NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1C H 4.7394 8.4449 117.8351 56.2464 29.9826 172.8848 1D H 4.6704 8.6509 118.7467 55.6091 29.6042 172.6783 1E H 5.0895 7.5523 115.7111 53.6256 33.5638 171.9487 1F H 4.6577 8.8754 116.9307 55.9376 28.9534 174.3992 1G F 4.8953 8.4074 119.1220 57.8881 39.9516 173.8869 2 N 4.6203 8.6202 117.0418 52.4171 39.0448 174.3720 3 L 4.8324 8.0589 123.1856 51.8841 44.1332 174.6970 4 P 4.5012 0.0000 0.0000 61.9463 31.9940 174.7984 5 P 4.3118 0.0000 0.0000 64.2013 31.7697 176.6047 6 G 3.7858 7.7356 108.3581 45.1150 0.0000 171.1032 7 N 4.5061 8.0601 115.7423 51.2848 40.1990 173.6939 8 Y 4.8848 7.8316 112.5576 57.8719 38.4080 177.1087 9 K 4.1041 8.8377 122.6024 58.8109 32.2127 177.1578 10 K 4.7217 7.6224 114.9495 53.2810 35.4986 173.6465 11 P 4.8549 0.0000 0.0000 63.1874 32.5171 174.8536 12 K 4.6942 9.2230 119.0849 56.2652 36.7865 174.1288 13 L 5.0300 9.0588 120.5054 53.3704 43.9988 176.4072 14 L 5.0201 8.5789 123.2937 53.5317 42.9406 174.4000 15 Y 4.7216 9.2233 126.9060 56.9073 40.3818 173.6538 16 C 4.0940 8.7574 128.7312 57.9083 32.0655 174.3288 17 S 3.8763 8.0446 122.3614 61.0778 62.5952 175.4708 18 N 4.1516 8.0417 118.9551 56.1421 38.6619 175.4005 19 G 3.8174 7.6024 102.6120 44.6660 0.0000 173.3968 20 G 3.4265 7.7763 107.4061 45.5465 0.0000 173.4489 21 H 4.5794 7.1918 116.2554 54.8286 30.7670 174.1651 22 F 5.1867 8.9052 120.8528 56.0889 40.4111 175.2244 23 L 4.4193 9.1351 126.4620 55.3906 43.2682 175.5376 24 R 4.9772 9.3263 126.5406 54.5967 33.2979 173.9853 25 I 4.6385 8.2222 127.3125 59.5297 38.4538 175.5630 26 N 4.4883 9.0308 125.6343 51.9883 39.2044 175.0008 27 P 4.1282 0.0000 0.0000 65.7393 31.4620 177.8110 28 A 4.0607 7.8136 118.8043 53.2697 18.7240 178.0046 29 G 4.1188 8.5539 105.4205 44.7645 0.0000 173.9264 30 T 4.5086 7.5889 109.8409 60.9328 70.0152 173.6517 31 V 4.8594 7.8568 121.7890 61.3611 34.7277 174.7178 32 D 4.5688 8.4494 124.5566 53.1399 42.8748 174.1644 33 G 4.5615 8.6467 104.5905 45.5170 0.0000 172.1546 34 T 4.9729 8.8132 114.7324 60.5982 71.2047 174.5310 35 R 4.3603 8.8040 123.5159 56.2358 31.0453 176.3634 36 D 4.6117 8.3993 119.7398 53.2293 40.1622 176.5936 37 R 3.8028 8.6269 127.3164 57.7902 30.2220 177.0352 38 S 4.4294 8.8275 111.1787 59.1496 63.8421 174.1878 39 D 4.3704 7.7230 121.5307 55.1372 41.2148 175.8600 40 Q 4.5016 8.4431 122.6822 55.8394 29.2725 175.7175 41 H 4.9009 9.1743 115.9713 55.4433 29.2241 175.1626 42 I 4.5925 7.4953 110.8780 59.8429 38.4033 175.2097 43 Q 4.2160 7.8657 121.8653 55.7958 29.6895 174.7073 44 L 4.9542 9.0158 124.9296 52.7959 45.3286 175.4060 45 Q 4.8165 9.2433 124.8564 54.5707 30.5772 174.5528 46 L 5.1350 8.5808 126.6891 54.0962 43.5595 176.1735 47 S 4.5520 8.4571 114.4564 56.9527 66.7009 172.9773 48 A 4.3588 8.3870 122.9080 51.9558 19.8467 174.8727 49 E 4.2750 8.8035 117.4425 55.4634 32.2888 177.7178 50 S 4.7123 7.0731 112.6811 56.1870 65.8571 173.9254 51 V 3.8566 8.2231 121.3321 64.8992 31.5265 176.2201 52 G 3.9314 9.2207 114.5623 45.3357 0.0000 171.8689 53 E 5.2578 8.1891 119.4602 54.6257 32.4132 175.5859 54 V 4.8660 8.9440 115.7765 60.0422 36.8662 173.8285 55 Y 5.2306 8.7089 119.7835 56.5330 41.2484 175.2977 56 I 4.4273 8.5934 122.1658 59.6591 40.5421 173.9944 57 K 4.6090 8.7177 129.1509 54.1678 34.9540 175.0562 58 S 4.5491 8.8995 122.8745 58.3690 62.7677 174.8951 59 T 3.9502 8.4599 118.0333 64.1215 68.8250 175.8165 60 E 4.0893 8.3039 122.7881 58.1551 29.9323 176.8398 61 T 4.3426 7.8025 106.0528 60.5876 70.2109 