NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 K 4.2772 8.3149 120.1305 55.8967 33.8968 175.0342 4 I 4.0357 7.5873 120.2353 60.4893 38.2543 173.8930 5 I 4.0670 9.7105 129.3250 60.6383 38.8744 174.5747 6 H 5.1411 8.6815 125.6145 54.6213 28.7956 175.3714 7 L 4.6022 8.6029 124.2894 54.4002 42.9784 176.4659 8 T 4.8956 8.4780 108.7316 59.2380 72.4180 174.6103 9 D 4.4124 9.2126 122.6366 58.1193 40.6146 179.2734 10 D 4.5386 8.1581 116.9427 56.2225 41.2271 177.7002 11 S 4.5804 7.8262 113.6982 58.9399 63.8109 175.8111 12 F 3.8045 8.1102 125.2341 61.5233 38.9677 176.3737 13 D 4.4464 8.3995 116.9635 57.9239 40.8021 178.3303 14 T 4.0108 7.7483 107.8999 64.5812 69.2043 175.9928 15 D 4.3703 8.0999 121.1545 56.4179 40.9943 177.3023 16 V 3.6972 7.5215 117.3963 64.4544 32.5274 177.8382 17 L 3.9414 7.3042 117.9324 57.0677 41.8661 178.7758 18 K 4.3487 7.7731 115.0480 55.8854 32.3810 176.2449 19 A 4.2643 7.5404 125.3546 52.3315 19.2281 177.3243 20 D 4.8521 8.3653 117.8576 52.4579 42.2534 177.3860 21 G 3.9986 8.1327 107.6647 44.5326 0.0000 172.9020 22 A 4.5268 8.1216 120.0236 51.7884 19.8636 176.7108 23 I 4.9152 8.6871 121.9379 59.4229 41.2169 174.1355 24 L 4.9046 9.3622 130.1057 53.6934 43.6900 174.9862 25 V 4.6569 9.1453 127.2886 61.2280 34.0446 173.7272 26 D 5.2970 8.8514 128.2272 52.6474 42.9797 175.0063 27 F 5.0978 9.2623 127.0289 56.6867 40.1508 175.2294 28 W 5.6049 8.9877 120.1555 54.8215 32.4338 173.6739 29 A 4.2012 8.0860 120.0225 49.6420 21.3426 177.0878 30 E 4.1415 8.4580 121.4303 58.6392 29.9605 177.6902 31 W 4.6184 7.2411 113.2571 56.7005 29.0883 175.6272 32 C 4.7232 7.5849 120.7832 58.0504 32.5684 173.8251 33 G 3.6155 8.7062 115.1745 47.7089 0.0000 173.5993 34 P 4.2816 0.0000 0.0000 65.3089 31.4208 178.4457 35 C 4.1169 8.0126 114.8719 62.8282 27.9528 175.9883 36 K 3.9397 7.7600 119.4005 59.4506 31.7339 178.6033 37 M 4.1608 7.6170 118.5634 58.3458 32.2957 178.1537 38 I 3.8586 7.8486 117.6290 62.6205 38.2787 177.2893 39 A 3.7644 7.6023 121.9640 55.1044 17.9865 177.6017 40 P 4.2739 0.0000 0.0000 65.8894 31.4385 178.7477 41 I 3.6858 7.6876 117.9016 64.5204 36.9503 178.2862 42 L 3.9657 8.0272 119.7024 57.8239 41.2394 179.2756 43 D 4.3017 7.9355 118.4914 57.4601 40.6549 178.7628 44 E 4.0118 7.9798 119.2241 59.1830 29.3756 179.4552 45 I 3.7515 7.9018 119.7060 64.2812 36.9799 177.9173 46 A 4.0201 7.9037 120.5196 55.6761 17.9161 179.2299 47 D 4.5935 7.8601 116.9903 57.6031 40.7080 178.9040 48 E 4.0674 8.3488 118.1645 59.1110 29.7181 177.9988 49 Y 4.4205 8.7877 115.9156 56.9495 38.7491 175.4052 50 Q 4.2268 7.0863 118.2691 57.6731 29.2907 178.5652 51 G 4.0583 8.8241 108.2903 45.9175 0.0000 174.0939 52 K 4.4520 7.7529 118.1155 56.2415 33.6817 175.1604 53 L 4.6950 7.4799 117.3368 54.8588 45.1494 173.7316 54 T 4.5916 8.4787 120.7056 61.7429 71.5618 173.1229 55 V 4.5769 8.3791 126.1982 61.3910 33.2527 174.2872 56 A 5.3134 9.3038 129.5907 50.1076 22.7316 174.7982 57 K 4.9674 9.1316 118.3183 54.5722 36.9849 175.4610 58 L 4.8797 8.8356 125.6481 53.0724 45.1837 174.9601 59 N 3.8304 8.6345 126.6686 52.7027 39.0538 175.4905 60 I 4.0351 8.0470 121.3213 63.1320 37.5184 177.3665 61 D 4.5535 8.1336 122.2186 56.9258 41.1158 177.5157 62 Q 4.1964 8.5145 117.4928 57.5990 29.3980 175.8834 63 N 5.4065 8.2385 114.9263 49.6445 38.9539 172.8323 64 P 4.6299 0.0000 0.0000 64.0405 32.4088 178.7954 65 G 3.7237 8.3335 108.0028 48.6914 0.0000 175.4395 66 T 3.8216 8.6321 116.8619 66.5514 68.9251 176.3184 67 A 3.7607 8.3898 123.8946 54.9684 18.5843 177.7133 68 P 4.2197 0.0000 0.0000 65.7472 31.4493 178.8449 69 K 3.8616 7.8697 116.1348 58.5599 31.9103 177.1787 70 Y 4.4571 7.9353 115.4488 56.7085 38.2491 175.6195 71 G 3.9527 8.0275 107.6035 46.1544 0.0000 174.7716 72 I 3.6967 7.9149 121.3654 62.1563 37.6416 177.2577 73 R 4.6762 8.3261 119.7434 55.4222 