NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.3622 8.3344 115.4124 57.7700 64.3148 172.8919 3 D 4.2560 8.4569 121.8451 51.8725 41.1430 173.7159 4 P 4.5742 0.0000 0.0000 63.3395 32.8029 175.0937 5 I 4.4974 7.7951 120.3484 59.6248 39.5740 175.3009 6 V 3.8790 8.7693 127.3386 62.6980 32.6907 174.5187 7 H 5.0990 8.8524 125.9479 54.4262 29.2152 173.6223 8 F 4.6400 9.0183 126.6531 56.8128 40.4827 174.8792 9 N 4.7837 8.6482 122.2581 49.8414 41.7214 174.5818 10 G 3.8458 8.0675 111.0498 44.5492 0.0000 172.1921 11 T 4.3532 7.7119 110.5166 61.0175 71.0510 174.7278 12 H 4.1923 8.8682 120.2184 59.7235 29.7291 176.5905 13 E 3.8965 8.3059 120.1325 59.2915 29.5272 178.4811 14 A 4.0954 8.3388 120.8871 54.8238 18.3326 179.4661 15 L 3.0162 8.2086 119.0649 57.9994 42.1628 179.0922 16 L 3.8790 7.8046 118.9076 57.8261 41.3398 178.9151 17 N 4.2498 7.9882 115.6519 56.8482 39.1135 176.5127 18 R 4.0374 8.0797 119.9110 59.4259 30.1605 178.4713 19 I 3.6399 7.9574 120.0166 64.3562 36.9055 178.4536 20 K 4.1276 7.8982 117.5919 58.6689 31.9207 178.6225 21 E 4.1371 7.7408 117.4026 57.1458 29.9525 177.0760 22 A 4.1640 7.1479 122.3731 51.4017 18.9216 175.9599 23 P 4.5635 0.0000 0.0000 64.9101 32.9274 176.9639 24 G 3.7770 7.3035 110.8380 44.1156 0.0000 173.2380 25 L 4.2475 8.6793 126.5278 55.2635 43.3843 175.7491 26 V 4.6707 8.8427 125.0984 60.8792 35.0370 173.6745 27 L 4.4253 8.3078 129.9259 53.1840 44.0611 174.8666 28 V 4.3826 8.4396 127.5010 61.4359 33.5027 173.9769 29 D 5.1824 8.8960 128.1683 52.5083 43.3033 174.3953 30 F 5.1555 9.3149 126.8477 56.8097 40.3818 175.3257 31 F 5.3867 8.9462 117.7521 55.3730 42.3309 172.9924 32 A 4.5161 7.9964 119.0789 49.9141 21.7223 177.5842 33 T 3.9881 8.4930 110.7789 63.8739 69.1472 175.4203 34 W 4.4837 7.3874 117.1497 57.1358 29.0912 175.8766 35 C 4.6523 7.4886 120.9396 58.1426 31.9659 173.2446 36 G 3.8488 8.9127 115.4503 47.7602 0.0000 172.9232 37 P 4.3060 0.0000 0.0000 65.3642 31.3166 178.4873 38 C 4.1686 8.0403 114.7787 62.8787 27.6074 176.1101 39 Q 3.9391 8.1444 119.6334 59.0334 28.3991 178.9388 40 R 3.9696 8.0676 119.1052 59.0282 30.0538 178.9303 41 L 4.1263 8.0831 120.2886 58.1798 41.9369 179.1963 42 G 3.5342 8.0105 104.6310 47.8066 0.0000 175.0181 43 Q 4.0345 7.8454 121.0212 58.7083 29.5208 177.4494 44 I 4.0374 7.3429 117.2123 62.1714 38.2285 177.2467 45 L 3.7921 7.7187 121.6892 57.7129 41.8489 176.8798 46 P 4.0560 0.0000 0.0000 65.6689 31.2316 178.3778 47 S 4.0276 7.8853 111.2024 61.4919 62.1274 176.1347 48 I 3.6400 7.2477 120.6454 64.1988 37.1446 178.0382 49 A 3.4581 7.7551 122.0304 54.7227 17.9143 179.1605 50 E 3.8223 8.2409 117.0687 59.4071 29.7892 178.5373 51 A 4.2939 7.8247 118.5993 53.0507 20.2686 177.1505 52 N 5.1177 7.8270 114.5105 51.2592 38.9327 175.4327 53 K 4.1238 8.0512 118.6433 59.4845 33.3991 178.8685 54 D 4.5052 8.1610 117.4212 54.5658 39.8361 175.8098 55 V 4.4777 7.6599 120.5898 61.6378 33.4093 174.8645 56 T 4.5591 8.6144 124.5118 62.1372 70.5293 173.4846 57 F 4.9280 8.9351 125.2596 55.8381 41.5415 174.5692 58 I 4.8053 8.7534 125.9182 59.4646 39.4547 174.9415 59 K 4.8526 9.0929 127.8036 55.1573 34.3133 176.2666 60 V 4.5521 8.9110 124.0893 60.9199 34.5218 173.8918 61 D 3.7482 8.5591 128.9773 53.8399 41.7454 177.3239 62 V 3.7848 8.5543 120.2740 64.1392 32.1333 178.5393 63 D 4.5231 8.5401 120.6867 56.3810 40.8846 177.5106 64 K 4.2957 8.0241 115.9655 57.5803 34.1504 176.0765 65 N 5.1575 8.0776 117.2995 51.9302 39.2993 175.9877 66 G 3.6707 8.0302 107.5997 47.7027 0.0000 174.0101 67 N 4.3592 8.2409 118.1445 56.0916 38.1434 177.1340 68 A 4.1548 8.1242 121.3244 55.2534 18.6473 179.3396 69 A 3.5620 8.1424 119.3197 55.3278 18.4227 179.5908 70 D 4.2734 8.6237 117.6083 57.4900 40.6868 178.8803 71 A 3.9547 7.7932 119.9168 54.7413 18.3549 178.2449 72 Y 4.0739 7.3820 112.2335 57.1733 38.1326 175.9895 73 G 3.8257 7.7660 107.9149 46.2299 0.0000 174.0987 74 V 3.7239 7.5025 119.9811 62.4429 31.0514 174.1111 75 S 4.6100 7.9727 120.3041 59.7774 65.5858 174.2032 76 S 4.4187 7.8146 119.8249 57.4039 63.6060 173.8031 77 I 4.8432 