NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3926 8.3044 120.3494 54.8655 33.4331 174.9603 2 I 3.6883 8.2749 125.6937 60.9120 38.9246 173.4076 3 Q 4.8540 8.3517 124.6052 54.1486 33.5761 173.8414 4 S 5.1653 8.6006 116.1726 56.8326 66.4034 173.1915 5 Q 4.7703 9.1048 120.5453 54.8084 30.0875 175.7748 6 I 4.3768 8.3973 111.7104 59.9890 39.2803 174.7209 7 N 4.8407 7.8592 120.0464 51.1434 40.1807 174.5950 8 R 3.9962 8.5792 124.2257 59.3354 29.2343 178.2177 9 N 4.3601 8.6685 117.4125 56.0076 38.4509 177.3894 10 I 3.6950 7.5321 121.2518 64.6185 37.2163 178.7189 11 R 3.9957 7.8868 118.3097 59.0612 29.9015 179.0096 12 L 3.9964 8.1246 119.0764 57.6972 41.6146 179.0659 13 D 4.3717 8.4528 119.3532 57.2827 40.6787 178.5792 14 L 3.9271 7.9372 120.4216 58.0429 41.9884 178.7048 15 A 4.1263 8.2523 120.9201 55.4470 18.2906 179.4311 16 D 4.2636 8.0188 116.5797 57.3606 40.9467 178.6004 17 A 4.0060 7.9001 121.2510 55.3490 18.3113 179.6075 18 I 3.6482 8.0754 118.3994 64.7276 37.2565 178.6557 19 L 3.9784 8.2400 119.9580 57.5626 41.3150 179.3963 20 L 3.8854 8.0166 120.2396 58.2047 42.0381 178.8923 21 S 4.0279 8.0765 113.0035 61.3024 62.2461 175.7276 22 K 3.6982 8.6480 122.3744 59.6886 31.7449 178.5126 23 A 3.9213 7.8308 120.6335 55.0715 18.1644 179.6140 24 K 3.8532 8.0665 116.1637 59.4339 32.2542 178.8513 25 K 4.1675 8.1200 115.6543 55.5397 32.9263 175.9782 26 D 4.2808 7.8065 118.2967 55.0628 40.1138 172.9882 27 L 4.7613 7.8235 116.8934 53.5797 43.9291 177.4222 28 S 4.6289 8.5570 116.1435 56.9146 66.2220 175.4980 29 F 4.1403 8.3583 121.5792 60.6833 38.7223 177.7272 30 A 4.0996 8.1487 120.2355 55.1771 17.9959 179.3696 31 E 3.9728 8.3267 115.4416 59.5251 29.8948 178.9583 32 I 3.8129 7.6747 119.6954 64.2007 37.6246 177.9728 33 A 4.2268 8.4454 121.5390 53.4820 18.2753 177.2167 34 D 4.5042 7.5299 117.7886 55.7644 41.5833 176.4594 35 G 4.0525 9.1169 114.6243 45.6417 0.0000 173.9372 36 T 4.1434 7.6315 114.9069 63.4063 69.0363 176.4606 37 G 3.9791 8.2302 107.8795 45.3343 0.0000 173.1686 38 L 4.6279 7.4541 118.5641 52.4351 44.0645 176.7281 39 A 4.1282 8.3528 123.7012 52.0453 20.2553 178.1753 40 E 3.8954 9.0315 123.5621 59.8052 29.5728 179.6003 41 A 3.9590 7.9648 119.8937 54.9641 18.5239 179.2890 42 F 3.9214 8.1419 118.7165 61.4546 39.6752 177.4881 43 V 3.6368 8.0788 117.9388 66.2218 31.3213 178.1072 44 T 3.7958 8.0454 115.3015 66.5544 68.2466 176.4140 45 A 3.8302 7.9682 122.4333 54.9536 18.3334 179.5203 46 A 4.1411 7.6074 120.4431 54.8408 18.2457 179.6990 47 L 3.9828 7.6345 116.1019 57.7513 41.7790 178.9008 48 L 4.4734 7.5033 115.9062 54.4699 41.7552 177.4722 49 G 3.9164 8.0686 107.3859 45.5838 0.0000 174.3442 50 Q 4.4556 8.1517 116.7864 55.6116 29.6929 175.1251 51 Q 4.4160 7.3861 115.8984 54.3935 32.9576 172.6000 52 A 4.8801 8.2662 120.9407 50.5251 20.8502 176.5857 53 L 4.5866 8.5217 122.3493 53.2080 43.5517 175.1951 54 P 4.5495 0.0000 0.0000 62.3752 32.5144 177.4074 55 A 3.9898 8.7394 122.7046 55.6041 18.2858 179.8258 56 D 4.2798 8.0893 116.6677 57.4292 40.9585 178.7296 57 A 3.9985 8.0092 120.5779 55.0377 18.4009 179.1283 58 A 3.9793 8.6014 119.6394 55.6382 18.3909 180.1749 59 R 3.8683 8.3523 116.6981 59.0750 30.1384 178.9743 60 L 3.9361 8.0473 120.1214 58.4892 42.1853 179.5973 61 V 3.7909 8.3621 112.8270 64.1761 31.4328 178.8004 62 G 3.6341 8.5049 105.8251 47.6436 0.0000 175.6707 63 A 3.9499 8.1896 123.1114 55.0402 18.2906 179.7947 64 K 3.9196 7.9151 115.4995 58.9134 32.1559 178.4908 65 L 4.4812 7.6536 115.8953 53.0767 42.9626 175.9563 66 D 4.3620 7.6664 117.5365 55.2328 38.8330 173.6713 67 L 4.4394 8.0900 117.7605 53.7291 43.5129 177.9248 68 D 4.7249 8.2035 121.7071 52.7199 42.2170 177.2436 69 E 3.9897 8.5212 117.9780 59.6192 29.3692 179.1004 70 D 4.3912 8.0692 118.4848 57.4926 40.9258 178.8970 71 S 4.1313 8.9354 