NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4828 8.3049 120.3308 55.4911 33.2114 174.3619 2 M 4.4999 8.5833 123.5599 52.8823 34.5076 170.1699 3 V 4.3527 8.3149 122.1605 60.8406 34.1950 174.1532 4 W 4.6747 8.9553 135.0000 57.4948 31.1567 175.3230 5 T 4.1752 8.2523 124.1246 61.4129 66.9898 172.7034 6 P 4.4685 0.0000 0.0000 63.6171 32.1628 175.8755 7 V 3.9730 7.5125 120.1970 62.8947 32.4310 175.5864 8 N 4.2542 8.5186 125.5217 55.0470 35.8956 173.8303 9 N 4.7707 7.5012 108.5687 52.8835 40.3104 174.2177 10 K 4.0497 8.2818 115.7970 56.3986 32.7108 176.4970 11 M 4.8051 7.8487 120.4979 53.7718 35.5289 175.1730 12 F 4.8474 8.1188 116.8803 57.1405 40.9918 176.2749 13 E 3.5818 8.2630 121.2659 56.7176 27.6536 174.5736 14 T 3.7955 8.3777 119.9606 66.7856 68.8353 174.1286 15 F 4.5506 9.0235 124.4634 57.4158 36.7387 176.6772 16 S 4.3619 8.1642 115.0312 60.9453 62.8475 174.7000 17 Y 4.2907 8.3243 116.7163 58.2373 38.0466 174.9934 18 L 4.6619 7.6979 120.4760 52.1782 43.5939 174.4923 19 P 4.4450 0.0000 0.0000 61.8741 31.7740 175.0095 20 P 4.3188 0.0000 0.0000 62.8083 31.7765 176.4493 21 L 4.0369 8.3129 122.6271 54.6156 42.2175 177.9514 22 T 4.2256 8.1996 114.0612 61.1302 71.0759 175.2663 23 D 4.3435 8.5493 120.9160 57.6260 40.8079 178.7593 24 E 3.9239 8.1168 119.1888 59.3411 29.7863 178.7763 25 Q 3.9098 7.9812 118.1300 58.8789 28.7512 178.6799 26 I 3.7287 8.0358 120.8669 64.4348 37.1436 178.2977 27 A 4.0564 8.2679 121.4094 55.2015 18.1599 179.5585 28 A 3.9727 8.1553 119.2513 55.3300 18.4218 179.9176 29 Q 4.1127 8.0178 116.5025 59.1807 28.8228 179.1224 30 V 3.7734 8.0800 119.3656 66.0731 31.5468 177.7283 31 D 4.4128 8.4479 118.8608 57.5224 40.5547 178.1600 32 Y 4.1592 8.0915 119.9219 60.7440 38.8990 177.9222 33 I 3.7895 7.9881 120.7001 64.6737 37.3066 178.4797 34 V 3.5231 7.9097 118.3712 66.0546 31.1752 177.9199 35 A 3.9363 8.1207 119.5481 54.6013 18.2601 178.3704 36 N 4.1004 7.1290 112.1591 52.3070 38.7162 175.9916 37 G 3.7655 7.2842 108.3858 45.7794 0.0000 173.9415 38 W 4.9159 7.3284 118.5029 56.1219 30.5945 176.1289 39 I 4.3582 8.9218 123.1582 59.6463 37.8460 174.1013 40 P 4.8720 0.0000 0.0000 62.8897 32.7401 175.1516 41 C 4.9831 8.9613 121.8907 58.3161 35.5998 172.4523 42 L 5.3743 8.7377 123.7239 53.2813 44.4666 175.2036 43 E 5.6276 9.1516 120.7931 55.0777 34.4390 174.3781 44 F 5.5917 9.1834 116.3001 56.0969 42.0852 172.8627 45 A 4.2944 8.2526 118.7635 51.0138 22.0890 177.6850 46 E 3.8044 8.7989 120.5007 59.0249 29.8352 177.3577 47 H 5.1415 7.6305 112.5878 53.8059 32.4199 172.9536 48 S 4.6015 8.4487 115.4752 56.6663 63.7399 172.9021 49 N 5.0815 8.5067 125.3628 50.3563 41.1842 174.0331 50 P 4.1049 0.0000 0.0000 65.9268 31.2635 177.5535 51 E 3.7121 7.9626 116.7579 58.0314 29.6010 176.3822 52 E 4.3780 7.7427 118.7889 54.8432 29.3211 176.2888 53 F 4.0146 8.8493 123.3141 60.3155 39.2373 175.6781 54 Y 4.7368 7.8494 116.5011 56.6642 39.0133 175.0518 55 W 5.0398 8.6000 123.3971 55.3473 32.5041 174.9539 56 T 4.2301 8.1235 117.3052 62.9595 69.1736 174.6855 57 M 4.5433 8.5522 126.5288 55.2968 33.2168 175.2502 58 W 4.8407 9.5395 135.0000 56.3440 31.3382 176.9630 59 K 3.5184 8.6498 129.1037 57.4696 30.5296 178.5626 60 L 4.9393 8.3618 124.2770 52.7024 45.3227 173.9953 61 P 4.3471 0.0000 0.0000 63.3620 32.2512 177.5633 62 M 4.3298 8.6467 123.3311 53.7830 30.4622 175.9245 63 F 4.5232 7.4283 118.3757 58.8360 40.0411 176.6727 64 G 3.9736 9.1216 112.3975 45.6650 0.0000 172.9943 65 C 4.3010 8.0451 121.0200 59.5266 31.6555 173.1659 66 R 4.5224 8.6654 124.9455 55.6601 30.8400 174.9132 67 D 4.8064 7.8204 118.8103 51.3302 42.1925 174.3248 68 