NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.2229 8.2544 120.8568 56.0843 31.4517 174.7361 2 S 4.4536 8.1212 117.0603 55.7874 65.1542 171.9042 3 E 3.9745 9.4475 130.2215 59.2536 29.6863 178.9404 4 Q 3.1701 7.6159 117.7611 58.7658 28.7084 178.5505 5 I 3.6823 7.6885 120.5066 64.2378 37.1265 178.1725 6 A 3.9231 7.9296 121.3861 55.3185 18.1761 179.5838 7 A 3.7945 8.2867 119.4284 55.2797 18.4795 180.0758 8 V 3.5699 8.1691 116.9116 66.1556 31.5792 178.5473 9 R 3.9677 8.3331 118.2244 59.1015 29.8388 179.2533 10 R 3.7640 7.6561 118.1489 59.0060 29.6666 178.5505 11 M 4.0191 7.4459 118.0626 58.7180 32.2818 178.4025 12 V 3.8905 7.9167 118.2441 66.2336 31.7338 177.5933 13 E 4.0212 8.4879 118.7898 59.0717 29.3261 178.5355 14 A 4.0829 8.2524 121.0157 55.4659 18.2516 179.1182 15 Y 4.0744 7.5685 113.8526 61.3366 38.0200 178.5513 16 N 4.5955 7.9759 116.1112 56.5096 38.8539 177.1960 17 T 4.2521 8.4361 109.7885 61.9316 69.3585 176.0376 18 G 3.8413 8.1811 108.5378 45.4881 0.0000 173.0791 19 K 4.3816 7.9948 120.0452 55.4820 32.6010 176.5520 20 T 4.6959 8.3113 112.2945 60.9433 69.7736 175.1030 21 D 4.3355 8.4588 123.4888 56.4729 39.3354 176.9694 22 D 4.8340 7.8973 116.8535 52.7932 39.9198 178.4218 23 V 2.7650 7.5329 116.3061 64.4456 31.5565 178.2517 24 A 3.8473 7.8029 121.3725 54.6600 18.3144 178.2095 25 D 4.5131 7.9012 115.7462 56.8023 41.1146 176.7879 26 Y 4.7533 6.9584 113.2463 55.7981 39.5159 174.3607 27 I 4.2251 7.0169 122.4898 59.4162 38.3723 175.1556 28 H 4.1934 8.8183 126.2767 55.2389 30.3313 174.2494 29 P 4.2207 0.0000 0.0000 65.7496 30.9719 176.7686 30 E 4.4140 8.4134 115.5333 55.8834 29.7989 175.0591 31 Y 4.6614 7.7956 121.2164 57.9955 39.8484 175.1035 32 M 4.6580 7.9651 124.5785 53.5276 36.4826 173.1473 33 N 5.5221 8.4159 123.4114 50.0228 41.1601 173.0284 34 P 4.2986 0.0000 0.0000 65.1548 31.7262 178.7820 35 G 3.7297 8.3154 107.9896 47.8311 0.0000 174.2082 36 T 4.6892 7.6769 108.5893 61.2501 69.0252 176.0843 37 L 3.8688 7.6463 124.5023 58.1955 41.8071 179.2146 38 E 3.7910 7.6970 118.0709 58.2229 29.5198 177.1704 39 F 4.8046 7.3992 115.8103 58.2026 40.3383 175.4083 40 T 4.4600 7.1204 112.4596 61.6652 70.1992 172.9479 41 S 4.6787 8.4767 120.6750 58.1093 63.5276 174.7682 42 L 4.2134 7.7152 120.9799 54.9823 42.0457 176.1235 43 R 4.7672 7.8389 118.7042 55.0599 34.9124 175.5460 44 G 4.2463 8.9793 106.8633 45.1205 0.0000 172.3140 45 P 4.1206 0.0000 0.0000 65.9433 30.9807 178.0928 46 E 3.9201 8.1488 117.8138 59.2435 29.4934 178.6829 47 L 4.0027 7.8999 120.1455 58.2453 42.0894 178.8432 48 F 4.1214 8.1410 119.7723 61.3032 39.3224 176.8655 49 A 3.7381 8.2847 120.7603 55.1031 18.0504 179.4623 50 I 3.6385 7.7081 116.9974 64.2741 38.0468 177.9519 51 N 4.4019 8.1826 117.4155 56.1490 38.3682 177.4105 52 V 3.3859 7.4661 119.5440 66.0284 31.5367 177.9595 53 A 3.9680 7.8767 120.3437 54.7297 18.1587 179.2310 54 W 3.8937 8.5797 127.3407 60.5866 30.7723 178.1732 55 V 3.5682 8.2568 118.0551 66.1936 30.7117 178.1029 56 K 4.1849 8.0709 118.0541 59.4294 31.6446 179.3256 57 K 3.6982 7.7976 118.9330 59.3097 32.2891 178.4544 58 T 3.8061 7.3325 115.5383 64.5610 68.5086 176.2245 59 F 5.8025 8.3583 117.3165 56.1773 39.6325 176.0000 60 S 4.5951 7.6370 112.9139 58.0943 63.4613 170.5374 61 E 3.9913 8.6061 120.1245 59.4395 29.2789 178.0516 62 E 4.2114 7.7671 115.3942 56.6413 29.8093 176.7219 63 A 4.4567 7.7733 122.0082 52.5793 19.2531 177.5675 64 R 4.9008 9.2168 119.7578 54.6498 35.1575 174.1422 65 L 5.1877 9.8363 124.1710 53.3629 43.1862 175.7790 66 E 