NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 V 4.0976 8.0544 117.9083 60.7257 33.3993 174.4392 12 H 4.5123 8.5778 122.1557 53.4597 30.6852 173.0125 13 Q 4.4412 8.3373 125.0396 53.6354 32.3433 174.5421 14 A 4.0999 8.3004 122.6748 51.8968 19.1131 177.1815 15 I 3.7878 8.0543 120.5770 60.3761 38.8721 176.6996 16 S 4.2183 8.5742 123.1432 58.0259 64.0794 173.6959 17 P 4.3240 0.0000 0.0000 65.3413 31.0906 179.0797 18 R 3.9394 7.8953 116.8232 59.5509 30.1574 178.8496 19 T 3.9454 7.8384 115.0377 66.6912 68.4838 176.6344 20 L 4.1983 8.1695 120.9308 57.8053 41.6733 178.2895 21 N 4.1594 8.5134 117.0397 57.2380 38.8602 176.2828 22 A 4.0250 8.8229 121.7584 55.2850 18.4411 179.5043 23 W 4.3339 8.3456 126.6263 60.2886 29.1882 178.5072 24 V 3.2752 8.0059 118.4112 65.7808 31.1102 177.8393 25 K 3.7623 7.7395 117.9610 59.5892 32.0335 179.1285 26 V 3.4418 7.3848 117.6830 66.1008 31.3719 177.8042 27 V 3.1992 6.8420 115.6246 63.7005 31.0745 176.3756 28 E 4.1824 7.1754 116.3301 58.2030 30.9444 176.6868 29 E 4.1695 7.8206 116.4543 57.4378 30.0441 176.8669 30 K 4.4645 7.5646 115.2111 55.1081 35.6836 179.3659 31 A 3.4390 7.8596 122.1722 51.9284 18.8628 179.3014 32 F 4.8728 8.7172 117.9317 56.0167 40.5846 174.1160 33 S 4.6223 8.1651 116.9692 56.7529 64.9503 173.9277 34 P 4.2878 0.0000 0.0000 66.3060 30.4847 178.5615 35 E 4.1153 8.3144 116.2556 59.2361 29.3235 179.5787 36 V 3.8677 8.0249 112.7255 64.2431 31.4769 178.4303 37 I 3.8674 7.9726 119.8917 64.0202 37.0705 176.3952 38 P 4.3171 0.0000 0.0000 66.0776 31.1115 178.5257 39 M 4.1191 7.8813 116.1554 58.3062 31.8991 178.4362 40 F 3.7306 8.4163 120.6478 61.4824 39.3428 177.3523 41 S 3.9284 7.9275 112.9293 61.3105 62.5725 176.2640 42 A 4.0818 8.4847 123.6970 55.3642 18.0110 179.8246 43 L 3.7613 7.8729 115.8761 56.5985 41.9468 178.8016 44 S 4.4603 7.1388 113.4041 56.6997 63.2070 173.3713 45 E 3.9998 6.9007 122.4162 58.5417 29.3137 177.4521 46 G 3.8141 8.9003 111.4156 45.2973 0.0000 173.0979 47 A 4.2143 7.5634 122.9325 51.8405 19.1074 178.1482 48 T 4.3988 8.2406 112.4931 60.5108 71.3420 174.4901 49 P 4.4722 0.0000 0.0000 65.8198 31.3481 178.6230 50 Q 4.0187 8.6375 118.5416 59.4589 28.8454 178.3348 51 D 4.4700 8.1360 121.0537 56.8590 40.8434 178.7717 52 L 3.9391 8.1836 119.5953 57.8911 41.5062 179.3801 53 N 4.5234 8.8122 117.2033 56.3023 37.9243 177.5288 54 T 3.9056 8.0189 111.3934 65.0757 68.5309 176.1965 55 M 4.1519 8.1074 120.8792 58.4085 32.1994 178.5992 56 L 4.3992 8.2457 118.7792 57.8629 41.5422 179.3357 57 N 4.4565 8.3536 116.0403 56.4447 38.4942 177.2475 58 T 4.1813 7.7661 116.4097 64.9239 68.7780 175.5802 59 V 3.5487 7.3273 121.4182 62.8641 31.9159 175.0939 60 G 4.1103 8.5947 116.1974 44.6358 0.0000 173.8708 61 G 3.6048 8.3365 112.2528 45.8253 0.0000 174.3819 62 H 4.0730 8.5213 113.2432 56.3155 26.5540 176.4965 63 Q 4.0265 8.0808 122.3744 58.9370 29.0681 176.5308 64 A 3.9632 8.0181 121.4222 54.9845 18.5643 179.0141 65 A 3.8802 8.0170 118.8204 55.8416 18.3835 179.6305 66 M 4.0065 8.1288 116.9468 58.5609 31.8942 178.8308 67 Q 4.0047 8.4189 119.9847 59.4115 29.2257 178.2331 68 M 4.0411 8.1029 119.8869 57.9979 31.9517 178.2810 69 L 3.8516 8.0025 120.5710 58.2563 42.2290 179.0513 70 K 3.9735 8.1634 118.1944 59.6923 32.0965 179.0766 71 E 3.9526 8.4855 118.8652 59.8004 29.3869 179.5960 72 T 3.8470 7.8728 115.5888 66.5768 68.4009 176.7594 73 I 3.7908 7.8704 121.6629 64.5422 37.2256 178.0707 74 N 4.2700 8.3871 117.4615 56.5763 38.3434 177.3399 75 E 3.9164 8.0242 119.5979 59.3505 29.5180 179.3293 76 E 3.5181 7.8320 118.4483 58.9294 29.3322 179.1152 77 A 3.6599 7.4422 120.8010 54.9043 18.4134 179.6212 78 A 3.9166 7.9231 119.2789 55.1877 18.4660 179.4680 79 E 3.8305 8.2241 118.0059 58.9377 29.6811 178.6142 80 W 4.1851 8.5600 128.8157 60.8215 30.5839 177.5508 81 D 4.4605 8.0360 117.1442 57.4580 40.3506 178.5815 82 R 3.9859 7.7818 117.9215 59.4840 30.2254 178.3507 83 L 4.0510 7.7812 116.9599 56.1951 42.9756 177.0013 84 H 4.7194 7.3788 115.0309 52.9349 28.8303 171.4678 85 P 4.3470 0.0000 0.0000 62.1600 32.3339 177.3403 86 