NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.3929 8.3049 120.3448 54.6777 32.7927 175.5809 3 L 4.6966 8.6588 117.1294 52.6273 42.3404 176.0055 4 T 4.2761 8.7199 114.6746 60.9183 72.5607 175.1626 5 A 4.0230 8.3712 121.4767 54.7969 18.2653 179.0544 6 E 3.8250 8.0827 118.3969 59.6087 29.6679 178.8253 7 E 3.8878 8.0067 117.6943 59.4505 29.6907 179.2310 8 K 3.7715 8.0828 118.1774 59.6027 32.0971 179.2206 9 A 3.9842 7.9842 120.3790 54.9043 18.3020 179.4848 10 A 3.9183 7.8020 118.8031 55.3172 18.4623 179.7477 11 V 3.4366 7.9280 116.8645 66.5856 31.2500 178.3192 12 T 3.9659 8.0616 114.8862 66.6957 68.1206 176.4518 13 A 4.0896 7.8942 121.2338 55.1355 18.6643 179.1401 14 F 4.1829 8.4818 119.1417 61.3280 39.5768 176.9381 15 W 4.5314 9.0129 128.3383 60.7861 30.1408 178.0284 16 G 3.6933 7.7088 104.4203 47.2219 0.0000 175.0213 17 K 4.1338 7.6214 118.7004 56.2995 32.6445 177.1985 18 V 3.6354 6.5557 120.0365 62.0949 31.9997 175.9108 19 K 4.2296 8.2328 126.8580 54.7734 31.3406 177.3366 20 V 3.5888 8.1579 119.1515 64.3889 32.1324 178.8355 21 D 4.3087 8.1393 119.5188 56.5067 39.2564 178.1695 22 E 3.7913 7.9466 121.0441 58.6596 29.8931 178.7756 23 V 3.6654 8.1569 118.8399 65.7409 31.5211 178.2719 24 G 3.6959 8.3521 106.0753 47.7532 0.0000 176.0394 25 G 3.6086 8.0637 108.6037 47.3429 0.0000 175.4561 26 E 3.9102 8.2616 121.5816 58.8680 29.6384 178.8393 27 A 3.9253 8.0062 120.8445 55.1193 18.5407 179.4483 28 L 3.9937 7.9770 119.0549 57.9586 42.1371 179.2205 29 G 3.5811 8.0884 105.7242 48.1031 0.0000 175.8856 30 R 3.8902 8.1385 121.2374 58.4508 29.9329 178.9036 31 L 4.0481 7.9018 120.2533 58.3289 41.8965 179.1527 32 L 3.8721 7.4973 117.4548 57.4750 41.5231 179.5652 33 V 3.6131 7.3829 117.4657 66.0498 31.6895 178.1046 34 V 3.5024 7.7254 116.9191 64.3104 32.6906 175.5019 35 Y 3.8079 7.2721 116.8647 53.8814 37.8352 173.7760 36 P 4.2745 0.0000 0.0000 65.2643 31.6787 177.5578 37 W 4.3517 7.9748 114.9051 59.5561 27.8408 178.0818 38 T 4.4277 7.5816 110.5895 64.4933 68.2771 176.4563 39 Q 4.1993 8.3314 121.4996 58.7785 28.3977 178.4444 40 R 3.8557 7.7179 118.8750 59.0918 30.0396 177.6667 41 F 4.3753 8.0914 115.2727 57.7798 39.5347 175.8004 42 F 4.7088 8.0156 118.3896 56.6397 39.9650 177.1632 43 E 4.0129 8.6037 122.8486 59.7488 29.4085 179.0996 44 S 4.6884 8.1385 109.6832 59.0774 63.2002 174.5781 45 F 4.5272 8.5036 119.9606 58.1940 40.0014 176.0561 46 G 4.0087 7.5191 104.2343 44.0743 0.0000 174.6263 47 D 4.5243 8.6643 125.8715 54.1886 41.1172 175.6836 48 L 4.8603 8.3544 125.5069 54.3296 43.2599 177.6374 49 S 4.2662 8.5443 116.5681 61.0404 62.9495 174.9120 50 T 4.6923 7.4787 109.3163 58.3318 73.0252 174.3011 51 A 3.9432 8.4321 122.6638 55.7171 18.4290 179.7426 52 D 4.2948 8.0695 116.4748 57.1692 40.6880 178.6539 53 A 3.9531 7.7358 120.5096 55.1490 18.6242 179.3826 54 V 3.6839 8.1491 116.9461 66.7227 31.4096 178.2728 55 M 4.1105 7.9440 116.4976 57.6026 31.8378 177.4714 56 N 4.8462 7.6433 113.5170 51.9463 39.6873 175.1308 57 N 4.4131 7.4300 120.9636 53.0735 39.9848 173.6018 58 P 4.2863 0.0000 0.0000 65.5622 31.5004 178.8582 59 K 3.8572 8.1401 117.1339 58.9498 31.8313 179.7179 60 V 3.8175 7.9701 118.2525 66.0193 31.5113 177.8629 61 K 3.8952 8.0045 118.0066 59.6864 31.5864 179.1904 62 A 4.0304 8.0140 120.8269 55.2659 18.3055 179.2173 63 H 4.3426 8.6855 117.1424 59.3545 30.1579 177.4510 64 G 3.8548 8.7020 108.0531 48.0666 0.0000 175.4484 65 K 4.0544 7.9499 121.7509 59.1596 32.3375 179.1451 66 K 4.0753 7.7992 118.5838 59.2265 32.0406 179.5513 67 V 3.7455 8.0048 118.5841 