4.6115 9.2252 124.6756 54.8812 31.7353 175.0021 67 E 4.4366 8.7074 124.9449 56.0278 30.0944 175.6944 68 V 4.0246 8.7786 127.8889 64.5314 32.4938 176.0406 69 G 4.2370 7.5081 104.1406 45.6161 0.0000 172.0137 70 I 5.3356 8.4097 121.6196 59.3028 40.9012 174.4748 71 E 5.0332 9.5205 124.5540 54.4457 33.2667 174.3906 72 E 5.2351 8.5948 116.8571 54.9754 33.4378 175.3415 73 R 4.4070 9.2614 121.4038 55.9664 33.5162 175.1115 74 A 3.5620 8.3670 130.6759 53.8531 18.0059 176.7857 75 D 4.7686 8.9537 118.9049 55.6982 39.5145 175.0781 76 W 5.3993 8.4546 120.0634 55.2905 32.5084 174.6920 77 V 4.9672 9.3088 123.1531 61.1193 34.7135 174.0457 78 R 5.1838 9.4507 127.3302 54.5625 32.7314 173.7722 79 A 5.2124 9.1093 128.4492 50.2242 22.0372 175.0331 80 R 4.9548 9.3473 121.9807 54.7096 32.1868 175.5183 81 L 5.4026 8.9441 123.2707 52.8302 46.8305 175.7617 82 V 4.7243 8.7308 119.4619 61.1966 34.6669 173.9815 83 L 4.9111 8.8870 130.7424 54.6246 43.6293 174.7487 84 Y 4.7009 9.0519 123.6874 56.4221 41.5499 175.2344 85 G 4.1046 7.1846 108.9528 45.6795 0.0000 171.3346 86 R 5.2385 8.4340 119.3660 54.6649 33.5792 174.6308 87 H 5.1521 9.7355 126.8928 56.4867 29.5238 175.2693 88 V 4.4344 9.1510 117.4713 60.6478 33.1075 175.7909 89 G 4.0755 7.7955 108.1882 42.7042 0.0000 172.1611 90 E 4.2642 8.3806 120.1628 56.7244 30.3890 175.7368 91 M 5.0651 9.2013 123.8725 56.0293 35.8065 175.2722 92 V 3.4620 9.6920 120.0534 62.6667 29.5770 174.3846 93 G 4.3048 8.1276 104.0635 46.6156 0.0000 172.5826 94 M 4.8102 8.2677 120.1923 52.9199 33.5506 175.9806 95 A 4.9869 8.4134 125.6598 50.6969 19.3052 175.2901 96 P 3.8496 0.0000 0.0000 63.5692 31.6449 176.8204 97 T 4.1975 8.2739 111.9274 61.1083 69.6754 175.6825 98 G 3.9185 8.0702 109.7158 46.0831 0.0000 173.3453 99 R 4.4401 7.6336 119.6291 54.8775 31.3383 176.3403 100 L 4.7139 8.6067 124.1115 55.4449 42.5966 176.2439 101 F 5.2197 8.4330 115.9079 56.2358 41.6550 173.0373 102 S 4.7668 9.1293 114.1141 57.0937 65.9378 173.7465 103 G 4.2145 8.7273 109.0178 44.7222 0.0000 172.3494 104 E 4.7188 8.8447 123.1285 56.6507 31.0888 175.9097 105 Q 4.8458 9.5693 120.4474 54.4000 33.8253 173.9754 106 I 5.0542 8.5795 122.7936 59.9750 40.0258 174.2581 107 H 5.3258 9.3669 124.0302 53.8769 32.0909 172.8871 108 L 5.2308 8.9776 122.7504 52.9714 44.5325 175.3584 109 L 5.2073 9.3114 124.1952 53.1202 45.1822 174.8483 110 H 4.3174 8.8435 124.2863 54.1908 31.4173 173.5175 111 F 4.7595 8.9977 125.6107 56.7600 40.0991 175.7230 112 V 4.2061 8.2872 122.0040 62.3737 34.2882 174.8825 113 D 4.4594 9.8068 125.3419 55.5232 38.2229 174.7551 114 G 4.0442 8.7097 104.7811 45.5748 0.0000 174.0577 115 K 4.7929 7.9947 118.2414 53.8932 35.9761 175.5012 116 I 3.1959 8.5178 122.7582 62.0565 37.4716 175.8946 117 H 4.5331 9.2200 127.8251 56.9975 32.3343 173.6415 118 H 5.0639 7.7959 116.4725 54.4508 33.8505 171.9671 119 H 5.2344 8.5241 124.0883 54.8502 33.0838 171.5791 120 R 4.8770 9.2541 127.5277 54.3738 32.4016 174.2807 121 D 4.9254 8.3423 124.4146 51.3600 42.9637 175.2618 122 W 4.9135 8.9745 121.8335 54.2096 30.6926 173.5303 123 P 4.4003 0.0000 0.0000 62.1876 31.8793 177.4801 124 D 4.5541 8.1120 121.3746 53.1004 38.9081 176.3661 125 Y 4.0690 7.8093 122.0010 60.7824 38.4253 177.8074 126 Q 4.1926 8.2342 118.4752 58.9143 28.8204 178.8298 127 G 3.8869 8.2139 107.5683 47.6207 0.0000 175.7421 128 T 3.8666 8.1243 118.3537 66.3892 68.3817 176.1271 129 Y 4.1784 8.4917 121.8879 60.8383 38.7434 178.4704 130 R 3.7720 8.1659 118.7575 59.5641 30.0465 179.1936 131 Q 4.0921 7.6551 