V 3.6614 8.0754 120.2190 63.0857 31.9810 175.5379 87 H 4.5329 8.4778 124.3705 54.8872 29.4812 175.0942 88 A 4.0348 8.6899 126.7104 52.5756 18.8021 177.5966 89 G 4.2025 8.3455 113.2410 43.4734 0.0000 171.0915 90 P 4.6527 0.0000 0.0000 61.0942 32.7845 175.4320 91 I 3.6735 8.1964 119.8744 60.8258 38.5491 175.7022 92 A 4.1403 8.5901 130.9632 51.5350 18.9315 174.5891 93 P 4.5942 0.0000 0.0000 63.7351 32.2392 176.7346 94 G 3.9727 9.0755 109.7229 45.2024 0.0000 172.8020 95 Q 4.6256 7.5374 117.3751 54.4491 31.4227 174.3446 96 M 4.5755 8.0173 118.0825 53.0778 34.2427 176.5130 97 R 4.1887 8.3955 117.1512 56.3860 29.9683 176.3057 98 E 4.3269 8.6537 119.0228 55.3572 30.1642 175.3844 99 P 3.7448 0.0000 0.0000 62.7724 31.8597 176.2605 100 R 4.6069 9.1184 121.4239 54.6320 32.1865 177.6263 101 G 4.1261 10.0938 108.1051 48.6062 0.0000 176.3367 102 S 4.2556 8.0685 116.1263 60.6896 63.1592 176.0336 103 D 4.3445 8.1326 123.1595 57.2535 40.2917 178.6493 104 I 3.2446 7.1207 118.8608 63.7742 37.1702 177.3695 105 A 2.5800 7.4079 118.4692 51.0138 18.2014 177.6131 106 G 4.3076 7.2267 105.2852 46.3532 0.0000 175.2918 107 T 4.1959 7.9157 111.9321 63.0104 69.3040 175.6354 108 T 4.6563 7.8931 109.3083 60.6567 69.8273 173.1787 109 S 5.0998 7.8758 116.3580 56.8970 65.7185 173.7276 110 T 4.5905 8.9524 114.0423 60.4914 71.3180 175.7672 111 L 3.9089 8.3299 122.5247 58.4691 41.9188 178.9488 112 Q 3.9316 7.9338 116.9613 59.1348 28.5608 177.9915 113 E 3.5087 7.9039 120.1345 59.3011 29.5932 179.4061 114 Q 4.3373 8.0431 117.8224 59.1189 28.7713 179.0271 115 I 3.8207 7.9660 120.9910 64.8489 37.2439 177.9786 116 G 3.6450 8.2127 104.9888 48.4036 0.0000 175.2831 117 W 4.4126 8.2627 120.1456 59.3576 29.1957 178.7529 118 M 4.1422 7.9185 117.0814 58.6874 31.5374 178.7086 119 T 4.0271 8.2991 108.5119 65.0183 69.3740 173.7764 120 H 3.8403 6.8192 119.6326 52.6805 32.2977 173.0237 121 N 4.8742 7.7825 121.3686 50.5777 40.2075 173.1935 122 P 4.5058 0.0000 0.0000 61.5521 32.1909 173.9538 123 P 4.6787 0.0000 0.0000 62.5314 32.1627 175.8229 124 I 4.3760 7.8873 120.8910 59.1842 38.5686 175.8118 125 P 4.5826 0.0000 0.0000 61.3736 28.2904 176.6660 126 V 3.3186 7.6833 118.0293 65.0768 31.9088 178.2252 127 G 3.7112 7.7680 106.3075 47.3735 0.0000 175.5746 128 E 3.9930 7.9660 120.5592 58.6725 29.3739 179.3892 129 I 3.3920 7.5745 120.1361 64.3382 37.1473 177.5202 130 Y 3.5714 7.3410 120.2752 60.5063 38.4396 178.0775 131 K 3.8070 7.8962 120.2656 59.6731 32.2455 178.6385 132 R 3.9636 7.7848 117.9861 59.3578 30.0440 179.0452 133 W 4.4663 7.8900 118.4520 59.9181 28.9293 178.7346 134 I 3.6892 7.7940 119.8524 64.3131 36.4099 178.4969 135 I 3.5822 8.0213 120.9126 64.3064 36.8851 178.5330 136 L 4.1122 8.1170 120.0293 57.5915 41.4678 179.5952 137 G 3.6497 8.1852 105.6931 47.9129 0.0000 175.5964 138 L 3.9453 8.5593 122.1509 57.5237 41.5435 179.2521 139 N 4.3529 8.4648 116.6912 56.3155 38.4813 177.2606 140 K 3.9085 8.0770 120.8251 59.6058 32.2216 178.9491 141 I 3.7376 7.7406 120.0756 64.3130 36.8655 178.5977 142 V 3.9883 8.6025 121.1252 65.4534 31.1469 178.2616 143 R 3.9163 8.1318 115.2772 59.3640 29.2923 178.2806 144 M 4.0125 7.8335 117.9870 58.5172 32.4386 177.3137 145 Y 4.3018 8.0930 114.0451 58.5658 38.5159 175.7913 146 S 4.3132 8.3026 119.7707 58.3731 63.3470 173.6751 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 11 V 8.05 4.10 2.08 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 0.91 0.00 0.00 0.93 0.00 0.00 12 H 8.58 4.51 0.00 3.18 3.21 0.00 5.64 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 8.34 4.44 0.00 2.07 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.79 0.00 0.00 0.00 0.00 0.00 2.13 2.23 0.00 14 A 8.30 4.10 1.26 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 0.00 0.00 15 I 8.05 3.79 2.01 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.70 0.92 0.00 0.00 16 S 8.57 4.22 0.00 4.08 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 17 P 0.00 4.32 0.00 2.19 2.16 0.00 3.59 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 18 R 7.90 3.94 0.00 1.82 1.98 0.00 3.30 