NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.5309 8.3044 120.2869 55.2982 33.8874 173.9405 3 V 4.2109 8.0756 121.6642 59.9221 33.6939 172.8971 4 W 4.6457 9.1431 135.0000 57.4633 31.6196 174.8858 5 T 4.1707 8.2368 123.9928 61.4504 67.1102 172.5150 6 P 4.5734 0.0000 0.0000 62.9328 32.2411 175.4352 7 V 4.1113 7.4344 119.6170 62.5622 32.9209 175.2234 8 N 4.2049 8.6530 125.0068 54.9368 36.1049 173.6634 9 N 4.8358 7.6249 108.8145 52.9400 40.0748 174.1862 10 K 4.1106 8.3743 116.4079 56.5475 32.7868 176.7033 11 M 4.9623 8.3189 121.1798 53.9890 35.0285 175.4434 12 F 4.6177 8.1608 116.8447 57.1604 41.2197 176.7256 13 E 3.5515 8.4741 121.1516 57.1591 27.5063 175.1844 14 T 3.8886 8.3374 122.2841 66.2584 68.9237 174.4016 15 F 4.4712 8.9723 123.7217 57.7437 36.7481 176.4159 16 S 4.4851 8.2600 114.8582 60.2959 62.9669 174.4729 17 Y 4.3581 8.2773 117.4946 58.2827 38.1762 175.0176 18 L 4.6913 7.6074 120.2775 52.0908 43.7241 174.4456 19 P 4.4390 0.0000 0.0000 61.8307 31.7673 174.9695 20 P 4.2664 0.0000 0.0000 62.9998 31.7366 176.3778 21 L 4.0113 8.3019 122.7571 54.5859 42.2022 177.9134 22 T 4.2118 8.1843 114.0802 61.1276 71.0542 175.1937 23 D 4.3456 8.5705 120.9136 57.6757 40.7647 178.8158 24 E 3.9151 8.0938 119.1505 59.3770 29.6872 178.7898 25 Q 3.9278 7.9528 118.1154 58.7885 28.7118 178.6407 26 I 3.7056 8.0792 121.0038 64.4090 37.1362 178.2776 27 A 4.0320 8.2917 121.4854 55.1646 18.1363 179.5723 28 A 3.9643 8.1073 119.3254 55.3599 18.4272 179.8929 29 Q 4.1005 8.1444 116.6704 59.1573 28.8445 179.1352 30 V 3.7372 8.1933 119.3517 66.2060 31.4901 177.6801 31 D 4.4385 8.4621 118.7841 57.6419 40.5324 178.3049 32 Y 4.1411 8.1301 119.9839 60.6006 38.8216 177.9434 33 I 3.9177 8.0339 120.8268 64.6186 37.4487 178.6090 34 V 3.5474 7.9367 118.6637 65.9533 31.1473 177.8838 35 A 3.9184 7.9682 119.6665 54.5786 18.2735 178.3786 36 N 4.0753 7.1066 111.9820 52.0734 38.7675 175.5586 37 G 3.7398 7.2094 107.9332 46.2338 0.0000 174.1051 38 W 5.0049 7.6197 118.8650 55.9318 30.8852 176.3995 39 I 4.5044 8.8321 123.1376 59.2469 37.9144 173.9921 40 P 4.9346 0.0000 0.0000 63.1718 32.9360 174.8119 41 C 5.0124 8.9453 120.1933 58.5168 35.6215 172.3730 42 L 5.3596 8.7343 123.3357 53.2097 44.4870 175.2318 43 E 5.6662 9.2044 120.9059 54.9848 34.1897 174.5241 44 F 5.6078 9.1418 116.0967 56.0236 42.2204 172.9550 45 A 4.4278 8.2917 119.6859 50.2784 22.5977 176.3476 46 E 4.2754 8.6191 119.2487 55.7751 30.6607 177.7161 47 A 4.2665 8.8285 122.7843 55.8424 18.4119 179.6672 48 D 4.5962 8.1380 113.0118 56.2351 41.0248 177.0806 49 K 4.6397 7.9631 117.2316 55.9888 32.8874 176.7170 50 A 3.9438 7.6625 124.3849 53.6356 18.9999 178.1905 51 Y 4.7376 7.4128 111.3303 55.6555 40.3964 176.0121 52 V 3.9616 8.3242 116.1064 62.3427 32.2035 175.6052 53 S 4.7609 8.9342 116.6364 56.7135 66.3550 173.8499 54 N 5.1495 8.5422 114.5481 52.8801 38.9962 176.3179 55 E 3.9691 8.1934 121.0121 59.6694 29.6409 179.0277 56 S 4.0656 8.8559 115.3996 60.3959 62.8522 175.9385 57 A 2.5800 7.6799 123.4351 53.4201 17.7550 179.0133 58 I 3.5422 6.9690 116.8640 63.7014 38.0257 177.1255 59 R 4.2599 7.5108 116.3801 55.7877 30.5007 176.2200 60 F 5.0750 7.1689 117.9936 55.8357 41.2663 177.3080 61 G 3.9809 8.2100 114.2305 46.0053 0.0000 174.4828 62 S 4.5904 8.4407 112.8106 58.9487 62.1667 174.4926 63 V 4.4483 7.2824 107.2353 61.1603 33.0240 177.7467 64 S 4.4915 8.2375 115.3769 59.8045 63.5461 173.4977 65 C 3.9853 8.1012 118.9789 61.5888 27.9680 173.1906 66 L 3.6217 8.4614 122.9656 55.6172 38.9622 173.1375 67 Y 4.3725 7.7566 119.7184 55.9576 39.9439 174.6015 68 Y 4.8026 7.1590 123.2512 56.2865 42.3551 174.6990 69 D 4.5242 8.8760 123.1469 55.2287 41.8123 177.1064 70 N 4.6003 8.9129 116.5057 54.0897 36.0359 176.0661 71 R 3.9359 7.9706 118.3806 59.3874 30.3355 177.1092 72 Y 4.3778 7.6823 114.5523 57.9484 38.3735 175.2934 73 W 5.0665 8.7124 124.4450 55.5244 32.5854 174.5159 74 T 4.3953 8.1027 116.9839 62.4822 69.7050 174.5354 75 M 4.5277 8.5557 126.3682 