NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 Q 4.2119 8.3293 121.7001 55.8490 30.4622 175.2685 4 S 4.3529 8.1470 119.6183 57.6641 65.6856 174.6347 5 F 4.1620 10.3730 123.5533 60.4840 39.2939 179.7294 6 T 3.9779 8.5967 116.1656 66.4771 68.2712 176.5815 7 S 4.0445 7.7354 114.6346 61.4022 62.4381 176.0498 8 I 3.6203 7.7324 122.2334 64.5862 36.8294 178.4140 9 A 4.0318 8.6105 121.4380 55.3231 18.1162 178.8635 10 R 3.9246 7.9155 117.7446 58.8585 30.0100 178.2755 11 I 3.7845 8.0710 118.9729 64.5894 37.3708 178.5255 12 G 3.7027 8.2944 106.2457 48.0847 0.0000 175.3036 13 D 4.3656 7.9145 121.5484 57.1251 40.7730 178.0594 14 Y 4.0796 7.8920 119.4919 60.9076 38.4357 178.5320 15 I 3.5997 7.4997 119.0367 64.4029 37.4544 178.0369 16 L 4.0138 8.0019 119.7157 57.4326 41.7932 178.7691 17 K 4.3533 7.5414 117.5188 57.8921 32.8550 177.1503 18 S 4.1161 7.2637 117.6639 57.1263 61.6677 172.6513 19 P 4.2137 0.0000 0.0000 65.2340 30.8536 178.7128 20 V 3.5811 7.5444 116.9105 66.0551 31.6323 177.8804 21 L 3.9511 7.7261 118.2512 57.6148 41.6356 178.9951 22 S 4.0468 8.1402 113.2110 61.6252 62.1565 176.5620 23 K 4.0123 7.6889 120.1606 58.8674 31.8052 178.5444 24 L 4.2325 7.2824 119.4068 57.1504 42.4999 177.8183 25 C 4.3137 8.2817 116.5595 62.2420 28.6610 175.8704 26 V 3.6098 7.5236 119.3535 65.8855 30.8432 176.4379 27 P 4.2128 0.0000 0.0000 65.4452 31.3665 178.4884 28 V 3.5870 7.8606 116.3864 66.1527 31.4021 177.6151 29 A 4.0948 8.3989 120.6769 55.4341 18.2223 179.4032 30 N 4.3559 8.3397 115.0098 56.4236 38.5417 177.5377 31 Q 3.9768 8.3910 121.1883 58.9667 29.2252 177.7376 32 F 4.1519 8.8704 122.1059 61.4469 39.5464 177.2717 33 I 3.5669 7.9272 119.2953 64.4873 36.7554 178.2677 34 N 4.3102 7.9343 115.7394 55.7660 38.3601 177.0620 35 L 4.0693 7.7820 119.6477 56.8781 41.8160 178.5828 36 A 3.9185 7.0922 120.4936 53.8583 18.5389 178.8497 37 G 3.6951 7.4648 103.4782 45.6404 0.0000 174.8626 38 Y 4.1050 7.4627 119.1121 59.9765 38.0163 178.1001 39 K 4.2220 7.1763 119.7122 59.1529 31.9859 178.5867 40 K 2.6331 7.3713 117.0012 57.0954 31.5419 177.9283 41 L 4.6836 7.7778 118.6707 53.3528 42.4900 175.9760 42 G 3.8994 8.1453 106.6305 47.0381 0.0000 173.9284 43 L 4.9924 7.9411 117.0661 52.4857 45.4071 176.6404 44 K 4.9006 8.9282 121.0821 54.9061 34.3236 177.6533 45 F 3.4073 9.1581 123.3368 61.5984 39.2916 177.3974 46 D 4.4355 8.2606 117.5910 57.1740 40.2444 178.2536 47 D 4.5341 7.7227 118.4510 56.6557 40.8584 178.0542 48 L 4.0672 7.5855 119.1925 55.5220 41.7436 177.3645 49 I 3.4257 6.3282 117.9685 61.2659 37.3646 175.6219 50 A 3.9771 8.6575 128.8674 52.7023 18.4341 176.6267 51 E 4.4361 8.1062 119.7939 56.3074 30.8232 176.6424 52 E 4.3854 7.8886 120.8079 55.0491 28.6403 176.2171 53 N 4.9159 7.6017 116.1233 49.7880 41.7929 172.8749 54 P 4.2081 0.0000 0.0000 66.5753 30.9728 178.3735 55 I 3.6504 7.7870 119.2401 64.3002 37.0464 178.1804 56 M 4.0577 7.9913 118.7016 58.5194 31.6191 178.7342 57 Q 3.9934 8.1518 117.5523 59.1052 28.7226 178.7650 58 T 3.9699 8.4040 116.8365 66.8379 68.5705 176.0034 59 A 3.9778 8.3099 122.8342 55.4765 18.5042 179.3155 60 L 3.7957 8.3944 116.7008 58.0992 41.5616 180.1933 61 R 3.9374 7.3937 117.1420 59.3056 30.1963 178.3718 62 R 4.0345 7.6430 115.8055 56.6499 30.3419 176.7737 63 L 3.3327 6.4916 121.0995 53.3437 42.7617 175.3030 64 P 4.2502 0.0000 0.0000 63.2596 32.7441 176.9316 65 E 3.4933 8.6224 121.3612 59.7775 29.5033 179.7220 66 D 4.4670 8.0022 118.0983 57.5457 40.9548 178.6307 67 E 3.9002 8.0453 118.4946 59.0044 29.3229 179.3228 68 S 3.9563 7.6896 112.9676 61.6610 62.5336 175.6734 69 Y 4.2960 7.6532 119.1652 61.0106 37.5710 178.6681 70 A 4.0351 8.0655 121.6019 55.3296 18.5630 179.5298 71 R 3.8039 8.1110 117.0218 59.4465 30.0347 178.2959 