NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2589 8.3144 119.9982 56.1375 32.7365 174.4441 2 E 3.8047 8.4868 126.5084 54.5834 30.4477 176.0030 3 T 4.1550 8.7483 118.4053 61.4012 72.0581 174.8302 4 A 4.0323 8.4960 123.1229 55.3158 18.4426 179.9146 5 A 3.9799 8.0069 118.6721 55.2304 18.5467 179.5677 6 A 4.3507 7.8519 120.8516 54.3907 18.3601 179.8347 7 K 3.9435 8.0494 118.1057 59.5513 32.2869 178.8506 8 F 4.1085 8.2910 120.8402 61.2848 38.7861 177.0323 9 E 4.0864 8.3084 117.8637 59.4290 29.0878 179.3304 10 R 3.9364 7.8214 117.5161 59.5621 30.2502 178.2953 11 Q 3.8790 7.9982 116.8777 58.4870 29.0458 176.5859 12 H 4.5846 8.0951 115.6667 55.2066 31.4480 174.5563 13 M 4.6514 7.7914 118.3066 54.1004 32.9156 176.7068 14 D 4.8367 8.9235 123.7037 52.7661 39.8524 175.9644 15 S 4.4323 8.3320 117.2398 59.9128 63.6815 176.3569 16 S 4.2060 7.9086 114.7977 59.6240 63.2251 174.2103 17 T 4.7158 7.1403 111.2567 59.6641 71.1140 174.2414 18 S 4.2635 8.5473 117.1172 60.6794 63.8259 174.1264 19 A 3.8387 7.2167 119.3239 50.4449 21.2619 175.0680 20 A 3.0171 8.0397 124.3581 52.1654 17.8385 178.0597 21 S 4.0641 8.2758 117.8878 60.7667 63.5100 175.4851 22 S 4.8404 7.5365 114.2052 54.8966 65.6663 174.6801 23 S 4.3615 8.5059 113.7805 60.4218 62.9250 174.5418 24 N 4.5720 7.8268 118.2542 55.0568 39.4316 175.8455 25 Y 4.1367 7.6777 118.0123 61.6593 38.6543 177.7464 26 C 4.2227 8.2695 116.4881 59.8795 38.5577 175.8730 27 N 4.4684 8.1270 117.8039 56.2298 38.1610 177.3335 28 Q 3.7633 7.7056 119.5429 59.4464 28.9232 178.8566 29 M 3.7157 7.7724 119.6778 58.2106 31.7150 178.7762 30 M 4.1111 7.8412 118.8839 57.5239 31.9793 178.6641 31 K 3.9719 7.3219 120.1167 59.1720 32.4202 178.8321 32 S 4.2481 8.0388 111.5701 60.1516 63.1705 174.7983 33 R 4.3858 7.6027 118.5686 55.6628 30.0411 175.6952 34 N 4.3906 7.8241 113.9951 54.6823 36.1602 174.9362 35 L 4.4698 8.1958 117.1666 55.1925 42.1516 177.8678 36 T 5.5158 7.6055 107.7950 60.6490 68.5707 175.6930 37 K 4.1924 7.7495 125.8025 59.9733 32.8603 178.0177 38 D 4.5072 7.7856 120.1318 54.9166 40.7917 178.3441 39 R 3.8285 7.0471 112.2964 54.6942 32.4099 174.5581 40 C 4.7491 8.4904 116.3517 55.8694 40.3413 173.9310 41 K 4.1909 8.3876 127.4762 55.8761 32.3825 174.9579 42 P 4.7815 0.0000 0.0000 64.4999 32.8331 176.3442 43 V 4.9984 7.6357 118.5362 61.0220 34.5179 174.2711 44 N 4.8475 9.6186 125.0146 52.6004 42.7534 172.7840 45 T 4.8328 7.8359 120.4267 61.6470 71.5822 172.8884 46 F 4.9042 8.9583 124.8103 55.6757 41.9689 174.7039 47 V 4.4330 8.9618 123.4126 60.8881 33.3780 175.9938 48 H 5.6841 8.6999 129.6329 54.9478 26.7007 174.3321 49 E 4.8336 7.7465 116.6683 53.6545 33.6104 177.4102 50 S 4.4111 8.3020 116.8841 57.6733 64.9274 175.0005 51 L 3.9460 8.5789 124.7271 58.4649 41.9536 179.0039 52 A 4.0008 8.1062 120.0262 55.6832 18.0407 179.2756 53 D 4.3474 7.6007 115.8018 57.4003 40.7700 178.8447 54 V 3.8380 7.8411 118.8483 65.7919 31.2203 178.1645 55 Q 3.9783 8.9411 118.1641 58.6112 28.4423 178.4793 56 A 3.9750 7.9654 121.7566 54.7556 18.4778 179.4623 57 V 3.5068 7.3859 115.2781 65.4749 31.2836 176.4832 58 C 4.0046 7.3857 113.9662 57.4409 40.2357 173.7744 59 S 4.6561 7.6587 114.0605 57.8561 64.1203 174.4875 60 Q 4.2284 7.1220 119.9592 56.1548 30.4900 177.9119 61 K 4.2730 8.4285 132.6317 56.6114 32.9398 175.1898 62 N 4.3664 8.8258 127.6686 53.6654 39.6221 174.3622 63 V 4.5779 8.4441 118.7963 58.8734 36.5228 175.1133 64 A 4.0636 8.4408 125.6425 52.3146 18.9322 178.7582 65 C 4.6803 9.2135 121.1051 56.4958 40.9913 175.2520 66 K 3.8349 8.2814 121.7149 59.5861 31.9283 178.1352 67 N 4.5707 8.1786 114.2234 52.8005 37.3079 