55.2845 33.2474 175.1696 76 W 4.7891 9.5481 135.0000 56.2423 31.4368 176.8390 77 K 3.4389 8.5360 128.4632 57.4816 30.7809 178.1577 78 L 4.9209 8.2985 124.1210 52.7112 45.2674 173.9962 79 P 4.3427 0.0000 0.0000 63.5393 32.2713 177.4363 80 M 4.3069 8.5928 123.0635 53.7510 30.4656 175.9180 81 F 4.4768 7.2978 118.2872 58.8880 40.0178 176.6395 82 G 3.9975 9.1341 112.8203 45.5374 0.0000 173.0048 83 C 4.2991 7.9272 120.9358 59.5714 31.7606 173.1483 84 R 4.5303 8.6502 124.0447 55.5402 31.1840 174.5101 85 D 4.8297 7.8011 118.8608 51.4115 42.3589 174.5613 86 P 4.3414 0.0000 0.0000 66.3143 31.0955 178.1765 87 M 4.1088 8.1367 118.1130 58.3117 31.8534 178.6696 88 Q 4.0233 8.0002 118.0259 58.8082 28.8303 179.0423 89 V 3.6018 7.7318 118.7790 66.0753 31.8340 177.8939 90 L 4.0174 8.0483 118.7179 57.9169 41.3727 179.7656 91 R 3.9625 8.2513 118.0776 59.3819 29.9523 179.0140 92 E 4.1035 8.2853 118.2977 59.1735 29.4555 179.2736 93 I 3.5410 7.8805 120.1289 64.4022 37.1124 178.5712 94 V 3.4821 7.6711 118.4307 65.7696 31.3713 177.8319 95 A 3.9152 7.9664 120.5899 55.2749 18.2694 179.1994 96 C 2.0000 7.5641 117.5783 62.0823 30.9441 175.9072 97 T 3.7153 7.4702 111.3426 64.5903 68.0101 176.3492 98 K 3.8911 7.9267 121.6947 59.0210 32.2546 178.4287 99 A 4.0113 7.5663 120.4629 53.3995 19.9201 177.6412 100 F 4.6984 7.6583 115.4504 55.1854 39.0377 174.1293 101 P 4.4467 0.0000 0.0000 64.3449 31.8992 177.8250 102 D 4.5834 8.0646 116.7993 54.0970 41.2166 175.5733 103 A 4.8348 7.4349 121.3685 50.2757 21.3665 176.8915 104 Y 4.1943 8.5163 117.8728 57.9667 39.4665 175.3247 105 V 5.2573 8.8905 122.7214 61.2123 35.3597 174.2526 106 R 4.9871 9.4507 123.7453 54.2586 33.0472 173.8122 107 L 4.7975 8.2138 123.6332 54.0861 43.7296 175.7452 108 V 4.8452 8.6708 118.3059 59.6501 36.5953 174.0746 109 A 4.8467 7.8938 121.7907 50.6747 22.7946 175.3021 110 F 5.2140 9.0792 119.9286 55.7175 42.6102 174.1693 111 D 5.3528 8.8327 122.4692 52.6761 42.4954 176.5696 112 N 4.7467 9.1938 123.0102 54.2431 38.3566 176.2594 113 Q 4.2259 8.7107 118.7657 58.8100 29.1298 177.6455 114 K 4.0104 8.2941 114.9639 57.2492 32.8836 176.6523 115 Q 3.4546 8.0661 118.2806 55.9581 26.9641 172.4833 116 V 4.5184 7.7539 117.3069 60.0146 35.0322 174.1849 117 Q 4.2565 8.7099 123.0064 56.4705 29.2735 175.5492 118 I 4.2413 8.0160 124.7005 61.0164 39.5020 174.4837 119 M 4.5659 6.6809 117.1740 54.7828 34.2686 173.7560 120 G 4.6302 8.2860 105.7447 47.1188 0.0000 172.3603 121 F 5.0602 7.0838 116.3308 55.2476 41.2394 172.8297 122 L 4.4937 8.7797 122.6274 55.4959 42.0627 176.7688 123 V 4.5443 8.9997 117.9530 61.4595 34.1325 175.6706 124 Q 4.6119 7.8109 121.2626 54.5438 32.3376 173.1732 125 R 4.2806 8.1074 121.6885 53.1143 32.6473 173.8079 126 P 4.2169 0.0000 0.0000 62.3231 31.9748 177.9487 127 K 4.0063 8.5436 121.2833 59.6735 32.0914 178.3561 128 T 4.0985 7.8010 106.4526 62.5652 69.2993 174.7117 129 A 4.2620 7.6983 126.6529 52.9249 18.6849 177.3329 130 R 4.6436 8.8217 120.0275 55.9020 31.6801 175.4002 131 D 4.9686 8.4838 116.8406 52.7557 39.7129 175.4543 132 F 5.4025 7.6340 112.1789 54.6485 41.1190 173.4623 133 Q 4.4265 8.3288 119.7075 52.9551 31.5082 174.2055 134 P 4.4771 0.0000 0.0000 62.3185 32.3437 176.9485 135 A 3.9614 8.8905 122.9299 55.6615 18.1232 179.3330 136 N 4.6415 8.1084 109.1747 54.0215 37.6203 175.4276 137 K 4.4320 7.8495 117.6841 56.3090 33.1676 177.3476 138 R 3.5393 7.6692 120.7494 57.8468 30.1090 176.6830 139 S 5.0731 7.4416 110.0396 56.3415 66.1057 174.2242 140 V 3.9929 8.5205 114.5598 61.7566 32.2171 175.6256 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 8.30 4.53 0.00 1.99 2.16 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.58 0.00 3 V 8.08 4.21 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 1.06 0.00 0.00 0.97 0.00 0.00 4 W 9.14 4.65 0.00 3.48 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 5 T 8.24 4.17 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 1.00 0.00 0.00 6 P 0.00 4.57 0.00 2.23 