NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4721 8.3049 120.3482 54.8901 34.1765 175.9012 2 N 4.8263 7.8837 115.2422 52.1821 39.4150 173.0782 3 Q 4.3245 8.7819 119.0936 53.9589 30.5305 174.4120 4 P 4.3066 0.0000 0.0000 62.3788 32.2404 176.0188 5 E 3.8804 8.3433 120.6042 56.1110 30.0718 178.3793 6 R 3.8666 8.5525 123.6202 59.3443 30.4488 178.5752 7 Y 4.5155 7.6462 115.9458 59.4804 37.5081 176.7676 8 E 4.4138 7.0745 119.9335 56.5372 29.6553 176.7686 9 L 4.3712 8.1887 120.8155 55.1039 43.7745 176.6964 10 I 4.4365 6.8592 118.8142 59.2956 37.3086 176.3154 11 E 4.5183 7.5543 115.1197 55.2078 31.9296 174.9702 12 L 4.1485 8.6989 128.1637 55.8668 40.8165 178.1343 13 M 4.3480 8.6159 125.5938 56.2856 29.3529 176.3564 14 G 4.0210 8.0758 108.0758 45.9536 0.0000 170.3105 15 L 4.4781 7.1133 117.1796 51.8399 42.9090 174.8248 16 P 4.2409 0.0000 0.0000 62.8567 30.7762 176.0730 17 K 3.9686 8.1825 124.5517 58.5694 32.2942 175.4759 18 V 4.7627 7.5762 120.2572 61.6537 33.8758 174.7104 19 T 4.6759 8.0841 116.1006 60.4021 72.1979 171.6945 20 Y 4.7975 8.7818 127.2634 55.7896 40.8501 174.5949 21 E 4.6427 8.2165 125.0691 54.6069 34.2325 175.6235 22 L 3.9039 8.6155 124.5023 56.7182 42.4200 175.2863 23 D 4.4484 8.4620 118.1192 54.3781 41.5294 175.7614 24 S 4.5356 5.8100 111.3702 55.7024 70.0800 173.4460 25 K 3.7021 7.7154 116.0424 57.5625 29.1522 174.2983 26 S 4.8115 7.5711 115.5114 56.3288 64.8315 172.3421 27 P 4.3576 0.0000 0.0000 63.2649 32.4121 176.4778 28 N 4.1286 8.7937 119.6663 53.2328 35.3473 173.9766 29 A 5.3616 7.3857 116.2370 52.1817 23.2565 176.8426 30 A 4.5307 8.5177 123.1967 49.8282 23.1588 174.7189 31 V 4.6947 8.1674 117.8452 61.3538 34.6119 174.3053 32 V 4.5486 9.3277 129.4464 61.7728 33.0816 174.7909 33 T 5.1746 8.1861 123.6977 60.1658 68.9265 172.3408 34 L 4.4147 7.3603 124.8345 54.5343 43.4975 175.6355 35 E 4.5102 8.8351 121.5291 54.0499 33.6614 175.7825 36 K 4.2799 8.6841 117.2439 56.6195 30.4465 175.0601 37 E 4.5592 8.1201 118.9761 55.9138 30.5960 173.6068 38 D 4.5212 8.6081 125.3073 53.5906 41.9103 174.5277 39 H 4.2811 8.4289 111.5101 56.6267 26.9829 174.8204 40 T 4.4013 6.6901 118.2743 64.3964 76.4400 175.8291 41 L 3.9712 7.7145 120.7311 57.8179 41.5224 179.6528 42 A 3.5873 7.2842 119.1574 55.0533 18.7629 178.7683 43 N 3.6701 7.5198 114.8419 56.6419 38.5334 176.7879 44 M 4.0519 7.3232 119.2788 58.0225 32.4816 180.0193 45 L 4.1517 7.1177 117.8933 53.6355 40.2252 177.2148 46 A 4.5658 6.9399 121.0827 53.0145 25.3481 177.6504 47 N 4.4456 7.5526 114.6164 54.0875 39.7819 175.8114 48 Q 4.3281 7.9114 118.0863 57.0397 31.5582 177.0350 49 L 3.9403 7.8081 119.2182 57.8984 42.2380 177.8143 50 L 4.2104 8.3337 118.4066 56.2613 41.9500 177.1799 51 S 4.2504 7.8182 111.7976 60.4423 62.7992 173.3584 52 D 4.6712 7.8023 121.4238 53.4135 40.8431 177.1563 53 E 4.0043 8.9092 124.6830 59.1830 29.6232 178.7707 54 R 4.0359 7.9316 116.3785 58.0453 30.4027 176.8184 55 V 4.2427 7.7327 117.7238 62.0933 32.5481 175.3298 56 L 4.9137 8.0108 121.2158 53.9666 44.1535 175.9432 57 F 4.4668 7.9655 118.7860 57.7881 42.7387 172.7628 58 A 4.8296 7.0910 125.5143 49.3590 19.7856 177.7094 59 G 4.0036 9.6466 109.8734 45.8450 0.0000 171.0157 60 Y 4.5052 10.4014 134.2858 58.9171 36.7436 166.9048 61 K 3.7773 8.0004 122.7803 55.2169 35.1228 174.1514 62 V 3.8813 8.4885 126.8854 62.5199 31.9000 174.1437 63 P 4.4241 0.0000 0.0000 65.3540 32.0453 176.2630 64 H 4.3975 7.5819 113.7064 54.9658 32.4158 172.2345 65 P 4.5296 0.0000 0.0000 63.5888 31.3024 176.9766 66 L 4.3201 7.7966 119.3103 56.9108 42.2356 