NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.5285 8.3044 120.2867 55.3039 33.8412 173.9383 3 V 4.1929 8.0888 121.8958 60.0039 33.6009 172.9381 4 W 4.6611 9.1272 135.0000 57.4787 31.6576 174.8595 5 T 4.1921 8.3301 123.8427 61.4057 67.0847 172.5968 6 P 4.5267 0.0000 0.0000 63.1869 32.2231 175.6105 7 V 4.0737 7.4874 119.9674 62.5785 32.9873 175.2966 8 N 4.2646 8.6569 125.2648 54.9237 36.0502 173.6682 9 N 4.8707 7.5737 108.4852 52.9789 40.1376 174.1764 10 K 4.0879 8.3544 116.2300 56.4786 32.7529 176.7130 11 M 4.8837 8.2509 121.0715 53.9932 34.9862 175.4592 12 F 4.6990 7.9889 115.8012 57.2191 41.2155 176.5998 13 E 3.5042 8.3193 123.0167 57.3600 27.8445 176.1737 14 T 3.9109 8.3346 123.7895 66.2051 68.7993 174.3018 15 F 4.5178 8.9758 124.1183 57.5404 36.6272 176.5786 16 S 4.4140 8.2887 115.2940 60.7028 62.8313 174.5768 17 Y 4.4539 8.2926 116.9153 57.8921 38.2183 174.9511 18 L 4.7785 7.6014 120.0500 51.9128 44.0245 174.4781 19 P 4.4181 0.0000 0.0000 61.9387 31.7827 174.9949 20 P 4.3011 0.0000 0.0000 62.7972 31.7775 176.4102 21 L 3.9869 8.2957 122.6184 54.6658 42.2118 177.9978 22 T 4.1730 8.2016 114.0466 61.3157 71.0403 175.0966 23 D 4.4130 8.6411 121.5019 57.7318 40.7622 178.9372 24 E 3.9414 8.0662 119.2147 59.3342 29.7424 178.7620 25 Q 3.9245 7.9878 118.2004 58.7592 28.7315 178.5972 26 I 3.6966 8.1501 121.0883 64.4418 37.1411 178.1205 27 A 4.0372 8.1689 121.2816 55.3729 18.1442 179.5725 28 A 3.9695 8.1086 119.0893 55.3636 18.3992 179.9381 29 Q 4.1309 8.1039 116.7290 59.1422 28.8417 179.0620 30 V 3.7470 8.1943 119.3832 66.1025 31.5419 177.7243 31 D 4.4276 8.4931 118.9084 57.6029 40.4421 178.1951 32 Y 4.1988 8.2246 119.9604 60.6610 38.7939 178.0599 33 I 3.8687 7.9852 120.7654 64.5654 37.3175 178.6095 34 V 3.5212 7.8971 118.6146 65.9769 31.1744 177.8609 35 A 3.9428 8.1611 119.7120 54.5253 18.2422 178.3105 36 N 4.1541 7.0468 112.0502 52.0120 38.7651 175.6339 37 G 3.7396 7.2502 108.2749 46.0623 0.0000 174.0946 38 W 4.9741 7.5071 118.9269 56.0384 30.7036 176.2307 39 I 4.4039 8.7505 122.8242 59.4800 37.9820 174.0533 40 P 4.9203 0.0000 0.0000 62.8101 32.8967 175.1159 41 C 4.9893 8.8772 121.0644 58.4218 35.6126 172.4775 42 L 5.3338 8.7464 123.8570 53.2453 44.3346 175.2029 43 E 5.6457 9.2326 121.0073 54.9561 34.1729 174.5600 44 F 5.6103 9.2659 116.0530 55.9499 42.1582 172.9923 45 A 4.5173 8.3366 120.3145 50.0832 22.5877 176.2594 46 E 4.2866 8.6293 118.8687 55.7706 30.6574 177.7678 47 A 4.2445 8.7834 122.7076 55.7997 18.4472 179.6008 48 D 4.6088 8.1235 113.0297 56.1733 41.0402 177.0457 49 K 4.6331 7.9440 117.3667 56.0052 32.8777 176.8274 50 A 3.8806 7.6771 124.4430 53.9594 18.7674 178.2669 51 Y 4.7690 7.3676 111.1320 55.6943 40.3998 176.1001 52 V 4.0113 8.2765 116.0735 62.1571 32.2399 175.5970 53 S 4.7698 8.9810 116.6895 56.6967 66.3709 173.8623 54 N 5.1677 8.5494 114.3253 52.7348 39.1402 176.2062 55 E 3.9753 8.2070 121.1194 59.7114 29.5455 179.0634 56 S 4.0680 8.8442 115.4077 60.4402 62.8710 175.9515 57 A 2.5800 7.6567 123.4018 53.4413 17.7452 178.9951 58 I 3.5413 6.9705 116.8130 63.6732 38.0144 177.0959 59 R 4.2711 7.5286 116.4554 55.7217 30.5258 176.2246 60 F 5.0764 7.1334 117.9831 55.9047 41.3304 177.1615 61 G 4.0107 8.2401 115.9879 46.2576 0.0000 175.2374 62 S 4.6017 8.4368 113.6842 58.6183 60.8713 174.4711 63 V 4.4521 7.2480 108.6416 61.1075 33.1852 178.4953 64 S 4.2843 8.2269 115.9126 60.0927 63.4235 173.5881 65 C 3.9984 7.2438 119.2707 61.5661 28.0214 173.3534 66 L 3.6073 8.4403 123.2687 55.6387 39.0025 173.1821 67 Y 4.3788 7.6927 119.3852 55.9353 40.0166 174.5524 68 Y 4.8540 7.1598 123.2544 56.2957 42.3290 174.7136 69 D 4.4942 8.9233 123.3802 55.4384 41.7062 177.0266 70 N 4.7903 8.9169 117.0103 54.0709 35.9008 176.0062 71 R 3.9673 7.9357 118.7155 59.2644 30.4002 177.1814 72 Y 4.3630 7.6523 114.7488 57.9920 38.3373 175.3369 73 W 5.0593 8.6968 124.4487 55.5489 32.5848 174.6120 74 T 4.3800 8.1826 117.0792 62.4952 69.7136 174.5341 75 M 4.6975 8.5202 126.2817 55.2972 33.2177 175.1736 76 W 4.8127 9.5678 135.0000 56.2807 31.4281 176.8425 77 K 3.4601 8.5832 128.5554 57.4887 30.7226 