NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.1421 8.0549 114.0573 61.5442 33.0453 174.2637 2 M 4.5969 8.0722 119.3871 51.6827 35.3018 174.8056 3 T 4.1864 9.3475 114.8082 62.9313 70.2447 176.1714 4 D 4.3039 7.9278 122.5954 57.3825 41.0602 176.6206 5 P 4.2681 0.0000 0.0000 65.3942 31.2862 178.8723 6 I 3.7097 7.6196 118.3352 64.2224 37.0568 178.0017 7 A 4.0046 8.4369 122.0431 55.1036 18.1656 179.3857 8 D 4.2642 8.2510 117.4401 57.8023 40.9962 178.6317 9 M 4.0031 8.0739 118.5178 58.7752 32.1359 178.2793 10 L 3.9983 8.0533 119.0459 57.9958 41.6877 179.6207 11 T 3.8304 8.3259 115.9519 66.4983 68.3082 176.6125 12 A 3.9917 8.0421 122.6735 55.2574 18.3899 179.7690 13 I 3.6328 7.8344 118.3622 64.3334 37.1445 178.4226 14 R 3.8586 8.1988 119.7282 59.6615 29.8080 178.0910 15 N 4.2920 8.5329 116.1419 56.5330 38.5427 177.3272 16 A 3.9963 8.2741 122.0843 55.0916 18.4774 179.2333 17 N 4.4309 8.4675 115.8161 56.9336 38.7902 176.9093 18 M 4.0986 7.8957 119.2414 58.5417 32.2028 178.3898 19 V 3.9944 7.1851 109.1853 60.1606 32.4467 176.4085 20 R 4.2463 7.5369 115.1940 56.4402 27.9166 176.5286 21 H 4.6518 8.3101 113.5693 55.9606 29.8663 176.3885 22 E 4.6181 8.8844 121.8199 59.0063 30.6987 176.1857 23 K 5.4908 8.0294 116.3743 57.0501 35.8204 174.4169 24 L 4.4882 7.7661 118.2025 55.2064 43.2719 173.4394 25 E 5.3416 8.6163 118.4999 54.7503 33.3387 175.6727 26 V 4.5523 8.4044 121.0162 59.3018 35.3366 172.3861 27 P 4.7128 0.0000 0.0000 63.3650 31.5812 176.1559 28 A 4.5294 8.9832 126.6408 52.2383 19.5708 176.6036 29 S 4.5236 8.1860 111.4702 56.1033 65.6759 176.4329 30 K 3.8539 8.6225 122.2439 59.8649 31.8837 178.8091 31 I 3.6350 7.7035 118.3263 64.0693 37.9153 177.8134 32 K 3.9292 8.0649 119.4422 59.2859 31.8294 179.3623 33 R 3.7256 7.9765 119.1451 59.2872 30.0963 178.4315 34 E 3.9378 8.2800 118.6383 59.4024 29.4123 179.4041 35 I 3.6482 8.0437 119.9730 64.2636 37.1280 178.3222 36 A 3.8016 7.8684 121.6032 55.0216 18.0067 179.5037 37 E 4.0220 7.9387 117.0396 59.5657 29.5249 179.7146 38 I 3.7061 7.5617 119.2110 64.4649 37.2509 178.3667 39 L 4.1861 8.0070 119.8474 57.7634 41.4203 179.7042 40 K 3.9990 8.3088 119.4620 59.6495 32.0475 178.9423 41 R 3.9881 8.2682 118.0401 59.0538 30.0001 177.2411 42 E 4.4517 8.4851 116.5318 55.5832 29.5846 176.8519 43 G 3.8205 7.6236 106.2225 46.3237 0.0000 175.3170 44 F 4.4066 8.6250 120.9440 58.8056 39.2544 175.5378 45 I 4.6625 7.4430 111.5990 58.9344 40.2294 175.9612 46 R 4.1316 8.9980 123.6768 59.1488 30.6839 175.2279 47 D 4.7436 8.0458 116.1546 54.7283 44.7750 173.6000 48 Y 5.6005 8.4031 116.8991 56.3183 40.8474 173.6923 49 E 4.7086 9.1871 117.2369 55.2071 33.5008 173.2662 50 Y 5.0299 8.6334 123.0636 57.0122 40.0870 174.2503 51 I 4.5201 8.2930 125.6453 59.2198 42.3485 173.2263 52 E 4.9498 8.4972 125.1693 54.4420 32.4717 175.0084 53 D 4.6084 8.9053 123.5969 53.2022 43.2996 175.1609 54 N 4.2847 9.5753 125.0461 54.5472 36.0641 175.0354 55 K 3.8767 8.2971 112.5664 56.9923 30.0564 175.2438 56 Q 4.4992 8.1374 121.8257 54.0743 30.3813 174.7799 57 G 4.1583 8.6136 113.0531 46.3112 0.0000 172.3181 58 I 5.1543 8.8097 125.4378 59.4044 41.9930 174.3204 59 L 5.1191 8.9723 125.9493 53.2321 43.9560 175.4218 60 R 4.5624 9.1626 126.0713 54.9487 31.6890 174.7813 61 I 4.7529 8.5307 128.5335 59.7953 39.4941 174.8318 62 F 5.2127 8.8561 126.4050 55.8064 40.2335 175.8502 63 L 4.5144 8.5954 124.4297 54.4870 42.3524 176.5984 64 K 4.6276 8.1212 120.9566 54.8896 35.5993 174.5349 65 Y 4.8789 8.4360 123.4690 56.0403 41.2317 176.2629 66 G 4.1440 8.9238 113.6994 44.3031 0.0000 169.9008 67 P 4.6353 0.0000 0.0000 62.2063 29.8056 174.7113 68 N 4.7957 8.5310 117.4307 52.8887 37.5638 175.1568 69 E 4.4976 7.4368 116.4046 55.0818 30.6982 175.9657 70 R 4.5186 8.4609 121.0430 56.3861 30.7222 177.3810 71 V 3.7760 7.8611 121.7332 64.8058 31.9031 176.1299 72 I 4.4817 7.6012 120.5230 60.3569 37.9915 175.3551 73 T 