72 A 3.9813 8.2309 120.7321 55.4623 18.3802 178.6483 73 Y 4.1340 8.0666 117.6406 61.2078 38.8723 178.3976 74 R 3.6957 8.1140 118.6441 59.5758 30.2165 179.1062 75 I 3.6190 7.7045 119.0549 64.3039 37.0445 178.5223 76 I 3.6591 7.6057 120.5938 64.4309 36.9214 178.1741 77 R 3.6817 7.9585 119.6276 59.4876 29.6165 178.1734 78 A 3.9040 7.8080 120.1494 55.5822 18.2929 179.3796 79 H 4.1498 7.9352 114.6539 58.9742 28.5411 177.8606 80 Q 3.9333 8.0929 120.5110 59.4029 29.1825 178.2141 81 T 4.0680 8.0120 118.1368 66.1711 68.5770 176.1782 82 E 3.9449 8.3914 121.6881 59.2043 29.4504 178.4971 83 L 4.0894 8.1044 118.1468 57.4799 40.6175 177.9995 84 T 4.2530 7.8029 110.0230 60.9637 69.0850 174.8938 85 H 4.4820 7.6924 117.3029 57.1460 26.9793 173.9131 86 H 5.1378 7.4534 117.3177 54.1677 31.1400 173.3697 87 L 5.0279 8.0826 118.2925 52.9978 44.8532 177.0476 88 L 4.3742 8.2690 121.2516 54.1104 42.6811 175.5491 89 P 4.2247 0.0000 0.0000 63.3737 31.9163 177.9524 90 R 2.0000 8.4300 123.6885 58.6639 30.1193 178.1854 91 N 4.3441 7.6899 113.2897 54.8448 37.5309 175.3296 92 E 4.4288 8.4675 117.7549 56.2807 30.1636 176.6788 93 W 4.6090 7.7033 119.1973 56.5919 29.6244 175.9643 94 I 4.1154 8.3078 122.9315 61.0553 36.8542 176.1259 95 K 4.2416 10.0064 126.4785 56.0392 32.9041 178.4863 96 A 3.6005 8.7074 125.5740 55.5227 18.1574 179.6401 97 Q 4.1645 8.0620 115.2200 58.5409 28.9663 177.6279 98 E 4.3239 9.0624 119.8650 57.7835 30.9001 177.1958 99 D 4.8315 7.4670 118.6572 53.8814 39.6123 176.2059 100 V 4.1101 7.4413 119.3851 61.8509 31.8993 174.4777 101 P 4.7439 0.0000 0.0000 61.8265 29.8149 176.1876 102 Y 4.4867 7.8563 122.7899 60.2790 39.1842 177.9373 103 L 4.2589 7.4631 122.4884 56.9235 42.8920 178.0980 104 L 3.6277 7.4824 119.1937 57.7004 41.8741 177.1424 105 P 4.1131 0.0000 0.0000 66.2970 30.8438 177.7811 106 Y 4.0535 7.6044 116.0037 60.6601 37.7659 178.4530 107 I 3.6224 7.6168 120.1387 64.5640 37.2905 178.2145 108 L 4.0645 7.9635 119.6363 57.6958 41.4244 179.2710 109 E 3.8689 8.2555 118.9025 59.3492 29.6716 178.6524 110 A 4.0335 8.1828 120.8081 55.2216 18.3113 179.3258 111 E 3.8867 8.7079 117.0889 59.7604 29.6494 179.5655 112 A 3.9731 8.1790 120.3303 55.0157 18.4430 179.5346 113 A 3.9380 8.1601 119.3040 55.2868 18.3661 179.7661 114 A 3.9592 8.0266 119.3852 54.9715 18.4383 179.6504 115 K 3.8182 8.2460 118.5135 59.6019 32.1917 178.6298 116 E 3.8718 8.1863 119.3955 59.1825 29.6378 178.3125 117 K 3.7829 7.8706 119.5791 59.8046 31.9352 177.9237 118 D 4.3284 8.0829 116.7801 57.4565 41.4865 177.8676 119 E 4.1177 8.2313 118.9795 59.4698 29.3464 179.3033 120 L 4.1463 8.4122 117.4774 57.2017 41.6825 178.7233 121 D 4.5946 7.8362 117.8858 55.8311 40.8857 176.7067 122 N 4.9318 7.5314 114.4006 52.3255 39.4360 174.5058 123 I 3.6419 7.7918 112.6281 61.4323 37.6348 175.8710 124 E 4.3919 8.5534 124.3342 55.6205 30.5753 175.9105 125 V 4.4212 7.9796 112.4485 59.6267 34.6596 175.8183 126 S 4.4773 8.4565 116.6692 56.6050 64.0265 173.9620 127 K 4.1909 8.6333 126.2774 56.5622 32.0114 176.7666 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 Q 8.33 4.21 0.00 1.96 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.96 0.00 0.00 0.00 0.00 0.00 2.08 2.28 0.00 4 S 8.15 4.35 0.00 4.44 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 5 F 10.37 4.16 0.00 3.30 3.17 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 6 T 8.60 3.98 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 1.23 0.00 0.00 7 S 7.74 4.04 0.00 3.87 4.01 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 8 I 7.73 3.62 1.85 0.00 0.00 0.47 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 0.53 0.89 0.00 0.00 9 A 8.61 4.03 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.92 3.92 0.00 2.11 2.08 0.00 3.11 0.00 0.00 3.13 7.