175.3947 62 G 3.8231 8.0990 109.9579 45.3832 0.0000 173.8355 63 Q 4.4276 7.5075 119.1149 56.0502 30.3049 174.5619 64 Y 4.7419 8.7888 119.6310 55.9220 40.7048 175.2516 65 L 4.5025 9.1020 126.0083 55.4380 43.4552 175.5773 66 A 5.1315 8.6618 125.7558 50.7265 23.2565 174.4473 67 M 5.3276 8.7589 119.2971 53.9444 34.8849 175.6224 68 D 5.2535 9.5589 126.2793 51.8421 41.4128 176.8322 69 T 4.2205 8.5104 107.9945 63.9124 68.8379 174.5347 70 D 4.6408 8.4162 120.8580 54.1087 41.4613 177.0284 71 G 3.1188 8.5046 108.5847 45.0429 0.0000 172.8936 72 L 4.7347 7.8680 119.9663 52.9076 43.0907 176.1698 73 L 5.0137 8.3308 122.8827 55.3257 42.7474 175.4844 74 Y 4.8944 8.8597 119.0388 56.3048 41.9894 173.2728 75 G 4.2501 9.0439 108.6507 45.2132 0.0000 173.2782 76 S 5.0781 9.0414 121.1242 56.8282 63.9816 175.3310 77 Q 4.1912 9.0297 125.0416 58.1945 28.9371 176.3517 78 T 4.6294 7.5554 106.5817 58.8937 71.7185 172.1646 79 P 3.9596 0.0000 0.0000 61.3708 30.8409 174.0571 80 N 5.1733 7.9589 122.8688 50.7439 40.4065 174.4812 81 E 3.8692 8.7441 114.3128 59.6805 29.7005 178.1944 82 E 4.1044 8.9101 118.3231 57.7102 29.7510 177.4149 83 C 5.0675 7.8469 115.1957 58.9038 29.2125 173.4389 84 L 4.2810 7.0294 120.9554 53.6981 42.7338 175.8731 85 F 5.1621 8.8816 121.6061 55.5590 43.4272 174.3714 86 L 4.8612 9.2243 122.9336 53.8428 42.6081 175.4402 87 E 4.5116 8.7879 126.7170 55.2323 30.3520 175.7496 88 R 4.8173 8.5030 125.1865 54.0340 34.7971 174.6207 89 L 4.6804 8.7622 124.3877 55.3076 43.0853 175.8314 90 E 4.6927 9.1829 124.9521 55.2792 33.6409 174.7975 91 E 4.0220 9.7906 123.2032 57.4661 27.3378 174.2056 92 N 4.3034 8.4221 111.0553 54.1464 36.4390 174.0179 93 H 4.8149 8.4069 117.3495 57.5282 37.9375 173.5250 94 Y 4.7008 7.7789 116.1816 57.5553 39.9914 173.5302 95 N 5.5485 9.6503 118.4288 51.9555 41.1274 174.6146 96 T 5.2584 8.9246 113.2152 60.1562 72.7809 172.8192 97 Y 5.0309 8.6249 119.0524 56.6208 41.4985 174.1932 98 I 4.5664 8.5520 126.0935 59.1774 39.5079 175.4900 99 S 3.9634 8.8019 122.0166 58.7158 62.4019 174.0343 100 K 3.9694 8.7881 129.4191 59.3725 32.2916 178.6670 101 K 3.8432 7.9326 117.8190 58.8995 32.2754 177.3884 102 H 4.8519 8.1681 116.8087 54.4697 30.1003 176.6287 103 A 4.0242 7.7122 125.7197 55.1968 18.3323 179.8080 104 E 3.9035 8.1021 114.4079 58.3874 29.9194 178.1965 105 K 4.1208 7.5391 117.5112 55.5947 32.9086 175.7536 106 N 3.9678 7.5421 115.7316 53.9558 36.4992 174.6601 107 W 5.0770 7.7179 117.5757 55.7619 31.0643 177.2280 108 F 5.4426 9.1907 124.0694 55.4643 40.9742 175.8176 109 V 3.9167 8.9791 122.2391 63.1355 32.4345 175.2281 110 G 4.4115 8.5865 112.6659 45.2894 0.0000 171.4810 111 L 5.2794 8.3115 121.6143 52.4618 44.5893 177.1986 112 K 4.2413 8.9955 123.2811 55.4654 32.9039 178.3502 113 K 3.8851 8.4509 119.7148 59.3897 31.9353 177.9359 114 N 4.5531 8.0319 113.7118 52.8646 37.8321 175.7045 115 G 3.5802 8.2343 109.6599 45.2162 0.0000 174.0475 116 S 4.5477 8.4990 115.5143 57.6230 63.9618 173.4620 117 C 4.7358 8.3025 117.6892 58.3543 30.2225 173.3544 118 K 4.3506 9.1484 121.4903 56.1966 33.0622 176.5792 119 R 4.3113 8.3210 121.0196 54.9423 31.7714 177.6091 120 G 3.3118 8.8288 113.4662 48.2725 0.0000 174.1707 121 P 4.4183 0.0000 0.0000 64.3948 31.4023 177.2751 122 R 4.4593 7.8320 116.0365 55.9245 30.2661 176.0081 123 T 5.0983 7.4430 108.1660 59.7337 70.9699 173.2137 124 H 4.7535 7.8827 115.4473 54.9587 30.5859 172.9860 125 Y 3.9562 8.7689 118.2644 60.0362 38.0477 177.3541 126 G 4.0296 9.0782 111.5956 45.3331 0.0000 173.7341 