NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4943 8.3231 116.8010 59.0826 64.6977 173.8125 2 G 4.0102 7.9137 108.3892 44.2367 0.0000 172.9443 3 F 4.2184 8.8778 117.7796 56.8737 41.2524 175.9183 4 V 4.0480 8.1725 116.8697 61.3366 33.5911 175.3560 5 C 4.3900 8.4493 119.6834 57.1233 40.1154 174.8630 6 N 4.4260 5.7700 115.4447 53.7611 39.2468 175.1306 7 T 3.9119 7.9408 115.0407 63.0070 68.1163 175.6331 8 C 4.9719 7.5199 118.3790 55.2827 39.8267 171.7517 9 P 4.3262 0.0000 0.0000 64.2066 31.5172 177.1535 10 E 4.5585 7.2908 117.8735 55.4775 32.5018 176.5598 11 K 4.2439 8.7206 120.3919 59.6788 33.0238 177.9550 12 W 4.9773 8.2360 116.5667 56.3807 30.1096 176.2042 13 I 4.2207 7.8166 122.7052 59.5032 40.3821 173.7650 14 N 4.9530 8.2006 125.0347 50.7139 41.1239 174.6364 15 F 4.8589 8.7980 123.7516 56.7581 39.4869 176.4831 16 Q 4.2365 9.3587 127.1421 60.1899 28.0198 177.6138 17 R 4.7008 7.7585 109.4488 56.2188 33.5041 174.1535 18 K 4.8486 8.1528 119.6540 55.5209 36.2057 175.2182 19 C 5.3900 9.5561 120.7343 55.1940 44.1397 171.8603 20 Y 5.3080 8.8488 119.0877 56.2592 41.1697 174.3939 21 Y 3.2351 8.8775 126.1385 55.8760 39.9050 173.9625 22 F 5.0829 8.2522 126.2205 56.1411 40.8417 175.6303 23 G 4.1188 8.7156 109.8281 45.2895 0.0000 171.0461 24 K 4.9735 7.9701 118.1544 55.0071 35.4310 176.7399 25 G 3.4322 8.1011 106.3762 48.1366 0.0000 172.8865 26 T 5.1999 8.9803 104.7322 61.1875 70.0411 173.4492 27 K 4.1663 8.5994 135.0000 57.3593 36.6074 173.7896 28 Q 4.8199 7.8387 124.2090 54.4434 32.2430 175.8796 29 W 3.0130 8.6079 126.6618 60.8735 30.7179 178.2827 30 V 3.1531 7.9678 111.7868 64.6490 30.9215 177.8935 31 H 3.7624 7.4145 116.5575 58.4920 29.5591 177.3399 32 A 2.9557 6.7001 122.9788 54.6016 18.1678 179.7229 33 R 3.3827 6.6546 114.1405 59.4982 29.1771 178.2639 34 Y 3.5582 7.4666 119.7498 59.8466 38.4703 177.5569 35 A 4.0059 7.2557 121.2802 55.2698 18.7423 178.6924 36 C 5.0519 7.9737 116.0960 59.2344 40.0915 175.8317 37 D 4.1127 7.5923 119.5999 56.6453 40.3969 177.8905 38 D 4.5167 7.5721 119.5048 57.1396 40.8874 176.1142 39 M 4.3895 7.7750 119.6109 55.5615 34.5118 175.7664 40 E 3.8117 8.0406 115.3987 59.4352 30.3661 178.3171 41 G 4.4691 6.6241 110.4233 46.7923 0.0000 174.5183 42 Q 4.6084 5.9850 119.9609 54.2528 34.0842 173.2757 43 L 3.8216 8.7894 124.8897 56.2955 42.3676 178.4674 44 V 2.7003 7.7923 117.6171 62.9747 32.8001 176.2925 45 S 3.3779 7.4614 114.5407 58.3412 60.2688 172.0658 46 I 3.7431 7.6142 111.8326 62.0616 37.6966 175.2068 47 H 4.9858 8.1846 115.1211 54.2104 30.1249 173.6186 48 S 4.3335 7.4918 117.2266 55.9589 65.6599 172.6087 49 P 4.0752 0.0000 0.0000 65.7423 30.9950 178.3232 50 E 4.0270 7.9954 117.5317 59.3273 29.7634 178.4709 51 E 4.1329 7.9686 118.4410 59.4129 29.6956 179.1775 52 Q 4.2476 8.5351 118.1805 59.5336 28.7349 178.1429 53 D 4.4143 8.3925 120.0787 56.7552 41.2274 178.1688 54 F 3.9738 8.7547 119.2264 60.5923 39.0732 177.6352 55 L 3.9494 8.3827 119.3749 58.9329 40.0808 179.2509 56 T 3.8571 8.0646 116.1595 66.4256 68.4742 176.1579 57 K 4.0978 8.3896 120.8134 59.5621 32.2877 178.1157 58 H 4.4787 8.2377 117.7543 57.9820 30.0265 174.8343 59 A 4.0007 8.0711 123.9073 51.4606 16.5318 176.9282 60 S 4.0841 7.9615 116.4633 61.4566 62.9400 174.2293 61 H 4.9279 7.5294 113.7342 54.7930 29.4993 173.0939 62 T 4.3807 7.6425 109.5855 60.1238 71.2175 173.7893 63 G 4.2432 8.5703 113.6969 45.9970 0.0000 170.9335 64 S 5.0032 8.0410 112.8315 55.1331 66.0653 172.1630 65 W 4.8942 8.5151 122.9272 54.9478 30.5345 175.7826 