NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.4940 8.1633 120.6140 55.6180 34.3653 173.3538 3 I 4.8634 8.2129 121.8192 59.1297 39.4417 174.1547 4 R 4.6971 9.2797 125.2453 54.3184 34.7439 174.5472 5 G 4.2488 8.7650 109.8056 45.8727 0.0000 172.9438 6 I 4.8945 8.7693 123.0825 59.3224 40.9900 174.8586 7 R 5.1247 8.8695 124.4613 54.8380 33.6225 174.9589 8 G 4.6859 8.5935 106.9551 45.1578 0.0000 171.4934 9 A 5.2211 7.8196 119.6780 51.3415 22.9059 175.1131 10 T 5.3053 8.5800 114.1339 61.3977 71.7209 172.1286 11 T 5.2188 8.3083 112.1695 60.0123 72.0184 173.4898 12 V 4.5994 8.4424 115.6592 59.7603 33.8442 176.2942 13 E 4.1816 9.2488 123.2108 58.6683 29.7706 177.8761 14 R 4.6401 7.4056 115.7510 54.4442 34.4007 175.7617 15 D 4.6110 8.5154 122.2961 53.7630 39.5265 175.0610 16 T 4.6822 7.2570 116.3199 58.9881 72.2895 173.1379 17 E 3.8667 8.4894 124.0218 59.6182 29.9186 178.5427 18 E 3.8985 8.2613 118.0646 59.5129 29.4008 178.9766 19 E 4.0040 8.0114 118.4123 58.8938 29.9775 178.3702 20 I 3.6505 7.5167 119.2688 64.4815 37.2472 178.2516 21 L 3.9687 8.1136 119.9228 57.9123 41.5576 179.5525 22 Q 3.9199 7.9221 118.7551 59.0741 29.0303 178.4156 23 K 3.9338 8.3751 119.8463 59.8082 32.0637 179.4879 24 T 3.7949 7.9295 115.9089 66.4578 68.2850 176.6095 25 K 3.8124 8.0871 121.4504 59.6434 32.2398 178.7931 26 Q 3.9163 7.9220 118.0692 58.7803 28.4986 178.6447 27 L 3.8835 7.8630 121.3136 58.0365 42.0585 178.9210 28 L 3.7672 8.0588 119.2445 57.9981 41.4951 179.5144 29 E 3.8121 8.2524 118.5513 59.0668 29.2826 179.4290 30 K 4.0719 8.1327 119.8820 59.3122 32.2649 178.9546 31 I 3.6255 7.8980 120.3596 64.4159 37.0569 178.3351 32 I 3.8201 7.7887 122.0224 63.8549 36.7695 177.9566 33 E 3.9769 8.1012 118.6576 59.4258 29.4811 178.4966 34 E 4.1174 8.0031 117.2227 59.2121 29.7449 178.3315 35 N 4.6451 8.1250 112.5248 52.1091 40.1275 174.5239 36 H 4.1343 8.0520 117.2003 57.0070 26.5435 175.1212 37 T 4.4289 7.5698 115.3740 62.6398 70.2029 175.0131 38 K 4.5738 8.3041 125.3436 53.8116 34.4378 175.5549 39 P 2.9700 0.0000 0.0000 65.4165 30.8469 178.1600 40 E 3.9923 7.7504 114.7416 58.0337 29.8993 176.9982 41 D 4.4473 7.9101 119.1198 54.8356 41.3968 175.8275 42 V 4.3613 7.1217 119.8849 61.5016 31.9952 175.5149 43 V 3.8792 8.6856 128.7589 65.0433 31.7643 175.5992 44 Q 4.7923 7.5086 115.4827 56.0328 31.4029 171.5754 45 M 5.2931 8.7407 118.3798 53.8969 36.2739 173.7148 46 L 5.1860 8.8274 123.2320 52.9651 46.4062 175.4210 47 L 5.2543 8.7897 122.7152 53.0876 44.8498 176.2588 48 S 5.6699 9.2747 118.7568 56.4408 65.9854 172.9568 49 A 5.2078 8.1603 121.0037 50.1314 22.6447 175.9366 50 T 4.2442 8.3498 111.4962 60.9722 70.0030 173.6833 51 P 4.3975 0.0000 0.0000 64.1993 31.3321 176.6729 52 D 4.7289 8.2660 118.0656 52.9241 40.1512 175.6641 53 L 4.9201 7.4355 120.2321 53.6174 43.3805 175.7778 54 H 4.7206 9.1678 116.4155 55.7486 32.0732 175.5339 55 A 3.7241 8.3260 121.9653 54.7493 18.3547 177.7657 56 V 4.2081 6.5941 111.2780 60.7495 34.4129 172.7575 57 F 4.3754 8.3367 121.0548 56.7082 39.6502 174.8644 58 P 4.2823 0.0000 0.0000 65.7470 31.1006 178.4954 59 A 3.9805 8.2744 118.9035 54.9079 17.9907 179.3067 60 K 3.9741 8.0554 117.6657 59.3622 32.1223 178.7585 61 A 4.8162 8.3070 122.7150 54.3187 18.3076 179.6550 62 V 3.4596 7.7823 117.2569 65.9331 31.3656 177.5204 63 R 4.3735 7.5913 114.7774 56.7563 30.4058 176.5812 64 E 4.4267 8.2241 119.1149 56.0364 30.0931 175.1739 65 L 4.8758 7.5715 120.3471 52.4933 43.4751 176.2281 66 S 4.3732 8.6486 119.9966 60.1872 63.2461 174.8650 67 G 3.9790 9.1468 