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 11 I 8.07 3.78 1.86 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 1.40 1.28 0.91 0.00 0.00 12 G 8.29 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 D 7.91 4.37 0.00 2.91 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 14 Y 7.89 4.08 0.00 3.09 3.17 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 15 I 7.50 3.60 2.09 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.04 0.91 0.00 0.00 16 L 8.00 4.01 0.00 1.88 1.76 0.91 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.54 4.35 0.00 1.76 1.74 0.00 1.75 0.00 0.00 1.61 0.00 0.00 2.99 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.59 7.81 18 S 7.26 4.12 0.00 3.45 3.46 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 19 P 0.00 4.21 0.00 2.16 2.09 0.00 3.58 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.13 0.00 20 V 7.54 3.58 2.05 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 1.06 0.00 0.00 0.90 0.00 0.00 21 L 7.73 3.95 0.00 1.89 1.69 0.95 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 22 S 8.14 4.05 0.00 4.06 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 0.00 23 K 7.69 4.01 0.00 1.70 1.86 0.00 1.73 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.49 7.81 24 L 7.28 4.23 0.00 1.73 1.93 0.92 0.93 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 25 C 8.28 4.31 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 26 V 7.52 3.61 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 1.04 0.00 0.00 0.96 0.00 0.00 27 P 0.00 4.21 0.00 2.20 2.08 0.00 3.75 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 2.25 2.14 0.00 28 V 7.86 3.59 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 0.85 0.00 0.00 0.99 0.00 0.00 29 A 8.40 4.09 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 30 N 8.34 4.36 0.00 2.95 2.90 0.00 0.00 6.68 7.13 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 31 Q 8.39 3.98 0.00 2.29 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.78 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 32 F 8.87 4.15 0.00 3.10 3.28 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 33 I 7.93 3.57 2.02 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 1.68 1.13 0.87 0.00 0.00 34 N 7.93 4.31 0.00 2.66 2.81 0.00 0.00 7.14 7.29 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 35 L 7.78 4.07 0.00 1.76 1.60 0.96 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 36 A 7.09 3.92 1.19 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 0.00 0.00 0.00 37 G 7.46 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 Y 7.46 4.11 0.00 3.17 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 39 K 7.18 4.22 0.00 1.49 1.96 0.00 1.54 0.00 0.00 1.92 0.00 0.00 2.72 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.31 0.83 7.81 40 K 7.37 2.63 0.00 1.38 0.95 0.00 1.11 0.00 0.00 0.66 0.00 0.00 2.80 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.30 0.63 7.81 41 L 7.78 4.68 0.00 1.62 1.63 0.85 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 42 G 8.15 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 0.00 0.00 0.00 43 L 7.94 4.99 0.00 1.72 1.55 0.88 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 44 K 8.93 4.90 0.00 2.04 1.94 0.00 1.78 0.00 0.00 1.85 0.00 0.00 3.03 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.55 1.49 7.81 45 F 9.16 3.41 0.00 2.98 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 46 D 8.26 4.44 0.00 2.36 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 0.00 0.00 0.00 0.00 47 D 7.72 4.53 0.00 2.70 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 48 L 7.59 4.07 0.00 1.03 1.24 0.76 0.42 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 49 I 6.33 3.43 