NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8773 8.3549 109.7364 44.7538 0.0000 174.5356 2 S 4.1434 7.5560 123.1651 56.1254 65.2148 172.2567 3 S 4.4480 8.7503 122.8251 57.4135 64.3831 174.2045 4 G 3.9148 8.4518 114.7385 44.9977 0.0000 172.7095 5 S 4.5871 8.0941 117.6196 58.3862 66.7789 174.5627 6 S 4.7029 8.3370 116.3766 56.6089 67.0539 175.8996 7 G 3.7882 7.6928 109.4442 46.1544 0.0000 171.4125 8 Q 4.5376 7.9640 121.2264 53.6752 31.3623 175.0314 9 A 4.1632 8.1560 121.6637 51.8117 19.0892 177.5325 10 A 4.2271 8.1789 123.0406 51.0171 19.2527 175.9645 11 P 4.8379 0.0000 0.0000 61.9735 32.5732 175.7056 12 S 4.4244 8.6464 116.4530 58.2840 63.7449 172.5445 13 Q 4.5677 8.2958 122.5736 53.7216 30.4673 175.3655 14 V 3.6837 8.5706 126.8010 63.7890 31.8806 176.2640 15 V 4.4551 8.5057 118.4585 60.7812 32.7246 175.0279 16 V 4.4743 7.6767 120.8115 61.2225 33.8569 174.3485 17 I 5.2953 8.3511 127.7052 59.9774 41.2273 174.8790 18 R 4.7303 9.3968 124.2732 54.5095 34.9559 173.8016 19 Q 4.6827 8.5640 123.0750 55.3827 29.4230 175.2592 20 E 4.1114 8.9130 126.5303 58.8024 30.3193 177.6341 21 R 4.2203 7.5843 118.2925 55.1796 33.3704 174.0134 22 A 4.6246 8.5842 127.6320 50.4918 18.6138 176.6633 23 G 3.9546 8.8986 112.4587 45.1846 0.0000 173.4110 24 Q 4.0767 8.7319 119.4267 58.6628 29.2948 177.3576 25 T 4.5635 7.9172 105.3600 60.8879 70.8612 173.1411 26 S 5.1443 7.8003 116.8471 56.5099 66.4651 173.1277 27 V 4.7563 8.5542 121.0076 61.3286 34.9372 174.2364 28 S 5.1591 8.5059 120.9763 56.8055 65.0210 172.6405 29 L 5.0037 8.6517 122.2277 53.2775 46.8041 175.9586 30 L 4.3526 8.8764 122.8507 54.2156 44.8940 174.1790 31 W 5.7865 8.0343 123.2066 53.6783 31.5932 173.9720 32 Q 4.6610 8.5554 117.5230 53.8744 30.9280 175.2439 33 E 4.3184 8.6257 119.0819 55.4244 30.1155 175.4702 34 P 4.4701 0.0000 0.0000 62.7855 31.8680 176.0485 35 E 3.7819 8.3650 121.7938 59.2107 29.8547 177.7369 36 Q 4.5307 7.7656 124.6891 53.2717 29.8329 174.6402 37 P 4.1639 0.0000 0.0000 63.6620 31.9202 176.5815 38 N 3.8693 8.7892 114.4594 53.4291 35.9422 173.1249 39 G 3.7019 7.6508 104.5329 44.4451 0.0000 172.5253 40 I 4.2306 7.9979 121.5554 59.9193 38.3156 175.2145 41 I 4.1047 8.1347 126.4702 60.0977 37.8856 175.7312 42 L 4.1098 8.1071 125.5162 56.7878 42.0714 176.9356 43 E 4.9109 7.4344 113.5626 55.8512 32.6503 173.1397 44 Y 4.5950 9.3582 119.4598 56.8751 40.1399 174.1602 45 E 5.1051 9.0327 125.5275 54.8533 31.6722 174.4325 46 I 5.1024 8.9277 128.2777 59.6303 40.1383 174.4811 47 K 5.0785 9.2966 128.0953 54.7713 34.1758 174.2351 48 Y 5.4127 8.4734 125.4066 54.1739 40.9286 174.1487 49 Y 5.2413 7.7501 120.0399 54.9581 42.5540 173.5367 50 E 3.6554 9.2916 119.9067 57.1475 30.0700 177.3415 51 K 3.8383 8.5026 127.4629 59.9575 31.7595 177.7342 52 D 4.2889 8.1694 117.2447 56.4132 41.3617 175.8481 53 K 4.2003 7.3116 118.9183 54.6393 31.9327 176.1534 54 E 3.9858 8.4323 126.4498 54.9916 28.7940 175.2124 55 M 4.3574 8.0847 126.2619 54.0826 33.2668 176.5731 56 Q 3.9589 8.9064 123.2765 58.7372 28.9505 177.3867 57 S 4.3976 7.7661 113.9181 56.7777 62.6249 173.1221 58 Y 4.4211 7.9498 123.8863 56.4022 39.4578 174.9171 59 S 4.5883 7.7861 117.9094 57.4715 64.5180 173.5739 60 T 5.2186 8.3546 114.3863 60.0620 71.3882 173.4908 61 L 4.9262 8.9475 124.4969 53.4035 45.4202 175.1844 62 K 5.0464 8.9644 125.6935 55.5662 33.3267 175.9070 63 A 4.8795 9.2203 127.1647 50.4483 21.3778 177.2347 64 V 4.0614 8.8560 115.5026 62.7296 32.3690 175.7162 65 T 4.6051 7.5633 113.2949 59.8215 69.8944 173.8246 66 T 2.6868 7.8960 110.8186 62.1298 69.3344 173.9065 67 R 4.6132 6.9723 120.9993 54.6150 32.8456 174.9088 68 A 4.7665 8.1860 121.5746 51.3881 23.5472 175.5427 69 T 4.7555 8.1830 115.1857 62.0370 72.2637 174.0077 70 V 3.7735 8.7726 128.5865 62.1219 32.3539 175.3486 71 S 4.9150 8.8179 123.6315 57.6293 65.6548 173.8464 72 G 3.9163 8.8797 108.5319 46.3816 0.0000 173.0217 73 L 4.7301 7.2848 117.9544 52.4356 44.6388 175.9619 74 K 4.6725 8.5969 119.1257 54.0960 33.6569 175.3824 75 P 4.6940 0.0000 0.0000 62.5298 32.1089 175.5217 76 G 4.0814 8.0089 104.1594 46.5815 0.0000 174.1467 77 