115.6448 58.3787 28.7336 177.8517 132 L 4.3789 7.6366 117.9408 54.4090 41.7560 177.3866 133 G 3.6662 7.7628 106.9826 45.3883 0.0000 174.1885 134 E 2.0000 7.6252 116.5050 55.7737 27.1175 173.4153 135 P 4.4678 0.0000 0.0000 62.4304 32.7009 176.6190 136 W 4.5862 8.6933 120.5428 54.9014 30.1676 174.7992 137 P 4.6210 0.0000 0.0000 63.1287 31.1948 176.1130 138 E 4.4137 8.9392 118.5299 57.3896 30.8218 175.8679 139 T 4.4180 7.3689 112.2507 61.5591 69.8817 172.9602 140 E 4.5750 8.7525 122.9397 56.9995 31.5083 176.4842 141 H 5.0265 7.3916 117.9128 56.2354 27.5052 176.8303 142 R 4.1450 8.9453 125.7266 60.1082 30.1460 176.1102 143 R 4.1221 8.0318 120.4435 56.7130 29.9888 175.8674 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 R 8.25 4.22 0.00 1.77 1.87 0.00 3.37 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.55 0.00 2 S 8.12 4.45 0.00 4.02 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 3 E 9.45 3.97 0.00 1.90 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 2.34 2.30 0.00 4 Q 7.62 3.17 0.00 1.90 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.90 0.00 0.00 0.00 0.00 0.00 1.16 1.92 0.00 5 I 7.69 3.68 1.84 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 1.47 0.69 0.91 0.00 0.00 6 A 7.93 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 7 A 8.29 3.79 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 V 8.17 3.57 2.26 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 1.06 0.00 0.00 1.22 0.00 0.00 9 R 8.33 3.97 0.00 1.99 1.93 0.00 3.16 0.00 0.00 3.16 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 10 R 7.66 3.76 0.00 1.18 1.21 0.00 3.06 0.00 0.00 2.88 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00 11 M 7.45 4.02 0.00 2.26 1.88 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.89 0.00 12 V 7.92 3.89 2.26 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 1.01 0.00 0.00 1.01 0.00 0.00 13 E 8.49 4.02 0.00 2.30 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 2.32 2.40 0.00 14 A 8.25 4.08 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 0.00 0.00 15 Y 7.57 4.07 0.00 3.26 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 N 7.98 4.60 0.00 2.93 2.93 0.00 0.00 7.07 7.95 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 17 T 8.44 4.25 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 1.28 0.00 0.00 18 G 8.18 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 19 K 7.99 4.38 0.00 1.80 1.95 0.00 1.67 0.00 0.00 1.77 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.38 7.81 20 T 8.31 4.70 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 1.11 0.00 0.00 21 D 8.46 4.34 0.00 2.78 2.86 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 22 D 7.90 4.83 0.00 3.06 2.93 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 23 V 7.53 2.77 1.81 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 0.86 0.00 0.00 0.91 0.00 0.00 24 A 7.80 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 D 7.90 4.51 0.00 2.86 2.84 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 26 Y 6.96 4.75 0.00 3.09 3.12 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 27 I 7.02 4.23 1.48 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.25 0.03 0.31 0.00 0.00 28 H 8.82 4.19 0.00 3.21 3.27 0.00 5.60 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 P 0.00 4.22 0.00 2.22 2.16 0.00 3.39 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.90 0.00 30 E 8.41 4.41 0.00 1.98 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 2.37 2.28 0.00 31 Y 7.80 4.66 0.00 3.09 