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.66 0.00 19 T 7.84 3.95 4.36 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 1.17 0.00 0.00 20 L 8.17 4.20 0.00 1.91 1.82 0.96 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 21 N 8.51 4.16 0.00 2.97 3.05 0.00 0.00 7.00 8.31 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 22 A 8.82 4.02 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 23 W 8.35 4.33 0.00 3.41 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 24 V 8.01 3.28 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 0.91 0.00 0.00 0.95 0.00 0.00 25 K 7.74 3.76 0.00 1.98 1.81 0.00 1.72 0.00 0.00 1.53 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.59 7.81 26 V 7.38 3.44 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 0.93 0.00 0.00 1.00 0.00 0.00 27 V 6.84 3.20 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 0.02 0.00 0.00 -0.76 0.00 0.00 28 E 7.18 4.18 0.00 1.88 1.75 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 2.13 2.25 0.00 29 E 7.82 4.17 0.00 1.95 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 0.00 2.27 2.34 0.00 30 K 7.56 4.46 0.00 1.87 1.64 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.31 1.30 7.81 31 A 7.86 3.44 1.10 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 32 F 8.72 4.87 0.00 2.96 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 33 S 8.17 4.62 0.00 4.06 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 34 P 0.00 4.29 0.00 2.21 2.22 0.00 3.65 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.26 0.00 35 E 8.31 4.12 0.00 2.07 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 2.42 2.50 0.00 36 V 8.02 3.87 2.15 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 0.85 0.00 0.00 1.21 0.00 0.00 37 I 7.97 3.87 1.95 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.79 1.00 0.00 0.00 38 P 0.00 4.32 0.00 2.20 2.15 0.00 3.85 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.24 0.00 39 M 7.88 4.12 0.00 2.31 2.52 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.77 0.00 40 F 8.42 3.73 0.00 3.22 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 41 S 7.93 3.93 0.00 3.90 3.89 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 42 A 8.48 4.08 1.35 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 0.00 0.00 43 L 7.87 3.76 0.00 1.32 1.58 1.15 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 44 S 7.14 4.46 0.00 3.51 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 45 E 6.90 4.00 0.00 1.93 1.88 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 2.28 2.17 0.00 46 G 8.90 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 0.00 0.00 0.00 47 A 7.56 4.21 1.21 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 0.00 0.00 48 T 8.24 4.40 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 1.26 0.00 0.00 49 P 0.00 4.47 0.00 2.15 2.18 0.00 3.63 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 2.02 2.13 0.00 50 Q 8.64 4.02 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 51 D 8.14 4.47 0.00 2.86 2.65 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 52 L 8.18 3.94 0.00 1.86 1.63 0.82 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 53 N 8.81 4.52 0.00 3.01 2.96 0.00 0.00 6.75 6.62 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 54 T 8.02 3.91 4.29 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 1.27 0.00 0.00 55 M 8.11 4.15 0.00 1.66 2.30 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.34 0.00 56 L 8.25 4.40 0.00 1.92 1.82 0.89 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 57 N 8.35 4.46 0.00 2.98 2.95 0.00 0.00 7.07 8.27 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 58 T 7.77 4.18 4.68 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 1.33 0.00 0.00 59 V 7.33 3.55 2.31 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 0.73 0.00 0.00 0.94 0.00 0.00 60 G 8.59 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 0.00 0.00 0.00 61 G 8.34 3.60 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 0.00 0.00 0.00 62 H 8.52 4.07 0.00 3.34 3.55 0.00 5.63 0.00 0.00 0.00 0.00 7.