66.2187 31.4891 178.1948 68 L 4.3999 8.0293 118.2633 57.9157 41.4611 179.1980 69 D 4.5555 8.4257 119.3148 57.5084 40.6552 179.0295 70 S 4.1918 8.1603 114.2682 61.2445 62.8476 176.7464 71 F 3.9957 8.4131 121.3098 60.6872 38.5685 177.6662 72 S 4.2811 8.6840 113.8238 61.8169 63.0288 176.1951 73 N 4.5831 8.3674 119.7319 56.6133 38.6491 177.2088 74 G 3.7067 7.8698 107.1069 48.1681 0.0000 175.4508 75 M 3.9164 7.9801 120.3200 58.0929 31.9611 178.6175 76 K 4.1567 7.7645 117.1278 57.9192 33.4053 176.7699 77 H 4.9681 8.1883 116.5506 54.8267 29.1603 174.9424 78 L 4.1637 7.9479 118.2796 56.7685 41.9601 178.1551 79 D 4.7926 7.9161 116.6800 54.3828 42.5622 176.0431 80 D 4.8112 7.7413 117.5944 51.7950 41.1047 175.1852 81 L 4.2818 7.9205 123.5891 57.2348 42.1497 178.5389 82 K 3.9971 8.2073 118.2205 59.7915 31.8153 179.3483 83 G 3.5799 7.8413 103.6444 48.0586 0.0000 175.4473 84 T 3.9410 7.4282 116.2949 64.8857 68.5646 175.1556 85 F 4.6578 7.7509 118.6101 56.4358 40.7748 176.5666 86 A 3.9270 8.2366 123.7308 55.7037 18.0402 180.4153 87 A 3.9654 7.8376 118.1242 55.1548 18.5829 179.6886 88 L 4.0315 7.8621 117.1590 57.7740 41.6229 179.5110 89 S 4.0765 8.3870 113.7873 61.3125 62.4108 175.7750 90 E 3.8244 8.0453 121.8216 59.0052 29.3253 178.5251 91 L 3.8545 7.9194 120.3078 58.6450 42.2783 178.7636 92 H 4.2563 8.2897 116.0655 58.7938 28.4880 177.5788 93 C 4.1143 8.1520 119.9457 61.7516 27.9749 175.9523 94 D 4.2241 7.5759 118.7186 57.3023 40.7438 178.1755 95 K 4.1754 7.8459 116.3054 58.9016 32.7281 178.3228 96 L 4.1750 8.2381 117.7365 56.2569 41.7604 177.1949 97 H 4.5822 8.0377 112.5189 56.7039 25.6304 175.0399 98 V 3.6342 7.8669 119.1207 62.1633 32.1374 175.0703 99 D 4.1981 8.5573 127.1032 53.2382 41.8861 175.1188 100 P 3.1346 0.0000 0.0000 65.1771 31.5876 177.8501 101 E 3.8433 8.7212 120.3180 59.4374 29.3066 178.5363 102 N 4.3727 8.1013 116.4946 56.0969 38.6225 177.3762 103 F 4.5669 7.4931 119.3355 60.2271 38.8471 177.9379 104 K 4.0482 7.9631 118.0979 59.4051 31.8292 179.1944 105 L 3.8444 7.8504 118.7441 57.8109 41.5270 179.2630 106 L 4.1240 8.0618 120.2449 58.0193 41.9784 179.1162 107 G 3.7815 8.1350 105.3920 48.0956 0.0000 175.4084 108 N 4.4379 8.4508 119.3739 55.9579 38.5785 177.6883 109 V 3.6523 8.2517 120.0680 65.8224 31.5128 177.7536 110 L 3.8567 8.0703 120.1423 58.0470 41.8582 179.0210 111 V 3.4832 7.5614 117.7492 66.0443 31.4689 177.9498 112 V 3.5670 7.6544 117.6966 66.1995 31.3453 178.0924 113 V 3.5590 7.7929 117.7187 66.0490 31.2639 178.0085 114 L 3.9632 7.9675 118.6343 57.4024 41.2771 179.4145 115 A 3.9143 7.6200 120.9330 55.1127 18.1563 179.6329 116 R 3.8163 8.0986 116.4493 59.6510 30.2158 178.0967 117 N 4.2844 8.0839 115.0248 54.7582 39.0593 176.3854 118 F 4.7051 8.4950 117.1104 56.0899 40.7137 176.7873 119 G 3.8412 8.8270 109.1083 45.9645 0.0000 177.2412 120 K 4.0009 8.9654 121.6367 59.5796 32.3941 178.2063 121 E 4.2036 8.1585 118.3455 58.8547 29.7755 177.4590 122 F 4.4424 8.0819 123.0432 56.7823 37.9438 175.6409 123 T 4.0739 7.2748 115.2497 60.3706 71.1900 173.3845 124 P 4.1363 0.0000 0.0000 65.8462 31.3171 179.2193 125 V 3.4655 7.5094 116.3278 65.8516 31.6269 177.6631 126 L 3.7793 7.4703 119.6742 58.0877 41.7997 178.5004 127 Q 3.5490 7.9843 119.4958 59.1162 28.6927 178.3304 128 A 3.9940 7.9354 121.6661 55.2658 18.3707 179.3999 129 D 4.2281 7.8873 116.9201 57.5268 40.8540 179.0272 130 F 4.0841 8.2880 118.3029 60.6052 38.9116 177.6683 131 Q 4.1857 8.6701 118.1810 58.8480 28.4489 179.1720 132 K 3.9264 7.7279 119.4621 59.3870 32.1039 179.4612 