NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 D 4.6493 8.3644 120.3204 53.5604 40.5260 175.5582 3 N 4.9425 8.6102 115.1650 50.7025 39.8800 174.2811 4 S 4.3850 10.0416 118.7312 60.4666 63.9327 175.9007 5 R 4.0752 8.0320 121.4751 59.1845 29.8608 178.1528 6 Y 4.5397 8.3009 120.6291 60.4574 38.7738 177.8319 7 T 3.6895 8.1039 110.6510 64.8055 68.7716 176.4151 8 H 4.1648 8.3409 119.4043 58.4534 28.6106 177.3956 9 F 4.1200 8.3091 122.6516 61.2934 39.2368 177.2345 10 L 3.8769 7.8726 118.5914 58.0071 41.1642 179.5658 11 T 3.8528 7.7152 114.6097 66.7894 68.5120 176.2668 12 Q 4.0612 8.0116 118.2131 57.6180 29.0766 176.2578 13 H 4.6536 8.0081 114.2693 53.6208 31.6093 172.0934 14 Y 5.2233 8.2856 120.1101 55.8673 41.3164 174.6576 15 D 4.0093 8.8469 125.6811 52.4967 43.6640 175.2251 16 A 3.8436 7.9918 127.7868 53.6623 18.5558 177.0813 17 K 4.2221 7.3649 123.3578 53.4877 33.1783 174.2453 18 P 3.9849 0.0000 0.0000 65.4217 31.7725 178.6152 19 Q 3.5608 7.5653 115.7279 54.8189 26.2910 172.7552 20 G 3.7449 8.5095 107.5401 47.6910 0.0000 174.3093 21 R 3.9189 8.1869 126.0232 55.3016 30.2918 174.7147 22 D 4.8772 7.4490 118.2910 51.6284 42.6428 176.8388 23 D 4.4884 8.8838 117.9993 58.1901 40.6366 179.6808 24 R 4.1796 8.0646 117.3872 59.1309 29.9327 178.4169 25 Y 4.0378 8.2799 119.7161 60.7866 38.8075 177.2604 26 C 3.8224 8.2251 116.8849 60.1082 37.5440 175.8339 27 E 4.0367 8.1086 119.9606 59.3741 28.9140 179.5273 28 S 4.0118 7.8567 113.0246 61.4801 62.5073 176.0828 29 I 3.3304 7.3372 121.4537 64.0878 37.4181 177.7362 30 M 3.9897 7.8214 119.7108 58.1717 31.7017 178.7680 31 R 3.8533 7.6484 118.6676 59.4560 30.1174 178.4406 32 R 3.9095 7.9595 117.5151 59.0561 30.0259 177.6292 33 R 4.4741 7.9589 115.4152 54.9318 30.4239 176.3177 34 G 3.9873 7.8828 106.4129 47.0999 0.0000 174.4308 35 L 4.7630 8.1221 117.2868 54.7191 42.3277 177.9975 36 T 4.8408 7.9503 105.2802 61.2494 69.2493 174.9189 37 S 4.6459 7.6710 118.6776 57.5972 64.5364 171.8573 38 P 3.9858 0.0000 0.0000 61.3747 32.8692 176.8639 39 C 4.6306 9.1033 119.1562 56.7582 40.4520 174.1066 40 K 4.1361 8.4688 125.7107 56.3761 32.1053 176.2085 41 D 4.5928 8.9368 127.2616 57.2481 42.2153 175.7021 42 I 5.2109 7.5240 115.7858 59.8174 41.3940 173.4583 43 N 5.0807 9.1384 126.4214 52.6825 42.4100 172.8872 44 T 4.8874 8.8623 122.3211 61.7060 71.6341 173.0795 45 F 4.9159 8.9904 124.2724 55.7540 41.9900 174.6386 46 I 4.5073 9.0507 124.6256 60.4416 39.0326 174.6602 47 H 5.6554 8.3911 122.3523 53.8213 31.7633 173.3354 48 G 4.0342 8.4871 104.1737 44.2841 0.0000 172.2961 49 N 4.8926 8.8959 116.3651 51.8609 38.8316 176.0882 50 K 3.9270 8.8727 122.2529 59.3352 32.2129 179.0998 51 R 3.9740 8.1536 116.4789 59.4572 29.0333 178.9011 52 S 4.2577 8.8242 114.3847 61.0395 63.3846 176.3375 53 I 3.8904 7.4890 123.8293 64.2245 36.8836 178.4688 54 K 3.9223 8.2566 119.1358 59.3913 31.8413 179.1344 55 A 4.2880 8.2677 120.5241 54.6268 18.0825 179.4974 56 I 3.7891 7.7575 118.2852 64.2692 36.8971 177.0107 57 C 4.5485 8.0191 115.4446 57.1477 39.1172 172.7288 58 E 4.6918 7.7236 120.4020 54.1147 31.8654 176.3637 59 N 4.5856 8.4961 115.9855 55.0748 38.8187 177.0142 60 K 4.1351 7.9986 117.7338 59.1865 32.4368 177.2007 61 N 5.0876 8.1076 114.2654 53.0511 41.1447 173.7220 62 G 4.7890 8.0143 101.8166 43.6051 0.0000 172.2738 63 N 5.2864 9.0317 117.6870 50.2364 42.7452 172.6328 64 P 4.6826 0.0000 0.0000 63.4724 32.6194 175.3298 65 H 4.7102 9.2031 121.9304 55.3409 33.1418 173.1112 66 R 3.3195 8.6712 124.6367 57.6936 28.8302 177.3187 67 E 4.1418 8.7322 121.8330 59.8147 29.6787 178.0858 68 N 5.0216 7.8267 113.9162 52.5492 38.2232 173.3817 69 L 4.9843 8.0540 