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 8.08 4.03 0.00 2.19 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.92 0.00 0.00 0.00 0.00 0.00 2.45 2.51 0.00 64 A 8.02 3.96 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 65 A 8.02 3.88 0.91 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 66 M 8.13 4.01 0.00 2.09 2.29 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 3.01 0.00 67 Q 8.42 4.00 0.00 2.30 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 68 M 8.10 4.04 0.00 2.10 2.18 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.55 0.00 69 L 8.00 3.85 0.00 1.68 1.86 0.85 0.39 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 70 K 8.16 3.97 0.00 2.02 1.89 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.64 7.81 71 E 8.49 3.95 0.00 2.19 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 2.33 2.51 0.00 72 T 7.87 3.85 4.41 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 1.24 0.00 0.00 73 I 7.87 3.79 2.14 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.93 1.31 0.00 0.00 74 N 8.39 4.27 0.00 2.90 2.85 0.00 0.00 7.09 8.52 0.00 0.00 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 E 8.02 3.92 0.00 2.07 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 2.28 2.41 0.00 76 E 7.83 3.52 0.00 1.16 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 2.24 2.18 0.00 77 A 7.44 3.66 1.33 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 0.00 0.00 0.00 78 A 7.92 3.92 1.35 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 0.00 0.00 79 E 8.22 3.83 0.00 2.01 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 2.29 2.35 0.00 80 W 8.56 4.19 0.00 3.79 3.38 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 81 D 8.04 4.46 0.00 2.93 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 82 R 7.78 3.99 0.00 1.93 2.00 0.00 3.22 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 1.59 1.64 0.00 83 L 7.78 4.05 0.00 1.40 1.31 0.83 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 84 H 7.38 4.72 0.00 2.79 2.98 0.00 5.66 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 P 0.00 4.35 0.00 2.14 2.02 0.00 3.67 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.91 0.00 86 V 8.08 3.66 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 0.85 0.00 0.00 0.95 0.00 0.00 87 H 8.48 4.53 0.00 3.23 3.20 0.00 5.76 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 A 8.69 4.03 1.26 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 0.00 0.00 89 G 8.35 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 0.00 0.00 0.00 0.00 90 P 0.00 4.65 0.00 2.20 2.06 0.00 3.79 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 1.95 0.00 91 I 8.20 3.67 1.90 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 1.41 0.70 0.92 0.00 0.00 92 A 8.59 4.14 1.35 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 0.00 0.00 93 P 0.00 4.59 0.00 2.19 2.06 0.00 3.74 0.00 0.00 3.67 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 94 G 9.08 3.97 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 0.00 0.00 0.00 95 Q 7.54 4.63 0.00 2.29 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.66 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 96 M 8.02 4.58 0.00 1.78 1.74 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 1.86 0.00 97 R 8.40 4.19 0.00 2.05 2.05 0.00 3.19 0.00 0.00 3.33 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.15 0.00 98 E 8.65 4.33 0.00 2.05 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 2.41 2.29 0.00 99 P 0.00 3.74 0.00 1.38 0.49 0.00 3.71 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 1.79 1.31 0.00 100 R 9.12 4.61 0.00 1.89 1.94 0.00 3.51 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.76 0.00 101 G 10.09 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 S 8.07 4.26 0.00 4.06 4.15 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 0.00 103 D 8.13 4.34 0.00 2.65 2.55 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 0.00 0.00 0.00 104 I 7.12 3.24 1.40 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 0.73 -0.29 -0.44 0.00 0.00 