133 V 3.5106 7.6617 118.3177 66.3161 31.5487 178.5170 134 V 3.8637 8.4644 112.2108 64.4010 31.3970 178.5196 135 A 4.1761 8.2172 120.9159 54.8210 18.1497 179.9522 136 G 3.4660 7.9807 104.3999 47.9308 0.0000 176.1363 137 V 2.9940 7.8174 120.9865 65.4049 31.3312 177.9541 138 A 3.9634 7.9525 120.4019 55.0551 17.9109 179.5147 139 N 4.3199 7.7706 113.9980 56.5158 38.7784 177.0983 140 A 4.0991 7.9508 122.1866 55.2493 18.1685 179.7403 141 L 3.7659 7.3509 116.2624 57.2665 41.9674 178.5296 142 A 4.8894 7.6354 118.7841 52.5763 17.4206 178.5180 143 H 4.0580 7.8321 120.0269 59.8027 30.0608 177.2855 144 R 3.7382 7.6591 115.4366 57.6338 30.1173 176.9370 145 Y 4.5244 7.8258 116.5116 60.5340 38.7204 175.5425 146 H 4.3702 7.2557 119.8751 56.5061 28.8760 175.0503 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 4.39 0.00 1.96 1.85 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.52 0.00 3 L 8.66 4.70 0.00 1.69 1.53 0.77 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.72 4.28 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 1.28 0.00 0.00 5 A 8.37 4.02 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 6 E 8.08 3.83 0.00 2.05 1.94 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 2.28 2.34 0.00 7 E 8.01 3.89 0.00 1.98 1.90 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 2.36 2.64 0.00 8 K 8.08 3.77 0.00 2.04 1.85 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.41 1.42 7.81 9 A 7.98 3.98 1.41 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 0.00 0.00 10 A 7.80 3.92 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 11 V 7.93 3.44 1.63 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 0.79 0.00 0.00 0.42 0.00 0.00 12 T 8.06 3.97 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 1.28 0.00 0.00 13 A 7.89 4.09 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 14 F 8.48 4.18 0.00 3.41 3.56 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 15 W 9.01 4.53 0.00 3.83 3.37 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 16 G 7.71 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.62 4.13 0.00 1.22 1.76 0.00 1.64 0.00 0.00 1.26 0.00 0.00 3.09 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.28 7.81 18 V 6.56 3.64 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 0.00 0.00 0.22 0.00 0.00 0.27 0.00 0.00 19 K 8.23 4.23 0.00 1.81 1.91 0.00 1.56 0.00 0.00 1.72 0.00 0.00 2.89 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.41 1.43 7.81 20 V 8.16 3.59 2.13 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 0.73 0.00 0.00 0.98 0.00 0.00 21 D 8.14 4.31 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 22 E 7.95 3.79 0.00 2.00 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 2.31 2.30 0.00 23 V 8.16 3.67 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 0.87 0.00 0.00 0.86 0.00 0.00 24 G 8.35 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 0.00 0.00 0.00 25 G 8.06 3.61 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 0.00 26 E 8.26 3.91 0.00 2.10 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 0.00 2.26 2.28 0.00 27 A 8.01 3.93 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 28 L 7.98 3.99 0.00 1.93 1.64 0.90 0.82 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 29 G 8.09 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 0.00 0.00 0.00 30 R 8.14 3.89 0.00 1.90 1.94 0.00 3.10 0.00 0.00 3.05 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 31 L 7.90 4.05 0.00 1.84 1.84 1.02 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.50 3.87 0.00 