113.9242 45.3528 0.0000 174.1195 68 W 4.2097 8.1691 119.0009 56.6168 29.1707 177.9975 69 Q 4.0146 7.4554 117.1356 58.2695 27.9449 176.6333 70 Y 4.5580 7.4474 114.4833 57.5237 38.5898 175.3092 71 V 3.8496 7.7324 121.7873 61.3895 31.9960 173.8087 72 P 4.5263 0.0000 0.0000 62.9947 32.2315 175.6602 73 V 5.0705 8.3634 116.9696 59.8547 35.3262 174.6031 74 T 4.6761 8.5425 117.2069 61.0220 71.4313 171.9064 75 C 5.5846 8.4491 121.5088 58.4740 32.0037 172.6062 76 M 4.8082 8.6220 116.9457 54.5358 34.9768 172.9731 77 Q 4.6822 8.4524 120.4519 54.8406 30.0905 174.8240 78 E 4.3351 8.8748 128.4281 55.9874 30.3929 176.5000 79 M 4.1434 8.5976 122.9925 55.1979 32.0983 175.6577 80 D 4.5973 8.4421 120.5149 53.0083 41.2549 175.4965 81 V 4.3792 7.8945 126.5993 60.6842 33.6680 175.0196 82 T 4.0802 8.4310 124.2590 65.0854 68.6710 174.5869 83 G 3.9089 9.0348 113.8721 45.5323 0.0000 173.5906 84 G 3.7961 7.8522 108.3625 44.2541 0.0000 174.0093 85 L 4.0190 8.2980 124.1796 54.7678 42.6528 177.1093 86 K 4.2429 8.5076 125.0517 56.6480 33.3007 176.2549 87 K 4.0330 8.7732 117.5878 56.7634 30.3834 174.2472 88 C 5.1909 7.8827 117.3197 57.7277 34.4181 172.5138 89 I 4.7881 8.5315 126.8726 59.7875 39.0436 174.8388 90 R 5.1596 9.0359 125.9208 54.2003 33.8452 174.9480 91 V 4.8168 8.3455 121.8081 60.0462 34.7681 174.1111 92 M 4.9921 8.9412 123.4495 54.1329 34.5931 173.8089 93 M 5.0017 9.1430 127.1995 54.0967 35.1569 174.2686 94 T 4.8804 8.5840 123.4994 62.6397 70.3570 174.5253 95 V 4.9647 8.9959 119.1400 59.5173 36.6003 174.2078 96 Q 4.8078 8.7286 124.3801 55.5885 29.4810 174.7554 97 T 4.6315 8.9795 120.2670 61.6872 70.4111 172.8298 98 D 4.6777 8.6597 123.9981 54.7532 42.1621 177.5974 99 V 3.6508 7.5815 119.8319 61.9495 31.9675 174.0712 100 P 4.4192 0.0000 0.0000 62.5026 31.7152 176.8309 101 Q 3.9555 8.8650 121.5191 59.5385 28.8818 178.0259 102 D 4.6878 8.0840 113.3440 54.3349 39.6019 176.2411 103 Q 4.5618 7.9924 117.9539 55.6553 29.8758 175.9134 104 I 3.7655 7.3446 119.4275 61.4431 37.4760 176.6995 105 R 4.3711 8.4975 124.9626 54.8449 28.9638 175.7190 106 H 4.5714 8.1834 119.0551 55.5361 30.0509 174.7191 107 V 4.4591 8.4493 121.0337 61.3206 34.4063 173.8325 108 Y 4.9472 8.7586 124.4905 56.3177 41.0263 174.5831 109 L 4.8331 8.7255 123.3450 52.0728 46.4205 178.0672 110 E 3.5160 8.7115 119.1430 58.3535 27.8120 176.9553 111 K 4.2213 9.2294 126.8482 57.7829 32.2032 177.1827 112 A 4.3343 7.9122 122.1082 53.1867 18.7651 180.0743 113 V 3.7109 7.2667 109.1604 64.0297 31.7162 178.2160 114 V 3.7503 7.6798 117.9819 63.9819 31.6734 177.4275 115 L 4.0900 7.8814 120.8159 57.5438 41.5128 178.0027 116 R 4.3833 6.7473 116.7118 54.2940 31.7729 173.2344 117 P 4.6038 0.0000 0.0000 60.7964 30.9923 176.7685 118 D 4.2366 7.3629 121.2394 54.3995 39.2339 175.6720 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 M 8.16 4.49 0.00 2.17 2.02 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.65 0.00 3 I 8.21 4.86 1.88 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 1.35 0.64 0.92 0.00 0.00 4 R 9.28 4.70 0.00 1.66 1.78 0.00 3.30 0.00 0.00 3.19 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.71 0.00 5 G 8.77 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 0.00 0.00 0.00 0.00 6 I 8.77 4.89 1.90 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 1.22 0.83 0.89 0.00 0.00 7 R 8.87 5.12 0.00 1.66 1.69 0.00 3.30 0.00 0.00 3.35 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.54 0.00 8 G 8.59 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 0.00 0.00 0.00 0.00 9 A 