NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.2877 8.1133 120.8590 55.6912 31.2993 174.9260 3 K 3.9818 8.5295 124.6883 57.3844 32.6224 175.8929 4 C 4.0859 9.8629 118.4252 57.9215 37.5930 172.8675 5 S 4.4042 7.6198 115.2540 57.7353 62.2328 175.1349 6 L 3.8821 8.6559 128.1558 56.7789 41.5813 177.8274 7 T 3.9960 6.9376 115.6464 64.3307 69.3765 173.0023 8 G 3.6155 7.8294 111.8349 44.0694 0.0000 171.5359 9 E 5.1689 8.2898 119.0066 54.4045 32.8759 175.4194 10 W 5.6828 9.2567 122.8651 55.0730 34.1619 173.7418 11 D 5.6251 9.3975 121.1482 51.8359 43.1858 173.7166 12 N 5.7776 8.8826 116.4931 49.7189 40.3444 174.9672 13 D 4.4251 8.6768 117.2646 55.6837 39.4963 177.0181 14 L 4.2478 8.2277 118.7235 55.0387 41.9824 177.5405 15 G 3.9941 8.1657 107.6671 44.8014 0.0000 174.1694 16 S 4.5894 7.9479 115.6219 58.6054 64.4981 173.1200 17 I 5.1554 8.5068 122.4349 59.7783 40.9149 174.5481 18 M 5.2380 9.2351 122.6365 53.6535 35.0752 173.9020 19 T 5.0321 8.8254 111.0628 60.0598 71.6718 172.7209 20 I 4.6921 8.9521 126.8075 59.5858 40.1286 176.0743 21 G 4.0650 8.5840 114.7995 45.5058 0.0000 173.1111 22 A 4.1699 8.6323 123.6472 52.1874 19.0762 177.3778 23 V 4.3658 7.6117 121.9329 61.3915 32.4713 176.1085 24 N 4.7967 8.7790 125.6541 51.8081 38.8289 175.5051 25 D 4.3657 8.5458 117.0078 57.2586 40.8323 177.2995 26 N 4.5352 8.3275 114.0430 53.2459 39.0558 175.8428 27 G 4.2395 8.4171 107.2033 46.3788 0.0000 173.0270 28 E 4.8506 8.4998 119.8566 55.8113 31.1034 175.5982 29 F 5.2899 8.3295 116.7286 55.7448 41.9938 172.6432 30 D 5.4570 8.6109 119.1042 51.7894 43.4822 173.8579 31 G 4.2266 7.3699 103.2952 46.8683 0.0000 171.7776 32 T 5.2265 8.2443 115.7648 61.8273 72.5841 172.7621 33 Y 4.8026 9.4297 127.4367 55.8409 41.6878 174.3340 34 I 4.5393 8.7806 127.8147 59.6765 39.2411 174.7991 35 T 4.5650 9.0151 121.8620 61.7581 67.9275 174.5637 36 A 4.2870 8.7544 130.9559 53.6809 19.0086 177.7604 37 V 4.4739 7.1985 107.2510 59.7947 35.5398 174.4529 38 A 4.2866 8.1240 122.2097 51.4383 21.6141 176.1813 39 D 4.4650 8.8765 119.8823 57.1166 41.0081 177.1705 40 N 4.8339 7.7466 117.5269 50.4513 39.5153 172.1796 41 P 4.2127 0.0000 0.0000 64.9829 31.7511 178.9470 42 G 3.6946 8.1204 105.3159 47.3684 0.0000 173.5405 43 N 4.6751 7.9609 116.2473 52.9919 39.4907 175.5375 44 I 2.0000 6.7404 120.2359 61.1311 37.4342 175.3207 45 T 4.7233 7.2809 113.3791 59.2710 72.0310 173.2459 46 L 4.3302 8.5328 121.7340 55.5597 42.2947 177.1547 47 S 5.0133 9.0062 118.2699 56.0386 67.3059 171.8886 48 P 5.0798 0.0000 0.0000 62.5943 32.8159 174.9023 49 L 5.3611 8.6962 120.9088 54.2744 44.4237 174.9992 50 L 4.6270 8.6718 121.3434 54.1941 46.1602 174.9641 51 G 3.8416 8.0525 111.9116 45.7544 0.0000 171.4017 52 I 5.3136 8.4180 119.3920 59.5647 41.5854 174.8929 53 Q 5.4307 9.3428 124.1088 54.4312 31.8821 174.9360 54 H 4.4745 9.0224 118.1478 56.1217 29.4350 175.6425 55 K 4.4408 8.5312 121.5027 58.0886 33.6877 178.3223 56 R 4.0244 8.1011 116.4492 58.8349 30.3013 177.3508 57 A 4.1379 7.8924 119.6443 52.1469 18.8099 177.7125 58 S 4.3280 8.6891 116.4049 60.7660 63.6436 174.5418 59 Q 4.8882 7.8116 118.7084 52.0635 28.2932 173.0638 60 P 4.6464 0.0000 0.0000 62.4230 33.6642 177.0839 61 T 4.7797 8.4190 112.1637 61.9810 70.8481 172.8021 62 F 5.3011 8.2828 116.1305 56.6230 41.8458 172.7620 63 G 4.7329 9.3177 105.9206 45.3982 0.0000 171.4864 64 F 5.5049 8.9218 114.0006 56.1208 41.8501 172.9846 65 T 5.0063 9.1252 117.0729 61.8904 71.4887 173.5578 66 V 4.3667 8.8071 125.8343 61.2742 33.7610 173.9790 