118.6659 53.9329 45.6934 175.3471 70 R 5.1567 9.1440 117.7537 54.6239 34.4043 174.6369 71 I 4.9605 8.6019 122.9057 58.8838 40.7443 175.0215 72 S 4.8128 8.8420 124.4546 58.6848 63.2704 174.6128 73 K 4.2814 9.0751 122.8839 59.2864 32.2200 178.1838 74 S 4.3804 8.7870 114.4396 57.6025 64.2383 173.1035 75 S 4.6235 7.8348 116.9759 57.5513 64.2541 173.6477 76 F 5.0186 8.7603 120.4675 55.6966 43.4042 174.2432 77 Q 5.0830 9.0467 120.5678 56.2065 30.0011 175.5454 78 V 4.9212 9.0107 115.7307 60.1110 36.9794 174.4943 79 T 5.0023 8.7627 118.1965 62.4469 72.4098 173.0775 80 T 4.7927 9.1932 123.9525 62.2213 71.0073 173.0594 81 C 5.3285 9.4434 124.3693 55.3867 38.1997 172.8194 82 K 5.2751 9.0814 124.5863 54.1593 34.2548 175.8512 83 L 4.0012 9.0797 128.3473 55.2930 42.7462 175.3949 84 H 4.6599 9.1035 126.6889 54.7824 31.7977 172.3206 85 G 3.6691 8.3061 110.7403 44.2984 0.0000 172.8399 86 G 3.9169 8.4677 105.8431 45.1803 0.0000 173.3638 87 S 4.6143 7.7648 114.8847 56.2802 63.2550 172.0094 88 P 4.1975 0.0000 0.0000 63.3495 31.7201 175.5793 89 W 4.6944 7.2926 118.7284 53.9257 31.4153 174.0567 90 P 4.5420 0.0000 0.0000 61.9345 31.4162 174.6719 91 P 4.3649 0.0000 0.0000 62.9870 31.8648 176.3577 92 C 4.5107 8.6743 119.6168 55.6990 39.7146 172.7435 93 Q 4.8078 8.1723 123.7805 54.6011 30.3035 174.2843 94 Y 5.2905 8.8282 121.1038 56.2245 41.6594 175.1199 95 R 4.9154 9.3776 121.3520 54.5019 32.8935 174.8009 96 A 5.2424 9.1694 126.0027 50.8619 21.1645 176.6000 97 T 4.5907 8.9912 117.9507 61.5651 71.8341 173.4180 98 A 4.6715 8.8150 128.9215 51.9487 19.7686 176.2414 99 G 4.2827 9.5996 107.6407 45.5024 0.0000 171.7015 100 F 5.9769 8.8708 122.1459 58.1780 40.9892 172.8737 101 R 4.3903 7.9926 122.0180 55.0152 32.5567 173.6012 102 N 5.2771 8.5333 116.9849 52.4660 38.5176 174.4748 103 V 4.6986 8.8191 111.6722 59.6175 36.4936 174.7593 104 V 4.7904 8.2587 121.6915 61.4644 34.0867 174.8829 105 V 5.1832 8.9810 119.7831 59.8172 36.8510 173.6777 106 A 5.0402 8.7068 122.5846 50.5305 21.4587 174.9936 107 C 5.3382 8.6816 118.3182 55.2965 44.4530 173.4534 108 E 4.5025 9.0338 122.0577 56.1056 32.1565 175.0242 109 N 4.1913 9.8559 123.6909 54.4583 36.2480 175.1489 110 G 3.8723 8.4939 102.9964 45.5354 0.0000 173.9422 111 L 4.5109 7.4795 119.2413 51.3590 44.9525 174.2972 112 P 4.5004 0.0000 0.0000 63.0162 31.6353 176.7886 113 V 4.6564 8.2132 113.7597 61.0244 33.8837 175.1110 114 H 4.9721 7.7390 120.0467 54.8626 33.3946 171.4300 115 L 5.0623 8.3631 127.4113 53.1799 43.8204 175.0677 116 D 4.5345 8.7987 127.0712 54.1501 40.7872 176.1088 117 Q 4.4351 8.8795 126.4447 57.9091 29.6806 178.5931 118 S 4.1187 8.2702 113.4396 61.3381 62.7531 176.6364 119 I 3.6230 7.4852 112.0976 62.2954 37.3388 176.2169 120 F 4.7387 7.8987 119.5355 57.1067 38.9699 175.1586 121 R 4.4194 7.9054 122.3062 55.0277 29.8754 176.2721 122 R 4.4459 8.1971 127.7128 53.7882 29.0993 174.0226 123 P 4.4449 0.0000 0.0000 62.4259 31.3866 177.1487 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 D 8.36 4.65 0.00 2.83 2.22 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 3 N 8.61 4.94 0.00 2.91 2.78 0.00 0.00 6.67 6.75 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 4 S 10.04 4.39 0.00 4.12 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 5 R 8.03 4.08 0.00 1.95 2.10 0.00 3.16 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 1.78 1.74 0.00 6 Y 8.30 4.54 0.00 3.01 3.35 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 7 T 8.10 3.69 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 1.30 0.00 0.00 8 H 8.34 4.16 0.00 3.50 3.41 0.00 5.62 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 F 8.31 4.12 0.00 3.21 