127 Q 4.2824 7.3867 118.8073 55.0793 30.0366 176.8639 128 K 3.9054 8.2105 118.1641 58.2492 32.9338 179.3787 129 A 3.9432 7.7422 121.6533 54.2574 18.3869 178.3960 130 I 4.4225 7.1495 106.2800 60.2352 38.5223 175.3193 131 L 4.2969 7.1837 122.8394 54.0251 42.5000 175.8177 132 F 5.4631 9.3826 122.7346 55.5914 43.3372 174.4258 133 L 5.3502 9.2965 120.3130 52.4258 45.4611 174.1366 134 P 5.1049 0.0000 0.0000 62.7616 31.9881 175.5461 135 L 4.9860 9.2275 125.5303 51.7965 44.6031 174.6685 136 P 4.6522 0.0000 0.0000 62.8429 32.3651 176.7654 137 V 3.7682 8.1576 113.1550 61.8165 31.6256 176.3005 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 1C H 8.44 4.74 0.00 3.10 3.44 0.00 5.66 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1D H 8.65 4.67 0.00 3.13 3.20 0.00 5.64 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E H 7.55 5.09 0.00 3.15 3.31 0.00 5.71 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1F H 8.88 4.66 0.00 3.34 3.42 0.00 5.66 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 1G F 8.41 4.90 0.00 2.92 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 2 N 8.62 4.62 0.00 2.95 2.78 0.00 0.00 6.86 6.74 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 3 L 8.06 4.83 0.00 1.47 1.40 0.58 0.30 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 4 P 0.00 4.50 0.00 2.17 2.16 0.00 3.69 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.93 0.00 5 P 0.00 4.31 0.00 2.17 2.18 0.00 3.74 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 1.95 1.93 0.00 6 G 7.74 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 7 N 8.06 4.51 0.00 2.59 2.64 0.00 0.00 5.85 7.55 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 8 Y 7.83 4.88 0.00 3.05 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 9 K 8.84 4.10 0.00 1.81 1.90 0.00 1.63 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.55 7.81 10 K 7.62 4.72 0.00 1.71 1.69 0.00 1.77 0.00 0.00 1.77 0.00 0.00 3.05 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.33 1.33 7.81 11 P 0.00 4.85 0.00 2.06 2.05 0.00 3.79 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 1.98 1.95 0.00 12 K 9.22 4.69 0.00 1.97 1.95 0.00 1.37 0.00 0.00 1.92 0.00 0.00 2.94 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.37 1.50 7.81 13 L 9.06 5.03 0.00 1.71 1.70 0.37 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.58 5.02 0.00 1.52 1.52 0.33 0.87 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 15 Y 9.22 4.72 0.00 3.33 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 16 C 8.76 4.09 0.00 2.64 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 17 S 8.04 3.88 0.00 3.89 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 18 N 8.04 4.15 0.00 2.51 2.63 0.00 0.00 6.72 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 19 G 7.60 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 20 G 7.78 3.43 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 0.00 21 H 7.19 4.58 0.00 3.03 3.16 0.00 5.80 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 22 F 8.91 5.19 0.00 3.12 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 23 L 9.14 4.42 0.00 1.77 1.50 0.94 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 24 R 9.33 4.98 0.00 1.91 2.04 0.00 3.15 0.00 0.00 3.28 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.78 0.00 25 I 8.22 4.64 1.84 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.71 0.89 0.00 0.00 26 N 9.03 4.49 0.00 2.82 2.67 0.00 0.00 6.68 8.69 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 27 P 0.00 4.13 