1.84 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.14 0.97 0.00 0.00 50 A 8.66 3.98 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 51 E 8.11 4.44 0.00 2.20 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 2.21 2.24 0.00 52 E 7.89 4.39 0.00 1.96 1.98 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 2.31 2.35 0.00 53 N 7.60 4.92 0.00 2.88 2.87 0.00 0.00 5.81 7.76 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 54 P 0.00 4.21 0.00 2.28 2.39 0.00 3.72 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.10 0.00 55 I 7.79 3.65 1.91 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.94 0.94 0.00 0.00 56 M 7.99 4.06 0.00 2.00 2.12 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 2.94 2.60 0.00 57 Q 8.15 3.99 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.95 0.00 0.00 0.00 0.00 0.00 2.64 2.54 0.00 58 T 8.40 3.97 4.43 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 1.22 0.00 0.00 59 A 8.31 3.98 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.39 3.80 0.00 1.61 1.71 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 61 R 7.39 3.94 0.00 1.77 2.09 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 1.59 1.62 0.00 62 R 7.64 4.03 0.00 2.00 1.87 0.00 3.27 0.00 0.00 3.31 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.68 0.00 63 L 6.49 3.33 0.00 1.31 1.49 0.93 0.95 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 64 P 0.00 4.25 0.00 2.29 2.21 0.00 3.65 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.18 0.00 65 E 8.62 3.49 0.00 1.96 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 2.18 2.36 0.00 66 D 8.00 4.47 0.00 2.69 2.74 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 67 E 8.05 3.90 0.00 2.05 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 2.37 2.34 0.00 68 S 7.69 3.96 0.00 3.70 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 69 Y 7.65 4.30 0.00 3.07 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 70 A 8.07 4.04 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 71 R 8.11 3.80 0.00 1.93 2.12 0.00 3.28 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.96 0.00 72 A 8.23 3.98 1.51 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 0.00 0.00 0.00 73 Y 8.07 4.13 0.00 3.09 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 74 R 8.11 3.70 0.00 2.06 1.97 0.00 3.43 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.94 0.00 75 I 7.70 3.62 2.01 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.81 0.89 0.00 0.00 76 I 7.61 3.66 1.97 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 1.44 0.86 0.93 0.00 0.00 77 R 7.96 3.68 0.00 1.18 1.80 0.00 2.84 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.42 0.00 78 A 7.81 3.90 1.30 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 79 H 7.94 4.15 0.00 3.36 3.33 0.00 5.65 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 Q 8.09 3.93 0.00 2.01 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.95 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 81 T 8.01 4.07 4.35 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 1.28 0.00 0.00 82 E 8.39 3.94 0.00 2.08 2.19 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 2.32 2.37 0.00 83 L 8.10 4.09 0.00 1.75 1.79 0.88 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 84 T 7.80 4.25 4.09 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 1.26 0.00 0.00 85 H 7.69 4.48 0.00 3.38 3.45 0.00 5.62 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 H 7.45 5.14 0.00 2.95 3.29 0.00 5.79 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 L 8.08 5.03 0.00 1.66 1.74 0.96 0.88 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 88 L 8.27 4.37 0.00 1.84 1.81 1.02 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.22 