7.82 5.22 1.27 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 0.00 0.00 10 T 8.58 5.31 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 1.24 0.00 0.00 11 T 8.31 5.22 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 1.28 0.00 0.00 12 V 8.44 4.60 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 0.69 0.00 0.00 0.97 0.00 0.00 13 E 9.25 4.18 0.00 2.09 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 2.47 2.42 0.00 14 R 7.41 4.64 0.00 2.00 1.75 0.00 3.15 0.00 0.00 3.14 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 15 D 8.52 4.61 0.00 2.60 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.26 4.68 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 1.26 0.00 0.00 17 E 8.49 3.87 0.00 2.06 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 0.00 2.37 2.40 0.00 18 E 8.26 3.90 0.00 2.04 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 2.40 2.38 0.00 19 E 8.01 4.00 0.00 2.06 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 0.00 2.55 2.44 0.00 20 I 7.52 3.65 1.98 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 1.50 0.75 0.90 0.00 0.00 21 L 8.11 3.97 0.00 1.66 1.71 0.92 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 22 Q 7.92 3.92 0.00 2.24 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 23 K 8.38 3.93 0.00 1.75 1.82 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.65 1.78 7.81 24 T 7.93 3.79 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 1.17 0.00 0.00 25 K 8.09 3.81 0.00 1.82 1.84 0.00 1.59 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.40 7.81 26 Q 7.92 3.92 0.00 2.29 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.70 0.00 0.00 0.00 0.00 0.00 2.35 2.47 0.00 27 L 7.86 3.88 0.00 1.71 1.81 0.85 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.06 3.77 0.00 1.66 1.29 0.72 0.62 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 29 E 8.25 3.81 0.00 2.05 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 2.21 2.31 0.00 30 K 8.13 4.07 0.00 1.99 1.86 0.00 1.66 0.00 0.00 1.63 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.50 7.81 31 I 7.90 3.63 1.94 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.64 0.90 0.00 0.00 32 I 7.79 3.82 2.00 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 1.51 1.09 1.11 0.00 0.00 33 E 8.10 3.98 0.00 2.04 2.26 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 2.34 2.38 0.00 34 E 8.00 4.12 0.00 2.16 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 2.62 2.49 0.00 35 N 8.13 4.65 0.00 2.82 2.87 0.00 0.00 7.50 8.00 0.00 0.00 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 H 8.05 4.13 0.00 3.26 3.33 0.00 5.66 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 T 7.57 4.43 4.57 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 1.36 0.00 0.00 38 K 8.30 4.57 0.00 1.69 1.64 0.00 1.71 0.00 0.00 1.89 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.65 1.33 7.81 39 P 0.00 2.97 0.00 1.71 0.70 0.00 3.55 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.61 0.00 40 E 7.75 3.99 0.00 2.01 2.02 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 2.18 2.21 0.00 41 D 7.91 4.45 0.00 2.86 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 42 V 7.12 4.36 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 0.87 0.00 0.00 0.98 0.00 0.00 43 V 8.69 3.88 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 0.82 0.00 0.00 0.97 0.00 0.00 44 Q 7.51 4.79 0.00 2.12 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.63 0.00 0.00 0.00 0.00 0.00 2.24 2.28 0.00 45 M 8.74 5.29 0.00 2.12 1.96 