P 4.3361 0.0000 0.0000 66.4031 30.9444 178.1440 69 M 4.0678 8.2484 118.1117 58.0972 31.8514 178.3702 70 Q 3.9675 8.1237 119.3869 59.1406 29.2462 178.5983 71 V 3.5983 7.7548 118.6345 66.1650 31.8107 177.8043 72 L 4.0558 8.1340 118.7332 57.9322 41.3218 179.8200 73 R 3.9895 8.3219 118.2117 59.2544 29.9768 178.9576 74 E 4.1175 8.3061 118.4530 59.1200 29.3884 179.2673 75 I 3.5112 7.7646 120.0744 64.3435 37.2117 178.4438 76 V 3.4683 7.6077 118.3389 65.9732 31.3567 177.8420 77 A 3.9393 8.1913 120.7294 55.2160 18.2675 179.1563 78 C 2.0000 7.7243 117.6272 62.0821 31.3423 176.0078 79 T 3.7617 7.6324 111.2932 64.3104 68.0090 176.4887 80 K 3.7954 7.7335 121.8191 59.3704 32.3430 178.4839 81 A 3.9844 7.5798 119.7426 53.4440 19.6697 177.5990 82 F 4.6641 7.7238 115.9036 55.0908 39.1834 173.7284 83 P 4.6423 0.0000 0.0000 63.8322 31.9548 177.7533 84 D 4.6261 7.9757 116.7724 53.9946 41.6258 175.8071 85 A 4.5684 7.3454 121.3234 50.7564 20.5913 177.0821 86 Y 4.2136 8.5029 118.1721 58.0740 39.2620 175.5095 87 V 5.2843 9.0402 123.4349 61.1488 35.2601 174.2874 88 R 5.0656 9.5119 123.6349 54.3200 33.1942 173.6954 89 L 4.8394 8.0941 123.2166 53.8219 43.8814 175.6794 90 V 4.8202 8.6767 118.3173 59.5336 36.5028 174.1485 91 A 4.8593 8.1107 121.5658 50.4506 22.8567 175.1896 92 F 5.2676 8.9532 119.4148 55.7179 42.7263 174.1413 93 D 5.3879 8.8759 122.6171 52.6928 42.3691 176.6515 94 N 4.7112 9.1577 123.2259 54.4769 38.3680 176.5142 95 Q 4.1427 8.6952 118.7664 59.0569 28.8931 177.4617 96 K 4.0911 8.3077 113.5727 56.4840 33.0287 176.5636 97 Q 3.3475 8.0368 118.1088 55.9177 27.0000 172.5302 98 V 4.4754 7.7432 117.5812 60.1334 35.0022 173.9942 99 Q 4.4878 8.6586 122.8973 56.3735 29.4124 175.4245 100 I 4.2838 8.2461 124.4573 61.1151 40.1683 174.5440 101 M 4.7016 6.8675 117.4835 54.2970 34.5610 173.8088 102 G 4.8177 8.3124 105.5682 47.0723 0.0000 172.3912 103 F 5.0455 7.1394 116.6094 55.3907 41.1474 173.1284 104 L 4.7726 8.8679 120.4722 55.3096 41.7725 177.3960 105 V 4.5416 9.0728 115.1762 61.3554 33.5564 175.5024 106 Q 4.6141 7.7979 120.8285 54.9073 32.3326 173.0369 107 R 4.5180 8.1614 122.9419 53.1180 34.3959 173.6682 108 P 4.2619 0.0000 0.0000 62.7114 31.8806 178.1340 109 K 4.1838 8.4220 121.0168 59.2397 32.3032 178.4965 110 T 3.9980 7.7665 106.7861 62.7303 69.1455 174.3698 111 A 4.2512 7.4620 126.0091 52.2969 18.6254 177.3435 112 R 4.3918 8.5276 119.4440 55.8893 30.2127 175.6365 113 D 4.7728 8.2151 116.3724 53.7611 39.9647 175.3133 114 F 5.4523 7.3067 113.0459 54.1909 41.0749 173.8325 115 Q 4.5652 8.4543 120.1412 53.0659 30.8770 174.2407 116 P 4.4467 0.0000 0.0000 62.5930 31.9757 176.8807 117 A 3.9731 8.9204 123.3117 55.6674 18.1666 179.0999 118 N 4.7646 8.1064 109.0259 53.6023 37.7212 175.4172 119 K 4.4582 7.8964 117.3031 56.4826 32.9136 177.3285 120 R 3.6196 7.4912 119.3752 57.6092 30.2158 176.5476 121 S 5.0999 7.5023 110.4760 56.3386 66.1316 174.2544 122 V 3.9978 8.6202 114.7097 61.7230 32.0287 175.6551 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 4.48 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.59 0.00 2 M 8.58 4.50 0.00 2.04 2.06 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.64 0.00 3 V 8.31 4.35 2.12 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 1.10 0.00 0.00 0.97 0.00 0.00 4 W 8.96 4.67 0.00 3.48 3.05 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 0.00 0.00 0.00 0.00 5 T 8.25 4.18 4.10 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 1.11 0.00 0.00 6 P 0.00 4.47 0.00 2.24 2.19 0.00 3.79 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 7 V 7.51 3.97 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 