67 H 4.3368 8.4212 129.2585 54.4272 29.9046 174.6819 68 W 4.2975 7.4892 126.8628 56.9000 29.0129 176.5322 69 N 4.7720 9.2816 121.9498 53.7559 38.3732 175.4982 70 F 5.0036 7.4344 111.4911 56.0819 38.9297 173.9608 71 S 4.5158 7.2155 114.3749 57.8554 65.4491 173.4867 72 E 4.2714 8.4513 117.8359 56.6650 29.1808 176.8907 73 S 4.7011 7.7178 114.8524 58.4745 64.0865 172.8778 74 T 5.0433 8.6490 118.8688 61.9538 72.7092 173.3024 75 S 5.3655 8.6490 120.2569 56.8894 66.9390 173.5002 76 V 4.9710 8.7496 115.1519 59.6744 35.5886 174.7211 77 F 5.3352 8.9393 122.0173 55.6671 42.7426 174.5385 78 V 4.5448 8.7301 121.4592 60.3813 35.2749 175.2666 79 G 4.1415 7.2188 106.7899 46.4523 0.0000 171.3552 80 Q 4.9368 8.0154 120.0127 54.4400 32.9104 174.1137 81 C 5.2589 9.0659 126.2995 55.5945 46.4198 172.2125 82 F 5.3142 9.4163 124.9489 55.7091 42.1401 174.4976 83 V 5.0919 9.0256 121.6916 61.2998 33.9030 175.3345 84 D 4.8519 8.8501 127.9805 51.6962 41.0959 177.5074 85 R 3.9330 8.4253 115.4650 59.0378 29.4223 178.0004 86 S 4.1707 8.0729 111.5848 59.4867 63.3207 174.8564 87 G 3.9542 8.4583 110.0055 44.8451 0.0000 173.0596 88 K 4.2530 8.5802 122.2997 56.0563 33.2577 175.5217 89 E 5.3665 8.8529 126.8139 55.2033 31.4184 175.6005 90 V 4.8411 8.9055 122.9902 61.2748 35.3237 174.0820 91 L 5.0703 9.2324 128.4767 53.6896 43.1242 175.8965 92 K 5.1175 9.1790 125.6389 55.6117 33.4110 176.2605 93 T 5.2979 9.1916 115.2528 59.8445 72.5669 173.0872 94 K 5.2170 8.9833 121.6097 54.4719 36.2611 175.1739 95 W 5.4491 8.4677 118.5847 54.7997 32.1329 173.7113 96 L 5.3699 8.7961 120.4157 53.0667 44.8243 175.1958 97 Q 5.0003 9.3907 124.7403 54.3873 31.7152 173.9280 98 R 4.8402 9.0427 127.9963 55.2501 31.6507 175.0964 99 L 4.8580 8.7836 126.6002 53.2613 43.5860 176.1213 100 A 4.2844 8.4347 124.0603 51.7422 19.0595 177.4362 101 V 4.4476 8.2202 115.1055 59.4805 34.8681 175.7522 102 D 4.5119 8.5600 121.3920 55.9531 41.3779 176.5434 103 D 4.8948 7.7280 118.1205 51.7706 43.9959 175.9920 104 I 3.6620 8.5564 126.3066 64.0602 38.0514 177.4457 105 S 4.3805 8.2253 113.3738 60.2190 63.2618 174.3727 106 D 4.9273 8.2409 121.2758 54.1716 41.0865 177.6048 107 D 4.3438 8.2113 122.5105 56.8766 41.3335 178.5216 108 W 4.3038 8.3396 115.2247 59.1984 27.9642 176.6780 109 I 2.8003 6.3392 116.8817 61.5498 37.5939 175.7419 110 A 4.2982 7.5936 121.7343 52.7851 19.2014 176.1112 111 T 5.0913 7.5933 112.6965 61.7275 71.0698 173.8495 112 R 4.7218 9.0519 126.4202 54.9480 32.2904 176.0044 113 V 4.3827 7.7171 120.8888 60.3465 34.5660 175.5434 114 G 3.0850 6.3210 106.9112 45.8468 0.0000 171.6213 115 N 5.5534 8.3773 116.0788 51.8374 40.9700 173.5476 116 N 5.3302 9.3041 115.4453 52.4713 44.1247 173.1619 117 D 5.7426 9.3376 122.2331 52.7483 43.7401 175.2927 118 F 5.6316 9.5971 121.9826 56.0646 42.3957 174.6033 119 T 5.4813 9.0305 111.2159 59.6841 72.7660 173.2545 120 R 3.8619 8.4939 120.9661 56.0377 30.8257 176.9276 121 Q 4.2156 8.3050 123.1850 56.4427 29.0193 175.5500 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 2 R 8.11 4.29 0.00 1.86 1.88 0.00 3.16 0.00 0.00 3.35 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 3 K 8.53 3.98 0.00 1.90 1.77 0.00 2.05 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.49 7.81 4 C 9.86 4.09 0.00 3.11 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 5 S 7.62 4.40 0.00 3.86 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 6 L 8.66 3.88 0.00 0.99 0.95 -0.33 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 7 T 6.94 4.00 