7.8822 115.9600 57.9715 40.7053 173.2036 78 P 4.6816 0.0000 0.0000 63.0144 32.7874 174.8192 79 A 4.8818 9.0509 124.3176 50.4307 21.2588 175.2140 80 L 4.8096 8.0928 123.0746 53.3755 44.2090 176.0929 81 F 5.1169 8.7754 121.4158 55.7814 42.8410 173.8664 82 F 4.9267 9.4057 124.2100 56.8096 40.1116 175.6670 83 V 5.0569 9.0015 116.5433 59.8432 36.7245 174.3324 84 K 4.7630 8.7917 122.4010 54.7236 35.9999 175.0103 85 K 4.5638 8.6613 128.6147 56.4506 32.8417 175.9159 86 E 4.5040 9.1406 126.9620 55.3974 32.7855 175.3724 87 G 4.0971 8.4739 115.0023 47.1872 0.0000 173.1549 88 N 4.9028 8.7875 120.8890 52.7656 38.9608 173.9740 89 E 4.7357 7.7622 116.9529 54.5285 33.0619 174.6772 90 I 4.7096 8.0921 121.2399 59.8195 38.7109 175.1578 91 K 4.3780 9.1278 129.5869 55.6236 33.8378 175.3046 92 T 4.7236 8.4563 124.0617 62.9192 68.8189 174.4143 93 L 4.3144 9.0705 127.2500 56.4224 43.0005 176.5534 94 D 5.0567 7.9553 115.9338 53.4087 44.7241 174.1815 95 Q 5.0200 8.6750 120.9152 55.0569 31.8086 173.3130 96 F 4.8546 7.9517 115.5189 56.5614 41.8257 172.7515 97 V 4.7359 8.6960 111.5251 60.5871 34.7281 176.2151 98 G 3.9913 9.0865 110.1306 45.1420 0.0000 174.3709 99 A 4.4058 8.1239 123.4392 51.0611 17.3959 179.6554 100 D 4.6771 7.6875 123.0792 52.2157 39.9611 175.6104 101 V 3.7090 7.8503 123.7256 65.5490 31.9241 177.1240 102 S 4.0955 8.0349 114.5003 61.6788 62.6472 176.5539 103 R 3.7457 8.0808 120.8918 59.0995 29.7074 178.5736 104 I 4.2212 7.9707 119.8169 64.6521 37.3439 178.5907 105 K 4.0879 8.4407 119.2076 59.2754 31.8401 179.4050 106 A 3.8922 8.2296 121.3274 55.1848 18.2612 179.3208 107 D 3.4795 8.0283 117.5502 57.2287 40.6282 179.0592 108 I 3.7280 7.5563 120.1064 64.5746 36.9418 178.3658 109 E 3.9225 7.6743 117.4383 59.0608 29.3300 179.0034 110 K 3.8518 7.8102 118.9165 59.7173 32.3150 178.7007 111 F 4.6329 7.7853 116.7750 60.1390 38.8748 175.6630 112 K 4.0576 7.7661 121.8297 57.2428 34.0103 174.4298 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 2 S 8.33 4.36 0.00 4.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 D 8.46 4.26 0.00 2.76 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 4 P 0.00 4.57 0.00 2.15 2.11 0.00 3.74 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 1.89 1.92 0.00 5 I 7.80 4.50 1.81 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.81 0.75 0.00 0.00 6 V 8.77 3.88 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.95 0.00 0.00 7 H 8.85 5.10 0.00 3.10 3.30 0.00 5.74 0.00 0.00 0.00 0.00 6.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 F 9.02 4.64 0.00 3.02 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 9 N 8.65 4.78 0.00 2.43 2.46 0.00 0.00 6.93 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 10 G 8.07 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 0.00 0.00 0.00 11 T 7.71 4.35 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 1.26 0.00 0.00 12 H 8.87 4.19 0.00 3.28 3.42 0.00 5.68 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.31 3.90 0.00 2.10 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 2.40 2.39 0.00 14 A 8.34 4.10 1.61 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 0.00 0.00 15 L 8.21 3.02 0.00 1.66 1.56 0.58 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 16 L 7.80 3.88 0.00 1.80 1.64 0.81 0.35 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 17 N 7.99 4.25 0.00 2.89 3.00 0.00 0.00 7.24 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 18 R 8.08 4.04 0.00 2.17 1.94 0.00 3.39 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.69 0.00 19 I 7.96 3.64 1.95 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.39 0.86 0.00 0.00 20 K 7.90 4.13 0.00 1.90 1.85 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.58 7.81 21 E 7.74 4.14 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.52 0.00 22 A 7.15 4.16 1.23 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 0.00 0.00 0.00 23 P 0.00 4.56 0.00 2.20 2.19 0.00 3.77 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 24 G 7.30 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 25 L 8.68 4.25 0.00 