66 I 4.2346 7.7268 114.8179 58.0071 40.0318 176.0798 67 G 4.0961 7.9319 109.3452 45.5378 0.0000 173.2187 68 L 5.3812 7.9543 120.9522 53.1360 45.8758 175.8930 69 R 3.9776 9.4374 126.2772 54.5702 33.4357 173.5012 70 N 4.5904 8.4115 125.5542 52.8831 40.1480 174.3931 71 L 3.8876 8.4491 122.3161 56.5801 41.5569 177.6884 72 D 4.7056 7.2160 119.9305 54.8351 43.7633 177.2061 73 L 4.8563 6.8986 117.7371 56.0222 49.8100 176.6421 74 K 4.5498 7.9780 119.7337 57.4016 34.3299 178.7958 75 G 4.3303 7.1458 114.8774 45.6148 0.0000 175.3314 76 E 4.7482 8.6754 123.6158 54.0750 33.3423 173.9619 77 F 5.0029 8.6554 122.0020 57.3891 40.5181 174.4879 78 I 4.7663 8.7246 124.6884 59.1147 40.4198 175.4585 79 W 5.8163 9.3364 126.1900 56.0671 29.7485 178.0783 80 V 4.0273 8.7729 122.1463 64.8191 30.8901 176.6907 81 D 4.5014 8.3203 117.7479 54.7806 41.4163 175.5004 82 G 3.8795 9.1657 106.4413 46.8997 0.0000 174.0392 83 S 4.3543 7.9062 112.8486 55.7602 65.8456 173.1907 84 H 4.2839 8.2306 120.5521 54.9969 28.7801 175.3182 85 V 4.0103 7.6756 121.3951 63.6943 31.9974 175.4541 86 D 4.6971 9.0414 121.0192 54.7725 43.6215 176.1643 87 Y 4.2802 8.3255 113.5016 58.5800 40.1359 174.7849 88 S 3.5506 8.2370 116.2761 57.6517 63.6183 171.2771 89 N 4.2965 7.3619 114.1977 51.9123 40.9677 174.2679 90 W 4.5773 8.2654 114.4213 56.7912 27.6488 175.3033 91 A 3.8493 8.9072 126.6822 50.9044 16.9411 174.8704 92 P 4.4120 0.0000 0.0000 65.2822 31.7698 178.1885 93 G 3.9837 7.6860 113.4610 43.8687 0.0000 171.5535 94 E 4.5813 7.9825 125.3033 52.8310 29.7224 173.1081 95 P 4.3051 0.0000 0.0000 63.7517 32.2874 176.2626 96 T 3.5435 8.4525 116.3897 64.3697 65.8684 173.6105 97 S 4.6433 7.7998 111.1127 58.9090 64.8167 175.8243 98 R 4.5923 8.1127 119.6037 55.6376 31.5711 175.4538 99 S 4.6780 7.6337 113.7914 56.3322 62.0173 171.2260 100 Q 4.5559 7.3641 124.8260 54.5606 35.6119 174.1972 101 G 4.5646 7.0650 108.1782 44.9615 0.0000 170.7498 102 E 4.8208 7.7467 116.9437 55.1524 32.3947 173.8420 103 D 4.8121 7.6486 122.3361 55.3597 47.3800 175.7669 104 C 4.5986 7.8041 114.9785 53.7763 43.1964 173.2991 105 V 4.7126 7.9122 122.3906 61.4503 33.5285 174.3374 106 M 4.8603 8.9051 124.2230 53.5420 35.1881 173.7611 107 M 5.0438 8.2710 117.0669 53.2323 35.2090 175.1675 108 R 4.4438 8.9993 123.4337 58.0328 37.7400 175.1469 109 G 4.0005 8.9182 110.8562 47.4632 0.0000 174.7661 110 S 4.4484 9.3444 114.3224 59.0280 63.2555 173.9289 111 G 4.1636 8.3627 105.1168 46.5185 0.0000 174.4042 112 R 5.2620 7.5955 118.3503 54.1049 32.9549 174.0402 113 W 5.5244 8.9856 117.1815 55.4587 32.9142 174.9952 114 N 5.3196 9.6264 118.7226 52.0379 42.2838 173.1348 115 D 4.9540 9.1565 124.1681 53.3097 42.3263 175.1174 116 A 4.7524 8.5253 125.7956 51.4003 22.8185 175.1604 117 F 3.3989 8.8379 117.2523 60.5268 39.7756 175.6567 118 C 5.7817 7.7162 125.1549 57.2488 46.0665 174.2390 119 D 4.4183 8.4362 117.4782 54.0359 41.4874 176.0656 120 R 3.9210 7.9978 117.6893 57.1221 29.9008 176.8520 121 K 4.4888 8.4526 124.0965 55.2930 31.3017 177.0436 122 L 4.2834 8.0191 126.8301 55.2971 43.6440 178.4522 123 G 4.7403 7.6758 107.2970 45.9705 0.0000 172.8160 124 A 5.0803 7.4823 120.8988 49.8539 23.0839 176.2975 125 W 5.0882 9.1382 123.2813 55.5956 30.3200 175.3138 126 V 4.7528 8.3563 124.9882 61.2270 33.0130 175.2803 127 C 5.2165 9.2305 124.3454 55.2390 41.5660 172.3193 128 D 5.4198 9.0545 119.4095 51.9825 42.3004 174.8258 129 R 4.7230 9.1419 119.8522 54.9868 34.1942 173.9178 130 L 4.5381 8.6729 124.6059 54.4039 42.4124 176.7003 131 A 