115.9403 61.7239 62.6286 176.8373 72 I 3.7313 7.5727 121.3036 64.1834 37.0992 177.9757 73 L 4.2434 8.0493 121.1937 58.1296 42.0186 178.9033 74 L 3.9846 8.2907 119.3541 57.9621 41.6273 179.4902 75 L 4.0433 8.0961 118.5821 57.6995 41.2768 179.1677 76 Q 4.5885 7.7200 117.7567 56.3072 29.2856 176.2872 77 M 4.4581 7.1848 119.8498 55.0634 33.0680 176.5085 78 I 3.9936 8.8849 124.8528 60.7784 38.0494 174.2110 79 P 4.6334 0.0000 0.0000 62.3022 32.7046 176.2824 80 L 4.2932 8.3254 123.4986 54.3168 41.7441 176.4775 81 R 4.1994 8.4537 125.5294 55.6702 30.9182 175.1316 82 G 3.0439 8.0383 109.1927 44.9092 0.0000 172.9873 83 C 4.3204 8.0599 122.5087 58.4481 30.7257 174.3384 84 I 3.9768 7.5383 122.1587 60.5648 37.3887 174.6615 85 D 4.4940 8.9227 125.8842 57.0859 41.3927 176.7287 86 D 4.6363 7.2646 115.1880 53.2398 41.4815 174.2318 87 R 4.1227 8.1516 126.9409 56.8478 29.4178 177.0377 88 I 3.9941 7.1956 116.6278 58.3782 38.6710 173.9431 89 P 4.4361 0.0000 0.0000 62.8469 31.8249 176.5276 90 T 4.1831 8.3290 111.4011 63.4087 69.9294 175.4901 91 D 4.4990 7.9678 122.2522 53.1940 42.5791 174.5523 92 P 4.3524 0.0000 0.0000 66.2279 31.1902 178.8545 93 T 3.9712 7.9639 112.7419 67.0536 68.6859 176.2552 94 M 4.4516 8.2251 120.5479 58.5157 32.0068 177.9498 95 Y 4.0549 8.8094 120.0992 61.0381 38.9022 178.3460 96 R 3.9024 8.3478 118.7479 59.6292 29.9612 178.9963 97 F 4.0679 8.0071 117.1457 60.4892 38.9138 177.0678 98 Y 3.9751 7.9414 118.7588 60.6538 38.5449 177.5555 99 E 3.6685 8.2426 120.4475 59.4744 29.5997 178.5055 100 M 4.0659 8.0420 118.6747 58.5564 31.8814 178.8205 101 L 3.9636 7.4589 119.0428 57.7983 41.5653 179.4472 102 Q 3.7831 7.4018 117.0618 58.5319 28.5999 178.7527 103 V 3.6357 7.7595 118.6370 65.2534 32.1526 176.8842 104 Y 4.7315 8.0952 114.0379 57.2396 38.6432 177.5648 105 G 3.8759 8.2466 109.2101 48.4694 0.0000 175.9427 106 T 4.0538 7.8538 111.6814 64.3505 68.9396 176.8984 107 T 3.9167 7.7901 118.3723 66.4181 68.5316 176.3357 108 L 3.9957 8.4712 121.3633 57.7091 41.6820 179.5602 109 K 3.8122 8.0409 119.0502 59.5168 32.1985 178.7287 110 A 4.0585 8.2213 121.1937 55.2417 18.3026 179.6324 111 L 4.0374 8.4119 117.9519 57.5456 41.6521 179.7342 112 V 3.8160 8.0937 118.6234 66.5387 31.6145 177.8943 113 H 4.9989 8.2085 117.1910 58.2662 28.2928 177.3296 114 E 3.9271 8.0140 120.2003 59.4993 29.6008 178.8633 115 K 3.9300 8.0413 116.8831 58.3254 32.1522 177.7365 116 F 4.0424 8.2338 116.1973 59.5803 40.9324 173.8214 117 G 3.8535 7.4201 104.2983 43.8960 0.0000 171.9402 118 D 4.7301 8.8301 118.8186 53.7542 42.4091 176.2828 119 G 4.1612 7.8405 113.3784 45.6895 0.0000 171.9016 120 I 4.7696 8.0151 115.3440 59.2976 41.8435 174.9054 121 I 4.4960 8.2407 124.1563 59.8929 37.7191 176.1667 122 G 3.7425 8.9222 115.6564 46.2017 0.0000 172.9610 123 A 3.9542 8.4697 124.6822 51.6411 19.5312 177.0107 124 I 4.2602 7.4949 115.4321 63.4219 39.2412 176.9713 125 N 4.7683 7.8068 123.5516 52.5669 37.6153 172.2048 126 F 5.4164 8.0805 122.8496 56.7383 42.7938 172.3294 127 K 4.6256 8.2099 123.2904 55.1463 36.3779 174.6802 128 L 5.3009 8.2157 119.6556 53.3733 43.9209 174.9261 129 D 4.7026 8.2524 117.4275 52.3964 42.8703 173.9950 130 V 4.8069 8.3390 119.5662 61.2484 33.7412 174.5780 131 K 4.6840 8.9485 127.7384 54.3636 35.0161 175.3037 132 K 4.6920 8.6287 125.9959 55.8936 33.3336 175.9664 133 V 4.5175 8.7902 126.6298 60.6148 34.7059 174.4629 134 A 4.3149 8.8439 129.5430 52.3923 19.2207 176.0661 135 D 4.6020 9.3105 121.6945 52.4700 42.3361 175.1878 136 P 4.2286 0.0000 0.0000 66.0802 31.3057 177.3362 137 E 4.0936 8.3203 113.9358 56.5931 29.4529 177.0860 138 G 4.0399 8.4687 107.7875 45.5766 0.0000 176.1193 139 G 3.8409 8.7932 109.0024 44.3991 0.0000 171.8301 140 E 5.1920 8.5296 117.2560 54.6322 33.0460 175.8087 141 R 4.8220 8.9176 120.2903 54.3638 