105 A 7.41 2.58 1.11 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 0.00 0.00 106 G 7.23 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 0.00 0.00 0.00 0.00 107 T 7.92 4.20 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 1.23 0.00 0.00 108 T 7.89 4.66 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 0.00 109 S 7.88 5.10 0.00 4.21 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 0.00 110 T 8.95 4.59 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 1.20 0.00 0.00 111 L 8.33 3.91 0.00 1.74 1.66 0.90 0.37 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 0.00 112 Q 7.93 3.93 0.00 2.24 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.65 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 113 E 7.90 3.51 0.00 2.13 1.49 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 2.02 2.20 0.00 114 Q 8.04 4.34 0.00 2.27 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.81 0.00 0.00 0.00 0.00 0.00 2.49 2.56 0.00 115 I 7.97 3.82 1.82 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.77 0.90 0.00 0.00 116 G 8.21 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 0.00 117 W 8.26 4.41 0.00 3.49 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 0.00 118 M 7.92 4.14 0.00 2.05 2.18 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.57 0.00 119 T 8.30 4.03 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 1.29 0.00 0.00 120 H 6.82 3.84 0.00 3.42 3.41 0.00 5.70 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 0.00 121 N 7.78 4.87 0.00 2.60 2.66 0.00 0.00 6.98 8.02 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 0.00 122 P 0.00 4.51 0.00 2.09 2.05 0.00 3.73 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.10 0.00 123 P 0.00 4.68 0.00 2.20 2.35 0.00 3.49 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 2.12 0.00 124 I 7.89 4.38 1.90 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.60 0.75 0.00 0.00 125 P 0.00 4.58 0.00 2.21 2.19 0.00 3.72 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.05 0.00 126 V 7.68 3.32 1.75 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 0.21 0.00 0.00 0.94 0.00 0.00 127 G 7.77 3.71 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 0.00 0.00 0.00 128 E 7.97 3.99 0.00 1.92 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 0.00 2.34 2.30 0.00 129 I 7.57 3.39 1.35 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.20 -0.16 0.00 0.00 130 Y 7.34 3.57 0.00 2.70 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 0.00 131 K 7.90 3.81 0.00 1.90 1.87 0.00 1.64 0.00 0.00 1.54 0.00 0.00 2.74 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.51 1.57 7.81 132 R 7.78 3.96 0.00 2.13 2.10 0.00 3.24 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.91 0.00 133 W 7.89 4.47 0.00 3.48 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 0.00 134 I 7.79 3.69 1.80 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 1.18 0.58 0.19 0.00 0.00 135 I 8.02 3.58 2.05 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.85 0.96 0.00 0.00 136 L 8.12 4.11 0.00 1.94 1.74 1.03 0.90 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 0.00 137 G 8.19 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 0.00 138 L 8.56 3.95 0.00 1.76 1.79 0.66 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 139 N 8.46 4.35 0.00 2.98 2.90 0.00 0.00 6.68 8.66 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 0.00 140 K 8.08 3.91 0.00 1.83 2.05 0.00 1.61 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.47 7.81 141 I 7.74 3.74 1.60 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.36 0.07 0.00 0.00 142 V 8.60 3.99 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 1.22 0.00 0.00 1.18 0.00 0.00 143 R 8.13 3.92 0.00 1.98 2.06 0.00 3.13 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.67 0.00 144 M 7.83 4.01 0.00 2.07 2.02 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.07 0.00 145 Y 8.09 4.30 0.00 3.20 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 0.00 146 S 8.30 4.31 0.00 3.97 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