T 4.4669 7.6936 114.2423 61.2528 72.3624 174.8028 78 R 4.3455 8.3680 125.5821 56.6755 31.6777 175.3074 79 Y 4.7685 9.1781 119.5313 56.2631 42.6601 174.6303 80 V 4.7149 7.7626 124.3675 61.0856 32.2388 174.9340 81 F 5.4957 8.3680 126.8003 56.4924 41.4060 175.8053 82 Q 4.5530 8.4696 120.3419 55.3665 32.4172 173.4543 83 V 4.5722 8.7163 125.8357 61.6857 33.2661 175.0228 84 R 4.9073 8.7042 122.4001 54.5978 33.3289 173.4171 85 A 4.4436 8.4157 121.9654 50.4597 21.2928 175.8026 86 R 4.6580 7.9107 121.0460 54.5274 33.2750 174.7946 87 T 4.7003 8.1335 115.2891 59.3661 71.8656 174.5627 88 S 3.9410 9.0000 118.5621 61.7713 62.4807 175.3420 89 A 4.2384 8.0859 121.2968 54.4866 18.9400 176.8286 90 G 3.8590 7.6849 108.1482 45.3711 0.0000 172.3689 91 C 4.6578 8.5139 121.2079 58.2453 32.4232 174.1067 92 G 4.0117 7.8249 108.5284 44.9554 0.0000 173.0925 93 R 4.4522 8.2398 118.8984 55.3621 31.5891 176.3585 94 F 4.7049 8.4765 118.9710 56.4473 40.2970 176.3073 95 S 4.6327 8.3578 117.1157 57.6535 63.7131 173.7706 96 Q 4.2121 8.6035 118.1564 55.7693 29.3053 176.8580 97 A 4.0289 8.5997 123.5428 52.7939 18.8106 176.3440 98 M 4.3711 8.5762 122.6152 55.5807 33.9034 174.6618 99 E 4.9539 8.7933 125.6527 54.8216 31.5550 175.5797 100 V 4.5959 8.5793 123.5156 61.1594 35.5820 173.2157 101 E 5.1143 8.8112 127.9762 54.4295 31.6297 175.6298 102 T 4.3256 8.7562 117.2358 60.9624 70.9222 174.0550 103 G 3.7955 8.4189 109.9557 45.8615 0.0000 173.8014 104 K 4.4946 8.7937 125.2083 55.9009 32.8802 176.5908 105 P 4.0795 0.0000 0.0000 65.7710 31.8484 178.0600 106 S 4.1652 7.8177 113.2218 60.7981 62.9757 173.9740 107 G 3.9604 6.9362 106.1713 44.2002 0.0000 170.3282 108 P 4.5402 0.0000 0.0000 62.1848 32.3835 176.4938 109 S 4.1942 8.7051 112.5865 60.8363 62.4052 173.9510 110 S 4.8556 7.4070 112.3815 56.6865 65.3012 174.0078 111 G 3.7469 8.2921 109.1618 46.5234 0.0000 173.4278 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 G 8.35 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 0.00 0.00 0.00 2 S 7.56 4.14 0.00 3.89 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 S 8.75 4.45 0.00 3.85 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 4 G 8.45 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 5 S 8.09 4.59 0.00 3.81 3.73 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.34 4.70 0.00 3.80 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 7 G 7.69 3.79 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 8 Q 7.96 4.54 0.00 2.02 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.97 0.00 0.00 0.00 0.00 0.00 2.26 2.26 0.00 9 A 8.16 4.16 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 10 A 8.18 4.23 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 11 P 0.00 4.84 0.00 2.05 2.21 0.00 3.33 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.73 0.00 12 S 8.65 4.42 0.00 4.18 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 13 Q 8.30 4.57 0.00 2.06 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.69 0.00 0.00 0.00 0.00 0.00 2.24 2.42 0.00 14 V 8.57 3.68 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 1.11 0.00 0.00 15 V 8.51 4.46 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 0.95 0.00 0.00 0.96 0.00 0.00 16 V 7.68 4.47 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 1.05 0.00 0.00 0.97 0.00 0.00 17 I 8.35 5.30 1.93 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 0.98 0.00 0.00 18 R 9.40 4.73 0.00 1.64 1.74 0.00 3.09 0.00 0.00 3.08 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.57 0.00 19 Q 8.56 4.68 0.00 2.02 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 7.07 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 20 E 8.91 4.11 0.00 1.93 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 2.22 2.19 0.00 21 R 7.58 4.22 0.00 1.78 1.76 0.00 3.08 0.00 0.00 3.32 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 22 A 8.58 4.62 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 23 G 8.90 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 0.00 0.00 0.00 24 Q 8.73 4.08 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.65 0.00 0.00 0.00 0.00 