178.2599 78 L 4.9229 8.3129 124.1368 52.7164 45.2607 174.0278 79 P 4.3584 0.0000 0.0000 63.4218 32.2747 177.4381 80 M 4.3037 8.6128 122.9534 53.7005 30.4631 175.9843 81 F 4.4798 7.2949 118.3205 58.9107 40.0411 176.7223 82 G 3.9924 9.1110 112.5757 45.6260 0.0000 173.0634 83 C 4.2958 7.9512 121.0219 59.5371 31.5341 173.0845 84 R 4.5528 8.5762 123.5906 55.7038 29.9698 174.5700 85 D 4.7988 7.8865 118.8363 52.4959 42.0610 174.5954 86 P 4.3594 0.0000 0.0000 65.8470 31.2600 178.5585 87 M 4.1284 8.2521 117.5567 58.2481 31.8575 178.4834 88 Q 3.9785 8.0458 119.4771 59.0095 29.2136 178.5117 89 V 3.6018 7.7397 118.7971 66.0946 31.8493 177.8441 90 L 4.0337 7.8994 118.6609 57.9199 41.4303 179.7695 91 R 3.9790 8.2617 118.1064 59.3213 29.9581 179.0003 92 E 4.1326 8.2848 118.3273 59.1887 29.4624 179.2552 93 I 3.5358 7.8450 120.0677 64.3422 37.1527 178.5525 94 V 3.4779 7.6395 118.3107 65.8627 31.3654 177.8835 95 A 3.9261 7.9810 120.4623 55.2026 18.2712 179.1521 96 C 2.0000 7.6828 117.6329 62.1251 30.9735 175.9828 97 T 3.7177 7.4973 111.2294 64.4780 67.9727 176.3382 98 K 3.8688 7.7976 121.7606 59.1887 32.2802 178.4253 99 A 3.9859 7.6010 120.2842 53.4347 20.0365 177.6559 100 F 4.7205 7.7460 115.5415 55.1297 39.0296 174.0642 101 P 4.4339 0.0000 0.0000 64.2107 31.9133 177.8392 102 D 4.6162 8.0542 116.8008 53.9776 41.2392 175.5669 103 A 4.7882 7.4006 121.0110 50.3957 21.1749 177.0481 104 Y 4.1602 8.4922 117.9272 57.9479 39.4155 175.3316 105 V 5.1927 8.9517 123.0579 61.1681 35.2702 174.2339 106 R 5.0322 9.4745 123.9728 54.2685 32.9281 173.9186 107 L 4.8107 8.1759 123.6123 54.0136 43.7901 175.7073 108 V 4.8289 8.6797 118.2828 59.6144 36.5567 174.0849 109 A 4.8237 8.0557 121.3223 50.5410 22.9052 175.1645 110 F 5.2446 8.9101 118.9910 55.7316 42.5804 174.2269 111 D 5.3251 8.7821 122.7279 52.7244 42.3451 176.5582 112 N 4.7541 9.1729 123.0852 54.1729 38.3848 176.3316 113 Q 4.2128 8.8229 118.9864 58.9109 29.0909 177.7169 114 K 4.0040 8.3624 114.9337 57.3049 32.8634 176.6850 115 Q 3.4551 8.0484 118.3367 55.9126 27.0253 172.5406 116 V 4.5044 7.7733 117.3038 60.0504 35.0166 174.1112 117 Q 4.3704 8.7258 123.1442 56.5141 29.2863 175.5556 118 I 4.2233 8.1781 124.7957 61.1638 39.7480 174.3951 119 M 4.6058 6.6681 117.3915 54.4603 34.3878 173.7129 120 G 4.3641 8.2439 107.7438 46.3255 0.0000 172.1942 121 F 5.0583 7.5496 116.3845 55.2317 41.6946 173.0415 122 L 4.5773 8.8320 122.7086 55.5788 42.0410 176.7847 123 V 4.5487 8.9613 118.0654 61.4741 34.1781 175.6973 124 Q 4.6058 7.8534 121.2446 54.4139 32.3978 173.3003 125 R 4.3133 8.1241 121.8114 52.9197 32.7117 173.7307 126 P 4.2157 0.0000 0.0000 62.6010 31.8435 177.7105 127 K 4.0617 8.4524 119.9238 59.4754 32.1385 178.3035 128 T 4.1113 7.8031 106.7618 62.4869 69.3399 174.8046 129 A 4.2511 7.7073 126.1252 53.0099 18.6758 177.3212 130 R 4.6483 8.8026 119.7779 55.9072 31.7857 175.3921 131 D 5.1407 8.7165 116.3015 52.0461 39.6919 175.4345 132 F 5.4387 7.7092 112.4983 54.3328 41.1428 173.6188 133 Q 4.3749 8.3205 119.4832 52.9621 31.5846 174.2168 134 P 4.4943 0.0000 0.0000 62.2412 32.2861 176.9190 135 A 3.9588 8.8690 122.8357 55.6493 18.1394 179.3423 136 N 4.5983 8.1080 109.4919 54.1315 37.6349 175.4584 137 K 4.4296 7.8991 117.7015 56.3415 33.1673 177.2414 138 R 3.5806 7.6076 120.3621 57.5064 30.2045 176.5277 139 S 5.0885 7.5020 110.4147 56.3215 65.9950 174.2745 140 V 3.9923 8.5768 114.5234 61.7607 32.2351 175.6179 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 M 8.30 4.53 0.00 1.98 2.16 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.58 0.00 3 V 8.09 4.19 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 1.07 0.00 0.00 0.97 0.00 0.00 4 W 9.13 4.66 0.00 3.47 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 5 T 8.33 4.19 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 0.98 0.00 0.00 6 P 0.00 4.53 0.00 2.23 2.19 0.00 3.78 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 1.95 1.96 0.00 7 V 7.49 4.07 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 0.77 0.00 0.00 0.90 0.00 0.00 8 N 8.66 4.26 0.00 2.91 2.87 0.00 0.00 6.52 6.92 