34.3105 174.2176 142 A 5.0494 8.5832 123.0844 50.3063 21.2720 176.1882 143 V 4.1799 8.7929 123.5531 61.4008 33.2762 174.5331 144 I 4.7577 8.3906 129.5835 60.4709 38.4168 175.3538 145 T 4.5509 8.6314 124.4170 61.8877 70.5196 173.5324 146 L 4.6552 8.5185 126.4964 53.2082 43.6345 175.5539 147 D 4.6566 8.4539 123.1372 52.4634 43.7728 174.3560 148 G 4.6732 8.5635 112.0593 44.1724 0.0000 170.8280 149 K 4.4295 8.6887 123.4673 55.7592 33.7312 175.3827 150 Y 4.5971 8.6523 128.5517 57.6053 39.7015 174.4634 151 L 4.4199 8.5853 127.9330 52.0133 43.5737 174.3435 152 P 4.5227 0.0000 0.0000 62.8588 32.5367 175.8718 153 T 4.5474 8.6153 118.9880 62.1810 69.9711 174.2287 154 K 4.7453 8.5160 125.2400 53.4153 35.5719 174.4116 155 P 4.3946 0.0000 0.0000 62.8919 31.9341 176.6836 156 F 4.5385 7.7779 114.5803 57.1233 37.9811 174.6684 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 M 8.30 4.39 0.00 1.98 2.03 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 2 I 8.27 3.69 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.05 0.91 0.00 0.00 3 Q 8.35 4.85 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.57 0.00 0.00 0.00 0.00 0.00 2.50 2.27 0.00 4 S 8.60 5.17 0.00 3.81 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 5 Q 9.10 4.77 0.00 1.96 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.75 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 6 I 8.40 4.38 1.87 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 1.29 0.66 0.91 0.00 0.00 7 N 7.86 4.84 0.00 2.77 2.69 0.00 0.00 6.95 7.65 0.00 0.00 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 R 8.58 4.00 0.00 2.06 2.30 0.00 3.12 0.00 0.00 3.32 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 9 N 8.67 4.36 0.00 2.88 2.91 0.00 0.00 6.86 6.94 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 10 I 7.53 3.70 1.87 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 1.52 1.29 0.91 0.00 0.00 11 R 7.89 4.00 0.00 1.80 1.96 0.00 3.28 0.00 0.00 3.52 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.64 0.00 12 L 8.12 4.00 0.00 1.69 1.70 0.91 0.90 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 13 D 8.45 4.37 0.00 2.92 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 14 L 7.94 3.93 0.00 1.79 1.83 0.92 1.22 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 15 A 8.25 4.13 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 16 D 8.02 4.26 0.00 2.86 2.73 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 17 A 7.90 4.01 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 18 I 8.08 3.65 2.07 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 1.53 0.87 0.95 0.00 0.00 19 L 8.24 3.98 0.00 1.84 1.75 0.98 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 20 L 8.02 3.89 0.00 1.77 1.81 0.92 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.08 4.03 0.00 3.93 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 22 K 8.65 3.70 0.00 1.83 1.92 0.00 1.12 0.00 0.00 1.19 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.28 1.24 7.81 23 A 7.83 3.92 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.07 3.85 0.00 1.88 1.88 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.63 7.81 25 K 8.12 4.17 0.00 1.68 1.82 0.00 1.82 0.00 0.00 1.61 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.61 7.81 26 D 7.81 4.28 0.00 2.73 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 27 L 7.82 4.76 0.00 1.54 1.43 0.95 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 28 S 8.56 4.63 0.00 4.03 3.94 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 29 F 8.36 4.14 0.00 3.19 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 30 A 8.15 4.10 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 31 E 8.33 3.97 0.00 2.12 2.09 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 2.55 2.32 0.00 32 I 7.67 3.81 2.04 