0.00 1.99 2.11 0.00 3.54 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.88 0.00 28 A 7.81 4.06 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 29 G 8.55 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 30 T 7.59 4.51 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 31 V 7.86 4.86 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 0.86 0.00 0.00 0.93 0.00 0.00 32 D 8.45 4.57 0.00 2.83 2.74 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 33 G 8.65 4.56 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 0.00 0.00 0.00 34 T 8.81 4.97 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 1.36 0.00 0.00 35 R 8.80 4.36 0.00 1.89 1.99 0.00 3.22 0.00 0.00 3.09 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.54 0.00 36 D 8.40 4.61 0.00 2.81 2.65 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 37 R 8.63 3.80 0.00 1.86 1.90 0.00 3.26 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.19 0.00 38 S 8.83 4.43 0.00 3.96 3.95 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 39 D 7.72 4.37 0.00 2.81 2.65 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 40 Q 8.44 4.50 0.00 1.90 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.17 0.00 0.00 0.00 0.00 0.00 2.26 2.22 0.00 41 H 9.17 4.90 0.00 3.29 3.47 0.00 5.77 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.50 4.59 1.90 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.17 1.03 0.00 0.00 43 Q 7.87 4.22 0.00 2.02 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.89 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 44 L 9.02 4.95 0.00 1.48 1.44 0.80 0.52 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 45 Q 9.24 4.82 0.00 2.09 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.83 0.00 0.00 0.00 0.00 0.00 2.27 2.37 0.00 46 L 8.58 5.13 0.00 1.71 1.40 0.92 1.06 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 47 S 8.46 4.55 0.00 3.92 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 48 A 8.39 4.36 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 49 E 8.80 4.28 0.00 1.76 1.72 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 2.15 2.32 0.00 50 S 7.07 4.71 0.00 4.17 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 51 V 8.22 3.86 2.34 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 0.97 0.00 0.00 1.04 0.00 0.00 52 G 9.22 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 53 E 8.19 5.26 0.00 2.05 1.69 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 2.20 2.28 0.00 54 V 8.94 4.87 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 0.60 0.00 0.00 1.18 0.00 0.00 55 Y 8.71 5.23 0.00 2.99 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 56 I 8.59 4.43 1.75 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.59 0.68 0.00 0.00 57 K 8.72 4.61 0.00 1.41 1.50 0.00 1.21 0.00 0.00 1.35 0.00 0.00 2.59 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.91 0.23 7.81 58 S 8.90 4.55 0.00 3.82 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 59 T 8.46 3.95 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 1.16 0.00 0.00 60 E 8.30 4.09 0.00 1.95 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 2.13 2.32 0.00 61 T 7.80 4.34 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 1.26 0.00 0.00 62 G 8.10 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 63 Q 7.51 4.43 0.00 1.93 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.72 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 64 Y 8.79 4.74 0.00 2.94 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 