1.84 1.59 1.06 0.99 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 26 V 8.84 4.67 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 0.86 0.00 0.00 0.90 0.00 0.00 27 L 8.31 4.43 0.00 0.98 0.85 -0.21 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 28 V 8.44 4.38 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 0.15 0.00 0.00 0.73 0.00 0.00 29 D 8.90 5.18 0.00 2.69 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 30 F 9.31 5.16 0.00 3.09 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 31 F 8.95 5.39 0.00 2.98 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 32 A 8.00 4.52 -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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 T 8.49 3.99 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 34 W 7.39 4.48 0.00 3.51 3.25 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 35 C 7.49 4.65 0.00 2.39 2.53 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 36 G 8.91 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 0.00 0.00 0.00 37 P 0.00 4.31 0.00 2.19 2.16 0.00 3.65 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.23 0.00 38 C 8.04 4.17 0.00 3.19 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 39 Q 8.14 3.94 0.00 2.29 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.55 0.00 40 R 8.07 3.97 0.00 2.01 1.98 0.00 3.14 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.76 0.00 41 L 8.08 4.13 0.00 1.78 1.79 0.95 0.88 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 42 G 8.01 3.53 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 0.00 43 Q 7.85 4.03 0.00 2.13 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.82 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 44 I 7.34 4.04 1.85 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.49 0.95 0.00 0.00 45 L 7.72 3.79 0.00 1.90 1.50 0.93 0.95 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 46 P 0.00 4.06 0.00 2.11 2.01 0.00 3.66 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 2.04 2.05 0.00 47 S 7.89 4.03 0.00 3.83 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 48 I 7.25 3.64 1.75 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.76 0.98 0.00 0.00 49 A 7.76 3.46 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 E 8.24 3.82 0.00 2.01 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 51 A 7.82 4.29 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 N 7.83 5.12 0.00 3.16 2.94 0.00 0.00 6.58 7.45 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 53 K 8.05 4.12 0.00 1.90 1.99 0.00 1.62 0.00 0.00 1.78 0.00 0.00 2.99 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.44 1.40 7.81 54 D 8.16 4.51 0.00 2.82 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 55 V 7.66 4.48 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 0.23 0.00 0.00 1.02 0.00 0.00 56 T 8.61 4.56 4.15 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 1.18 0.00 0.00 57 F 8.94 4.93 0.00 2.93 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 58 I 8.75 4.81 1.66 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.61 0.75 0.00 0.00 59 K 9.09 4.85 0.00 1.66 1.72 0.00 1.39 0.00 0.00 1.36 0.00 0.00 2.13 0.00 0.00 2.50 0.00 0.00 0.00 0.00 1.22 1.26 7.81 60 V 8.91 4.55 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 1.02 0.00 0.00 0.44 0.00 0.00 61 D 8.56 3.75 0.00 2.46 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 62 V 8.55 3.78 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.94 0.00 0.00 63 D 8.54 4.52 0.00 2.83 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.02 4.30 0.00 1.83 1.91 0.00 1.55 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.40 7.81 65 N 8.08 5.16 0.00 2.96 2.90 0.00 0.00 6.71 7.67 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 66 G 8.03 3.67 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 0.00 0.00 0.00 67 N 8.24 4.36 0.00 2.88 2.93 0.00 0.00 7.03 8.09 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 68 A 8.12 4.15 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 0.00 0.00 0.00 0.00 0.00 69 A 8.14 