4.3342 8.4494 122.0181 65.3356 69.6215 175.1390 74 G 4.2431 7.3080 104.7889 45.3874 0.0000 172.5872 75 L 5.2612 8.3991 121.0933 52.6966 45.6834 175.8274 76 K 4.6223 8.9954 123.7076 54.7061 36.1490 174.6720 77 R 4.2028 8.6261 127.0626 56.5541 30.5184 174.2622 78 I 4.0422 8.6648 128.5003 62.7360 37.1117 175.9884 79 S 4.5456 7.7191 119.8123 58.7723 63.5592 173.9661 80 K 4.8069 8.8385 124.1443 54.6579 35.6111 173.4197 81 P 4.3020 0.0000 0.0000 64.5990 31.4155 177.3135 82 G 4.0145 10.2288 110.7446 45.7798 0.0000 173.8196 83 L 4.6400 7.9859 121.1051 54.1060 43.0798 174.4776 84 R 4.3302 7.7511 119.6109 55.8393 31.3368 176.9885 85 V 4.3202 8.8658 122.3839 61.4233 33.3709 173.1617 86 Y 5.3202 8.5965 128.4496 55.5645 41.4417 174.9765 87 V 4.4343 7.4267 124.2418 59.7093 34.8680 175.6255 88 K 4.3263 9.2433 124.0934 55.4266 32.7537 177.7720 89 A 4.1353 9.0563 122.9525 55.0131 18.0810 179.9296 90 H 4.3274 8.2359 108.9328 57.5535 28.8314 175.6855 91 E 4.3191 7.7169 117.0102 55.5248 29.9108 176.2037 92 V 3.5312 7.2237 120.4705 62.3035 31.8207 173.9316 93 P 4.1698 0.0000 0.0000 63.1800 31.3981 176.2598 94 R 4.1675 8.3090 122.1651 54.9097 29.0316 175.2004 95 V 3.9760 8.0277 124.3656 61.3691 31.9399 176.1542 96 L 4.0795 8.4713 127.5175 54.6178 42.1432 176.2434 97 N 4.5553 8.5362 120.5611 55.3305 39.0752 175.1689 98 G 4.0391 9.1684 114.2366 45.3997 0.0000 173.4863 99 L 4.4837 7.6405 118.2323 54.3250 42.1892 175.8617 100 G 3.8097 8.6060 104.3407 43.9467 0.0000 172.6745 101 I 4.5594 7.7362 118.1859 59.5588 41.8988 174.2837 102 A 4.9459 9.0827 128.1007 50.4178 21.5322 175.6891 103 I 4.8031 8.8833 122.7133 59.4845 40.0696 174.7732 104 L 5.2252 8.8792 126.9656 52.9485 45.2522 175.3449 105 S 5.0748 9.1653 117.9925 57.2004 64.1891 173.0913 106 T 5.0376 8.6348 117.1737 59.5989 72.1174 174.9628 107 S 4.1941 8.9290 114.9909 60.8492 63.1084 174.9198 108 Q 4.3780 8.1838 118.9375 55.5155 28.7988 175.7731 109 G 3.7628 8.0011 106.3621 43.9008 0.0000 172.2342 110 V 4.3840 7.5789 119.0482 62.5735 32.0027 176.4087 111 L 5.0895 8.7637 126.6540 53.4004 46.8243 175.6597 112 T 4.8026 8.9102 111.4642 60.7225 70.5553 175.4982 113 D 4.3197 8.6473 122.5619 56.8574 39.1048 178.9993 114 K 3.9834 7.9515 120.2770 59.2366 32.2039 178.5708 115 E 4.0122 8.0331 118.6430 59.0323 29.4171 179.0104 116 A 3.9695 8.2643 121.1850 55.1414 18.5419 179.9388 117 R 3.8681 8.0064 116.7901 59.4875 29.9943 179.3812 118 Q 4.0539 7.7940 115.7665 58.9260 28.6449 177.9670 119 K 4.2392 8.2843 118.5911 55.8010 32.8867 176.4873 120 G 3.7905 7.8940 106.5307 46.9138 0.0000 173.2292 121 T 4.6450 8.0646 111.8048 59.8903 71.0427 172.7027 122 G 4.3116 8.8506 114.0403 44.7440 0.0000 171.5953 123 G 3.8445 6.8837 105.0804 45.8990 0.0000 170.0743 124 E 4.8623 7.9112 120.7281 55.1857 31.3201 176.3766 125 I 4.6213 8.8302 129.1524 61.0084 37.5733 176.3166 126 I 4.1812 8.9792 122.0313 62.1563 39.4540 175.3196 127 A 5.0703 7.5699 122.3384 51.1759 22.7774 174.3247 128 Y 5.0257 8.9733 120.0271 55.8301 42.6202 174.3549 129 V 4.6732 8.0077 125.2319 60.9748 35.1393 175.0520 130 I 4.3049 8.3130 126.8111 61.3347 37.8768 174.4603 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 1 V 8.05 4.14 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 0.90 0.00 0.00 0.94 0.00 0.00 2 M 8.07 4.60 0.00 2.02 1.91 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.59 0.00 3 T 9.35 4.19 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 4 D 7.93 4.30 0.00 2.71 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 5 P 0.00 4.27 0.00 2.15 2.09 0.00 3.85 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 2.11 2.17 0.00 6 I 7.62 3.71 2.03 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 1.75 1.04 0.89 0.00 0.00 7 A 8.44 4.00 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 8 D 8.25 4.26 0.00 2.91 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 9 M 8.07 4.00 0.00 2.18 