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 1.17 0.00 0.00 8 G 7.83 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 9 E 8.29 5.17 0.00 1.77 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 2.21 2.29 0.00 10 W 9.26 5.68 0.00 3.20 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 11 D 9.40 5.63 0.00 2.79 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 12 N 8.88 5.78 0.00 2.33 1.42 0.00 0.00 6.65 7.94 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 13 D 8.68 4.43 0.00 2.83 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 14 L 8.23 4.25 0.00 1.86 1.79 1.05 0.94 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 G 8.17 3.99 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 0.00 0.00 0.00 16 S 7.95 4.59 0.00 3.97 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 17 I 8.51 5.16 1.83 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 1.28 0.98 0.92 0.00 0.00 18 M 9.24 5.24 0.00 1.49 1.94 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 19 T 8.83 5.03 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 1.18 0.00 0.00 20 I 8.95 4.69 1.92 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.60 0.56 0.00 0.00 21 G 8.58 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 0.00 0.00 0.00 22 A 8.63 4.17 1.25 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 23 V 7.61 4.37 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 0.93 0.00 0.00 0.94 0.00 0.00 24 N 8.78 4.80 0.00 3.00 2.98 0.00 0.00 6.55 8.03 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 25 D 8.55 4.37 0.00 2.69 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 26 N 8.33 4.54 0.00 2.90 2.84 0.00 0.00 7.06 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 27 G 8.42 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 28 E 8.50 4.85 0.00 2.02 1.78 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 2.23 2.22 0.00 29 F 8.33 5.29 0.00 3.04 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 30 D 8.61 5.46 0.00 2.87 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 31 G 7.37 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 0.00 0.00 0.00 0.00 32 T 8.24 5.23 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 1.30 0.00 0.00 33 Y 9.43 4.80 0.00 2.96 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 34 I 8.78 4.54 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 1.17 0.57 0.96 0.00 0.00 35 T 9.02 4.56 4.69 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 1.30 0.00 0.00 36 A 8.75 4.29 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 37 V 7.20 4.47 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 0.73 0.00 0.00 0.91 0.00 0.00 38 A 8.12 4.29 1.17 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 0.00 0.00 39 D 8.88 4.46 0.00 2.63 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 40 N 7.75 4.83 0.00 2.67 2.68 0.00 0.00 7.19 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 41 P 0.00 4.21 0.00 2.16 2.03 0.00 3.62 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.05 0.00 42 G 8.12 3.69 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 0.00 0.00 0.00 43 N 7.96 4.68 0.00 2.88 2.96 0.00 0.00 6.98 7.08 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 44 I 6.74 2.00 1.67 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 0.70 -0.01 0.75 0.00 0.00 45 T 7.28 4.72 4.33 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 1.29 0.00 0.00 46 L 8.53 4.33 0.00 1.63 1.74 0.95 0.84 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 47 S 9.01 5.01 0.00 3.90 