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 32 M 7.97 4.66 0.00 1.93 1.68 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.48 0.00 33 N 8.42 5.52 0.00 2.53 2.58 0.00 0.00 7.44 7.71 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 34 P 0.00 4.30 0.00 2.24 2.28 0.00 3.77 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.97 0.00 35 G 8.32 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.68 4.69 4.39 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 1.30 0.00 0.00 37 L 7.65 3.87 0.00 1.68 1.68 0.87 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 38 E 7.70 3.79 0.00 1.35 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.01 0.00 39 F 7.40 4.80 0.00 2.95 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 40 T 7.12 4.46 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 41 S 8.48 4.68 0.00 3.89 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 42 L 7.72 4.21 0.00 1.70 1.65 0.95 0.72 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 43 R 7.84 4.77 0.00 1.84 1.83 0.00 3.25 0.00 0.00 3.35 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 44 G 8.98 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 0.00 0.00 0.00 45 P 0.00 4.12 0.00 2.19 2.16 0.00 3.69 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.97 0.00 46 E 8.15 3.92 0.00 2.30 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 2.41 2.43 0.00 47 L 7.90 4.00 0.00 1.99 2.12 1.03 1.08 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 48 F 8.14 4.12 0.00 2.59 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 A 8.28 3.74 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 50 I 7.71 3.64 1.89 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 1.03 0.00 0.00 51 N 8.18 4.40 0.00 2.94 2.97 0.00 0.00 6.66 7.06 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 52 V 7.47 3.39 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 -0.47 0.00 0.00 53 A 7.88 3.97 1.39 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 0.00 0.00 54 W 8.58 3.89 0.00 3.41 3.30 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 55 V 8.26 3.57 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 1.17 0.00 0.00 1.39 0.00 0.00 56 K 8.07 4.18 0.00 1.80 1.84 0.00 1.77 0.00 0.00 1.79 0.00 0.00 3.14 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.63 1.60 7.81 57 K 7.80 3.70 0.00 1.62 1.85 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.68 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.95 1.23 7.81 58 T 7.33 3.81 2.69 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 0.46 0.00 0.00 59 F 8.36 5.80 0.00 3.23 3.08 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 60 S 7.64 4.60 0.00 4.26 4.21 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 61 E 8.61 3.99 0.00 1.98 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 2.31 2.28 0.00 62 E 7.77 4.21 0.00 1.98 1.98 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 2.33 2.25 0.00 63 A 7.77 4.46 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 0.00 0.00 0.00 0.00 0.00 0.00 64 R 9.22 4.90 0.00 1.70 1.76 0.00 3.06 0.00 0.00 3.08 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.61 0.00 65 L 9.84 5.19 0.00 1.67 1.64 0.68 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 66 E 9.23 4.61 0.00 2.01 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 2.30 2.32 0.00 67 E 8.71 4.44 0.00 2.00 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 2.28 2.32 0.00 68 V 8.78 4.02 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 0.82 0.00 0.00 0.97 0.00 