NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.3985 8.4293 116.1862 55.0782 30.2943 173.2298 2 C 4.1166 7.6048 113.9908 56.8398 30.0860 172.1499 3 D 4.5502 8.3215 118.4422 55.0976 40.1935 175.4406 4 L 4.0714 8.0330 120.4508 57.1170 42.2478 175.7410 5 P 4.5607 0.0000 0.0000 62.3121 32.3105 175.3519 6 C 4.2998 8.4900 113.4775 57.8473 30.7232 175.0054 7 G 3.9538 8.3730 107.4210 45.4015 0.0000 172.8200 8 V 4.3615 7.3365 118.9180 61.0489 32.8323 174.3254 9 Y 4.7116 8.1700 123.4847 56.7532 42.1559 174.4430 10 D 3.7564 7.8931 118.1307 51.7246 43.9145 174.6645 11 P 4.0890 0.0000 0.0000 64.4964 31.2010 178.0836 12 A 4.0266 8.5366 120.6747 54.9387 17.6916 179.6843 13 Q 3.7608 7.9950 116.6566 59.0670 28.7736 178.8140 14 A 4.0811 7.7519 121.2622 55.0118 18.4527 179.3665 15 R 3.8483 8.0633 117.2576 59.7733 30.2609 178.7913 16 I 3.7018 7.9081 119.5511 64.5064 37.0738 178.3567 17 E 4.0096 7.9745 118.0648 59.3166 29.2861 179.2726 18 A 4.0893 8.2313 120.8448 54.9985 18.3166 179.5771 19 E 3.9677 8.3853 117.6323 59.6480 29.4182 179.6765 20 S 4.1197 7.9852 115.1212 61.3347 62.8449 176.7019 21 V 3.5695 7.7216 121.0324 66.0803 31.2862 178.0675 22 K 4.1344 8.1162 118.9849 59.4443 32.0530 178.5481 23 A 4.0348 8.2718 121.2562 55.2840 18.2026 179.7266 24 I 3.7695 8.1828 118.6952 64.6031 37.0105 178.7004 25 Q 4.0187 8.0843 119.0117 58.9561 28.0202 178.6492 26 E 4.0180 8.4052 119.6891 59.4062 29.5214 179.6014 27 K 3.8881 8.1742 118.5179 59.7455 31.9125 179.4010 28 M 4.4328 8.3046 118.1586 58.2484 31.9160 178.3344 29 A 4.1484 7.9979 119.5627 54.1428 18.5958 178.5301 30 A 4.6166 7.3415 117.7290 51.5741 19.9785 176.1914 31 N 4.6738 7.7673 115.5248 52.1800 39.5440 173.5710 32 D 4.7295 8.5859 124.8143 54.3098 41.4282 177.0350 33 D 4.4187 8.5955 120.7662 54.2933 42.4060 176.3161 34 L 3.9393 8.6894 128.4032 58.9982 42.2122 178.9897 35 H 4.1587 8.3370 115.3470 58.6091 28.6382 177.5382 36 F 4.1747 8.7331 122.7339 61.3457 39.2914 177.1728 37 Q 3.9046 8.4658 117.9437 58.9456 28.4106 179.0548 38 I 3.6217 7.8314 120.6467 64.5340 37.1439 178.6510 39 R 3.8123 7.9603 118.5261 59.2030 29.8083 179.0387 40 A 3.6916 8.0306 120.7468 55.2994 18.2477 179.8796 41 T 3.7427 7.7924 114.2131 66.5823 68.3858 177.0829 42 V 3.5214 7.8320 120.2229 66.2344 31.5326 178.2457 43 I 3.9941 7.8890 121.0684 63.5689 36.9014 178.2932 44 K 3.8832 8.3834 121.0413 59.3666 31.9917 178.4044 45 E 3.9064 8.1520 119.6358 59.3793 29.6506 178.9296 46 Q 3.9613 7.7277 118.1248 59.1628 28.8301 179.0052 47 R 4.0606 8.2597 118.9766 59.0203 30.0028 178.9857 48 A 4.0144 8.2297 120.8903 55.0372 18.3100 179.2708 49 E 3.8698 8.1707 117.8682 59.3915 29.6045 179.1144 50 L 3.9286 7.9797 118.8464 57.5916 41.6641 179.2643 51 A 4.0538 8.1629 120.7626 55.1384 18.2632 179.8203 52 K 3.9075 8.2626 117.0936 59.8238 32.1421 178.9613 53 H 4.1484 8.3879 118.5255 59.7314 29.8967 176.9755 54 H 4.2318 8.3829 118.1119 58.9012 28.5095 177.8678 55 L 4.1068 8.0730 120.8302 57.8860 41.4575 179.1643 56 D 4.5701 8.5592 119.3299 57.4486 40.7096 179.1268 57 V 3.7476 8.0421 118.7414 65.9541 31.4891 178.0782 58 L 3.9870 7.9859 118.4398 57.5352 41.2545 179.3621 59 W 4.6520 8.4790 127.3799 60.7130 30.8350 177.7958 60 S 4.0328 8.8334 113.2355 60.3224 62.8646 175.0956 61 D 4.7331 8.3292 120.8563 56.0357 41.8682 177.3880 62 Y 3.3679 7.5951 118.1590 60.1595 39.0133 175.8122 63 F 4.0376 7.9509 118.3510 57.3763 39.4882 175.3002 64 K 4.5090 8.0345 124.0566 53.7143 35.0071 175.2910 65 P 4.4405 0.0000 0.0000 65.9344 31.0103 177.1379 66 P 4.2713 0.0000 0.0000 65.8107 31.0917 178.4152 67 H 4.2958 8.0015 115.1411 58.9794 28.5046 177.9069 68 F 4.2605 7.7924 118.8790 60.2071 38.5173 177.5721 69 E 4.1215 7.8358 117.5424 59.5363 29.4171 179.1263 70 S 4.1487 8.1215 114.2321 60.0460 64.1933 174.2443 71 Y 4.6782 7.9179 119.2663 54.6235 37.8592 173.9549 72 P 4.4390 0.0000 0.0000 64.2097 32.0701 177.1777 73 E 4.4732 8.1306 115.7160 56.3002 30.2950 177.5009 74 L 3.9444 8.3815 122.4434 58.4597 42.0421 178.3853 75 H 4.4208 8.3781 115.5530 59.5018 28.7091 177.6784 76 T 3.8158 7.9608 116.8052 66.3842 68.3053 176.2138 77 L 3.7985 8.2364 122.5611 58.2559 42.1623 179.2943 78 V 3.5546 7.9705 118.2689 65.9366 31.4610 177.4483 79 N 4.0504 8.1049 116.8532 56.6470 38.6845 