0.00 2.54 2.43 0.00 25 T 7.92 4.56 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 1.27 0.00 0.00 26 S 7.80 5.14 0.00 3.81 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 27 V 8.55 4.76 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 0.63 0.00 0.00 1.02 0.00 0.00 28 S 8.51 5.16 0.00 3.84 3.83 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 0.00 0.00 0.00 29 L 8.65 5.00 0.00 1.80 1.66 0.81 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 30 L 8.88 4.35 0.00 1.64 1.52 0.73 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 31 W 8.03 5.79 0.00 3.27 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 32 Q 8.56 4.66 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 7.07 0.00 0.00 0.00 0.00 0.00 2.26 2.49 0.00 33 E 8.63 4.32 0.00 2.03 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 2.46 2.37 0.00 34 P 0.00 4.47 0.00 2.25 2.18 0.00 4.04 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 35 E 8.36 3.78 0.00 2.01 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 2.35 2.42 0.00 36 Q 7.77 4.53 0.00 2.04 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 6.92 0.00 0.00 0.00 0.00 0.00 2.34 2.25 0.00 37 P 0.00 4.16 0.00 2.42 2.35 0.00 3.87 0.00 0.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.02 0.00 38 N 8.79 3.87 0.00 2.88 3.00 0.00 0.00 7.06 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 39 G 7.65 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 40 I 8.00 4.23 1.86 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 1.42 0.51 0.91 0.00 0.00 41 I 8.13 4.10 1.79 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 1.24 0.45 0.42 0.00 0.00 42 L 8.11 4.11 0.00 1.64 1.71 0.92 0.84 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 43 E 7.43 4.91 0.00 2.24 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 2.22 2.27 0.00 44 Y 9.36 4.60 0.00 3.22 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 45 E 9.03 5.11 0.00 2.12 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 2.39 2.48 0.00 46 I 8.93 5.10 2.07 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.13 1.20 0.00 0.00 47 K 9.30 5.08 0.00 1.35 1.02 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.94 0.00 0.00 2.49 0.00 0.00 0.00 0.00 1.12 1.23 7.81 48 Y 8.47 5.41 0.00 2.49 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 49 Y 7.75 5.24 0.00 3.01 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 50 E 9.29 3.66 0.00 2.15 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 2.13 2.28 0.00 51 K 8.50 3.84 0.00 1.58 1.77 0.00 1.71 0.00 0.00 1.58 0.00 0.00 3.11 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.43 7.81 52 D 8.17 4.29 0.00 2.61 2.62 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 0.00 0.00 0.00 0.00 53 K 7.31 4.20 0.00 1.87 1.74 0.00 1.74 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.35 1.58 7.81 54 E 8.43 3.99 0.00 1.79 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 1.79 1.73 0.00 55 M 8.08 4.36 0.00 2.03 1.97 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.55 0.00 56 Q 8.91 3.96 0.00 2.01 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.01 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 57 S 7.77 4.40 0.00 3.85 3.84 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 58 Y 7.95 4.42 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 59 S 7.79 4.59 0.00 2.72 3.49 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 60 T 8.35 5.22 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 1.51 0.00 0.00 61 L 8.95 4.93 0.00 2.13 1.73 1.04 0.85 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 62 K 8.96 5.05 0.00 1.74 1.81 0.00 1.89 0.00 0.00 1.79 0.00 0.00 2.99 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.46 1.74 7.81 63 A 9.22 4.88 1.65 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 64 V 8.86 4.06 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 0.86 0.00 0.00 0.98 0.00 0.00 65 T 7.56 4.61 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 1.25 0.00 0.00 66 T 7.90 2.69 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 67 R 6.97 4.61 0.00 1.48 1.68 0.00 3.02 