3.27 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 10 L 7.87 3.88 0.00 1.76 1.69 0.44 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 11 T 7.72 3.85 4.38 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 1.20 0.00 0.00 12 Q 8.01 4.06 0.00 1.63 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.93 0.00 0.00 0.00 0.00 0.00 2.23 2.39 0.00 13 H 8.01 4.65 0.00 1.98 2.67 0.00 5.56 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.29 5.22 0.00 2.75 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 15 D 8.85 4.01 0.00 2.65 2.49 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 16 A 7.99 3.84 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 17 K 7.36 4.22 0.00 1.61 1.65 0.00 1.67 0.00 0.00 1.69 0.00 0.00 3.10 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.25 1.41 7.81 18 P 0.00 3.98 0.00 1.64 1.33 0.00 3.73 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.64 0.00 19 Q 7.57 3.56 0.00 2.15 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.78 0.00 0.00 0.00 0.00 0.00 2.17 2.28 0.00 20 G 8.51 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 21 R 8.19 3.92 0.00 1.61 1.75 0.00 2.83 0.00 0.00 3.07 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.07 0.00 22 D 7.45 4.88 0.00 2.87 2.82 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 23 D 8.88 4.49 0.00 2.74 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 24 R 8.06 4.18 0.00 1.88 2.01 0.00 3.14 0.00 0.00 3.28 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.71 0.00 25 Y 8.28 4.04 0.00 3.21 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 26 C 8.23 3.82 0.00 3.29 3.07 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 27 E 8.11 4.04 0.00 2.20 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 0.00 2.63 2.53 0.00 28 S 7.86 4.01 0.00 3.92 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 29 I 7.34 3.33 0.88 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 -0.08 0.64 -0.20 0.00 0.00 30 M 7.82 3.99 0.00 1.91 1.96 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 2.42 0.00 31 R 7.65 3.85 0.00 2.05 1.89 0.00 3.13 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 32 R 7.96 3.91 0.00 1.95 1.95 0.00 3.24 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 33 R 7.96 4.47 0.00 1.85 2.03 0.00 3.64 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 2.01 0.00 34 G 7.88 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 35 L 8.12 4.76 0.00 1.87 1.61 0.95 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.95 4.84 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 1.35 0.00 0.00 37 S 7.67 4.65 0.00 3.94 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 38 P 0.00 3.99 0.00 1.41 0.49 0.00 3.68 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.69 0.00 39 C 9.10 4.63 0.00 2.75 3.06 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 0.00 0.00 0.00 40 K 8.47 4.14 0.00 1.76 1.71 0.00 1.72 0.00 0.00 1.52 0.00 0.00 3.11 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.34 7.81 41 D 8.94 4.59 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 42 I 7.52 5.21 1.93 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.90 0.95 0.00 0.00 43 N 9.14 5.08 0.00 2.68 2.31 0.00 0.00 6.86 6.54 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 44 T 8.86 4.89 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 0.45 0.00 0.00 45 F 8.99 4.92 0.00 2.93 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 46 I 9.05 4.51 1.93 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.59 0.77 0.00 0.00 47 H 8.39 5.66 0.00 3.11 3.19 0.00 5.58 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.49 