NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 I 4.0608 8.0244 120.7858 60.4850 38.6274 174.6728 4 K 4.0090 8.5209 129.9140 54.9171 32.9000 172.5205 5 E 4.4016 9.2955 128.0818 54.9997 31.6127 175.2406 6 L 4.5237 8.3154 125.5555 54.9402 42.6241 176.6882 7 H 4.4115 9.0241 120.5600 56.0645 30.0585 174.4347 8 V 4.6610 8.4218 122.2408 61.2545 33.2397 174.8845 9 K 4.4513 8.9662 127.8338 54.9510 34.6151 175.6382 10 T 4.7066 8.4552 123.1053 62.7971 69.0070 174.9225 11 V 4.4551 8.4448 119.9514 59.3388 35.5126 175.1251 12 K 4.7040 8.2208 119.8890 54.0528 34.9241 176.0590 13 R 4.4576 8.7647 121.1623 58.4057 30.2037 177.2814 14 G 3.9756 9.2650 112.4099 45.7083 0.0000 173.4784 15 E 4.2857 7.9180 119.5409 56.4350 30.9435 175.4025 16 N 5.4599 8.4651 117.8622 51.8002 41.2849 175.0399 17 V 4.4748 8.7979 120.2435 60.3981 35.3207 174.1711 18 T 4.8756 8.3439 118.6635 62.0653 71.7552 172.9040 19 M 4.5588 9.0070 126.3356 53.6262 34.1346 175.0659 20 E 5.1218 8.8965 123.4825 55.9521 31.5735 176.5892 21 C 4.9404 9.2934 122.3506 55.7402 47.5101 172.9556 22 S 5.0921 8.8321 120.9876 57.8926 63.2713 173.5591 23 M 4.3453 9.0707 125.7105 55.7242 32.5195 178.4700 24 S 4.0886 8.0818 114.3921 61.0947 62.9224 175.6434 25 K 4.3824 7.7484 116.5496 55.2738 32.2955 176.5224 26 V 3.9396 7.8293 119.8886 62.3378 31.7129 175.9018 27 K 4.2458 8.6909 125.0391 57.0238 33.8886 176.1200 28 D 4.2296 7.5965 119.7607 53.1957 42.6010 175.4964 29 K 3.7507 8.1860 127.6728 58.8718 32.1593 179.3532 30 N 4.4946 7.7111 115.1565 55.4449 38.7754 175.7849 31 K 4.2779 8.2673 116.7927 56.2082 32.9632 175.8356 32 L 4.6570 7.3711 120.6077 54.2879 42.7689 175.9763 33 A 5.3150 8.9271 124.0597 50.6870 23.6597 174.3953 34 W 5.4979 9.3715 119.2432 55.5130 31.8035 175.1983 35 Y 5.3686 10.3552 122.0253 56.3798 40.6646 174.4887 36 R 4.4701 9.2526 124.0355 54.4287 32.7181 174.3556 37 Q 4.7533 8.6035 127.7104 54.3999 31.3806 175.0766 38 S 4.7648 8.4715 122.6794 57.2962 64.9356 173.6877 39 F 4.1230 8.8559 123.5991 60.1306 39.2601 175.5464 40 G 3.5710 8.0748 114.5112 45.5621 0.0000 172.7005 41 K 4.6559 7.5337 117.9777 53.7429 35.3745 176.0916 42 V 4.0338 8.0031 119.7053 60.8924 32.3048 174.4382 43 P 4.8449 0.0000 0.0000 63.1120 32.4101 175.4811 44 Q 4.8062 9.2022 122.3940 54.6046 32.6059 173.3750 45 Y 4.1880 9.0173 127.6837 57.6571 39.8364 175.4902 46 F 4.4667 8.6439 119.2583 55.8517 40.2530 174.6883 47 V 4.6509 6.5189 117.1656 60.7668 34.1297 172.2521 48 R 5.4302 9.1295 119.9861 54.0863 33.4955 173.7004 49 Y 4.9607 8.6733 121.0025 58.7565 39.7487 175.3712 50 Y 4.6423 7.9319 126.7153 56.1273 42.2496 173.8641 51 S 3.8475 8.6398 122.5143 59.2274 62.4422 173.1929 52 S 4.5276 7.5388 121.1556 58.3535 64.6097 176.6717 53 N 4.5253 8.7668 117.5310 56.1704 38.5973 177.2632 54 S 4.1466 7.9762 112.0797 60.0599 63.5424 175.2928 55 G 4.3037 9.7627 108.1144 44.3667 0.0000 171.4550 56 Y 5.5914 6.8235 115.4643 57.1795 40.9931 173.3872 57 K 4.1624 8.1712 117.5281 55.4742 35.4212 173.9332 58 F 5.1277 8.7400 125.1135 56.2271 40.5143 175.4385 59 A 4.2110 8.5034 124.4127 51.2339 19.5103 177.0949 60 E 4.0705 9.0277 119.3580 58.1839 29.8607 177.5518 61 G 3.7858 8.7668 111.7453 46.5674 0.0000 173.0060 62 F 4.3859 8.0423 122.6093 55.9590 39.5147 175.4684 63 K 4.0352 7.5710 127.5257 54.7042 34.2306 176.0981 64 D 4.2729 7.5478 124.3807 53.0780 43.0219 175.9398 65 S 4.3804 8.6183 122.0463 60.6043 63.8417 175.5643 66 R 4.0756 8.3289 120.4733 58.3511 30.8197 176.3957 67 F 5.1472 8.1495 118.1235 56.7847 40.3943 175.6744 68 S 4.8626 8.8739 116.6166 58.3855 66.2915 172.3577 69 M 4.7654 7.8907 116.6897 54.6404 36.2115 175.0416 70 T 4.4994 8.7213 117.7105 62.0215 71.4219 173.1122 71 V 5.1388 8.1053 126.4359 61.3525 34.5537 174.5437 72 N 4.6969 8.5898 122.7967 52.9283 40.1290 174.3762 73 D 4.6346 8.9014 116.8207 56.5981 41.4112 176.9139 74 Q 4.5938 9.9375 119.1836 56.3668 31.3090 175.8802 75 K 5.0995 8.2040 116.1025 53.8567 36.2312 176.2540 76 F 5.2282 9.0574 124.0299 57.1900 38.2955 174.2438 77 D 5.0574 8.5421 120.9680 53.4430 