0.77 0.00 0.00 0.91 0.00 0.00 8 N 8.52 4.25 0.00 2.85 2.85 0.00 0.00 6.53 6.92 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 9 N 7.50 4.77 0.00 2.70 2.69 0.00 0.00 7.31 6.68 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 10 K 8.28 4.05 0.00 1.85 1.39 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.61 1.81 7.81 11 M 7.85 4.81 0.00 2.03 1.96 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.58 0.00 12 F 8.12 4.85 0.00 3.04 3.05 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 0.00 0.00 0.00 0.00 13 E 8.26 3.58 0.00 2.14 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 2.24 2.17 0.00 14 T 8.38 3.80 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 0.21 0.00 0.00 15 F 9.02 4.55 0.00 3.27 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 16 S 8.16 4.36 0.00 4.09 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 0.00 17 Y 8.32 4.29 0.00 3.02 3.19 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 18 L 7.70 4.66 0.00 1.84 1.61 0.86 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.45 0.00 2.03 2.00 0.00 3.70 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 20 P 0.00 4.32 0.00 2.05 2.01 0.00 3.70 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 2.07 2.16 0.00 21 L 8.31 4.04 0.00 1.62 1.51 0.54 0.52 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 22 T 8.20 4.23 4.22 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 1.18 0.00 0.00 23 D 8.55 4.34 0.00 2.71 2.77 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 24 E 8.12 3.92 0.00 2.02 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 2.36 2.39 0.00 25 Q 7.98 3.91 0.00 2.29 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 26 I 8.04 3.73 2.06 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 1.65 0.72 1.10 0.00 0.00 27 A 8.27 4.06 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 28 A 8.16 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 29 Q 8.02 4.11 0.00 2.55 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.75 0.00 0.00 0.00 0.00 0.00 2.37 1.88 0.00 30 V 8.08 3.77 2.32 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 1.10 0.00 0.00 1.13 0.00 0.00 31 D 8.45 4.41 0.00 2.99 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 32 Y 8.09 4.16 0.00 3.08 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 33 I 7.99 3.79 2.15 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.18 1.05 0.00 0.00 34 V 7.91 3.52 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 1.02 0.00 0.00 1.01 0.00 0.00 35 A 8.12 3.94 1.25 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 36 N 7.13 4.10 0.00 1.44 1.42 0.00 0.00 7.05 8.97 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 37 G 7.28 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 0.00 0.00 0.00 38 W 7.33 4.92 0.00 3.33 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 39 I 8.92 4.36 2.11 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.92 0.77 0.00 0.00 40 P 0.00 4.87 0.00 2.08 1.98 0.00 3.77 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.12 0.00 41 C 8.96 4.98 0.00 3.01 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 42 L 8.74 5.37 0.00 1.88 1.63 0.90 0.85 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 43 E 9.15 5.63 0.00 2.11 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 2.38 2.34 0.00 44 F 9.18 5.59 0.00 3.06 3.06 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 0.00 0.00 0.00 45 A 8.25 4.29 -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 46 E 8.80 3.80 0.00 1.78 1.57 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 2.27 2.31 0.00 47 H 7.63 5.14 0.00 