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.58 0.96 0.00 0.00 33 A 8.45 4.23 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 34 D 7.53 4.50 0.00 2.76 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 35 G 9.12 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 0.00 0.00 0.00 36 T 7.63 4.14 4.51 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 1.32 0.00 0.00 37 G 8.23 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 38 L 7.45 4.63 0.00 1.73 1.71 1.10 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 39 A 8.35 4.13 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 40 E 9.03 3.90 0.00 2.08 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 2.45 2.49 0.00 41 A 7.96 3.96 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 42 F 8.14 3.92 0.00 3.19 3.23 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 0.00 43 V 8.08 3.64 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 1.05 0.00 0.00 1.16 0.00 0.00 44 T 8.05 3.80 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 0.39 0.00 0.00 45 A 7.97 3.83 1.20 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 0.00 0.00 46 A 7.61 4.14 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 47 L 7.63 3.98 0.00 1.88 1.85 1.15 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 48 L 7.50 4.47 0.00 1.65 1.63 0.75 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 49 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 50 Q 8.15 4.46 0.00 1.97 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.50 6.63 0.00 0.00 0.00 0.00 0.00 2.23 2.37 0.00 51 Q 7.39 4.42 0.00 1.37 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.90 0.00 0.00 0.00 0.00 0.00 2.06 1.58 0.00 52 A 8.27 4.88 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 53 L 8.52 4.59 0.00 1.67 1.65 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.55 0.00 2.10 2.00 0.00 3.71 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 2.14 0.00 55 A 8.74 3.99 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 56 D 8.09 4.28 0.00 2.71 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 57 A 8.01 4.00 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 58 A 8.60 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 59 R 8.35 3.87 0.00 1.99 2.00 0.00 3.14 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.76 0.00 60 L 8.05 3.94 0.00 2.02 1.80 0.93 0.94 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 61 V 8.36 3.79 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 0.81 0.00 0.00 1.03 0.00 0.00 62 G 8.50 3.63 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 0.00 0.00 0.00 63 A 8.19 3.95 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 64 K 7.92 3.92 0.00 1.89 1.89 0.00 1.68 0.00 0.00 1.71 0.00 0.00 3.09 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.49 7.81 65 L 7.65 4.48 0.00 1.71 1.66 0.92 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 66 D 7.67 4.36 0.00 2.77 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 0.00 67 L 8.09 4.44 0.00 1.58 1.59 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 68 D 8.20 4.72 0.00 2.95 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 69 E 8.52 3.99 0.00 2.00 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 0.00 2.40 2.34 0.00 70 D 8.07 4.39 0.00 2.72 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 71 S 8.94 4.13 0.00 3.99 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 72 I 7.57 3.73 1.88 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 1.59 0.47 0.93 0.00 0.00 73 L 8.05 4.24 0.00 1.86 1.84 0.93 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 74 L 8.29 3.98 0.00 1.87 1.71 0.92 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 75 L 8.10 4.04 0.00 1.90 1.74 0.93 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 76 Q 7.72 4.59 