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 0.00 0.00 0.00 49 N 8.90 4.89 0.00 3.06 3.06 0.00 0.00 5.62 7.20 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 50 K 8.87 3.93 0.00 1.76 1.84 0.00 1.53 0.00 0.00 1.51 0.00 0.00 3.02 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.50 1.18 7.81 51 R 8.15 3.97 0.00 2.11 2.22 0.00 3.06 0.00 0.00 3.42 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 1.74 0.00 52 S 8.82 4.26 0.00 4.33 4.12 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 53 I 7.49 3.89 1.97 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 1.28 1.37 0.96 0.00 0.00 54 K 8.26 3.92 0.00 2.05 1.82 0.00 1.57 0.00 0.00 1.40 0.00 0.00 2.95 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.30 1.51 7.81 55 A 8.27 4.29 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 56 I 7.76 3.79 1.95 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.92 0.00 0.00 57 C 8.02 4.55 0.00 3.06 3.06 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 0.00 0.00 0.00 58 E 7.72 4.69 0.00 1.98 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 2.19 2.31 0.00 59 N 8.50 4.59 0.00 2.71 2.87 0.00 0.00 6.91 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 60 K 8.00 4.14 0.00 1.75 1.88 0.00 1.69 0.00 0.00 1.94 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.43 7.81 61 N 8.11 5.09 0.00 2.82 2.83 0.00 0.00 6.84 7.92 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 62 G 8.01 4.79 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 63 N 9.03 5.29 0.00 2.63 2.67 0.00 0.00 7.27 8.86 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 64 P 0.00 4.68 0.00 1.93 1.99 0.00 3.65 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 65 H 9.20 4.71 0.00 3.16 3.17 0.00 5.93 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 R 8.67 3.32 0.00 1.86 1.50 0.00 3.36 0.00 0.00 3.13 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.32 0.00 67 E 8.73 4.14 0.00 1.91 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 0.00 2.29 2.34 0.00 68 N 7.83 5.02 0.00 2.73 2.81 0.00 0.00 5.84 7.79 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 69 L 8.05 4.98 0.00 1.79 1.81 0.97 0.77 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 70 R 9.14 5.16 0.00 1.60 1.75 0.00 3.22 0.00 0.00 3.08 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.65 0.00 71 I 8.60 4.96 1.68 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.64 0.97 0.00 0.00 72 S 8.84 4.81 0.00 4.18 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 73 K 9.08 4.28 0.00 1.83 1.89 0.00 1.70 0.00 0.00 1.75 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.39 7.81 74 S 8.79 4.38 0.00 3.74 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 75 S 7.83 4.62 0.00 2.87 2.63 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 F 8.76 5.02 0.00 2.91 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 Q 9.05 5.08 0.00 2.21 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.78 0.00 0.00 0.00 0.00 0.00 2.68 2.42 0.00 78 V 9.01 4.92 1.79 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 0.82 0.00 0.00 0.97 0.00 0.00 79 T 8.76 5.00 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 80 T 9.19 4.79 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 1.27 0.00 0.00 81 C 9.44 5.33 0.00 2.74 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 82 K 9.08 5.28 0.00 1.77 1.78 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.43 7.81 83 L 9.08 4.00 0.00 1.58 1.57 0.36 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 84 H 9.10 4.66 0.00 3.11 3.10 0.00 5.79 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.31 3.67 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 86 G 8.47 