31.7571 173.2834 74 G 4.3254 7.5673 103.2049 45.5258 0.0000 172.6888 75 I 4.8165 7.9615 113.7085 57.7187 40.8558 173.3455 76 P 4.7638 0.0000 0.0000 63.3131 33.0355 174.9152 77 T 4.7673 8.6117 118.5762 61.9820 71.1497 173.2158 78 L 5.0997 9.1725 127.8755 53.3011 43.5795 175.2447 79 L 4.9078 9.1737 127.5598 53.0722 44.6066 174.5966 80 L 5.1131 8.6337 128.7988 53.6769 44.0092 174.7830 81 F 5.3028 9.4471 127.9903 56.3453 41.8365 175.6604 82 K 4.7140 9.4187 126.3038 53.3448 35.0165 174.5274 83 N 4.3527 10.0420 125.9242 53.4861 36.0527 175.4283 84 G 4.4655 9.1166 104.9677 44.6813 0.0000 172.7619 85 E 4.9663 8.0542 117.6735 54.1751 33.6675 174.7925 86 V 3.5870 8.3197 120.3086 62.9206 32.0165 175.2533 87 A 4.5021 9.1120 129.5361 53.6245 19.9967 176.7453 88 A 4.8277 7.5971 114.6681 50.9611 23.3727 174.8522 89 T 5.2126 8.4244 112.5974 60.7185 70.7961 172.9513 90 K 4.4772 9.0344 128.8326 54.5863 35.8278 174.7328 91 V 4.6558 8.2366 126.3229 61.9389 33.8094 174.3563 92 G 3.9478 8.6779 113.4714 44.2155 0.0000 174.6620 93 A 4.2926 8.0801 123.4666 50.4849 16.8425 177.5029 94 L 4.2245 7.5606 121.3221 54.0533 42.8797 178.0409 95 S 4.5434 8.5639 116.7408 57.1575 65.6657 175.3637 96 K 3.9657 8.5234 122.3331 59.5767 31.8405 178.6790 97 G 3.6505 8.0645 105.3385 48.1885 0.0000 175.5268 98 Q 4.2259 8.1686 120.9929 58.2208 28.5511 178.8312 99 L 3.9667 8.2006 121.8394 58.1502 42.1397 178.9134 100 K 3.9798 8.6661 118.7800 59.7177 31.9906 179.1133 101 E 4.0012 8.3017 118.6506 59.3550 29.3220 179.0796 102 F 4.2658 8.1919 120.6745 61.8042 39.3345 176.7087 103 L 3.7980 8.4804 119.1757 56.9578 41.1350 178.7746 104 D 4.7518 8.5641 119.8142 58.0107 41.1733 179.3083 105 A 4.0911 7.9615 119.3028 54.9160 18.3922 178.6812 106 N 4.4389 7.4168 113.3276 54.9980 39.1465 175.8923 107 L 4.2541 8.5376 125.4701 54.9938 41.8587 176.7141 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 K 8.31 4.28 0.00 1.75 1.89 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.46 7.81 4 I 7.59 4.04 1.74 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.40 0.72 0.00 0.00 5 I 9.71 4.07 1.78 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.67 0.85 0.00 0.00 6 H 8.68 5.14 0.00 3.08 3.33 0.00 5.69 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 L 8.60 4.60 0.00 1.62 1.72 0.81 0.50 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 8 T 8.48 4.90 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 9 D 9.21 4.41 0.00 2.72 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 D 8.16 4.54 0.00 2.67 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 11 S 7.83 4.58 0.00 4.18 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 12 F 8.11 3.80 0.00 3.29 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 13 D 8.40 4.45 0.00 2.85 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 14 T 7.75 4.01 4.22 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 1.21 0.00 0.00 15 D 8.10 4.37 0.00 2.59 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 16 V 7.52 3.70 0.86 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 -0.25 0.00 0.00 -0.17 0.00 0.00 17 L 7.30 3.94 0.00 1.95 1.76 1.15 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 18 K 7.77 4.35 0.00 1.89 1.80 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.40 1.59 7.81 19 A 7.54 4.26 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 20 D 8.37 4.85 0.00 2.68 2.43 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 21 G 8.13 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 A 8.12 4.53 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 I 8.69 4.92 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.82 0.80 0.00 0.00 24 L 9.36 4.90 0.00 1.72 1.52 1.09 0.90 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 25 V 9.15 4.66 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.88 