43.1553 177.1564 78 L 4.4449 8.4605 125.6999 53.5840 43.9339 174.8641 79 N 5.4153 9.0428 122.8243 51.4350 42.8344 173.3833 80 I 4.5321 8.4969 122.5208 59.4724 40.9294 174.3294 81 I 4.4066 8.3521 128.4890 60.3338 38.1039 175.3655 82 G 3.4897 8.3693 116.7928 45.8946 0.0000 172.4397 83 T 4.2167 8.4136 115.5707 62.2658 68.7404 173.4502 84 R 4.9089 8.6829 126.8353 53.8988 33.6451 176.4590 85 E 2.5400 8.2811 119.8401 59.1929 29.4075 178.9861 86 D 4.6070 7.6949 115.1045 54.4455 40.0163 177.0124 87 D 4.6704 8.6372 120.6836 56.7750 41.0813 177.0180 88 G 4.0997 7.7399 107.0115 45.1613 0.0000 174.2469 89 G 3.7872 7.3564 110.3006 44.6964 0.0000 171.0653 90 E 5.1899 8.0227 119.2438 54.6647 33.1356 175.0670 91 Y 4.8753 8.6886 119.8660 56.2400 41.6115 174.5626 92 F 5.6380 9.5797 122.8120 55.8719 43.2518 173.2242 93 C 4.6528 9.4555 123.3715 54.8528 41.7024 172.5626 94 G 4.1607 9.2214 113.4803 44.2257 0.0000 170.7067 95 E 4.7547 8.4690 126.2940 54.5597 31.0064 175.3530 96 V 3.7487 8.0070 128.1307 62.7746 32.3853 175.8756 97 E 4.3758 9.1710 126.4059 55.7098 31.5971 176.4263 98 G 3.9177 8.3007 118.8425 46.9604 0.0000 174.2372 99 N 4.6854 8.9975 122.8675 53.0319 39.5692 174.2277 100 T 4.6155 7.4700 107.6307 59.4729 71.9071 172.0256 101 I 4.4928 7.8480 122.0376 59.1937 40.0804 174.2819 102 K 4.3094 8.4493 130.1940 54.7231 34.1009 174.7534 103 F 5.1613 8.6287 126.8043 56.7190 39.1734 175.8068 104 T 4.3090 8.6113 114.9921 62.8021 69.8847 174.4581 105 S 4.7279 7.6055 115.2640 57.9049 66.6535 173.1057 106 G 4.8100 8.4305 105.9434 46.4599 0.0000 172.1440 107 T 5.4280 9.3419 116.3052 61.7336 73.1031 173.4736 108 R 4.7633 9.1032 126.9131 55.2988 31.6822 174.7787 109 L 4.9823 9.1700 130.7115 53.9514 43.3740 175.1996 110 Q 4.9955 9.2515 124.4535 54.4301 32.6756 175.6522 111 F 4.8378 8.8348 117.0747 56.9973 39.4321 175.6778 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 3 I 8.02 4.06 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.33 0.91 0.00 0.00 4 K 8.52 4.01 0.00 1.85 1.71 0.00 2.05 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.46 7.81 5 E 9.30 4.40 0.00 1.95 1.82 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 2.27 2.40 0.00 6 L 8.32 4.52 0.00 1.66 1.72 1.13 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 7 H 9.02 4.41 0.00 3.18 3.27 0.00 5.58 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 8 V 8.42 4.66 2.11 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 0.82 0.00 0.00 0.98 0.00 0.00 9 K 8.97 4.45 0.00 1.65 1.59 0.00 1.63 0.00 0.00 1.55 0.00 0.00 3.00 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.29 1.37 7.81 10 T 8.46 4.71 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 1.15 0.00 0.00 11 V 8.44 4.46 1.76 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 0.58 0.00 0.00 -0.06 0.00 0.00 12 K 8.22 4.70 0.00 1.79 1.72 0.00 1.71 0.00 0.00 1.76 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.58 7.81 13 R 8.76 4.46 0.00 1.82 1.96 0.00 3.48 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 14 G 9.26 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 15 E 7.92 4.29 0.00 1.94 1.83 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 2.30 2.47 0.00 16 N 8.47 5.46 0.00 2.51 2.62 0.00 0.00 6.65 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 17 V 8.80 4.47 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 0.65 0.00 0.00 0.78 0.00 0.00 18 T 8.34 4.88 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 1.14 0.00 0.00 19 M 9.01 4.56 0.00 1.68 1.32 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.33 0.00 20 E 8.90 5.12 0.00 1.89 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.31 0.00 21 C 9.29 4.94 0.00 3.14 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 S 8.83 5.09 0.00 3.93 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 23 M 9.07 4.35 0.00 2.03 2.27 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.91 2.74 0.00 24 S 8.08 4.09 0.00 4.00 4.03 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 0.00 0.00 0.00 25 K 7.75 4.38 0.00 1.72 1.82 0.00 1.75 