1.73 1.61 0.57 0.73 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 33 V 7.38 3.61 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 0.69 0.00 0.00 0.92 0.00 0.00 34 V 7.73 3.50 1.49 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 0.05 0.00 0.00 0.73 0.00 0.00 35 Y 7.27 3.81 0.00 2.58 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 36 P 0.00 4.27 0.00 2.19 2.10 0.00 3.39 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.20 0.00 37 W 7.97 4.35 0.00 3.63 3.59 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 38 T 7.58 4.43 4.48 0.00 0.00 0.00 0.00 0.00 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 39 Q 8.33 4.20 0.00 2.26 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.79 0.00 0.00 0.00 0.00 0.00 2.37 2.52 0.00 40 R 7.72 3.86 0.00 1.78 1.56 0.00 3.15 0.00 0.00 3.01 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.52 0.00 41 F 8.09 4.38 0.00 2.81 2.52 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 42 F 8.02 4.71 0.00 2.77 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 0.00 0.00 0.00 43 E 8.60 4.01 0.00 2.06 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 0.00 2.41 2.32 0.00 44 S 8.14 4.69 0.00 4.14 4.07 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 45 F 8.50 4.53 0.00 3.17 3.20 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 0.00 0.00 0.00 0.00 46 G 7.52 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 47 D 8.66 4.52 0.00 2.65 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 48 L 8.35 4.86 0.00 1.64 1.59 1.01 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.54 4.27 0.00 3.99 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 T 7.48 4.69 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 1.21 0.00 0.00 51 A 8.43 3.94 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 52 D 8.07 4.29 0.00 2.69 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 53 A 7.74 3.95 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 54 V 8.15 3.68 2.18 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 1.00 0.00 0.00 0.94 0.00 0.00 55 M 7.94 4.11 0.00 2.01 2.09 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 2.60 2.94 0.00 56 N 7.64 4.85 0.00 2.79 2.83 0.00 0.00 6.95 7.50 0.00 0.00 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 N 7.43 4.41 0.00 2.94 2.90 0.00 0.00 7.13 8.72 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 58 P 0.00 4.29 0.00 2.17 2.06 0.00 3.64 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.16 0.00 59 K 8.14 3.86 0.00 1.79 0.91 0.00 1.51 0.00 0.00 1.21 0.00 0.00 2.66 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.88 1.19 7.81 60 V 7.97 3.82 2.29 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 1.02 0.00 0.00 1.09 0.00 0.00 61 K 8.00 3.90 0.00 2.08 1.86 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.46 1.52 7.81 62 A 8.01 4.03 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 63 H 8.69 4.34 0.00 3.79 3.65 0.00 5.81 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 64 G 8.70 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 65 K 7.95 4.05 0.00 1.92 1.99 0.00 1.68 0.00 0.00 1.85 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.64 7.81 66 K 7.80 4.08 0.00 2.03 1.87 0.00 1.79 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.70 7.81 67 V 8.00 3.75 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 1.30 0.00 0.00 1.08 0.00 0.00 68 L 8.03 4.40 0.00 2.00 1.87 1.10 0.90 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 69 D 8.43 4.56 0.00 2.99 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 