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 48 P 0.00 5.08 0.00 2.07 2.15 0.00 3.96 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.93 0.00 49 L 8.70 5.36 0.00 1.87 1.70 0.81 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 50 L 8.67 4.63 0.00 1.69 1.41 0.89 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 51 G 8.05 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 52 I 8.42 5.31 1.85 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.81 0.90 0.00 0.00 53 Q 9.34 5.43 0.00 2.25 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.98 0.00 0.00 0.00 0.00 0.00 2.53 2.40 0.00 54 H 9.02 4.47 0.00 3.23 3.31 0.00 5.63 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 K 8.53 4.44 0.00 1.76 1.86 0.00 2.02 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.40 1.47 7.81 56 R 8.10 4.02 0.00 1.83 2.01 0.00 3.24 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 57 A 7.89 4.14 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 58 S 8.69 4.33 0.00 4.02 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 59 Q 7.81 4.89 0.00 1.85 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 7.03 0.00 0.00 0.00 0.00 0.00 2.29 2.20 0.00 60 P 0.00 4.65 0.00 2.25 2.27 0.00 3.67 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.99 0.00 61 T 8.42 4.78 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 1.12 0.00 0.00 62 F 8.28 5.30 0.00 3.52 3.29 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 0.00 63 G 9.32 4.73 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 64 F 8.92 5.50 0.00 3.23 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 65 T 9.13 5.01 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 1.22 0.00 0.00 66 V 8.81 4.37 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 -0.59 0.00 0.00 0.76 0.00 0.00 67 H 8.42 4.34 0.00 3.12 3.08 0.00 5.81 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 W 7.49 4.30 0.00 2.94 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 0.00 0.00 0.00 0.00 69 N 9.28 4.77 0.00 3.06 3.02 0.00 0.00 6.83 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 70 F 7.43 5.00 0.00 3.17 3.14 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 0.00 0.00 0.00 71 S 7.22 4.52 0.00 3.84 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 72 E 8.45 4.27 0.00 1.95 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 2.26 2.22 0.00 73 S 7.72 4.70 0.00 3.88 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 74 T 8.65 5.04 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 1.20 0.00 0.00 75 S 8.65 5.37 0.00 3.98 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 76 V 8.75 4.97 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 0.76 0.00 0.00 0.95 0.00 0.00 77 F 8.94 5.34 0.00 1.51 2.67 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 78 V 8.73 4.54 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 0.65 0.00 0.00 0.88 0.00 0.00 79 G 7.22 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 80 Q 8.02 4.94 0.00 1.93 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.02 6.81 0.00 0.00 0.00 0.00 0.00 1.39 2.19 0.00 81 C 9.07 5.26 0.00 3.03 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 82 F 9.42 5.31 0.00 3.04 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 83 V 9.03 5.09 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 0.86 0.00 0.00 1.01 0.00 0.00 84 D 8.85 4.85 0.00 2.99 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 85 R 8.43 3.93 0.00 1.96 2.13 0.00 3.05 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 