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.38 7.81 26 V 7.83 3.94 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 0.78 0.00 0.00 0.84 0.00 0.00 27 K 8.69 4.25 0.00 1.83 1.83 0.00 1.62 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.27 1.27 7.81 28 D 7.60 4.23 0.00 2.62 2.42 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 29 K 8.19 3.75 0.00 0.79 0.74 0.00 1.45 0.00 0.00 1.44 0.00 0.00 2.80 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.03 1.06 7.81 30 N 7.71 4.49 0.00 2.87 2.89 0.00 0.00 6.95 6.92 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 31 K 8.27 4.28 0.00 1.77 1.91 0.00 1.87 0.00 0.00 1.68 0.00 0.00 2.83 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.33 1.32 7.81 32 L 7.37 4.66 0.00 1.38 0.72 0.04 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 33 A 8.93 5.32 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 34 W 9.37 5.50 0.00 2.98 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 35 Y 10.36 5.37 0.00 3.27 3.22 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 36 R 9.25 4.47 0.00 1.15 1.41 0.00 2.39 0.00 0.00 2.73 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.50 0.00 37 Q 8.60 4.75 0.00 2.17 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.67 0.00 0.00 0.00 0.00 0.00 2.23 2.48 0.00 38 S 8.47 4.76 0.00 3.83 3.79 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 39 F 8.86 4.12 0.00 2.96 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 40 G 8.07 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.53 4.66 0.00 1.82 1.70 0.00 1.72 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.47 7.81 42 V 8.00 4.03 2.11 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 0.77 0.00 0.00 0.95 0.00 0.00 43 P 0.00 4.84 0.00 2.18 2.33 0.00 3.72 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.26 0.00 44 Q 9.20 4.81 0.00 2.15 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.00 0.00 0.00 0.00 0.00 0.00 2.30 2.44 0.00 45 Y 9.02 4.19 0.00 2.44 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 46 F 8.64 4.47 0.00 2.43 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 6.52 4.65 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 0.03 0.00 0.00 0.25 0.00 0.00 48 R 9.13 5.43 0.00 2.11 2.21 0.00 2.81 0.00 0.00 3.08 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.73 0.00 49 Y 8.67 4.96 0.00 2.93 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 50 Y 7.93 4.64 0.00 3.02 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 51 S 8.64 3.85 0.00 3.98 3.66 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.54 4.53 0.00 3.98 3.72 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 53 N 8.77 4.53 0.00 2.73 2.91 0.00 0.00 6.86 7.57 0.00 0.00 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 S 7.98 4.15 0.00 3.71 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 55 G 9.76 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 56 Y 6.82 5.59 0.00 2.86 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 57 K 8.17 4.16 0.00 1.34 1.42 0.00 1.61 0.00 0.00 1.75 0.00 0.00 2.79 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.01 0.48 7.81 58 F 8.74 5.13 0.00 3.11 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 59 A 8.50 4.21 0.84 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 60 E 9.03 4.07 0.00 2.02 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 2.36 2.43 0.00 61 G 8.77 3.79 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 0.00 0.00 0.00 62 F 8.04 4.39 0.00 3.03 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 63 K 7.57 4.04 0.00 1.55 1.52 0.00 1.76 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.22 1.30 7.81 64 D 7.55 4.27 0.00 1.98 2.28 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 65 S 8.62 4.38 0.00 4.03 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 66 R 8.33 4.08 0.00 1.93 1.94 0.00 3.34 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.60 0.00 67 F 8.15 5.15 0.00 3.38 3.48 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 68 S 8.87 4.86 0.00 3.92 4.11 