2.19 0.00 3.77 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 1.94 1.96 0.00 7 V 7.43 4.11 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 8.65 4.20 0.00 2.96 2.87 0.00 0.00 6.52 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 7.62 4.84 0.00 2.64 2.67 0.00 0.00 7.30 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 8.37 4.11 0.00 1.98 1.65 0.00 0.61 0.00 0.00 1.31 0.00 0.00 2.39 0.00 0.00 2.36 0.00 0.00 0.00 0.00 1.33 1.40 7.81 11 M 8.32 4.96 0.00 2.09 2.11 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 2.53 2.66 0.00 12 F 8.16 4.62 0.00 3.09 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 13 E 8.47 3.55 0.00 2.16 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 2.21 2.15 0.00 14 T 8.34 3.89 4.16 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 0.08 0.00 0.00 15 F 8.97 4.47 0.00 3.31 3.08 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 16 S 8.26 4.49 0.00 4.13 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 8.28 4.36 0.00 3.03 3.20 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 18 L 7.61 4.69 0.00 1.82 1.61 0.88 1.10 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 4.44 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 4.27 0.00 2.04 2.03 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 2.18 0.00 21 L 8.30 4.01 0.00 1.55 1.46 0.15 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.18 4.21 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 8.57 4.35 0.00 2.70 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 8.09 3.92 0.00 2.01 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 2.35 2.39 0.00 25 Q 7.95 3.93 0.00 2.27 1.92 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 2.26 2.31 0.00 26 I 8.08 3.71 2.05 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 1.61 0.71 1.09 0.00 0.00 27 A 8.29 4.03 1.39 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 0.00 0.00 0.00 0.00 0.00 0.00 28 A 8.11 3.96 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 29 Q 8.14 4.10 0.00 2.55 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.75 0.00 0.00 0.00 0.00 0.00 2.44 2.07 0.00 30 V 8.19 3.74 2.30 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 1.15 0.00 0.00 1.03 0.00 0.00 31 D 8.46 4.44 0.00 3.00 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 32 Y 8.13 4.14 0.00 3.23 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 8.03 3.92 2.17 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.01 1.07 0.00 0.00 34 V 7.94 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 1.02 0.00 0.00 0.98 0.00 0.00 35 A 7.97 3.92 1.21 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 0.00 0.00 36 N 7.11 4.08 0.00 1.44 1.42 0.00 0.00 7.04 9.00 0.00 0.00 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 7.21 3.74 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 0.00 0.00 0.00 38 W 7.62 5.00 0.00 3.36 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 8.83 4.50 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 1.52 0.96 0.73 0.00 0.00 40 P 0.00 4.93 0.00 2.13 2.20 0.00 3.92 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 2.10 2.00 0.00 41 C 8.95 5.01 0.00 3.14 2.82 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 42 L 8.73 5.36 0.00 1.82 1.59 0.93 0.79 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 43 E 9.20 5.67 0.00 2.07 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 2.38 2.33 0.00 44 F 9.14 5.61 0.00 3.06 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 45 A 8.29 4.43 -0.27 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 46 E 8.62 4.28 0.00 2.18 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 2.29 2.27 0.00 47 A 8.83 4.27 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 48 D 8.14 4.60 0.00 2.70 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 49 K 7.96 4.64 0.00 1.49 1.66 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.31 1.42 7.81 50 A 7.66 3.94 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.41 