177.2991 67 N 4.4989 8.0645 115.5325 53.4971 39.5003 175.8060 68 H 4.6972 8.6992 126.4232 54.5327 28.9371 172.4482 69 N 5.2324 7.1520 118.3854 54.2747 40.2491 175.0443 70 F 5.0475 7.5266 114.4738 57.3676 41.6337 173.6071 71 I 4.8608 7.4887 114.0685 59.2562 40.8034 174.3452 72 L 4.9184 8.1339 123.4122 54.3385 45.1657 173.4966 73 R 5.1595 8.9891 126.9712 54.6564 32.8322 174.6302 74 V 5.1640 8.9205 125.3035 60.0081 35.1743 173.6258 75 Q 5.0464 9.5278 127.8071 53.3556 31.9951 173.7541 76 T 4.5728 8.9975 130.4548 63.2442 71.6067 168.8558 77 V 3.2179 8.8653 134.2286 62.6618 28.9451 169.9629 78 E 4.5778 8.1895 125.7946 53.3220 30.0463 173.3422 79 D 4.9277 8.0003 132.5894 53.4799 40.3030 177.5215 80 C 4.8943 7.3786 110.7337 57.9936 31.3327 172.3184 81 S 4.4760 8.9418 115.1842 59.2360 64.4418 173.1189 82 P 4.9583 0.0000 0.0000 62.1528 31.6847 176.7876 83 K 4.1962 8.1714 120.6709 60.1056 32.7320 178.7281 84 Q 4.1738 8.0025 118.1219 57.9172 29.4434 178.1888 85 V 3.6224 7.6877 118.0982 65.8339 31.4226 178.0711 86 I 3.8342 7.7226 112.4938 63.6636 37.6844 178.3463 87 V 3.5469 7.4488 119.2286 66.0517 31.2439 177.6254 88 D 4.5557 8.1259 117.1763 57.3978 40.9515 178.7889 89 A 4.0741 7.7730 121.1830 54.9622 18.5661 179.1134 90 A 3.9523 8.5864 119.4094 55.5129 18.3012 180.0165 91 K 3.8998 8.6135 116.8706 59.7298 31.8247 179.5147 92 S 4.2200 7.9216 112.2505 60.7155 62.1765 175.6406 93 L 4.1937 7.6907 121.8769 57.1676 41.9257 178.3271 94 I 3.6875 7.8520 112.8117 64.9576 37.2214 177.8997 95 T 3.9330 7.8170 114.2572 64.8865 66.9682 175.8247 96 H 4.3430 7.7567 118.8692 58.5401 30.0802 177.1283 97 L 4.1117 8.4056 121.6175 57.9528 41.4933 178.8199 98 E 3.9358 8.0315 117.9031 59.8351 28.9472 179.2637 99 E 3.9040 7.6817 117.1371 59.1294 29.4048 179.0438 100 I 3.9110 8.2142 112.2158 62.3734 38.6632 177.7581 101 K 3.9020 7.9613 120.7562 58.9517 31.9695 178.6468 102 V 3.7651 8.1532 118.8179 65.7576 31.7401 177.5638 103 N 4.3690 7.6805 115.8909 56.3432 38.3316 177.1303 104 F 4.1207 8.7271 122.2841 61.6672 39.4850 176.8670 105 M 4.2759 7.8349 115.5567 56.7273 31.7269 177.5896 106 R 4.3138 7.5326 118.4892 58.1989 31.4702 177.0520 107 E 4.2341 8.5371 117.9408 57.7987 29.7225 176.8500 108 W 3.9008 8.2544 128.9071 60.6053 30.2181 176.9363 109 E 4.0971 8.4603 119.3712 59.0818 29.0977 179.0480 110 L 4.0586 7.3140 119.2040 56.8340 42.1605 177.8608 111 K 4.3985 7.7449 116.0774 56.3521 32.5041 176.8639 112 M 4.0294 7.2392 119.9204 56.6960 32.3979 177.8208 113 I 3.9495 7.5812 119.9840 63.8454 37.6119 178.0689 114 S 3.9308 7.9302 113.3036 60.2459 63.4369 174.4522 115 V 3.9519 6.8869 122.4767 62.5276 30.6898 175.5325 116 E 3.9153 8.0206 120.4525 56.4175 30.1609 174.7044 117 G 4.3469 7.9041 111.5737 45.7290 0.0000 175.8653 118 V 4.4111 7.9868 127.1436 60.3593 31.5018 175.0998 119 E 4.5020 8.6939 117.6241 57.0917 30.2971 175.5092 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 1 M 8.30 4.47 0.00 1.99 2.16 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.57 0.00 2 N 7.88 4.83 0.00 2.76 2.75 0.00 0.00 6.88 6.81 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 3 Q 8.78 4.32 0.00 2.02 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.96 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 4 P 0.00 4.31 0.00 1.98 1.95 0.00 3.65 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 5 E 8.34 3.88 0.00 1.20 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 2.23 2.10 0.00 6 R 8.55 3.87 0.00 1.86 1.96 0.00 3.12 0.00 0.00 3.39 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.59 0.00 