176.6079 68 G 3.9149 8.0678 107.3674 45.8369 0.0000 174.3854 69 Q 4.2607 7.4431 118.5555 56.1970 29.2512 176.2674 70 T 4.6694 8.2802 108.3721 61.6320 69.2592 173.8713 71 N 5.0647 8.0792 117.8665 53.8955 38.5940 174.2787 72 C 5.3099 7.4965 115.4387 56.8276 42.6202 172.7069 73 Y 5.0392 8.9208 119.9828 56.2039 41.6169 174.0446 74 Q 4.9936 9.0199 126.0938 54.2234 31.0174 174.8882 75 S 4.4875 8.7567 122.2535 58.5891 63.3847 173.9868 76 Y 4.5232 9.6344 123.0162 61.0957 37.7523 177.0941 77 S 4.7620 7.8163 111.7409 56.5602 65.3509 173.1638 78 T 4.2301 8.0201 110.2791 61.8956 69.7448 173.9335 79 M 5.0569 8.7568 122.0770 53.4001 36.4777 174.7820 80 S 4.8807 10.1235 118.6136 58.2991 63.6591 173.0598 81 I 5.1933 9.1830 120.1635 59.5510 41.5866 174.0863 82 T 5.0042 8.8446 120.0582 61.9116 71.7999 172.4666 83 D 4.9031 9.2543 127.3729 53.5481 42.9914 174.1879 84 C 5.6747 9.3434 123.7033 55.2334 42.9897 173.0638 85 R 5.2159 8.8270 123.4471 54.5232 33.5394 174.0243 86 E 4.0545 9.3927 126.8512 57.0463 30.7239 177.9357 87 T 4.3245 8.0340 113.8988 60.7556 71.3284 174.4054 88 G 3.6475 8.6613 109.1498 49.1071 0.0000 175.9572 89 S 4.0465 7.2849 108.5219 59.1007 62.8077 173.6541 90 S 4.3598 7.8453 116.4278 57.0754 62.7521 173.4347 91 K 4.3811 8.4209 128.4391 54.3560 33.8449 174.6138 92 Y 4.3486 8.6852 128.5255 57.2962 39.0645 173.8394 93 P 2.9700 0.0000 0.0000 62.5741 32.6820 176.0458 94 N 4.6778 8.2703 120.5146 51.5781 37.2325 174.1435 95 C 4.1991 7.9445 114.9629 57.6309 42.5962 173.8556 96 A 4.8944 8.6737 125.5140 50.2737 21.9417 174.3026 97 Y 5.1221 8.6115 118.7066 55.8992 41.5399 175.0507 98 K 4.3536 9.1501 125.1960 56.1820 33.8193 175.4180 99 T 4.8365 8.6240 124.3076 62.5801 70.0271 174.2836 100 T 4.5053 8.6259 124.2625 61.5114 70.9974 173.3598 101 Q 4.6422 8.6798 128.4811 55.9378 29.9894 174.7423 102 A 4.7184 9.1627 127.0148 50.9480 23.8120 174.5714 103 N 5.4225 8.6999 115.3286 51.7068 40.9379 174.3288 104 K 4.7882 8.7076 122.0959 54.4483 37.3357 175.8938 105 H 4.7475 9.3027 119.7792 55.9470 29.9932 174.6474 106 I 4.8294 8.4050 115.2092 59.3628 40.5353 174.3227 107 I 4.8624 8.6198 125.4611 59.8209 39.5587 175.0770 108 V 4.7172 8.6775 119.8377 59.2312 35.8207 174.6221 109 A 4.9484 8.3976 125.2159 51.6023 20.0105 175.8717 110 C 5.0937 8.9261 119.5946 55.3876 44.5046 173.1825 111 E 4.6777 8.7044 119.6404 55.9694 34.5363 174.3902 112 G 4.1649 9.3453 106.6896 45.0888 0.0000 172.6630 113 N 5.1339 8.1480 116.0510 50.7790 38.5233 170.3566 114 P 4.4747 0.0000 0.0000 61.0910 32.8869 175.4092 115 Y 4.5108 8.5977 123.2396 57.7994 39.0158 175.3318 116 V 4.4410 8.4494 119.0722 58.3895 36.9082 173.3437 117 P 4.4073 0.0000 0.0000 62.9331 31.1287 176.9883 118 V 4.4459 8.7647 115.7916 61.1925 33.8645 175.2289 119 H 5.0844 7.8857 120.5006 54.8793 33.4788 171.4699 120 F 4.5320 8.9756 128.1686 57.4172 39.7204 174.0953 121 D 4.5307 8.0378 126.4225 55.3671 41.5591 175.8587 122 A 4.7454 6.8583 117.2283 51.2729 22.6999 174.1280 123 S 5.3312 8.7742 113.3621 56.5512 66.3444 174.6478 124 V 4.1518 8.8451 120.6122 62.0888 31.5419 175.1275 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 K 8.31 4.26 0.00 1.89 1.95 0.00 1.55 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.44 7.81 2 E 8.49 3.80 0.00 2.04 1.92 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 2.31 2.37 0.00 3 T 8.75 4.16 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 1.22 0.00 0.00 4 A 8.50 4.03 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 5 A 8.01 3.98 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 A 7.85 4.35 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 