4.74 0.00 2.89 2.73 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 52 V 8.32 3.96 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 0.54 0.00 0.00 0.77 0.00 0.00 53 S 8.93 4.76 0.00 4.02 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 54 N 8.54 5.15 0.00 2.75 2.85 0.00 0.00 6.57 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 55 E 8.19 3.97 0.00 2.15 2.23 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 2.39 2.37 0.00 56 S 8.86 4.07 0.00 4.02 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 57 A 7.68 2.58 1.14 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 0.00 0.00 0.00 0.00 0.00 58 I 6.97 3.54 1.78 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 1.47 0.81 0.88 0.00 0.00 59 R 7.51 4.26 0.00 1.89 2.00 0.00 3.19 0.00 0.00 3.22 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 60 F 7.17 5.07 0.00 2.99 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 61 G 8.21 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 62 S 8.44 4.59 0.00 3.87 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 63 V 7.28 4.45 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.45 0.00 0.00 64 S 8.24 4.49 0.00 4.10 4.28 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 65 C 8.10 3.99 0.00 2.96 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 66 L 8.46 3.62 0.00 1.79 1.77 0.95 1.01 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 67 Y 7.76 4.37 0.00 2.93 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 68 Y 7.16 4.80 0.00 2.80 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 69 D 8.88 4.52 0.00 2.79 2.66 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 70 N 8.91 4.60 0.00 3.07 3.26 0.00 0.00 6.98 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 71 R 7.97 3.94 0.00 1.51 1.70 0.00 3.08 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.58 0.00 72 Y 7.68 4.38 0.00 3.06 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 73 W 8.71 5.07 0.00 3.08 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 74 T 8.10 4.40 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 0.95 0.00 0.00 75 M 8.56 4.53 0.00 2.09 2.04 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.77 0.00 76 W 9.55 4.79 0.00 3.65 3.29 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 0.00 77 K 8.54 3.44 0.00 1.70 0.74 0.00 1.76 0.00 0.00 1.56 0.00 0.00 2.79 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.79 0.21 7.81 78 L 8.30 4.92 0.00 1.60 1.58 1.00 1.02 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 79 P 0.00 4.34 0.00 0.62 1.79 0.00 3.66 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 1.93 2.14 0.00 80 M 8.59 4.31 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 2.70 2.54 0.00 81 F 7.30 4.48 0.00 3.11 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 82 G 9.13 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 83 C 7.93 4.30 0.00 3.03 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 84 R 8.65 4.53 0.00 1.80 1.87 0.00 3.22 0.00 0.00 3.17 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.74 0.00 85 D 7.80 4.83 0.00 2.73 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 86 P 0.00 4.34 0.00 2.33 2.33 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 2.09 2.08 0.00 87 M 8.14 4.11 0.00 2.04 2.35 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.74 0.00 88 Q 8.00 4.02 0.00 2.25 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.82 0.00 0.00 0.00 0.00 0.00 2.41 2.58 0.00 89 V 7.73 3.60 2.27 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 1.10 0.00 0.00 1.01 0.00 0.00 90 L 8.05 4.02 0.00 1.91 1.72 0.94 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.25 3.96 0.00 2.03 2.01 0.00 3.31 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.84 0.00 92 E 8.29 4.10 0.00 2.23 2.17 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 2.61 2.63 0.00 93 I 7.88 3.54 2.00 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 1.35 1.09 0.86 0.00 0.00 94 V 7.67 