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 9 N 7.57 4.87 0.00 2.64 2.67 0.00 0.00 7.30 6.68 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 10 K 8.35 4.09 0.00 1.89 1.51 0.00 0.61 0.00 0.00 0.93 0.00 0.00 2.45 0.00 0.00 2.37 0.00 0.00 0.00 0.00 1.26 1.30 7.81 11 M 8.25 4.88 0.00 2.10 2.08 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.51 0.00 12 F 7.99 4.70 0.00 3.16 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 13 E 8.32 3.50 0.00 2.14 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 2.23 2.16 0.00 14 T 8.33 3.91 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 0.10 0.00 0.00 15 F 8.98 4.52 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 16 S 8.29 4.41 0.00 4.11 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 17 Y 8.29 4.45 0.00 3.02 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 18 L 7.60 4.78 0.00 1.82 1.59 0.91 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.42 0.00 2.02 2.00 0.00 3.70 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.13 0.00 20 P 0.00 4.30 0.00 2.04 2.02 0.00 3.70 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.18 0.00 21 L 8.30 3.99 0.00 1.55 1.46 0.05 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.20 4.17 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 1.18 0.00 0.00 23 D 8.64 4.41 0.00 2.70 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 24 E 8.07 3.94 0.00 2.02 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 2.35 2.38 0.00 25 Q 7.99 3.92 0.00 2.25 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.57 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 26 I 8.15 3.70 2.06 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.87 1.08 0.00 0.00 27 A 8.17 4.04 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 28 A 8.11 3.97 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 29 Q 8.10 4.13 0.00 2.57 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.75 0.00 0.00 0.00 0.00 0.00 2.47 2.08 0.00 30 V 8.19 3.75 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 1.06 0.00 0.00 31 D 8.49 4.43 0.00 2.98 2.76 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 32 Y 8.22 4.20 0.00 3.10 3.32 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 33 I 7.99 3.87 2.15 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.88 1.06 0.00 0.00 34 V 7.90 3.52 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 1.04 0.00 0.00 1.00 0.00 0.00 35 A 8.16 3.94 1.24 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 36 N 7.05 4.15 0.00 1.44 1.42 0.00 0.00 7.04 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 37 G 7.25 3.74 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 38 W 7.51 4.97 0.00 3.34 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 39 I 8.75 4.40 2.11 0.00 0.00 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 1.48 1.01 0.71 0.00 0.00 40 P 0.00 4.92 0.00 2.09 1.97 0.00 3.76 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.12 0.00 41 C 8.88 4.99 0.00 3.10 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 42 L 8.75 5.33 0.00 1.85 1.61 0.89 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 43 E 9.23 5.65 0.00 2.07 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 2.33 0.00 44 F 9.27 5.61 0.00 3.06 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 A 8.34 4.52 -0.24 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 46 E 8.63 4.29 0.00 2.18 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 2.28 0.00 47 A 8.78 4.24 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.12 4.61 0.00 2.70 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 49 K 7.94 4.63 0.00 1.49 1.66 0.00 1.71 0.00 0.00 1.80 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.32 1.42 7.81 50 A 7.68 3.88 0.42 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 51 Y 7.37 4.77 0.00 2.91 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 52 V 8.28 4.01 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 0.57 0.00 0.00 0.77 0.00 0.00 53 S 8.98 4.77 0.00 4.08 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 54 N 8.55 5.17 0.00 2.75 2.85 