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 69 M 7.89 4.77 0.00 1.12 0.57 0.00 0.00 0.00 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.89 0.00 70 T 8.72 4.50 4.20 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 1.23 0.00 0.00 71 V 8.11 5.14 2.44 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 1.18 0.00 0.00 1.00 0.00 0.00 72 N 8.59 4.70 0.00 3.01 2.96 0.00 0.00 6.76 8.22 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 73 D 8.90 4.63 0.00 2.73 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 74 Q 9.94 4.59 0.00 2.03 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.74 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 75 K 8.20 5.10 0.00 1.86 1.74 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.82 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.41 7.81 76 F 9.06 5.23 0.00 2.96 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 77 D 8.54 5.06 0.00 2.72 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 78 L 8.46 4.44 0.00 0.34 0.15 0.90 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 79 N 9.04 5.42 0.00 2.53 2.50 0.00 0.00 6.52 7.35 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 80 I 8.50 4.53 1.51 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.10 0.48 0.00 0.00 81 I 8.35 4.41 1.80 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 1.09 0.46 0.87 0.00 0.00 82 G 8.37 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 T 8.41 4.22 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 1.35 0.00 0.00 84 R 8.68 4.91 0.00 1.84 1.69 0.00 3.18 0.00 0.00 3.15 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 85 E 8.28 2.54 0.00 1.72 1.55 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 0.00 2.10 1.66 0.00 86 D 7.69 4.61 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 87 D 8.64 4.67 0.00 3.02 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 88 G 7.74 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 89 G 7.36 3.79 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 0.00 0.00 0.00 90 E 8.02 5.19 0.00 1.55 1.57 0.00 0.00 0.00 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 2.27 0.00 91 Y 8.69 4.88 0.00 2.99 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 92 F 9.58 5.64 0.00 2.75 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 C 9.46 4.65 0.00 1.23 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 94 G 9.22 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 95 E 8.47 4.75 0.00 1.92 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.08 0.00 96 V 8.01 3.75 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 0.74 0.00 0.00 0.86 0.00 0.00 97 E 9.17 4.38 0.00 1.92 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 2.24 2.15 0.00 98 G 8.30 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 N 9.00 4.69 0.00 2.68 2.84 0.00 0.00 6.55 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 T 7.47 4.62 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 1.17 0.00 0.00 101 I 7.85 4.49 1.56 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.59 0.33 0.00 0.00 102 K 8.45 4.31 0.00 1.87 1.47 0.00 1.59 0.00 0.00 1.57 0.00 0.00 2.78 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.27 1.31 7.81 103 F 8.63 5.16 0.00 2.83 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 0.00 104 T 8.61 4.31 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 1.17 0.00 0.00 105 S 7.61 4.73 0.00 4.09 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 0.00 106 G 8.43 4.81 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 0.00 0.00 0.00 107 T 9.34 5.43 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 1.29 0.00 0.00 108 R 9.10 4.76 0.00 1.98 1.89 0.00 3.16 0.00 0.00 3.18 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 109 L 9.17 4.98 0.00 1.85 1.88 0.78 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 110 Q 9.25 5.00 0.00 2.11 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.52 0.00 0.00 0.00 0.00 0.00 2.35 2.28 0.00 111 F 8.83 4.84 0.00 3.01 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