7 Y 7.65 4.52 0.00 3.19 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 8 E 7.07 4.41 0.00 1.67 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 2.31 2.32 0.00 9 L 8.19 4.37 0.00 1.57 1.70 0.93 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 10 I 6.86 4.44 1.90 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 1.17 0.78 0.93 0.00 0.00 11 E 7.55 4.52 0.00 1.93 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 2.13 2.20 0.00 12 L 8.70 4.15 0.00 1.91 1.72 0.93 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 13 M 8.62 4.35 0.00 2.10 2.09 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.53 0.00 14 G 8.08 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 0.00 0.00 0.00 15 L 7.11 4.48 0.00 1.71 1.72 0.97 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 16 P 0.00 4.24 0.00 2.04 2.04 0.00 3.72 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 2.07 0.00 17 K 8.18 3.97 0.00 1.84 1.78 0.00 1.71 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.52 1.50 7.81 18 V 7.58 4.76 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 0.89 0.00 0.00 0.93 0.00 0.00 19 T 8.08 4.68 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 1.21 0.00 0.00 20 Y 8.78 4.80 0.00 2.92 2.84 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 21 E 8.22 4.64 0.00 1.88 1.72 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 2.23 2.30 0.00 22 L 8.62 3.90 0.00 1.50 1.63 0.95 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 23 D 8.46 4.45 0.00 2.57 2.42 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 24 S 5.81 4.54 0.00 3.83 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 25 K 7.72 3.70 0.00 1.92 1.72 0.00 1.68 0.00 0.00 1.80 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.41 7.81 26 S 7.57 4.81 0.00 3.77 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 27 P 0.00 4.36 0.00 2.03 1.97 0.00 3.80 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.08 0.00 28 N 8.79 4.13 0.00 2.99 2.92 0.00 0.00 6.84 7.36 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 29 A 7.39 5.36 1.22 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 0.00 0.00 30 A 8.52 4.53 0.65 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 31 V 8.17 4.69 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 0.89 0.00 0.00 0.90 0.00 0.00 32 V 9.33 4.55 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 0.92 0.00 0.00 0.97 0.00 0.00 33 T 8.19 5.17 4.17 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 1.13 0.00 0.00 34 L 7.36 4.41 0.00 0.95 1.48 1.07 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.84 4.51 0.00 1.90 1.82 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 2.16 2.44 0.00 36 K 8.68 4.28 0.00 1.88 1.98 0.00 1.85 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.44 1.53 7.81 37 E 8.12 4.56 0.00 1.99 1.89 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 2.31 2.28 0.00 38 D 8.61 4.52 0.00 2.90 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 39 H 8.43 4.28 0.00 3.41 3.47 0.00 5.56 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 T 6.69 4.40 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 1.17 0.00 0.00 41 L 7.71 3.97 0.00 1.71 1.76 1.00 0.80 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 42 A 7.28 3.59 0.04 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 0.00 0.00 43 N 7.52 3.67 0.00 2.69 2.68 0.00 0.00 7.12 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 44 M 7.32 4.05 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.51 0.00 45 L 7.12 4.15 0.00 1.69 1.66 0.97 0.72 