0.00 0.00 6.57 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 55 E 8.21 3.98 0.00 2.15 2.23 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 2.39 2.37 0.00 56 S 8.84 4.07 0.00 4.04 3.80 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 57 A 7.66 2.58 1.13 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 0.00 0.00 58 I 6.97 3.54 1.78 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 1.47 0.80 0.84 0.00 0.00 59 R 7.53 4.27 0.00 1.87 2.00 0.00 3.19 0.00 0.00 3.22 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 60 F 7.13 5.08 0.00 2.98 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 61 G 8.24 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 62 S 8.44 4.60 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 63 V 7.25 4.45 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 0.79 0.00 0.00 0.49 0.00 0.00 64 S 8.23 4.28 0.00 4.10 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 65 C 7.24 4.00 0.00 3.08 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 66 L 8.44 3.61 0.00 1.78 1.76 0.95 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 67 Y 7.69 4.38 0.00 2.92 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 68 Y 7.16 4.85 0.00 2.82 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 69 D 8.92 4.49 0.00 2.79 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 70 N 8.92 4.79 0.00 3.07 3.25 0.00 0.00 6.99 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 71 R 7.94 3.97 0.00 1.50 1.71 0.00 3.07 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.58 0.00 72 Y 7.65 4.36 0.00 3.05 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 73 W 8.70 5.06 0.00 3.10 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 74 T 8.18 4.38 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 0.93 0.00 0.00 75 M 8.52 4.70 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.79 0.00 76 W 9.57 4.81 0.00 3.66 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 77 K 8.58 3.46 0.00 1.70 0.74 0.00 1.62 0.00 0.00 1.54 0.00 0.00 2.65 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.81 0.21 7.81 78 L 8.31 4.92 0.00 1.60 1.57 1.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.36 0.00 0.72 1.85 0.00 3.63 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 1.93 2.15 0.00 80 M 8.61 4.30 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.54 0.00 81 F 7.29 4.48 0.00 3.10 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 9.11 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 83 C 7.95 4.30 0.00 3.02 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 84 R 8.58 4.55 0.00 1.90 1.93 0.00 3.05 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.58 0.00 85 D 7.89 4.80 0.00 2.68 2.60 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 86 P 0.00 4.36 0.00 2.22 2.12 0.00 3.67 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 87 M 8.25 4.13 0.00 2.08 2.27 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.71 0.00 88 Q 8.05 3.98 0.00 2.17 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 89 V 7.74 3.60 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 1.04 0.00 0.00 0.97 0.00 0.00 90 L 7.90 4.03 0.00 1.91 1.72 0.95 1.00 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 91 R 8.26 3.98 0.00 2.04 2.01 0.00 3.14 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.90 0.00 92 E 8.28 4.13 0.00 2.25 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 0.00 2.63 2.65 0.00 93 I 7.84 3.54 2.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.09 0.86 0.00 0.00 94 V 7.64 3.48 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 0.94 0.00 0.00 95 A 7.98 3.93 1.54 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 0.00 0.00 96 C 7.68 2.00 0.00 1.23 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 0.00 0.00 0.00 97 T 7.50 3.72 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 1.15 0.00 0.00 98 K 7.80 3.87 0.00 1.87 1.91 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.38 1.38 7.81 99 A 7.60 3.99 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 0.00 100 F 7.75 4.72 0.00 2.80 