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.84 0.00 0.00 0.00 0.00 0.00 2.57 2.40 0.00 77 M 7.18 4.46 0.00 1.94 2.12 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.53 0.00 78 I 8.88 3.99 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.58 0.92 0.00 0.00 79 P 0.00 4.63 0.00 2.12 2.03 0.00 3.75 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 1.95 1.92 0.00 80 L 8.33 4.29 0.00 1.81 1.65 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 81 R 8.45 4.20 0.00 1.82 1.86 0.00 3.24 0.00 0.00 3.20 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.77 0.00 82 G 8.04 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 0.00 0.00 0.00 83 C 8.06 4.32 0.00 3.05 3.02 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 84 I 7.54 3.98 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.52 0.89 0.00 0.00 85 D 8.92 4.49 0.00 2.62 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 86 D 7.26 4.64 0.00 2.59 2.48 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 87 R 8.15 4.12 0.00 1.97 2.02 0.00 3.22 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.61 0.00 88 I 7.20 3.99 1.76 0.00 0.00 0.53 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 0.70 0.67 0.00 0.00 89 P 0.00 4.44 0.00 2.18 2.04 0.00 3.38 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.08 0.00 90 T 8.33 4.18 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 1.19 0.00 0.00 91 D 7.97 4.50 0.00 2.85 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 4.35 0.00 2.24 2.14 0.00 3.69 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.20 0.00 93 T 7.96 3.97 4.51 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 1.35 0.00 0.00 94 M 8.23 4.45 0.00 2.10 2.21 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.58 0.00 95 Y 8.81 4.05 0.00 3.19 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 96 R 8.35 3.90 0.00 1.53 1.73 0.00 3.35 0.00 0.00 3.29 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.79 0.00 97 F 8.01 4.07 0.00 3.31 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 98 Y 7.94 3.98 0.00 2.93 2.61 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 99 E 8.24 3.67 0.00 1.88 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 2.28 2.36 0.00 100 M 8.04 4.07 0.00 2.15 2.28 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.56 0.00 101 L 7.46 3.96 0.00 1.52 1.56 0.92 0.91 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 0.00 102 Q 7.40 3.78 0.00 1.98 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.93 0.00 0.00 0.00 0.00 0.00 1.70 2.32 0.00 103 V 7.76 3.64 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 0.10 0.00 0.00 0.83 0.00 0.00 104 Y 8.10 4.73 0.00 3.23 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 0.00 105 G 8.25 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 0.00 106 T 7.85 4.05 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 107 T 7.79 3.92 4.62 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 1.33 0.00 0.00 108 L 8.47 4.00 0.00 1.84 1.74 0.95 1.04 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 0.00 109 K 8.04 3.81 0.00 1.84 1.99 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.48 1.45 7.81 110 A 8.22 4.06 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 0.00 111 L 8.41 4.04 0.00 1.80 1.76 0.94 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 112 V 8.09 3.82 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 1.03 0.00 0.00 0.94 0.00 0.00 113 H 8.21 5.00 0.00 3.27 3.35 0.00 5.69 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 E 8.01 3.93 0.00 2.09 2.14 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 2.30 2.35 0.00 115 K 8.04 3.93 0.00 1.70 1.19 0.00 1.75 0.00 0.00 1.62 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.31 1.47 7.81 116 F 8.23 4.04 0.00 2.51 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 