7 K 8.05 3.94 0.00 2.08 1.96 0.00 1.68 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.57 7.81 8 F 8.29 4.11 0.00 3.22 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 9 E 8.31 4.09 0.00 2.31 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 2.49 2.70 0.00 10 R 7.82 3.94 0.00 1.82 1.94 0.00 3.38 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 11 Q 8.00 3.88 0.00 1.50 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.56 0.00 0.00 0.00 0.00 0.00 2.25 2.54 0.00 12 H 8.10 4.58 0.00 1.80 2.71 0.00 5.61 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.79 4.65 0.00 2.01 2.18 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.75 0.00 14 D 8.92 4.84 0.00 2.71 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 15 S 8.33 4.43 0.00 3.96 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 16 S 7.91 4.21 0.00 3.96 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 17 T 7.14 4.72 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 1.21 0.00 0.00 18 S 8.55 4.26 0.00 3.96 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 19 A 7.22 3.84 1.07 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 0.00 0.00 20 A 8.04 3.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.28 4.06 0.00 4.01 3.95 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 22 S 7.54 4.84 0.00 4.06 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 23 S 8.51 4.36 0.00 4.04 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 24 N 7.83 4.57 0.00 2.90 3.12 0.00 0.00 6.63 7.44 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 25 Y 7.68 4.14 0.00 3.11 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 26 C 8.27 4.22 0.00 3.18 3.16 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 27 N 8.13 4.47 0.00 2.94 2.92 0.00 0.00 7.17 7.74 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 28 Q 7.71 3.76 0.00 2.01 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 29 M 7.77 3.72 0.00 0.77 1.23 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.77 0.00 30 M 7.84 4.11 0.00 1.71 1.85 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.46 0.00 31 K 7.32 3.97 0.00 1.78 1.90 0.00 1.64 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.44 7.81 32 S 8.04 4.25 0.00 3.95 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 33 R 7.60 4.39 0.00 1.97 2.11 0.00 3.60 0.00 0.00 3.21 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.87 0.00 34 N 7.82 4.39 0.00 2.92 2.96 0.00 0.00 6.85 7.85 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 35 L 8.20 4.47 0.00 1.74 1.63 0.77 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.61 5.52 4.44 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 1.45 0.00 0.00 37 K 7.75 4.19 0.00 1.94 1.79 0.00 1.81 0.00 0.00 1.79 0.00 0.00 3.07 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.45 1.39 7.81 38 D 7.79 4.51 0.00 2.74 2.56 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 39 R 7.05 3.83 0.00 1.76 1.79 0.00 2.86 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.68 0.00 40 C 8.49 4.75 0.00 3.11 3.17 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 41 K 8.39 4.19 0.00 1.80 1.75 0.00 1.73 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.37 7.81 42 P 0.00 4.78 0.00 2.19 2.30 0.00 3.88 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.82 0.00 43 V 7.64 5.00 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 0.97 0.00 0.00 44 N 9.62 4.85 0.00 2.59 2.25 0.00 0.00 6.70 7.44 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 45 T 7.84 4.83 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 0.89 0.00 0.00 46 F 8.96 4.90 0.00 3.03 