176.7538 80 E 3.7174 8.3638 120.2298 58.9273 29.3699 179.1787 81 A 3.9068 7.5680 120.8198 55.3434 18.5351 180.1949 82 V 3.5856 7.7696 110.9327 64.4401 31.5739 179.0596 83 K 3.9867 8.0816 118.1392 59.2181 31.8125 179.2892 84 A 4.1073 8.1515 121.3852 55.0091 18.2615 179.7079 85 L 4.0235 7.8945 117.7790 57.9558 41.3946 179.7850 86 S 4.1202 8.1615 115.0450 61.5088 62.5132 176.5917 87 A 3.9966 7.9898 122.4416 55.0375 18.4311 179.2632 88 A 4.1745 7.9250 120.7635 54.5889 18.1741 179.9548 89 K 3.9254 7.8129 116.2837 59.2455 32.1987 178.3876 90 A 4.4549 7.3135 117.7171 51.3060 19.0379 176.6421 91 S 4.6906 7.3257 112.0774 57.0641 65.5731 173.8286 92 T 4.3867 8.3385 112.9714 61.2315 69.5827 173.6693 93 D 4.5461 8.2607 124.2599 53.1715 41.4276 175.0733 94 P 4.5997 0.0000 0.0000 64.7096 31.2589 178.3237 95 A 4.0080 8.7427 120.6460 55.1430 17.6721 179.7318 96 T 4.0028 8.2549 108.8380 64.8477 68.9783 177.2666 97 G 3.6205 8.1078 108.1806 47.5728 0.0000 175.3425 98 Q 3.9873 8.3516 122.1630 58.6765 29.0809 178.1047 99 K 3.7515 8.2022 120.5832 59.4139 32.1673 178.6486 100 A 4.1790 7.8742 120.9810 55.2359 18.3422 179.6193 101 L 3.9861 7.8638 117.3983 57.9470 41.5160 179.5338 102 D 4.3284 8.2567 119.1962 57.5534 40.7459 178.4239 103 Y 4.3084 7.7960 117.1394 61.2177 37.8220 178.5748 104 I 3.7956 8.1829 120.6341 64.4028 37.2933 178.3350 105 A 4.1073 8.2326 121.6004 55.2136 18.0268 179.7685 106 Q 4.0329 7.9547 116.5267 59.1965 28.7289 178.9556 107 I 3.7997 7.9709 120.9548 64.3083 37.1485 177.8848 108 D 4.3959 8.6259 119.4001 57.3916 41.0892 178.5852 109 K 4.1953 8.1099 118.4710 59.6440 32.1027 179.4897 110 I 3.4835 7.6395 120.0349 63.9505 36.9477 177.9807 111 F 4.0796 8.6255 121.9938 61.4708 39.2405 177.4526 112 W 4.1366 8.3251 118.0011 59.4488 28.8865 178.5422 113 E 4.0846 8.0607 118.8496 59.5881 28.7039 179.3765 114 T 3.9766 7.6984 108.7385 64.6282 68.8264 176.5159 115 K 4.0125 7.4318 120.7014 59.0234 32.0933 178.9717 116 K 4.2177 7.8875 116.8927 58.2637 32.2184 177.4285 117 A 4.3273 7.7010 124.8816 52.5614 18.4816 176.8993 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 H 8.43 4.40 0.00 3.20 3.14 0.00 5.48 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 C 7.60 4.12 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 3 D 8.32 4.55 0.00 2.86 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 4 L 8.03 4.07 0.00 1.59 1.74 0.91 0.97 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 5 P 0.00 4.56 0.00 2.29 2.09 0.00 3.81 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 6 C 8.49 4.30 0.00 3.02 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 G 8.37 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 0.00 0.00 0.00 8 V 7.34 4.36 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 0.89 0.00 0.00 0.94 0.00 0.00 9 Y 8.17 4.71 0.00 2.73 2.43 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 10 D 7.89 3.76 0.00 2.58 2.36 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 11 P 0.00 4.09 0.00 2.23 1.86 0.00 3.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.98 0.00 12 A 8.54 4.03 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 13 Q 8.00 3.76 0.00 1.84 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.21 2.30 0.00 14 A 7.75 4.08 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 15 R 8.06 3.85 0.00 1.90 2.09 0.00 3.12 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.69 0.00 16 I 7.91 3.70 1.86 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 1.52 1.15 0.91 0.00 0.00 17 E 7.97 4.01 0.00 2.20 2.21 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 2.55 2.56 0.00 18 A 8.23 4.09 1.40 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 0.00 0.00 19 E 8.39 3.97 0.00 2.23 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 2.34 2.53 0.00 20 S 7.99 4.12 0.00 4.09 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 21 V 7.72 3.57 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 1.00 0.00 0.00 0.99 0.00 0.00 22 K 8.12 4.13 0.00 1.89 1.80 0.00 1.77 0.00 0.00 1.66 0.00 0.00 3.13 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.45 1.61 7.81 23 A 8.27 4.03 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 24 I 8.18 3.77 2.03 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 1.54 0.81 0.87 