4.1175 8.0852 124.0461 53.3598 18.5852 176.8836 132 T 4.6020 8.3163 112.0664 60.5639 71.9462 172.6401 133 C 4.8262 8.4247 119.0258 56.1301 42.4871 173.4465 134 T 4.3418 7.8727 110.1985 59.5857 69.2171 171.7317 135 P 4.4357 0.0000 0.0000 61.9152 32.0704 175.9120 136 P 4.3007 0.0000 0.0000 64.4861 31.6890 177.1710 137 A 4.2023 7.4199 121.5396 54.6070 19.1841 177.9720 138 S 4.4430 7.6059 109.9673 57.5667 64.1523 173.1917 139 E 4.2309 8.5718 121.2857 56.6363 31.0108 175.0101 140 G 4.0310 9.0818 109.5632 45.9274 0.0000 171.6005 141 S 4.3336 8.9124 110.8458 58.2168 65.3405 173.8330 142 A 3.7881 7.9701 120.8892 53.1237 16.1533 176.5790 143 E 4.2254 8.1162 124.9926 57.8629 30.0692 175.0282 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 S 8.32 4.49 0.00 3.96 4.05 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 2 G 7.91 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 3 F 8.88 4.22 0.00 3.02 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 4 V 8.17 4.05 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 0.83 0.00 0.00 0.98 0.00 0.00 5 C 8.45 4.39 0.00 3.06 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 6 N 5.77 4.43 0.00 2.51 2.73 0.00 0.00 6.98 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 7 T 7.94 3.91 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 1.26 0.00 0.00 8 C 7.52 4.97 0.00 2.92 3.07 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.33 0.00 2.17 2.05 0.00 3.64 0.00 0.00 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.78 0.00 10 E 7.29 4.56 0.00 1.97 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 2.31 2.42 0.00 11 K 8.72 4.24 0.00 2.15 2.30 0.00 1.98 0.00 0.00 1.95 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.78 1.81 7.81 12 W 8.24 4.98 0.00 3.06 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 13 I 7.82 4.22 0.93 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.21 0.11 0.00 0.00 14 N 8.20 4.95 0.00 2.57 2.46 0.00 0.00 7.00 6.97 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 15 F 8.80 4.86 0.00 2.87 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 0.00 0.00 0.00 16 Q 9.36 4.24 0.00 2.11 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.85 0.00 0.00 0.00 0.00 0.00 2.44 2.36 0.00 17 R 7.76 4.70 0.00 1.81 2.10 0.00 3.11 0.00 0.00 3.44 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 18 K 8.15 4.85 0.00 2.03 2.08 0.00 1.58 0.00 0.00 1.86 0.00 0.00 2.96 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.76 1.75 7.81 19 C 9.56 5.39 0.00 3.02 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 20 Y 8.85 5.31 0.00 2.38 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 21 Y 8.88 3.24 0.00 1.43 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 0.00 0.00 0.00 0.00 22 F 8.25 5.08 0.00 2.78 2.78 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 23 G 8.72 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 24 K 7.97 4.97 0.00 1.48 1.59 0.00 1.67 0.00 0.00 1.69 0.00 0.00 2.81 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.27 1.40 7.81 25 G 8.10 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 26 T 8.98 5.20 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 1.28 0.00 0.00 27 K 8.60 4.17 0.00 1.79 1.28 0.00 1.15 0.00 0.00 1.55 0.00 0.00 2.73 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.31 1.03 7.81 28 Q 7.84 4.82 0.00 2.01 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.71 6.87 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 29 W 8.61 3.01 0.00 3.40 3.10 