3.56 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 70 D 8.62 4.27 0.00 2.84 2.72 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 71 A 7.79 3.95 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 Y 7.38 4.07 0.00 2.42 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 73 G 7.77 3.83 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 0.00 0.00 0.00 74 V 7.50 3.72 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 0.80 0.00 0.00 0.43 0.00 0.00 75 S 7.97 4.61 0.00 4.00 3.83 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 76 S 7.81 4.42 0.00 3.92 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 I 7.88 4.84 1.84 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.60 0.96 0.00 0.00 78 P 0.00 4.68 0.00 2.15 2.25 0.00 3.68 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.00 0.00 79 A 9.05 4.88 1.36 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 0.00 0.00 80 L 8.09 4.81 0.00 0.27 0.79 0.78 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 81 F 8.78 5.12 0.00 2.97 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 82 F 9.41 4.93 0.00 3.25 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 83 V 9.00 5.06 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 0.82 0.00 0.00 0.90 0.00 0.00 84 K 8.79 4.76 0.00 1.70 1.51 0.00 1.59 0.00 0.00 1.54 0.00 0.00 2.79 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.31 1.36 7.81 85 K 8.66 4.56 0.00 1.79 1.68 0.00 1.76 0.00 0.00 1.78 0.00 0.00 2.73 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.49 1.45 7.81 86 E 9.14 4.50 0.00 1.97 1.80 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 2.19 2.19 0.00 87 G 8.47 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 88 N 8.79 4.90 0.00 2.70 2.81 0.00 0.00 6.53 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 89 E 7.76 4.74 0.00 2.09 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.22 0.00 90 I 8.09 4.71 1.84 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 1.20 0.51 0.90 0.00 0.00 91 K 9.13 4.38 0.00 1.80 1.74 0.00 1.49 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.34 1.41 7.81 92 T 8.46 4.72 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 1.40 0.00 0.00 93 L 9.07 4.31 0.00 0.98 0.37 0.79 0.52 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 94 D 7.96 5.06 0.00 3.19 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.67 5.02 0.00 1.63 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.51 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 96 F 7.95 4.85 0.00 3.08 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 V 8.70 4.74 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 0.74 0.00 0.00 0.98 0.00 0.00 98 G 9.09 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 99 A 8.12 4.41 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 D 7.69 4.68 0.00 2.76 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 V 7.85 3.71 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.97 0.00 0.00 102 S 8.03 4.10 0.00 3.87 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 0.00 103 R 8.08 3.75 0.00 1.88 1.48 0.00 2.21 0.00 0.00 2.82 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.35 0.00 104 I 7.97 4.22 2.25 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 1.99 1.15 1.25 0.00 0.00 105 K 8.44 4.09 0.00 1.95 1.87 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.64 7.81 106 A 8.23 3.89 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 D 8.03 3.48 0.00 2.43 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 0.00 108 I 7.56 3.73 2.11 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.81 1.05 0.00 0.00 109 E 7.67 3.92 0.00 2.02 1.93 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 2.33 2.42 0.00 110 K 7.81 3.85 0.00 1.38 1.08 0.00 1.12 0.00 0.00 1.53 0.00 0.00 2.71 0.00 0.00 2.56 0.00 0.00 0.00 0.00 1.10 1.25 7.81 111 F 7.79 4.63 0.00 2.99 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 0.00 112 K 7.77 4.06 0.00 1.71 1.68 0.00 1.78 0.00 0.00 1.78 0.00 0.00 3.03 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.27 1.27 7.81