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 46 A 6.94 4.57 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 0.00 0.00 0.00 0.00 0.00 47 N 7.55 4.45 0.00 2.72 2.86 0.00 0.00 6.87 7.57 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 48 Q 7.91 4.33 0.00 1.98 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.80 0.00 0.00 0.00 0.00 0.00 2.17 2.31 0.00 49 L 7.81 3.94 0.00 1.69 1.65 0.97 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 50 L 8.33 4.21 0.00 1.56 1.78 0.87 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 51 S 7.82 4.25 0.00 3.87 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 52 D 7.80 4.67 0.00 2.74 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 53 E 8.91 4.00 0.00 1.96 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 2.33 2.35 0.00 54 R 7.93 4.04 0.00 1.82 2.01 0.00 3.20 0.00 0.00 3.16 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 55 V 7.73 4.24 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 0.84 0.00 0.00 1.02 0.00 0.00 56 L 8.01 4.91 0.00 1.73 1.69 0.95 0.78 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 57 F 7.97 4.47 0.00 3.13 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 58 A 7.09 4.83 1.08 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 0.00 0.00 59 G 9.65 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 0.00 0.00 0.00 60 Y 10.40 4.51 0.00 2.98 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 61 K 8.00 3.78 0.00 1.58 1.53 0.00 1.34 0.00 0.00 1.50 0.00 0.00 2.89 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.18 1.26 7.81 62 V 8.49 3.88 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 0.97 0.00 0.00 1.04 0.00 0.00 63 P 0.00 4.42 0.00 2.12 2.12 0.00 3.83 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 2.13 2.11 0.00 64 H 7.58 4.40 0.00 3.17 3.11 0.00 5.86 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 P 0.00 4.53 0.00 2.01 2.02 0.00 3.29 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.03 0.00 66 L 7.80 4.32 0.00 1.87 1.77 0.98 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 67 N 8.06 4.50 0.00 2.76 2.80 0.00 0.00 6.82 8.16 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 68 H 8.70 4.70 0.00 3.26 3.24 0.00 5.84 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 N 7.15 5.23 0.00 2.84 2.78 0.00 0.00 6.25 7.43 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 70 F 7.53 5.05 0.00 3.28 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 71 I 7.49 4.86 1.89 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 1.39 1.17 0.92 0.00 0.00 72 L 8.13 4.92 0.00 1.94 1.61 1.01 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 73 R 8.99 5.16 0.00 1.98 1.93 0.00 3.30 0.00 0.00 2.73 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.70 0.00 74 V 8.92 5.16 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 1.24 0.00 0.00 1.00 0.00 0.00 75 Q 9.53 5.05 0.00 2.13 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.01 0.00 0.00 0.00 0.00 0.00 2.33 2.30 0.00 76 T 9.00 4.57 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 1.26 0.00 0.00 77 V 8.87 3.22 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 78 E 8.19 4.58 0.00 1.91 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 0.00 2.19 2.22 0.00 79 D 8.00 4.93 0.00 2.83 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 80 C 7.38 4.89 0.00 3.07 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 81 S 8.94 4.48 0.00 3.81 4.04 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 82 P 0.00 4.96 0.00 2.41 2.28 0.00 3.77 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 