0.00 69 G 7.51 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 70 I 8.41 5.34 1.90 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 1.43 0.81 0.96 0.00 0.00 71 E 9.52 5.03 0.00 2.00 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 2.22 2.26 0.00 72 E 8.59 5.24 0.00 2.09 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.30 0.00 73 R 9.26 4.41 0.00 1.85 1.87 0.00 3.26 0.00 0.00 3.19 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 74 A 8.37 3.56 1.18 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 0.00 0.00 0.00 0.00 0.00 0.00 75 D 8.95 4.77 0.00 2.93 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 76 W 8.45 5.40 0.00 3.52 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 77 V 9.31 4.97 2.37 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 1.18 0.00 0.00 1.11 0.00 0.00 78 R 9.45 5.18 0.00 1.92 1.81 0.00 3.32 0.00 0.00 3.24 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 79 A 9.11 5.21 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 80 R 9.35 4.95 0.00 1.80 1.91 0.00 3.17 0.00 0.00 3.42 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.69 0.00 81 L 8.94 5.40 0.00 1.57 1.63 0.74 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 82 V 8.73 4.72 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 0.78 0.00 0.00 0.97 0.00 0.00 83 L 8.89 4.91 0.00 1.82 1.52 1.10 1.07 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 84 Y 9.05 4.70 0.00 2.67 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 85 G 7.18 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 86 R 8.43 5.24 0.00 1.89 1.79 0.00 3.13 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 87 H 9.74 5.15 0.00 3.38 3.34 0.00 5.60 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 V 9.15 4.43 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 0.79 0.00 0.00 1.04 0.00 0.00 89 G 7.80 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 0.00 0.00 0.00 90 E 8.38 4.26 0.00 2.07 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 2.60 2.45 0.00 91 M 9.20 5.07 0.00 2.25 2.24 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.65 0.00 92 V 9.69 3.46 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 0.91 0.00 0.00 1.00 0.00 0.00 93 G 8.13 4.30 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 0.00 94 M 8.27 4.81 0.00 2.18 2.26 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.59 0.00 95 A 8.41 4.99 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 3.85 0.00 2.00 1.95 0.00 3.67 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.04 0.00 97 T 8.27 4.20 4.30 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 1.36 0.00 0.00 98 G 8.07 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 R 7.63 4.44 0.00 1.85 2.06 0.00 3.55 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.92 0.00 100 L 8.61 4.71 0.00 1.55 1.59 0.93 0.80 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 0.00 101 F 8.43 5.22 0.00 3.06 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 0.00 102 S 9.13 4.77 0.00 2.72 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 0.00 103 G 8.73 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 E 8.84 4.72 0.00 1.94 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 2.40 2.33 0.00 105 Q 9.57 4.85 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.77 0.00 0.00 0.00 0.00 0.00 2.25 2.46 0.00 106 I 8.58 5.05 2.28 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.17 1.05 0.00 0.00 107 H 9.37 5.33 0.00 3.08 3.24 0.00 5.57 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 