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 30 V 7.97 3.15 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 1.09 0.00 0.00 0.90 0.00 0.00 31 H 7.41 3.76 0.00 2.86 2.64 0.00 5.58 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 32 A 6.70 2.96 0.62 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 33 R 6.65 3.38 0.00 1.49 1.14 0.00 2.67 0.00 0.00 2.87 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.20 0.00 34 Y 7.47 3.56 0.00 3.02 2.66 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 35 A 7.26 4.01 0.80 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 0.00 0.00 36 C 7.97 5.05 0.00 2.85 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 37 D 7.59 4.11 0.00 2.54 2.41 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 38 D 7.57 4.52 0.00 2.86 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 39 M 7.78 4.39 0.00 2.08 2.14 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 40 E 8.04 3.81 0.00 2.19 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 2.49 2.43 0.00 41 G 6.62 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 42 Q 5.98 4.61 0.00 2.07 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 7.03 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00 43 L 8.79 3.82 0.00 1.62 1.46 0.55 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 44 V 7.79 2.70 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 0.08 0.00 0.00 0.79 0.00 0.00 45 S 7.46 3.38 0.00 3.92 3.40 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 46 I 7.61 3.74 2.21 0.00 0.00 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 1.52 0.97 1.17 0.00 0.00 47 H 8.18 4.99 0.00 3.36 3.67 0.00 5.69 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 S 7.49 4.33 0.00 3.70 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 49 P 0.00 4.08 0.00 2.07 2.04 0.00 3.35 0.00 0.00 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 50 E 8.00 4.03 0.00 2.09 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 0.00 2.91 2.67 0.00 51 E 7.97 4.13 0.00 2.04 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 1.47 1.89 0.00 52 Q 8.54 4.25 0.00 2.79 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.99 0.00 0.00 0.00 0.00 0.00 2.27 2.63 0.00 53 D 8.39 4.41 0.00 3.06 2.85 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 54 F 8.75 3.97 0.00 3.47 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 L 8.38 3.95 0.00 1.51 1.16 0.95 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 56 T 8.06 3.86 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 1.23 0.00 0.00 57 K 8.39 4.10 0.00 1.88 1.81 0.00 1.73 0.00 0.00 1.57 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.41 7.81 58 H 8.24 4.48 0.00 3.63 3.37 0.00 6.00 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 A 8.07 4.00 1.29 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 60 S 7.96 4.08 0.00 3.77 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 61 H 7.53 4.93 0.00 3.22 3.28 0.00 5.52 0.00 0.00 0.00 0.00 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 T 7.64 4.38 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 1.20 0.00 0.00 63 G 8.57 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 64 S 8.04 5.00 0.00 3.58 3.41 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 65 W 8.52 4.89 0.00 3.25 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 66 I 7.73 4.23 1.51 0.00 0.00 -1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.32 0.43 0.00 0.00 67 G 7.93 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 68 L 7.95 