0.00 0.00 26 D 8.85 5.30 0.00 2.80 2.49 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 27 F 9.26 5.10 0.00 3.16 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 28 W 8.99 5.60 0.00 3.39 3.06 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 0.00 0.00 0.00 0.00 29 A 8.09 4.20 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 E 8.46 4.14 0.00 1.91 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 2.39 2.48 0.00 31 W 7.24 4.62 0.00 3.58 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 32 C 7.58 4.72 0.00 2.64 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 33 G 8.71 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 0.00 0.00 0.00 34 P 0.00 4.28 0.00 2.18 2.13 0.00 3.64 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.21 0.00 35 C 8.01 4.12 0.00 3.19 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 36 K 7.76 3.94 0.00 1.90 2.04 0.00 1.83 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.47 7.81 37 M 7.62 4.16 0.00 2.04 2.26 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 2.75 2.53 0.00 38 I 7.85 3.86 1.83 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.36 0.84 0.00 0.00 39 A 7.60 3.76 1.16 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 0.00 0.00 40 P 0.00 4.27 0.00 2.12 2.08 0.00 3.65 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.12 0.00 41 I 7.69 3.69 2.01 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.92 0.91 0.00 0.00 42 L 8.03 3.97 0.00 1.74 1.61 0.79 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 43 D 7.94 4.30 0.00 2.85 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 44 E 7.98 4.01 0.00 2.12 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 2.32 2.49 0.00 45 I 7.90 3.75 1.94 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.87 0.63 0.00 0.00 46 A 7.90 4.02 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 47 D 7.86 4.59 0.00 2.68 2.73 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 48 E 8.35 4.07 0.00 2.32 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 0.00 2.36 2.44 0.00 49 Y 8.79 4.42 0.00 3.08 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 50 Q 7.09 4.23 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.93 0.00 0.00 0.00 0.00 0.00 2.42 2.61 0.00 51 G 8.82 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 7.75 4.45 0.00 1.70 1.96 0.00 1.78 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.35 7.81 53 L 7.48 4.70 0.00 1.72 1.59 0.94 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.48 4.59 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 1.16 0.00 0.00 55 V 8.38 4.58 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 0.90 0.00 0.00 0.87 0.00 0.00 56 A 9.30 5.31 1.10 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 57 K 9.13 4.97 0.00 1.74 1.87 0.00 1.38 0.00 0.00 1.43 0.00 0.00 2.13 0.00 0.00 2.39 0.00 0.00 0.00 0.00 1.22 1.26 7.81 58 L 8.84 4.88 0.00 1.61 1.06 0.99 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 59 N 8.63 3.83 0.00 1.96 2.43 0.00 0.00 6.90 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 60 I 8.05 4.04 1.91 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.13 1.10 0.00 0.00 61 D 8.13 4.55 0.00 2.78 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 62 Q 8.51 4.20 0.00 1.92 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 7.08 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 63 N 8.24 5.41 0.00 2.78 3.02 0.00 0.00 6.81 7.44 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 64 P 0.00 4.63 0.00 2.18 2.18 0.00 3.91 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 65 G 8.33 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 66 T 8.63 3.82 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 0.45 0.00 0.00 67 A 8.39 3.76 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 68 P 0.00 4.22 0.00 2.15 