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.96 4.43 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 1.10 0.00 0.00 1.07 0.00 0.00 48 H 8.70 5.68 0.00 3.18 3.46 0.00 5.61 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.75 4.83 0.00 1.97 1.86 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 2.25 2.25 0.00 50 S 8.30 4.41 0.00 4.07 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 51 L 8.58 3.95 0.00 1.83 1.75 1.03 1.15 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 52 A 8.11 4.00 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 53 D 7.60 4.35 0.00 2.79 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 54 V 7.84 3.84 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 1.23 0.00 0.00 1.07 0.00 0.00 55 Q 8.94 3.98 0.00 2.12 2.08 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 2.31 2.52 0.00 56 A 7.97 3.98 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 57 V 7.39 3.51 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 1.00 0.00 0.00 0.93 0.00 0.00 58 C 7.39 4.00 0.00 2.94 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 59 S 7.66 4.66 0.00 3.89 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 Q 7.12 4.23 0.00 1.73 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.97 0.00 0.00 0.00 0.00 0.00 1.90 2.23 0.00 61 K 8.43 4.27 0.00 1.99 1.81 0.00 1.63 0.00 0.00 1.78 0.00 0.00 2.92 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.49 1.44 7.81 62 N 8.83 4.37 0.00 2.81 2.68 0.00 0.00 7.01 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 63 V 8.44 4.58 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 0.67 0.00 0.00 0.81 0.00 0.00 64 A 8.44 4.06 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 65 C 9.21 4.68 0.00 3.02 3.18 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 66 K 8.28 3.83 0.00 1.86 1.89 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.38 7.81 67 N 8.18 4.57 0.00 2.86 3.03 0.00 0.00 6.29 7.49 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 68 G 8.07 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 0.00 0.00 0.00 69 Q 7.44 4.26 0.00 2.22 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 70 T 8.28 4.67 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 71 N 8.08 5.06 0.00 3.08 3.16 0.00 0.00 6.06 7.68 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 72 C 7.50 5.31 0.00 3.09 2.88 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 73 Y 8.92 5.04 0.00 2.80 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 74 Q 9.02 4.99 0.00 2.03 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 7.00 0.00 0.00 0.00 0.00 0.00 2.27 2.26 0.00 75 S 8.76 4.49 0.00 3.92 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 76 Y 9.63 4.52 0.00 2.98 2.98 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 77 S 7.82 4.76 0.00 4.00 3.96 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 78 T 8.02 4.23 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 79 M 8.76 5.06 0.00 2.00 2.01 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.48 0.00 80 S 10.12 4.88 0.00 3.84 3.96 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 81 I 9.18 5.19 1.90 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 1.29 1.25 1.07 0.00 0.00 82 T 8.84 5.00 4.43 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 1.32 0.00 0.00 83 D 9.25 4.90 0.00 2.79 2.56 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 84 C 9.34 5.67 0.00 2.90 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 R 8.83 5.22 0.00 2.05 1.78 0.00 3.15 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.66 0.00 86 E 9.39 4.05 0.00 1.97 1.73 