2.04 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.55 0.00 10 L 8.05 4.00 0.00 2.02 1.67 0.87 0.62 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 11 T 8.33 3.83 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 1.21 0.00 0.00 12 A 8.04 3.99 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 13 I 7.83 3.63 1.84 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 1.38 0.73 0.88 0.00 0.00 14 R 8.20 3.86 0.00 1.97 2.15 0.00 3.11 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 15 N 8.53 4.29 0.00 2.89 2.87 0.00 0.00 7.02 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 16 A 8.27 4.00 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 N 8.47 4.43 0.00 2.98 3.05 0.00 0.00 7.17 7.18 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 18 M 7.90 4.10 0.00 2.05 2.30 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.61 0.00 19 V 7.19 3.99 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 0.71 0.00 0.00 0.71 0.00 0.00 20 R 7.54 4.25 0.00 1.74 1.40 0.00 2.88 0.00 0.00 2.73 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.44 0.00 21 H 8.31 4.65 0.00 3.22 3.42 0.00 5.65 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 E 8.88 4.62 0.00 2.03 2.16 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 2.47 2.32 0.00 23 K 8.03 5.49 0.00 1.45 1.83 0.00 1.09 0.00 0.00 2.51 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.22 7.81 24 L 7.77 4.49 0.00 1.68 1.77 0.91 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 25 E 8.62 5.34 0.00 1.77 1.78 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 2.10 2.18 0.00 26 V 8.40 4.55 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 0.86 0.00 0.00 0.92 0.00 0.00 27 P 0.00 4.71 0.00 1.96 2.06 0.00 3.67 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 2.03 2.11 0.00 28 A 8.98 4.53 1.45 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 29 S 8.19 4.52 0.00 3.96 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 30 K 8.62 3.85 0.00 1.82 1.83 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.49 1.48 7.81 31 I 7.70 3.63 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.31 0.90 0.00 0.00 32 K 8.06 3.93 0.00 1.99 1.80 0.00 1.85 0.00 0.00 1.56 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.43 7.81 33 R 7.98 3.73 0.00 1.99 2.08 0.00 3.13 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.74 0.00 34 E 8.28 3.94 0.00 2.17 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 2.58 0.00 35 I 8.04 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 1.40 0.70 0.84 0.00 0.00 36 A 7.87 3.80 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 E 7.94 4.02 0.00 2.20 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 2.49 2.59 0.00 38 I 7.56 3.71 2.00 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 1.52 0.64 0.92 0.00 0.00 39 L 8.01 4.19 0.00 1.91 1.80 0.81 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 40 K 8.31 4.00 0.00 2.11 2.21 0.00 1.91 0.00 0.00 1.90 0.00 0.00 2.89 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.54 1.57 7.81 41 R 8.27 3.99 0.00 2.10 2.08 0.00 3.32 0.00 0.00 3.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 42 E 8.49 4.45 0.00 2.16 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 2.59 2.54 0.00 43 G 7.62 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 44 F 8.62 4.41 0.00 3.18 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 45 I 7.44 4.66 2.12 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 1.28 0.79 0.95 0.00 0.00 46 R 9.00 4.13 0.00 1.89 2.24 0.00 3.29 0.00 0.00 3.18 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.58 0.00 47 D 8.05 4.74 0.00 2.74 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 48 Y 8.40 5.60 0.00 3.08 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 49 E 9.19 4.71 0.00 2.07 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 2.32 2.31 0.00 50 Y 8.63 5.03 0.00 3.08 