65 L 9.10 4.50 0.00 1.60 1.50 0.80 0.36 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 66 A 8.66 5.13 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.76 5.33 0.00 2.21 2.26 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.66 0.00 68 D 9.56 5.25 0.00 2.98 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 69 T 8.51 4.22 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 1.34 0.00 0.00 70 D 8.42 4.64 0.00 2.80 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 71 G 8.50 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 0.00 0.00 0.00 72 L 7.87 4.73 0.00 2.10 1.60 0.81 0.62 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 73 L 8.33 5.01 0.00 1.56 1.61 0.89 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 74 Y 8.86 4.89 0.00 3.10 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 75 G 9.04 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 0.00 0.00 0.00 0.00 76 S 9.04 5.08 0.00 3.68 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 77 Q 9.03 4.19 0.00 2.15 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.57 0.00 0.00 0.00 0.00 0.00 2.44 2.34 0.00 78 T 7.56 4.63 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 1.23 0.00 0.00 79 P 0.00 3.96 0.00 0.78 0.49 0.00 3.46 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.28 0.00 80 N 7.96 5.17 0.00 2.91 2.93 0.00 0.00 5.91 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 81 E 8.74 3.87 0.00 2.11 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 2.36 2.32 0.00 82 E 8.91 4.10 0.00 2.20 2.28 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 2.38 2.46 0.00 83 C 7.85 5.07 0.00 3.25 3.26 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 84 L 7.03 4.28 0.00 1.45 1.28 0.77 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 85 F 8.88 5.16 0.00 3.13 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 86 L 9.22 4.86 0.00 1.52 1.59 0.87 1.00 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 87 E 8.79 4.51 0.00 2.13 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 2.18 1.90 0.00 88 R 8.50 4.82 0.00 1.77 1.80 0.00 3.05 0.00 0.00 2.87 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.61 0.00 89 L 8.76 4.68 0.00 1.58 1.68 1.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 90 E 9.18 4.69 0.00 2.21 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 2.31 2.44 0.00 91 E 9.79 4.02 0.00 2.34 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 0.00 2.29 2.40 0.00 92 N 8.42 4.30 0.00 2.85 2.89 0.00 0.00 6.87 8.16 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 93 H 8.41 4.81 0.00 2.88 3.04 0.00 5.94 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 7.78 4.70 0.00 3.00 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 95 N 9.65 5.55 0.00 3.00 2.52 0.00 0.00 6.96 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 96 T 8.92 5.26 4.57 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 1.36 0.00 0.00 97 Y 8.62 5.03 0.00 2.79 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 98 I 8.55 4.57 1.65 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.47 0.65 0.00 0.00 99 S 8.80 3.96 0.00 4.10 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 0.00 100 K 8.79 3.97 0.00 1.66 1.65 0.00 1.68 0.00 0.00 1.45 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.30 7.81 101 K 7.93 3.84 0.00 1.79 1.64 0.00 1.73 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.02 1.38 7.81 102 H 8.17 4.85 0.00 3.22 2.60 0.00 5.69 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 