G 7.42 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 0.00 118 D 8.83 4.73 0.00 2.76 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 0.00 119 G 7.84 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 0.00 120 I 8.02 4.77 1.85 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.08 0.92 0.00 0.00 121 I 8.24 4.50 1.81 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.62 0.96 0.00 0.00 122 G 8.92 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 0.00 123 A 8.47 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 I 7.49 4.26 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.94 0.93 0.00 0.00 125 N 7.81 4.77 0.00 2.80 2.76 0.00 0.00 6.49 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 0.00 126 F 8.08 5.42 0.00 3.19 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 0.00 127 K 8.21 4.63 0.00 1.63 1.70 0.00 1.22 0.00 0.00 1.61 0.00 0.00 2.80 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.14 1.12 7.81 128 L 8.22 5.30 0.00 1.67 1.44 0.92 0.84 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 0.00 129 D 8.25 4.70 0.00 2.67 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 0.00 130 V 8.34 4.81 2.09 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 0.89 0.00 0.00 0.91 0.00 0.00 131 K 8.95 4.68 0.00 1.72 1.67 0.00 1.71 0.00 0.00 1.57 0.00 0.00 2.79 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.42 7.81 132 K 8.63 4.69 0.00 1.79 1.72 0.00 1.73 0.00 0.00 1.75 0.00 0.00 3.13 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.45 7.81 133 V 8.79 4.52 2.09 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 0.90 0.00 0.00 0.94 0.00 0.00 134 A 8.84 4.31 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 0.00 135 D 9.31 4.60 0.00 2.67 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 0.00 136 P 0.00 4.23 0.00 2.08 2.13 0.00 3.73 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 137 E 8.32 4.09 0.00 2.10 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 2.35 2.26 0.00 138 G 8.47 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 0.00 139 G 8.79 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 0.00 140 E 8.53 5.19 0.00 1.83 1.84 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 2.20 2.30 0.00 141 R 8.92 4.82 0.00 1.83 1.78 0.00 3.23 0.00 0.00 3.17 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 142 A 8.58 5.05 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 0.00 143 V 8.79 4.18 2.09 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 1.04 0.00 0.00 0.94 0.00 0.00 144 I 8.39 4.76 2.03 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.67 0.97 0.00 0.00 145 T 8.63 4.55 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 1.18 0.00 0.00 146 L 8.52 4.66 0.00 1.64 1.93 1.04 1.15 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 0.00 147 D 8.45 4.66 0.00 2.58 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 0.00 0.00 0.00 0.00 148 G 8.56 4.67 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 0.00 149 K 8.69 4.43 0.00 1.92 1.70 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.44 7.81 150 Y 8.65 4.60 0.00 2.53 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 0.00 151 L 8.59 4.42 0.00 1.44 1.40 0.86 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 152 P 0.00 4.52 0.00 2.01 1.88 0.00 3.44 0.00 0.00 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.87 0.00 153 T 8.62 4.55 4.29 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 1.30 0.00 0.00 154 K 8.52 4.75 0.00 1.73 1.73 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.14 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.52 7.81 155 P 0.00 4.39 0.00 2.02 1.93 0.00 3.65 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 156 F 7.78 4.54 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