70 S 8.16 4.19 0.00 4.09 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 0.00 71 F 8.41 4.00 0.00 3.62 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 72 S 8.68 4.28 0.00 4.21 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 0.00 73 N 8.37 4.58 0.00 2.84 2.82 0.00 0.00 7.05 7.94 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 74 G 7.87 3.71 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 0.00 0.00 0.00 75 M 7.98 3.92 0.00 1.76 2.12 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 2.56 0.00 76 K 7.76 4.16 0.00 1.90 1.67 0.00 1.67 0.00 0.00 1.69 0.00 0.00 3.08 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.69 7.81 77 H 8.19 4.97 0.00 3.07 3.19 0.00 5.62 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.95 4.16 0.00 1.59 1.68 0.86 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.92 4.79 0.00 2.63 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 80 D 7.74 4.81 0.00 2.57 2.52 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 81 L 7.92 4.28 0.00 1.74 1.73 0.87 0.92 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 82 K 8.21 4.00 0.00 1.76 1.80 0.00 1.66 0.00 0.00 1.78 0.00 0.00 3.13 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.33 1.50 7.81 83 G 7.84 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 0.00 0.00 0.00 84 T 7.43 3.94 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 0.75 0.00 0.00 85 F 7.75 4.66 0.00 2.84 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 86 A 8.24 3.93 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 87 A 7.84 3.97 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 88 L 7.86 4.03 0.00 1.95 1.84 0.92 0.89 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 89 S 8.39 4.08 0.00 3.99 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 90 E 8.05 3.82 0.00 2.08 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 0.00 2.27 2.51 0.00 91 L 7.92 3.85 0.00 1.78 1.77 0.89 0.96 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 92 H 8.29 4.26 0.00 3.25 3.60 0.00 5.86 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 93 C 8.15 4.11 0.00 2.55 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 94 D 7.58 4.22 0.00 2.83 2.67 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 95 K 7.85 4.18 0.00 1.85 1.83 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.37 1.59 7.81 96 L 8.24 4.17 0.00 1.78 1.78 0.77 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 97 H 8.04 4.58 0.00 3.50 3.57 0.00 5.75 0.00 0.00 0.00 0.00 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.87 3.63 1.67 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 0.33 0.00 0.00 0.46 0.00 0.00 99 D 8.56 4.20 0.00 2.62 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 0.00 0.00 0.00 0.00 100 P 0.00 3.13 0.00 2.19 2.48 0.00 3.28 0.00 0.00 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.38 0.00 101 E 8.72 3.84 0.00 2.09 1.90 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 2.22 2.34 0.00 102 N 8.10 4.37 0.00 2.63 2.81 0.00 0.00 6.97 8.16 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 0.00 103 F 7.49 4.57 0.00 3.08 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 0.00 104 K 7.96 4.05 0.00 2.04 1.86 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.51 1.50 7.81 105 L 7.85 3.84 0.00 1.70 1.21 0.63 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.06 4.12 0.00 1.90 1.96 0.99 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.14 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 0.00 108 N 8.45 4.44 