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 2.58 2.53 0.00 46 L 8.83 5.19 0.00 1.61 1.49 0.93 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 47 L 8.79 5.25 0.00 1.64 1.55 0.93 0.72 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 48 S 9.27 5.67 0.00 3.90 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 49 A 8.16 5.21 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 50 T 8.35 4.24 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 1.28 0.00 0.00 51 P 0.00 4.40 0.00 2.07 2.16 0.00 3.66 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 2.03 2.19 0.00 52 D 8.27 4.73 0.00 2.89 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 53 L 7.44 4.92 0.00 1.54 1.53 0.89 0.97 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 54 H 9.17 4.72 0.00 3.11 3.18 0.00 5.63 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 55 A 8.33 3.72 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 56 V 6.59 4.21 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 0.62 0.00 0.00 0.96 0.00 0.00 57 F 8.34 4.38 0.00 3.11 2.95 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 58 P 0.00 4.28 0.00 2.19 2.12 0.00 3.76 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.18 0.00 59 A 8.27 3.98 1.31 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 60 K 8.06 3.97 0.00 1.97 1.86 0.00 1.70 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.49 7.81 61 A 8.31 4.82 1.31 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 62 V 7.78 3.46 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 1.17 0.00 0.00 0.96 0.00 0.00 63 R 7.59 4.37 0.00 1.92 1.94 0.00 3.27 0.00 0.00 3.23 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 64 E 8.22 4.43 0.00 2.21 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 0.00 2.27 2.30 0.00 65 L 7.57 4.88 0.00 1.77 1.40 0.11 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 66 S 8.65 4.37 0.00 3.94 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 67 G 9.15 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 68 W 8.17 4.21 0.00 3.70 3.32 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 69 Q 7.46 4.01 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.68 6.72 0.00 0.00 0.00 0.00 0.00 1.16 1.43 0.00 70 Y 7.45 4.56 0.00 2.94 2.96 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 0.00 0.00 0.00 71 V 7.73 3.85 2.36 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 0.92 0.00 0.00 0.71 0.00 0.00 72 P 0.00 4.53 0.00 2.17 2.20 0.00 3.71 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 2.17 2.02 0.00 73 V 8.36 5.07 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 0.81 0.00 0.00 0.93 0.00 0.00 74 T 8.54 4.68 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 75 C 8.45 5.58 0.00 3.00 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 76 M 8.62 4.81 0.00 2.05 2.15 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.65 0.00 77 Q 8.45 4.68 0.00 2.11 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 7.02 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 78 E 8.87 4.34 0.00 2.01 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 2.33 2.31 0.00 79 M 8.60 4.14 0.00 2.17 2.06 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 2.57 2.53 0.00 80 D 8.44 4.60 0.00 2.64 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 81 V 7.89 4.38 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 0.99 0.00 0.00 0.94 0.00 0.00 82 T 8.43 4.08 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 1.21 0.00 0.00 83 G 9.03 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 