2.10 0.00 3.72 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.12 0.00 69 K 7.87 3.86 0.00 1.50 1.47 0.00 1.54 0.00 0.00 1.58 0.00 0.00 2.94 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.35 1.45 7.81 70 Y 7.94 4.46 0.00 2.85 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 G 8.03 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 0.00 0.00 0.00 72 I 7.91 3.70 1.79 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.59 0.91 0.00 0.00 73 R 8.33 4.68 0.00 1.77 1.75 0.00 3.30 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.16 0.00 74 G 7.57 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 I 7.96 4.82 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.78 0.99 0.00 0.00 76 P 0.00 4.76 0.00 2.24 2.25 0.00 3.65 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.99 0.00 77 T 8.61 4.77 4.36 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 1.19 0.00 0.00 78 L 9.17 5.10 0.00 1.55 1.64 0.81 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 79 L 9.17 4.91 0.00 2.03 1.72 0.85 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 0.00 0.00 0.00 0.00 80 L 8.63 5.11 0.00 1.83 1.46 0.70 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 81 F 9.45 5.30 0.00 2.99 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 82 K 9.42 4.71 0.00 1.35 1.64 0.00 1.95 0.00 0.00 1.65 0.00 0.00 2.77 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.25 1.25 7.81 83 N 10.04 4.35 0.00 2.81 2.89 0.00 0.00 7.45 7.65 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 84 G 9.12 4.47 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 0.00 0.00 0.00 85 E 8.05 4.97 0.00 2.03 1.87 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 2.35 2.32 0.00 86 V 8.32 3.59 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 0.57 0.00 0.00 0.30 0.00 0.00 87 A 9.11 4.50 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 88 A 7.60 4.83 1.22 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 0.00 0.00 89 T 8.42 5.21 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 90 K 9.03 4.48 0.00 0.79 1.04 0.00 1.33 0.00 0.00 1.13 0.00 0.00 2.74 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.67 1.10 7.81 91 V 8.24 4.66 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 0.94 0.00 0.00 0.90 0.00 0.00 92 G 8.68 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 0.00 0.00 0.00 93 A 8.08 4.29 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 L 7.56 4.22 0.00 1.58 1.57 0.66 0.87 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 95 S 8.56 4.54 0.00 4.06 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 96 K 8.52 3.97 0.00 1.84 1.86 0.00 1.74 0.00 0.00 1.86 0.00 0.00 3.08 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.54 1.54 7.81 97 G 8.06 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 Q 8.17 4.23 0.00 2.31 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.77 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 99 L 8.20 3.97 0.00 1.99 1.64 0.88 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 100 K 8.67 3.98 0.00 2.02 2.00 0.00 1.79 0.00 0.00 1.72 0.00 0.00 3.24 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.67 1.82 7.81 101 E 8.30 4.00 0.00 2.29 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 0.00 2.37 2.59 0.00 102 F 8.19 4.27 0.00 3.19 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 0.00 103 L 8.48 3.80 0.00 1.74 1.44 0.14 0.86 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 0.00 104 D 8.56 4.75 0.00 2.67 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 0.00 105 A 7.96 4.09 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 0.00 106 N 7.42 4.44 0.00 2.43 2.56 0.00 0.00 7.05 9.20 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 0.00 107 L 8.54 4.25 0.00 1.62 1.60 0.94 0.83 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