3.06 3.19 0.00 5.83 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 S 8.45 4.60 0.00 3.14 3.13 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 49 N 8.51 5.08 0.00 2.76 2.83 0.00 0.00 6.80 8.03 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 50 P 0.00 4.10 0.00 2.06 2.10 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 1.93 1.94 0.00 51 E 7.96 3.71 0.00 1.90 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 2.28 2.32 0.00 52 E 7.74 4.38 0.00 2.15 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 2.34 2.47 0.00 53 F 8.85 4.01 0.00 2.64 2.56 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 0.00 54 Y 7.85 4.74 0.00 3.10 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 55 W 8.60 5.04 0.00 3.12 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 56 T 8.12 4.23 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 0.96 0.00 0.00 57 M 8.55 4.54 0.00 2.09 2.04 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.77 0.00 58 W 9.54 4.84 0.00 3.71 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 59 K 8.65 3.52 0.00 1.71 0.74 0.00 1.72 0.00 0.00 1.54 0.00 0.00 2.68 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.82 0.21 7.81 60 L 8.36 4.94 0.00 1.61 1.59 1.01 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 61 P 0.00 4.35 0.00 0.66 1.86 0.00 3.66 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.18 0.00 62 M 8.65 4.33 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.55 0.00 63 F 7.43 4.52 0.00 3.10 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 64 G 9.12 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 65 C 8.05 4.30 0.00 3.03 3.03 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 66 R 8.67 4.52 0.00 1.81 1.87 0.00 3.20 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.73 0.00 67 D 7.82 4.81 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 68 P 0.00 4.34 0.00 2.33 2.34 0.00 3.77 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.09 0.00 69 M 8.25 4.07 0.00 2.11 2.29 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.71 0.00 70 Q 8.12 3.97 0.00 2.24 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 71 V 7.75 3.60 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 1.05 0.00 0.00 0.97 0.00 0.00 72 L 8.13 4.06 0.00 1.89 1.72 0.95 0.84 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 73 R 8.32 3.99 0.00 2.10 2.01 0.00 3.15 0.00 0.00 3.19 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.85 0.00 74 E 8.31 4.12 0.00 2.25 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 2.60 2.66 0.00 75 I 7.76 3.51 2.04 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 1.36 0.71 0.87 0.00 0.00 76 V 7.61 3.47 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 0.98 0.00 0.00 0.97 0.00 0.00 77 A 8.19 3.94 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 78 C 7.72 2.00 0.00 1.23 2.25 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 79 T 7.63 3.76 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 1.14 0.00 0.00 80 K 7.73 3.80 0.00 1.80 1.94 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.38 1.39 7.81 81 A 7.58 3.98 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 82 F 7.72 4.66 0.00 2.80 2.79 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 83 P 0.00 4.64 0.00 2.12 2.10 0.00 3.26 0.00 0.00 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.86 0.00 84 D 7.98 4.63 0.00 2.67 2.68 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 0.00 85 A 7.35 4.57 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 86 Y 8.50 4.21 0.00 2.46 2.68 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 0.00 87 V 9.04 5.28 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 1.03 0.00 0.00 0.95 0.00 0.00 88 R 9.51 5.07 0.00 1.88 2.06 0.00 2.40 0.00 0.00 2.