0.00 0.00 3.09 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.22 0.00 68 A 8.19 4.77 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 T 8.18 4.76 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 1.19 0.00 0.00 70 V 8.77 3.77 1.86 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 -0.65 0.00 0.00 0.80 0.00 0.00 71 S 8.82 4.92 0.00 3.83 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 72 G 8.88 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 73 L 7.28 4.73 0.00 1.56 1.11 0.64 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 74 K 8.60 4.67 0.00 1.92 1.80 0.00 1.79 0.00 0.00 1.87 0.00 0.00 3.08 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.46 7.81 75 P 0.00 4.69 0.00 2.21 2.27 0.00 3.58 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.95 0.00 76 G 8.01 4.08 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 0.00 77 T 7.69 4.47 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 0.75 0.00 0.00 78 R 8.37 4.35 0.00 1.66 1.75 0.00 3.04 0.00 0.00 3.32 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.64 0.00 79 Y 9.18 4.77 0.00 2.56 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 0.00 0.00 0.00 80 V 7.76 4.71 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.72 0.00 0.00 81 F 8.37 5.50 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 82 Q 8.47 4.55 0.00 1.62 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.97 0.00 0.00 0.00 0.00 0.00 2.33 2.22 0.00 83 V 8.72 4.57 1.59 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 -0.65 0.00 0.00 0.50 0.00 0.00 84 R 8.70 4.91 0.00 1.56 1.42 0.00 2.21 0.00 0.00 2.25 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.30 0.00 85 A 8.42 4.44 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 86 R 7.91 4.66 0.00 1.84 1.77 0.00 3.00 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.46 0.00 87 T 8.13 4.70 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 1.14 0.00 0.00 88 S 9.00 3.94 0.00 3.83 3.96 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 89 A 8.09 4.24 1.28 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 90 G 7.68 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 C 8.51 4.66 0.00 2.74 2.67 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 92 G 7.82 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 0.00 0.00 0.00 93 R 8.24 4.45 0.00 1.73 2.00 0.00 3.20 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 94 F 8.48 4.70 0.00 2.93 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 95 S 8.36 4.63 0.00 3.93 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 96 Q 8.60 4.21 0.00 1.99 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 7.19 0.00 0.00 0.00 0.00 0.00 2.39 2.40 0.00 97 A 8.60 4.03 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 98 M 8.58 4.37 0.00 2.33 2.01 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 2.62 2.64 0.00 99 E 8.79 4.95 0.00 1.90 1.87 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 2.21 2.28 0.00 100 V 8.58 4.60 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 0.91 0.00 0.00 1.08 0.00 0.00 101 E 8.81 5.11 0.00 2.01 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 2.21 2.27 0.00 102 T 8.76 4.33 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 103 G 8.42 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 0.00 104 K 8.79 4.49 0.00 1.74 1.76 0.00 1.68 0.00 0.00 1.88 0.00 0.00 2.87 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.46 7.81 105 P 0.00 4.08 0.00 2.19 2.20 0.00 3.82 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 2.00 1.97 0.00 106 S 7.82 4.17 0.00 4.00 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 0.00 107 G 6.94 3.96 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 0.00 0.00 0.00 108 P 0.00 4.54 0.00 2.31 2.10 0.00 3.77 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 2.08 1.95 0.00 109 S 8.71 4.19 0.00 3.86 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 0.00 110 S 7.41 4.86 0.00 3.99 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 0.00 111 G 8.29 3.75 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 0.00 0.00 0.00