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 1.79 1.97 0.00 87 T 8.03 4.32 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 1.19 0.00 0.00 88 G 8.66 3.65 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 0.00 0.00 0.00 89 S 7.28 4.05 0.00 3.93 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 S 7.85 4.36 0.00 3.68 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 K 8.42 4.38 0.00 1.70 1.58 0.00 1.65 0.00 0.00 1.53 0.00 0.00 2.81 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.31 1.34 7.81 92 Y 8.69 4.35 0.00 2.96 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 93 P 0.00 2.97 0.00 1.81 1.36 0.00 3.69 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 1.72 1.71 0.00 94 N 8.27 4.68 0.00 2.82 2.76 0.00 0.00 6.92 6.72 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 95 C 7.94 4.20 0.00 3.18 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 96 A 8.67 4.89 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 0.00 0.00 0.00 0.00 0.00 97 Y 8.61 5.12 0.00 2.90 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 98 K 9.15 4.35 0.00 1.87 1.85 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.46 7.81 99 T 8.62 4.84 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 1.34 0.00 0.00 100 T 8.63 4.51 4.28 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 1.23 0.00 0.00 101 Q 8.68 4.64 0.00 1.95 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.77 0.00 0.00 0.00 0.00 0.00 2.28 2.40 0.00 102 A 9.16 4.72 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 0.00 103 N 8.70 5.42 0.00 2.57 2.74 0.00 0.00 6.66 7.61 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 0.00 104 K 8.71 4.79 0.00 1.75 1.69 0.00 1.70 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.43 7.81 105 H 9.30 4.75 0.00 3.16 3.36 0.00 5.58 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.40 4.83 1.80 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 1.27 0.71 1.09 0.00 0.00 107 I 8.62 4.86 1.76 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.49 0.83 0.00 0.00 108 V 8.68 4.72 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 0.70 0.00 0.00 0.81 0.00 0.00 109 A 8.40 4.95 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 0.00 110 C 8.93 5.09 0.00 1.97 1.58 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 0.00 111 E 8.70 4.68 0.00 1.83 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 0.00 2.28 2.24 0.00 112 G 9.35 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 0.00 113 N 8.15 5.13 0.00 2.64 2.71 0.00 0.00 6.91 7.69 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 0.00 114 P 0.00 4.47 0.00 2.20 2.04 0.00 3.59 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.06 0.00 115 Y 8.60 4.51 0.00 2.80 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 0.00 116 V 8.45 4.44 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 0.67 0.00 0.00 0.88 0.00 0.00 117 P 0.00 4.41 0.00 0.49 1.16 0.00 3.28 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.77 0.00 118 V 8.76 4.45 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 0.63 0.00 0.00 0.99 0.00 0.00 119 H 7.89 5.08 0.00 3.25 3.12 0.00 5.85 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.98 4.53 0.00 2.61 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 0.00 121 D 8.04 4.53 0.00 2.51 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 0.00 122 A 6.86 4.75 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 0.00 123 S 8.77 5.33 0.00 4.02 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 0.00 124 V 8.85 4.15 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 0.87 0.00 0.00 0.95 0.00 0.00