L 8.98 5.23 0.00 1.42 1.68 0.93 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 109 L 9.31 5.21 0.00 1.55 1.32 0.75 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 110 H 8.84 4.32 0.00 1.40 2.59 0.00 5.77 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 F 9.00 4.76 0.00 2.86 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 0.00 112 V 8.29 4.21 1.72 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 0.84 0.00 0.00 0.49 0.00 0.00 113 D 9.81 4.46 0.00 2.93 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 0.00 114 G 8.71 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 0.00 115 K 7.99 4.79 0.00 1.84 1.74 0.00 1.59 0.00 0.00 1.57 0.00 0.00 3.09 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.41 7.81 116 I 8.52 3.20 1.65 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 0.09 0.04 0.81 0.00 0.00 117 H 9.22 4.53 0.00 2.93 3.16 0.00 5.52 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 H 7.80 5.06 0.00 3.13 2.96 0.00 5.67 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 H 8.52 5.23 0.00 3.24 2.82 0.00 5.61 0.00 0.00 0.00 0.00 6.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 R 9.25 4.88 0.00 1.81 1.51 0.00 2.75 0.00 0.00 3.33 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 1.32 0.00 121 D 8.34 4.93 0.00 2.08 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 0.00 122 W 8.97 4.91 0.00 3.33 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 0.00 123 P 0.00 4.40 0.00 0.73 1.63 0.00 3.38 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.91 0.00 124 D 8.11 4.55 0.00 2.89 2.51 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 0.00 125 Y 7.81 4.07 0.00 3.09 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 0.00 126 Q 8.23 4.19 0.00 2.12 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.90 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 127 G 8.21 3.89 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 0.00 0.00 0.00 128 T 8.12 3.87 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 0.58 0.00 0.00 129 Y 8.49 4.18 0.00 3.06 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 0.00 130 R 8.17 3.77 0.00 2.07 1.94 0.00 3.18 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.90 0.00 131 Q 7.66 4.09 0.00 2.18 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.02 0.00 0.00 0.00 0.00 0.00 2.40 2.53 0.00 132 L 7.64 4.38 0.00 1.64 1.66 0.76 0.68 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 0.00 133 G 7.76 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 E 7.63 2.00 0.00 1.76 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 1.71 1.92 0.00 135 P 0.00 4.47 0.00 2.28 2.10 0.00 3.16 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 2.14 2.04 0.00 136 W 8.69 4.59 0.00 3.32 3.26 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 0.00 137 P 0.00 4.62 0.00 2.28 2.14 0.00 4.03 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.03 0.00 138 E 8.94 4.41 0.00 2.11 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 0.00 2.54 2.29 0.00 139 T 7.37 4.42 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 140 E 8.75 4.57 0.00 2.06 2.02 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 2.09 1.96 0.00 141 H 7.39 5.03 0.00 3.38 2.72 0.00 5.65 0.00 0.00 0.00 0.00 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 R 8.95 4.14 0.00 1.86 2.04 0.00 3.44 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.60 0.00 143 R 8.03 4.12 0.00 1.81 1.86 0.00 3.30 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00