0.00 0.00 25 Q 8.08 4.02 0.00 2.30 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.62 0.00 26 E 8.41 4.02 0.00 2.18 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 2.56 2.51 0.00 27 K 8.17 3.89 0.00 2.24 2.09 0.00 1.82 0.00 0.00 1.79 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.50 1.75 7.81 28 M 8.30 4.43 0.00 2.04 2.32 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.91 2.51 0.00 29 A 8.00 4.15 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 30 A 7.34 4.62 1.23 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 0.00 0.00 31 N 7.77 4.67 0.00 2.36 2.33 0.00 0.00 7.22 8.48 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 32 D 8.59 4.73 0.00 2.73 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 33 D 8.60 4.42 0.00 2.85 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 34 L 8.69 3.94 0.00 1.80 1.66 0.89 1.03 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 35 H 8.34 4.16 0.00 3.48 3.40 0.00 5.87 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 F 8.73 4.17 0.00 3.18 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 37 Q 8.47 3.90 0.00 2.29 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.69 2.60 0.00 38 I 7.83 3.62 1.98 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.75 0.87 0.00 0.00 39 R 7.96 3.81 0.00 1.70 1.89 0.00 3.16 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.83 0.00 40 A 8.03 3.69 0.77 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 0.00 0.00 41 T 7.79 3.74 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 1.17 0.00 0.00 42 V 7.83 3.52 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 0.97 0.00 0.00 43 I 7.89 3.99 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.88 0.89 0.00 0.00 44 K 8.38 3.88 0.00 1.81 1.95 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.44 7.81 45 E 8.15 3.91 0.00 2.30 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 2.29 2.38 0.00 46 Q 7.73 3.96 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.62 0.00 47 R 8.26 4.06 0.00 1.82 2.11 0.00 3.29 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.79 0.00 48 A 8.23 4.01 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 49 E 8.17 3.87 0.00 2.20 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 2.29 2.38 0.00 50 L 7.98 3.93 0.00 1.94 1.69 0.93 0.77 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 51 A 8.16 4.05 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 8.26 3.91 0.00 1.99 1.87 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.65 7.81 53 H 8.39 4.15 0.00 3.21 3.42 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 H 8.38 4.23 0.00 3.36 3.28 0.00 5.67 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 55 L 8.07 4.11 0.00 1.89 1.77 0.95 1.16 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 56 D 8.56 4.57 0.00 2.90 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 57 V 8.04 3.75 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.88 0.00 0.00 58 L 7.99 3.99 0.00 2.10 1.69 0.76 0.21 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 59 W 8.48 4.65 0.00 3.47 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 60 S 8.83 4.03 0.00 4.05 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 0.00 61 D 8.33 4.73 0.00 3.04 3.01 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 62 Y 7.60 3.37 0.00 1.43 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 0.00 0.00 0.00 63 F 7.95 4.04 0.00 2.93 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 0.00 0.00 0.00 64 K 8.03 4.51 0.00 1.40 1.54 0.00 1.60 0.00 0.00 1.65 0.00 0.00 2.77 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.21 1.13 7.81 65 P 0.00 4.44 0.00 2.14 2.16 0.00 3.55 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.24 0.00 66 P 0.00 4.27 0.00 2.01 2.04 0.00 3.36 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.12 0.00 67 H 8.00 4.30 0.00 2.96 3.14 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 F 7.79 4.26 0.00 3.21 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.84 4.12 0.00 2.16 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.50 0.00 70 S 8.12 4.15 0.00 3.65 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 71 Y 7.92 4.68 0.00 2.95 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 72 P 0.00 4.44 0.00 