5.38 0.00 1.58 1.36 0.81 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 69 R 9.44 3.98 0.00 0.99 1.70 0.00 3.24 0.00 0.00 3.11 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.32 0.00 70 N 8.41 4.59 0.00 2.63 2.17 0.00 0.00 6.79 6.80 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 71 L 8.45 3.89 0.00 1.65 1.56 0.98 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 72 D 7.22 4.71 0.00 2.63 2.55 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 73 L 6.90 4.86 0.00 1.72 1.50 1.09 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 74 K 7.98 4.55 0.00 1.86 1.91 0.00 1.57 0.00 0.00 1.71 0.00 0.00 2.80 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.40 1.43 7.81 75 G 7.15 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 76 E 8.68 4.75 0.00 1.87 1.79 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 2.24 2.21 0.00 77 F 8.66 5.00 0.00 3.10 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 78 I 8.72 4.77 1.95 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 1.27 1.13 1.01 0.00 0.00 79 W 9.34 5.82 0.00 3.44 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 80 V 8.77 4.03 2.33 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 0.75 0.00 0.00 0.92 0.00 0.00 81 D 8.32 4.50 0.00 2.81 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 82 G 9.17 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 0.00 0.00 0.00 83 S 7.91 4.35 0.00 3.28 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 84 H 8.23 4.28 0.00 3.17 3.27 0.00 5.54 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 85 V 7.68 4.01 2.33 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 1.33 0.00 0.00 1.54 0.00 0.00 86 D 9.04 4.70 0.00 2.84 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 0.00 0.00 0.00 0.00 87 Y 8.33 4.28 0.00 2.82 2.85 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 88 S 8.24 3.55 0.00 3.19 4.27 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 89 N 7.36 4.30 0.00 1.44 2.28 0.00 0.00 5.91 7.20 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 90 W 8.27 4.58 0.00 3.75 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 A 8.91 3.85 1.42 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 0.00 0.00 92 P 0.00 4.41 0.00 2.08 2.10 0.00 3.69 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 2.00 2.00 0.00 93 G 7.69 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 94 E 7.98 4.58 0.00 1.99 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 2.22 2.35 0.00 95 P 0.00 4.31 0.00 2.10 2.00 0.00 3.91 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 96 T 8.45 3.54 4.26 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 1.22 0.00 0.00 97 S 7.80 4.64 0.00 4.08 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 98 R 8.11 4.59 0.00 1.75 1.90 0.00 3.26 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.67 0.00 99 S 7.63 4.68 0.00 3.89 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 0.00 100 Q 7.36 4.56 0.00 1.96 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 7.24 0.00 0.00 0.00 0.00 0.00 2.16 2.28 0.00 101 G 7.07 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 0.00 102 E 7.75 4.82 0.00 1.82 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 0.00 2.26 2.28 0.00 103 D 7.65 4.81 0.00 1.77 2.07 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.80 4.60 0.00 2.63 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 0.00 0.00 0.00 105 V 7.91 4.71 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 1.01 0.00 0.00 0.97 0.00 0.00 