0.00 2.97 2.96 0.00 0.00 6.71 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 V 8.25 3.65 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 1.07 0.00 0.00 1.23 0.00 0.00 110 L 8.07 3.86 0.00 1.84 1.68 0.36 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.56 3.48 2.31 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 1.22 0.00 0.00 1.15 0.00 0.00 112 V 7.65 3.57 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 0.93 0.00 0.00 0.98 0.00 0.00 113 V 7.79 3.56 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 0.91 0.00 0.00 0.97 0.00 0.00 114 L 7.97 3.96 0.00 0.95 0.85 0.49 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.62 3.91 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.10 3.82 0.00 1.87 1.90 0.00 3.22 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 117 N 8.08 4.28 0.00 2.73 2.25 0.00 0.00 6.91 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.50 4.71 0.00 3.55 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 0.00 119 G 8.83 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 0.00 120 K 8.97 4.00 0.00 1.91 2.03 0.00 1.52 0.00 0.00 1.75 0.00 0.00 3.20 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.61 7.81 121 E 8.16 4.20 0.00 2.61 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.65 0.00 122 F 8.08 4.44 0.00 3.07 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 0.00 123 T 7.27 4.07 4.17 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 1.28 0.00 0.00 124 P 0.00 4.14 0.00 2.12 2.11 0.00 3.54 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 2.09 2.13 0.00 125 V 7.51 3.47 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 0.98 0.00 0.00 0.88 0.00 0.00 126 L 7.47 3.78 0.00 1.58 1.23 0.88 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 127 Q 7.98 3.55 0.00 1.44 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 128 A 7.94 3.99 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 0.00 129 D 7.89 4.23 0.00 2.70 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.29 4.08 0.00 3.44 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 0.00 131 Q 8.67 4.19 0.00 2.20 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.72 2.60 0.00 132 K 7.73 3.93 0.00 2.00 1.82 0.00 1.62 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.59 7.81 133 V 7.66 3.51 2.19 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 1.06 0.00 0.00 0.74 0.00 0.00 134 V 8.46 3.86 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 1.00 0.00 0.00 1.13 0.00 0.00 135 A 8.22 4.18 1.44 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 0.00 0.00 136 G 7.98 3.47 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 0.00 137 V 7.82 2.99 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 -0.24 0.00 0.00 0.59 0.00 0.00 138 A 7.95 3.96 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.77 4.32 0.00 2.91 2.92 0.00 0.00 6.98 7.26 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 0.00 140 A 7.95 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 L 7.35 3.77 0.00 1.11 0.45 0.18 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.64 4.89 1.67 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 0.00 143 H 7.83 4.06 0.00 3.47 3.44 0.00 5.79 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 R 7.66 3.74 0.00 1.62 1.75 0.00 3.31 0.00 0.00 3.21 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 145 Y 7.83 4.52 0.00 3.29 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 0.00 146 H 7.26 4.37 0.00 3.27 3.24 0.00 5.69 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00