83 K 8.17 4.20 0.00 1.57 1.35 0.00 1.33 0.00 0.00 1.45 0.00 0.00 2.52 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.36 7.81 84 Q 8.00 4.17 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.96 0.00 0.00 0.00 0.00 0.00 2.41 2.32 0.00 85 V 7.69 3.62 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 1.08 0.00 0.00 0.99 0.00 0.00 86 I 7.72 3.83 1.92 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 1.57 0.70 1.08 0.00 0.00 87 V 7.45 3.55 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 1.01 0.00 0.00 0.96 0.00 0.00 88 D 8.13 4.56 0.00 2.90 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 89 A 7.77 4.07 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 90 A 8.59 3.95 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 91 K 8.61 3.90 0.00 1.85 1.87 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.53 7.81 92 S 7.92 4.22 0.00 3.97 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 93 L 7.69 4.19 0.00 1.95 1.64 0.88 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 94 I 7.85 3.69 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 1.69 0.71 0.91 0.00 0.00 95 T 7.82 3.93 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 1.33 0.00 0.00 96 H 7.76 4.34 0.00 3.24 3.51 0.00 6.00 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 L 8.41 4.11 0.00 1.87 1.68 0.91 0.87 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 98 E 8.03 3.94 0.00 2.03 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 2.34 2.38 0.00 99 E 7.68 3.90 0.00 2.20 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 0.00 2.32 2.51 0.00 100 I 8.21 3.91 1.89 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 1.65 1.26 0.87 0.00 0.00 101 K 7.96 3.90 0.00 1.83 1.99 0.00 1.69 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.53 1.50 7.81 102 V 8.15 3.77 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 1.00 0.00 0.00 0.99 0.00 0.00 103 N 7.68 4.37 0.00 2.78 2.93 0.00 0.00 6.73 8.01 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 0.00 104 F 8.73 4.12 0.00 3.27 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 0.00 105 M 7.83 4.28 0.00 2.00 2.15 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.84 0.00 106 R 7.53 4.31 0.00 2.01 2.13 0.00 3.27 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 107 E 8.54 4.23 0.00 2.03 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 2.22 2.28 0.00 108 W 8.25 3.90 0.00 3.25 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 0.00 109 E 8.46 4.10 0.00 2.14 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 0.00 2.77 2.58 0.00 110 L 7.31 4.06 0.00 1.92 1.84 0.91 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 111 K 7.74 4.40 0.00 1.54 1.64 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.50 7.81 112 M 7.24 4.03 0.00 1.88 2.02 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 1.91 1.57 0.00 113 I 7.58 3.95 1.84 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 1.45 1.06 0.89 0.00 0.00 114 S 7.93 3.93 0.00 3.93 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 0.00 115 V 6.89 3.95 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 0.74 0.00 0.00 0.83 0.00 0.00 116 E 8.02 3.92 0.00 2.12 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 2.20 2.26 0.00 117 G 7.90 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 0.00 0.00 0.00 0.00 118 V 7.99 4.41 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 0.80 0.00 0.00 0.93 0.00 0.00 119 E 8.69 4.50 0.00 1.92 1.82 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 2.11 2.19 0.00