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 51 I 8.29 4.52 1.74 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.10 0.77 0.00 0.00 52 E 8.50 4.95 0.00 1.77 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 2.18 2.11 0.00 53 D 8.91 4.61 0.00 2.52 2.44 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 0.00 0.00 0.00 0.00 54 N 9.58 4.28 0.00 2.88 2.87 0.00 0.00 7.22 7.61 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 55 K 8.30 3.88 0.00 1.92 1.95 0.00 1.75 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.36 7.81 56 Q 8.14 4.50 0.00 2.03 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 7.01 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 57 G 8.61 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 0.00 0.00 0.00 0.00 58 I 8.81 5.15 1.74 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 1.19 0.59 0.89 0.00 0.00 59 L 8.97 5.12 0.00 1.57 1.64 0.91 0.87 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 60 R 9.16 4.56 0.00 1.71 1.68 0.00 3.09 0.00 0.00 3.06 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 1.22 0.00 61 I 8.53 4.75 1.80 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 1.24 0.61 0.92 0.00 0.00 62 F 8.86 5.21 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 63 L 8.60 4.51 0.00 1.81 1.29 1.04 0.83 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 64 K 8.12 4.63 0.00 1.85 1.51 0.00 1.64 0.00 0.00 1.93 0.00 0.00 2.77 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.34 1.42 7.81 65 Y 8.44 4.88 0.00 3.03 2.90 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 66 G 8.92 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 0.00 0.00 0.00 67 P 0.00 4.64 0.00 2.16 2.08 0.00 3.80 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 68 N 8.53 4.80 0.00 2.85 3.18 0.00 0.00 7.24 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 69 E 7.44 4.50 0.00 1.96 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 2.33 2.35 0.00 70 R 8.46 4.52 0.00 1.90 2.08 0.00 3.29 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.78 0.00 71 V 7.86 3.78 2.16 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 0.78 0.00 0.00 0.91 0.00 0.00 72 I 7.60 4.48 1.87 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 1.53 0.87 0.84 0.00 0.00 73 T 8.45 4.33 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 1.25 0.00 0.00 74 G 7.31 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 0.00 0.00 0.00 0.00 75 L 8.40 5.26 0.00 1.43 1.46 0.84 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 76 K 9.00 4.62 0.00 1.80 1.61 0.00 1.59 0.00 0.00 1.55 0.00 0.00 2.76 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.36 7.81 77 R 8.63 4.20 0.00 1.85 1.81 0.00 3.44 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 1.73 1.78 0.00 78 I 8.66 4.04 2.09 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 1.16 1.04 0.91 0.00 0.00 79 S 7.72 4.55 0.00 4.03 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 80 K 8.84 4.81 0.00 1.93 1.84 0.00 1.66 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.37 7.81 81 P 0.00 4.30 0.00 2.06 2.06 0.00 3.71 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 2.03 2.11 0.00 82 G 10.23 4.01 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 0.00 0.00 0.00 83 L 7.99 4.64 0.00 1.63 1.50 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 84 R 7.75 4.33 0.00 1.84 1.88 0.00 3.41 0.00 0.00 3.16 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.85 0.00 85 V 8.87 4.32 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 1.03 0.00 0.00 0.99 0.00 0.00 86 Y 8.60 5.32 0.00 2.97 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 87 V 7.43 4.43 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 0.49 0.00 0.00 0.85 0.00 0.00 88 K 9.24 4.33 0.00 1.79 1.80 0.00 1.83 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.63 1.50 7.81 89 A 9.06 4.14 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 90 