7.71 4.02 1.40 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 0.00 0.00 0.00 104 E 8.10 3.90 0.00 1.90 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 2.18 2.14 0.00 105 K 7.54 4.12 0.00 0.79 1.02 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.48 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.98 0.85 7.81 106 N 7.54 3.97 0.00 3.02 3.05 0.00 0.00 6.90 7.83 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 0.00 107 W 7.72 5.08 0.00 3.29 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 0.00 108 F 9.19 5.44 0.00 2.84 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 0.00 109 V 8.98 3.92 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 0.65 0.00 0.00 0.46 0.00 0.00 110 G 8.59 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 0.00 0.00 0.00 0.00 111 L 8.31 5.28 0.00 1.40 1.47 1.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 112 K 9.00 4.24 0.00 1.97 1.68 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.35 7.81 113 K 8.45 3.89 0.00 1.70 1.85 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.13 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.37 7.81 114 N 8.03 4.55 0.00 2.78 2.89 0.00 0.00 6.27 7.00 0.00 0.00 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 G 8.23 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 0.00 116 S 8.50 4.55 0.00 3.94 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 0.00 117 C 8.30 4.74 0.00 3.00 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 0.00 118 K 9.15 4.35 0.00 1.64 1.73 0.00 1.61 0.00 0.00 1.63 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.36 7.81 119 R 8.32 4.31 0.00 1.64 1.60 0.00 3.05 0.00 0.00 3.27 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 120 G 8.83 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 0.00 0.00 0.00 121 P 0.00 4.42 0.00 1.95 2.21 0.00 3.12 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.66 0.00 122 R 7.83 4.46 0.00 1.84 1.92 0.00 3.30 0.00 0.00 3.26 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.65 0.00 123 T 7.44 5.10 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 1.38 0.00 0.00 124 H 7.88 4.75 0.00 3.45 3.53 0.00 5.67 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 8.77 3.96 0.00 3.16 2.94 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 0.00 126 G 9.08 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 0.00 0.00 0.00 127 Q 7.39 4.28 0.00 1.83 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 6.69 0.00 0.00 0.00 0.00 0.00 2.16 2.03 0.00 128 K 8.21 3.91 0.00 1.63 1.65 0.00 1.56 0.00 0.00 1.69 0.00 0.00 2.84 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 1.28 7.81 129 A 7.74 3.94 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 0.00 130 I 7.15 4.42 1.66 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.84 0.50 0.00 0.00 131 L 7.18 4.30 0.00 1.02 0.44 0.57 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 132 F 9.38 5.46 0.00 3.40 3.13 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 0.00 133 L 9.30 5.35 0.00 1.89 1.68 1.02 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 5.10 0.00 2.17 2.24 0.00 3.84 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 2.06 2.10 0.00 135 L 9.23 4.99 0.00 1.68 1.64 0.96 0.82 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 0.00 136 P 0.00 4.65 0.00 2.06 2.06 0.00 3.77 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 1.98 2.00 0.00 137 V 8.16 3.77 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 0.61 0.00 0.00 0.91 0.00 0.00