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 87 S 7.76 4.61 0.00 3.87 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 88 P 0.00 4.20 0.00 1.45 1.98 0.00 3.76 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.88 0.00 89 W 7.29 4.69 0.00 3.37 3.20 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 90 P 0.00 4.54 0.00 2.13 2.06 0.00 4.03 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.42 0.00 91 P 0.00 4.36 0.00 2.18 2.07 0.00 3.78 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 92 C 8.67 4.51 0.00 3.06 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 93 Q 8.17 4.81 0.00 2.07 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.83 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 94 Y 8.83 5.29 0.00 2.88 2.82 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 95 R 9.38 4.92 0.00 1.76 1.87 0.00 2.95 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.56 0.00 96 A 9.17 5.24 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 97 T 8.99 4.59 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 1.28 0.00 0.00 98 A 8.81 4.67 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 99 G 9.60 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 0.00 0.00 0.00 0.00 100 F 8.87 5.98 0.00 2.97 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 0.00 101 R 7.99 4.39 0.00 1.85 2.01 0.00 3.03 0.00 0.00 3.37 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.77 0.00 102 N 8.53 5.28 0.00 2.90 2.95 0.00 0.00 6.17 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 0.00 103 V 8.82 4.70 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 0.88 0.00 0.00 0.80 0.00 0.00 104 V 8.26 4.79 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 1.09 0.00 0.00 0.70 0.00 0.00 105 V 8.98 5.18 1.94 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 0.59 0.00 0.00 0.84 0.00 0.00 106 A 8.71 5.04 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 0.00 107 C 8.68 5.34 0.00 2.78 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 0.00 108 E 9.03 4.50 0.00 1.88 1.71 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 2.18 2.26 0.00 109 N 9.86 4.19 0.00 2.83 2.81 0.00 0.00 7.19 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 0.00 110 G 8.49 3.87 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 0.00 0.00 0.00 111 L 7.48 4.51 0.00 1.42 0.77 0.63 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 112 P 0.00 4.50 0.00 0.68 1.72 0.00 3.43 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 2.03 1.86 0.00 113 V 8.21 4.66 2.13 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 0.74 0.00 0.00 0.98 0.00 0.00 114 H 7.74 4.97 0.00 3.26 3.10 0.00 5.83 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 0.00 115 L 8.36 5.06 0.00 1.71 1.15 1.02 0.99 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 0.00 116 D 8.80 4.53 0.00 2.76 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 0.00 117 Q 8.88 4.44 0.00 2.17 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.61 0.00 0.00 0.00 0.00 0.00 2.46 2.31 0.00 118 S 8.27 4.12 0.00 4.01 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 0.00 119 I 7.49 3.62 1.52 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.15 -0.36 0.71 0.00 0.00 120 F 7.90 4.74 0.00 3.19 3.08 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 0.00 121 R 7.91 4.42 0.00 1.85 1.85 0.00 3.24 0.00 0.00 3.17 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 122 R 8.20 4.45 0.00 1.84 1.87 0.00 3.48 0.00 0.00 3.30 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.57 0.00 123 P 0.00 4.44 0.00 2.22 2.03 0.00 3.85 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 1.99 1.96 0.00