35 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 0.00 102 K 8.27 4.13 0.00 2.01 2.10 0.00 1.80 0.00 0.00 1.76 0.00 0.00 2.87 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.73 1.80 7.81 103 Q 8.42 3.98 0.00 2.13 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.50 0.00 104 Y 8.15 3.84 0.00 3.22 3.05 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 0.00 105 A 8.09 4.54 1.49 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 0.00 106 G 8.15 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 107 K 8.41 4.18 0.00 1.86 1.82 0.00 1.77 0.00 0.00 1.89 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.46 1.43 7.81 108 G 9.61 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 0.00 109 V 7.16 4.76 2.08 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 0.89 0.00 0.00 0.97 0.00 0.00 110 V 8.12 3.85 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.92 0.00 0.00 111 K 8.55 4.19 0.00 1.80 1.69 0.00 1.80 0.00 0.00 1.61 0.00 0.00 2.79 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.33 1.53 7.81 112 N 9.37 4.71 0.00 2.67 2.70 0.00 0.00 6.77 7.27 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 0.00 113 E 8.51 3.50 0.00 1.80 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 0.00 1.47 1.95 0.00 114 K 7.95 3.92 0.00 1.88 1.84 0.00 1.64 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.45 7.81 115 Q 8.44 3.89 0.00 2.08 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.38 2.34 0.00 116 A 8.03 3.75 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 0.00 117 V 8.12 3.76 2.31 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 1.10 0.00 0.00 1.17 0.00 0.00 118 K 7.82 4.29 0.00 1.91 1.84 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.52 7.81 119 T 8.03 3.85 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 1.12 0.00 0.00 120 F 8.16 4.49 0.00 3.18 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 0.00 121 E 8.52 4.02 0.00 2.18 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 2.38 2.64 0.00 122 K 8.12 4.05 0.00 1.87 1.98 0.00 1.64 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.47 7.81 123 A 8.26 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 124 C 8.66 4.43 0.00 3.10 3.34 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 0.00 125 R 8.10 3.89 0.00 2.00 2.01 0.00 3.23 0.00 0.00 3.24 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.89 0.00 126 L 7.86 4.34 0.00 1.77 1.72 0.98 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 127 G 7.90 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 0.00 128 S 8.56 4.50 0.00 3.94 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 0.00 129 E 8.70 3.96 0.00 2.06 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 2.41 2.41 0.00 130 D 8.24 4.37 0.00 2.79 2.76 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 0.00 131 A 7.82 3.79 1.48 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 0.00 0.00 0.00 0.00 0.00 0.00 132 C 8.01 4.36 0.00 3.12 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 0.00 133 G 8.36 3.52 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 I 7.73 3.63 1.48 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.35 0.25 0.00 0.00 135 L 7.58 4.26 0.00 1.79 1.58 1.02 0.99 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