H 8.24 4.33 0.00 3.25 3.45 0.00 5.71 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 91 E 7.72 4.32 0.00 1.95 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 1.76 2.26 0.00 92 V 7.22 3.53 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 0.82 0.00 0.00 1.00 0.00 0.00 93 P 0.00 4.17 0.00 2.26 2.06 0.00 3.78 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 2.02 1.99 0.00 94 R 8.31 4.17 0.00 1.79 1.92 0.00 3.23 0.00 0.00 3.16 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 95 V 8.03 3.98 2.27 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 0.94 0.00 0.00 1.08 0.00 0.00 96 L 8.47 4.08 0.00 1.78 1.61 0.94 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 97 N 8.54 4.56 0.00 2.66 2.74 0.00 0.00 7.32 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 98 G 9.17 4.04 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 0.00 0.00 0.00 99 L 7.64 4.48 0.00 1.91 1.84 0.96 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 100 G 8.61 3.81 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 0.00 0.00 0.00 101 I 7.74 4.56 1.84 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 1.18 0.50 0.77 0.00 0.00 102 A 9.08 4.95 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 0.00 103 I 8.88 4.80 1.84 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.69 0.88 0.00 0.00 104 L 8.88 5.23 0.00 1.50 1.51 0.85 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 105 S 9.17 5.07 0.00 3.85 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 0.00 106 T 8.63 5.04 4.37 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 1.25 0.00 0.00 107 S 8.93 4.19 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 0.00 108 Q 8.18 4.38 0.00 2.07 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.30 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 109 G 8.00 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 0.00 0.00 0.00 110 V 7.58 4.38 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 0.75 0.00 0.00 0.97 0.00 0.00 111 L 8.76 5.09 0.00 1.58 1.47 0.92 0.27 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 0.00 112 T 8.91 4.80 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 0.00 113 D 8.65 4.32 0.00 3.09 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 0.00 114 K 7.95 3.98 0.00 1.84 1.84 0.00 1.71 0.00 0.00 1.81 0.00 0.00 2.96 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.50 1.52 7.81 115 E 8.03 4.01 0.00 2.22 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 2.33 2.32 0.00 116 A 8.26 3.97 1.33 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 0.00 117 R 8.01 3.87 0.00 2.02 1.98 0.00 3.13 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.81 0.00 118 Q 7.79 4.05 0.00 2.24 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.91 0.00 0.00 0.00 0.00 0.00 2.49 2.40 0.00 119 K 8.28 4.24 0.00 1.83 2.06 0.00 1.80 0.00 0.00 2.03 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.56 7.81 120 G 7.89 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 0.00 121 T 8.06 4.64 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 1.21 0.00 0.00 122 G 8.85 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 0.00 0.00 0.00 0.00 123 G 6.88 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 0.00 0.00 0.00 124 E 7.91 4.86 0.00 2.22 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 2.30 2.51 0.00 125 I 8.83 4.62 1.88 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.39 0.96 0.00 0.00 126 I 8.98 4.18 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.78 0.92 0.00 0.00 127 A 7.57 5.07 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 0.00 128 Y 8.97 5.03 0.00 3.02 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 0.00 129 V 8.01 4.67 1.47 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 -0.31 0.00 0.00 0.65 0.00 0.00 130 I 8.31 4.30 2.04 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 1.19 1.15 1.00 0.00 0.00