0.00 2.22 1.96 0.00 3.81 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 2.22 2.16 0.00 90 R 8.43 2.00 0.00 1.32 0.83 0.00 2.69 0.00 0.00 3.20 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.31 0.00 91 N 7.69 4.34 0.00 2.75 2.84 0.00 0.00 5.99 7.66 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 92 E 8.47 4.43 0.00 2.19 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 2.36 2.30 0.00 93 W 7.70 4.61 0.00 3.38 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 94 I 8.31 4.12 1.97 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 1.45 0.98 1.03 0.00 0.00 95 K 10.01 4.24 0.00 1.95 1.96 0.00 1.74 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 1.46 7.81 96 A 8.71 3.60 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 97 Q 8.06 4.16 0.00 2.06 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.99 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 98 E 9.06 4.32 0.00 1.97 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 2.36 2.36 0.00 99 D 7.47 4.83 0.00 2.83 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 0.00 100 V 7.44 4.11 2.24 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 0.98 0.00 0.00 1.06 0.00 0.00 101 P 0.00 4.74 0.00 2.26 2.24 0.00 3.82 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.98 0.00 102 Y 7.86 4.49 0.00 3.18 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 0.00 103 L 7.46 4.26 0.00 0.91 1.36 0.87 0.62 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 0.00 104 L 7.48 3.63 0.00 1.66 1.78 0.88 0.86 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 0.00 105 P 0.00 4.11 0.00 1.90 2.14 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 1.70 1.91 0.00 106 Y 7.60 4.05 0.00 3.25 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 0.00 107 I 7.62 3.62 1.69 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.50 0.57 0.00 0.00 108 L 7.96 4.06 0.00 1.80 1.73 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 109 E 8.26 3.87 0.00 2.11 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 0.00 2.32 2.33 0.00 110 A 8.18 4.03 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 0.00 111 E 8.71 3.89 0.00 2.18 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 0.00 2.40 2.53 0.00 112 A 8.18 3.97 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 0.00 113 A 8.16 3.94 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 0.00 114 A 8.03 3.96 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 0.00 115 K 8.25 3.82 0.00 2.01 2.02 0.00 1.53 0.00 0.00 1.58 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.50 7.81 116 E 8.19 3.87 0.00 2.10 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 0.00 2.31 2.32 0.00 117 K 7.87 3.78 0.00 1.98 1.99 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.62 7.81 118 D 8.08 4.33 0.00 2.84 2.91 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 0.00 119 E 8.23 4.12 0.00 2.21 1.98 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 2.33 2.43 0.00 120 L 8.41 4.15 0.00 1.64 1.73 0.92 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 121 D 7.84 4.59 0.00 2.83 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 0.00 122 N 7.53 4.93 0.00 2.70 2.79 0.00 0.00 6.99 7.41 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 0.00 123 I 7.79 3.64 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.52 0.94 0.00 0.00 124 E 8.55 4.39 0.00 1.98 1.93 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 2.30 2.32 0.00 125 V 7.98 4.42 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 0.71 0.00 0.00 0.93 0.00 0.00 126 S 8.46 4.48 0.00 3.77 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 0.00 127 K 8.63 4.19 0.00 1.76 1.69 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.38 1.47 7.81