106 M 8.91 4.86 0.00 2.05 1.95 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 107 M 8.27 5.04 0.00 2.06 1.78 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.72 0.00 108 R 9.00 4.44 0.00 1.87 1.81 0.00 3.22 0.00 0.00 3.14 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.31 0.00 109 G 8.92 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 0.00 110 S 9.34 4.45 0.00 3.90 3.91 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 0.00 111 G 8.36 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 0.00 112 R 7.60 5.26 0.00 1.81 1.91 0.00 3.13 0.00 0.00 3.48 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.52 0.00 113 W 8.99 5.52 0.00 3.30 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 0.00 114 N 9.63 5.32 0.00 2.60 2.75 0.00 0.00 7.03 8.62 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 0.00 115 D 9.16 4.95 0.00 2.86 2.63 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 0.00 116 A 8.53 4.75 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 0.00 117 F 8.84 3.40 0.00 2.86 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 C 7.72 5.78 0.00 2.91 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 0.00 119 D 8.44 4.42 0.00 2.71 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 0.00 120 R 8.00 3.92 0.00 1.93 1.91 0.00 3.43 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.63 0.00 121 K 8.45 4.49 0.00 1.79 1.86 0.00 1.81 0.00 0.00 1.79 0.00 0.00 3.05 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.61 1.45 7.81 122 L 8.02 4.28 0.00 0.27 0.86 0.72 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 123 G 7.68 4.74 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 0.00 0.00 0.00 124 A 7.48 5.08 1.17 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 0.00 0.00 0.00 0.00 0.00 125 W 9.14 5.09 0.00 3.20 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 0.00 126 V 8.36 4.75 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 0.88 0.00 0.00 0.34 0.00 0.00 127 C 9.23 5.22 0.00 2.84 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 0.00 128 D 9.05 5.42 0.00 2.67 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 0.00 0.00 0.00 129 R 9.14 4.72 0.00 1.95 1.91 0.00 3.20 0.00 0.00 3.31 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.77 0.00 130 L 8.67 4.54 0.00 1.63 1.65 1.00 0.87 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 0.00 131 A 8.09 4.12 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 0.00 132 T 8.32 4.60 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 1.30 0.00 0.00 133 C 8.42 4.83 0.00 2.94 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 0.00 134 T 7.87 4.34 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 0.96 0.00 0.00 135 P 0.00 4.44 0.00 2.21 2.19 0.00 3.63 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 2.03 1.92 0.00 136 P 0.00 4.30 0.00 2.18 2.19 0.00 3.73 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 1.97 1.94 0.00 137 A 7.42 4.20 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 0.00 138 S 7.61 4.44 0.00 3.84 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 0.00 139 E 8.57 4.23 0.00 1.94 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 2.31 2.26 0.00 140 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 0.00 141 S 8.91 4.33 0.00 3.76 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 0.00 142 A 7.97 3.79 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 0.00 143 E 8.12 4.23 0.00 1.88 1.76 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 2.17 2.26 0.00