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.46 0.00 89 L 8.09 4.84 0.00 1.54 0.75 0.85 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 90 V 8.68 4.82 1.63 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 0.46 0.00 0.00 0.46 0.00 0.00 91 A 8.11 4.86 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 92 F 8.95 5.27 0.00 3.00 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 93 D 8.88 5.39 0.00 2.37 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 94 N 9.16 4.71 0.00 2.94 3.06 0.00 0.00 6.33 7.39 0.00 0.00 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 8.70 4.14 0.00 2.30 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.94 0.00 0.00 0.00 0.00 0.00 2.47 2.53 0.00 96 K 8.31 4.09 0.00 1.76 1.85 0.00 1.92 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.44 7.81 97 Q 8.04 3.35 0.00 2.10 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.72 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 98 V 7.74 4.48 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 0.51 0.00 0.00 0.92 0.00 0.00 99 Q 8.66 4.49 0.00 2.24 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.88 0.00 0.00 0.00 0.00 0.00 2.24 2.05 0.00 100 I 8.25 4.28 1.26 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.19 0.56 -0.49 0.00 0.00 101 M 6.87 4.70 0.00 2.12 2.28 0.00 0.00 0.00 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.62 0.00 102 G 8.31 4.82 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 0.00 0.00 0.00 103 F 7.14 5.05 0.00 3.23 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 0.00 104 L 8.87 4.77 0.00 1.68 1.74 1.28 0.66 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 0.00 105 V 9.07 4.54 2.12 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 0.72 0.00 0.00 0.94 0.00 0.00 106 Q 7.80 4.61 0.00 2.04 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.76 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 107 R 8.16 4.52 0.00 1.46 1.32 0.00 2.62 0.00 0.00 2.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.36 0.00 108 P 0.00 4.26 0.00 2.01 1.88 0.00 2.60 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.69 0.00 109 K 8.42 4.18 0.00 1.72 1.85 0.00 1.75 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.33 7.81 110 T 7.77 4.00 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 1.20 0.00 0.00 111 A 7.46 4.25 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 0.00 112 R 8.53 4.39 0.00 1.76 1.85 0.00 3.36 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.47 0.00 113 D 8.22 4.77 0.00 2.99 3.03 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 0.00 114 F 7.31 5.45 0.00 3.33 3.36 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 0.00 115 Q 8.45 4.57 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 7.02 0.00 0.00 0.00 0.00 0.00 2.36 2.21 0.00 116 P 0.00 4.45 0.00 2.21 2.20 0.00 3.63 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.93 0.00 117 A 8.92 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 0.00 118 N 8.11 4.76 0.00 2.84 2.95 0.00 0.00 5.85 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 0.00 119 K 7.90 4.46 0.00 1.81 1.74 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.32 1.46 7.81 120 R 7.49 3.62 0.00 1.58 0.66 0.00 3.06 0.00 0.00 3.17 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.53 0.00 121 S 7.50 5.10 0.00 4.01 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 0.00 122 V 8.62 4.00 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 0.98 0.00 0.00