0.00 0.00 0.00 84 G 7.85 3.80 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 0.00 0.00 0.00 85 L 8.30 4.02 0.00 1.61 1.61 0.93 0.70 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 86 K 8.51 4.24 0.00 1.79 1.83 0.00 1.96 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.43 1.40 7.81 87 K 8.77 4.03 0.00 1.95 1.85 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.82 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.30 7.81 88 C 7.88 5.19 0.00 3.03 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 89 I 8.53 4.79 1.86 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 1.22 0.57 0.89 0.00 0.00 90 R 9.04 5.16 0.00 1.71 1.77 0.00 3.26 0.00 0.00 3.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 91 V 8.35 4.82 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 0.70 0.00 0.00 0.91 0.00 0.00 92 M 8.94 4.99 0.00 2.14 1.95 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.50 0.00 93 M 9.14 5.00 0.00 2.12 1.90 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.59 0.00 94 T 8.58 4.88 4.27 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 1.23 0.00 0.00 95 V 9.00 4.96 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 0.79 0.00 0.00 1.00 0.00 0.00 96 Q 8.73 4.81 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.64 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 97 T 8.98 4.63 4.26 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 1.22 0.00 0.00 98 D 8.66 4.68 0.00 2.70 2.70 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 99 V 7.58 3.65 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 0.75 0.00 0.00 0.93 0.00 0.00 100 P 0.00 4.42 0.00 2.42 1.97 0.00 3.67 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.09 0.00 101 Q 8.87 3.96 0.00 2.10 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 7.05 0.00 0.00 0.00 0.00 0.00 2.46 2.40 0.00 102 D 8.08 4.69 0.00 2.84 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 0.00 103 Q 7.99 4.56 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.88 6.86 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 104 I 7.34 3.77 1.80 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 1.56 0.75 0.79 0.00 0.00 105 R 8.50 4.37 0.00 1.87 1.88 0.00 3.32 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.67 0.00 106 H 8.18 4.57 0.00 3.21 3.35 0.00 5.83 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 0.00 107 V 8.45 4.46 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 1.02 0.00 0.00 0.97 0.00 0.00 108 Y 8.76 4.95 0.00 2.84 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 0.00 109 L 8.73 4.83 0.00 1.53 1.53 0.90 1.04 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 0.00 110 E 8.71 3.52 0.00 2.20 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.25 0.00 111 K 9.23 4.22 0.00 1.75 1.85 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.53 7.81 112 A 7.91 4.33 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 0.00 113 V 7.27 3.71 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 0.80 0.00 0.00 0.97 0.00 0.00 114 V 7.68 3.75 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 0.76 0.00 0.00 0.91 0.00 0.00 115 L 7.88 4.09 0.00 1.47 1.68 1.11 0.72 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 0.00 116 R 6.75 4.38 0.00 0.87 1.52 0.00 3.27 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.44 0.00 117 P 0.00 4.60 0.00 2.12 2.02 0.00 3.64 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 1.89 1.88 0.00 118 D 7.36 4.24 0.00 2.72 2.57 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