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 0.00 101 P 0.00 4.43 0.00 2.12 2.11 0.00 3.26 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 1.93 1.87 0.00 102 D 8.05 4.62 0.00 2.70 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 0.00 103 A 7.40 4.79 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 0.00 104 Y 8.49 4.16 0.00 2.53 2.70 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 0.00 105 V 8.95 5.19 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 0.99 0.00 0.00 0.87 0.00 0.00 106 R 9.47 5.03 0.00 1.82 1.90 0.00 2.34 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.37 0.00 107 L 8.18 4.81 0.00 1.51 0.77 0.90 0.66 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 0.00 108 V 8.68 4.83 1.62 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 0.46 0.00 0.00 0.52 0.00 0.00 109 A 8.06 4.82 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 0.00 110 F 8.91 5.24 0.00 3.01 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 D 8.78 5.33 0.00 2.35 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 0.00 112 N 9.17 4.75 0.00 2.94 3.05 0.00 0.00 6.32 7.39 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 0.00 113 Q 8.82 4.21 0.00 2.27 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.05 0.00 0.00 0.00 0.00 0.00 2.46 2.54 0.00 114 K 8.36 4.00 0.00 1.75 1.87 0.00 1.87 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.47 7.81 115 Q 8.05 3.46 0.00 2.13 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.71 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 116 V 7.77 4.50 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 0.56 0.00 0.00 0.92 0.00 0.00 117 Q 8.73 4.37 0.00 2.14 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.86 0.00 0.00 0.00 0.00 0.00 2.18 1.91 0.00 118 I 8.18 4.22 1.20 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.25 0.25 -0.56 0.00 0.00 119 M 6.67 4.61 0.00 2.24 2.29 0.00 0.00 0.00 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.78 0.00 120 G 8.24 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 0.00 0.00 0.00 0.00 121 F 7.55 5.06 0.00 3.22 3.32 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 0.00 122 L 8.83 4.58 0.00 1.65 1.65 0.75 0.38 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 0.00 123 V 8.96 4.55 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 0.77 0.00 0.00 0.93 0.00 0.00 124 Q 7.85 4.61 0.00 1.99 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.80 0.00 0.00 0.00 0.00 0.00 2.25 2.22 0.00 125 R 8.12 4.31 0.00 1.20 1.49 0.00 2.21 0.00 0.00 2.40 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.23 0.00 126 P 0.00 4.22 0.00 2.12 2.15 0.00 2.20 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.76 0.00 127 K 8.45 4.06 0.00 1.75 1.92 0.00 1.71 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.42 1.38 7.81 128 T 7.80 4.11 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 1.22 0.00 0.00 129 A 7.71 4.25 1.54 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 0.00 0.00 130 R 8.80 4.65 0.00 1.80 1.89 0.00 3.34 0.00 0.00 3.29 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.54 0.00 131 D 8.72 5.14 0.00 2.89 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 0.00 132 F 7.71 5.44 0.00 3.25 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 0.00 133 Q 8.32 4.37 0.00 1.85 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 7.07 0.00 0.00 0.00 0.00 0.00 2.26 2.03 0.00 134 P 0.00 4.49 0.00 2.37 2.19 0.00 3.52 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.88 0.00 135 A 8.87 3.96 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 0.00 136 N 8.11 4.60 0.00 2.83 2.94 0.00 0.00 5.84 7.13 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 0.00 137 K 7.90 4.43 0.00 1.70 1.70 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.29 1.41 7.81 138 R 7.61 3.58 0.00 1.35 0.66 0.00 2.97 0.00 0.00 3.07 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.41 0.00 139 S 7.50 5.09 0.00 4.06 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 0.00 140 V 8.58 3.99 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 0.61 0.00 0.00 0.97 0.00 0.00