1.61 1.64 0.00 86 S 8.07 4.17 0.00 4.01 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 87 G 8.46 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 88 K 8.58 4.25 0.00 1.90 2.08 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.47 7.81 89 E 8.85 5.37 0.00 2.12 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 2.38 2.38 0.00 90 V 8.91 4.84 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 1.28 0.00 0.00 1.07 0.00 0.00 91 L 9.23 5.07 0.00 1.79 1.77 -0.70 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 92 K 9.18 5.12 0.00 2.03 1.94 0.00 1.91 0.00 0.00 1.79 0.00 0.00 2.89 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.79 1.73 7.81 93 T 9.19 5.30 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 1.65 0.00 0.00 94 K 8.98 5.22 0.00 1.63 1.55 0.00 1.57 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.23 1.33 7.81 95 W 8.47 5.45 0.00 2.56 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 0.00 0.00 0.00 96 L 8.80 5.37 0.00 1.60 1.59 0.90 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 97 Q 9.39 5.00 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.85 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 98 R 9.04 4.84 0.00 1.96 1.91 0.00 3.32 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 99 L 8.78 4.86 0.00 1.45 1.51 0.86 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 100 A 8.43 4.28 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 0.00 101 V 8.22 4.45 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 0.67 0.00 0.00 0.93 0.00 0.00 102 D 8.56 4.51 0.00 2.66 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 0.00 103 D 7.73 4.89 0.00 2.71 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 0.00 104 I 8.56 3.66 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 1.50 1.20 0.93 0.00 0.00 105 S 8.23 4.38 0.00 4.12 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 0.00 106 D 8.24 4.93 0.00 2.83 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 0.00 107 D 8.21 4.34 0.00 2.92 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 0.00 108 W 8.34 4.30 0.00 3.60 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 0.00 109 I 6.34 2.80 0.56 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 -0.36 0.55 0.00 0.00 110 A 7.59 4.30 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 0.00 111 T 7.59 5.09 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 1.27 0.00 0.00 112 R 9.05 4.72 0.00 2.01 2.11 0.00 3.32 0.00 0.00 3.35 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 113 V 7.72 4.38 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 0.55 0.00 0.00 0.69 0.00 0.00 114 G 6.32 3.09 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 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.38 5.55 0.00 2.81 2.63 0.00 0.00 5.69 8.04 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 0.00 116 N 9.30 5.33 0.00 3.21 2.58 0.00 0.00 7.18 7.78 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 0.00 117 D 9.34 5.74 0.00 2.66 2.68 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 0.00 0.00 0.00 118 F 9.60 5.63 0.00 2.79 3.10 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 0.00 119 T 9.03 5.48 4.37 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 1.36 0.00 0.00 120 R 8.49 3.86 0.00 1.47 1.50 0.00 2.83 0.00 0.00 2.48 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.17 0.00 121 Q 8.30 4.22 0.00 1.96 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.55 0.00 0.00 0.00 0.00 0.00 2.34 2.29 0.00