2.07 2.18 0.00 3.73 0.00 0.00 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.24 0.00 73 E 8.13 4.47 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.27 0.00 74 L 8.38 3.94 0.00 1.81 1.84 0.60 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 75 H 8.38 4.42 0.00 3.27 3.35 0.00 5.68 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 T 7.96 3.82 4.40 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 1.22 0.00 0.00 77 L 8.24 3.80 0.00 1.84 1.85 1.05 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 78 V 7.97 3.55 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 1.19 0.00 0.00 79 N 8.10 4.05 0.00 2.71 2.75 0.00 0.00 7.24 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 80 E 8.36 3.72 0.00 1.34 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 2.14 2.40 0.00 81 A 7.57 3.91 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 82 V 7.77 3.59 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.83 0.00 0.00 83 K 8.08 3.99 0.00 1.92 1.81 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.47 7.81 84 A 8.15 4.11 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 0.00 0.00 85 L 7.89 4.02 0.00 1.91 1.73 0.96 0.92 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 86 S 8.16 4.12 0.00 4.04 3.90 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 87 A 7.99 4.00 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 88 A 7.92 4.17 1.40 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 0.00 0.00 89 K 7.81 3.93 0.00 1.98 2.02 0.00 1.69 0.00 0.00 1.95 0.00 0.00 3.22 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.64 7.81 90 A 7.31 4.45 1.27 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 0.00 0.00 91 S 7.33 4.69 0.00 3.82 3.77 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 92 T 8.34 4.39 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 1.21 0.00 0.00 93 D 8.26 4.55 0.00 2.70 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 P 0.00 4.60 0.00 2.20 2.21 0.00 3.94 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 2.22 1.99 0.00 95 A 8.74 4.01 1.40 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 0.00 0.00 96 T 8.25 4.00 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 1.22 0.00 0.00 97 G 8.11 3.62 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 0.00 0.00 0.00 0.00 98 Q 8.35 3.99 0.00 2.25 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.74 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 99 K 8.20 3.75 0.00 1.95 1.96 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.24 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.29 7.81 100 A 7.87 4.18 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 L 7.86 3.99 0.00 1.93 1.74 0.98 1.08 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 0.00 102 D 8.26 4.33 0.00 2.59 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 Y 7.80 4.31 0.00 3.22 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 0.00 104 I 8.18 3.80 2.06 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.91 0.94 0.00 0.00 105 A 8.23 4.11 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 0.00 106 Q 7.95 4.03 0.00 2.39 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.75 0.00 0.00 0.00 0.00 0.00 2.43 2.62 0.00 107 I 7.97 3.80 2.11 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 1.48 0.94 1.10 0.00 0.00 108 D 8.63 4.40 0.00 2.93 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 0.00 109 K 8.11 4.20 0.00 2.08 1.91 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.55 1.76 7.81 110 I 7.64 3.48 1.85 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.94 0.09 0.00 0.00 111 F 8.63 4.08 0.00 3.05 3.01 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 0.00 112 W 8.33 4.14 0.00 3.53 3.25 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 0.00 113 E 8.06 4.08 0.00 2.10 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 2.40 2.54 0.00 114 T 7.70 3.98 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 1.23 0.00 0.00 115 K 7.43 4.01 0.00 1.94 1.90 0.00 1.46 0.00 0.00 0.87 0.00 0.00 2.88 0.00 0.00 3.12 0.00 0.00 0.00 0.00 0.35 0.27 7.81 116 K 7.89 4.22 0.00 1.92 1.91 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.54 1.80 7.81 117 A 7.70 4.33 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