3.48 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 1.04 0.00 0.00 0.95 0.00 0.00 95 A 7.97 3.92 1.56 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 0.00 0.00 96 C 7.56 2.00 0.00 1.23 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 0.00 0.00 0.00 97 T 7.47 3.72 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 1.09 0.00 0.00 98 K 7.93 3.89 0.00 1.68 2.03 0.00 1.79 0.00 0.00 1.89 0.00 0.00 3.04 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.37 1.54 7.81 99 A 7.57 4.01 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 0.00 100 F 7.66 4.70 0.00 2.84 2.82 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 0.00 101 P 0.00 4.45 0.00 2.12 2.11 0.00 3.25 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 1.93 1.87 0.00 102 D 8.06 4.58 0.00 2.71 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 0.00 103 A 7.43 4.83 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 0.00 104 Y 8.52 4.19 0.00 2.51 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 0.00 105 V 8.89 5.26 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 0.80 0.00 0.00 0.88 0.00 0.00 106 R 9.45 4.99 0.00 1.81 1.86 0.00 2.29 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.34 0.00 107 L 8.21 4.80 0.00 1.50 0.74 0.84 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.67 4.85 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 0.54 0.00 0.00 109 A 7.89 4.85 1.16 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 0.00 0.00 110 F 9.08 5.21 0.00 3.00 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 0.00 111 D 8.83 5.35 0.00 2.35 2.44 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.19 4.75 0.00 2.94 3.05 0.00 0.00 6.31 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 0.00 113 Q 8.71 4.23 0.00 2.25 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.05 0.00 0.00 0.00 0.00 0.00 2.46 2.54 0.00 114 K 8.29 4.01 0.00 1.76 1.87 0.00 1.90 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.46 7.81 115 Q 8.07 3.45 0.00 2.13 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.72 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 116 V 7.75 4.52 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 0.49 0.00 0.00 0.91 0.00 0.00 117 Q 8.71 4.26 0.00 2.09 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.85 0.00 0.00 0.00 0.00 0.00 2.14 1.86 0.00 118 I 8.02 4.24 1.26 0.00 0.00 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 -0.07 0.34 -0.61 0.00 0.00 119 M 6.68 4.57 0.00 2.14 2.22 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 2.44 2.78 0.00 120 G 8.29 4.63 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 0.00 0.00 0.00 121 F 7.08 5.06 0.00 3.20 3.31 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 0.00 122 L 8.78 4.49 0.00 1.56 1.62 0.47 0.57 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 0.00 123 V 9.00 4.54 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 0.78 0.00 0.00 0.91 0.00 0.00 124 Q 7.81 4.61 0.00 2.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.80 0.00 0.00 0.00 0.00 0.00 2.29 2.22 0.00 125 R 8.11 4.28 0.00 1.22 1.55 0.00 2.21 0.00 0.00 2.51 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.27 0.00 126 P 0.00 4.22 0.00 2.06 1.98 0.00 2.47 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.80 0.00 127 K 8.54 4.01 0.00 1.72 1.88 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.40 7.81 128 T 7.80 4.10 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 1.22 0.00 0.00 129 A 7.70 4.26 1.55 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 0.00 0.00 130 R 8.82 4.64 0.00 1.80 1.88 0.00 3.33 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.53 0.00 131 D 8.48 4.97 0.00 2.90 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 0.00 132 F 7.63 5.40 0.00 3.23 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 0.00 133 Q 8.33 4.43 0.00 1.86 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 7.06 0.00 0.00 0.00 0.00 0.00 2.28 2.03 0.00 134 P 0.00 4.48 0.00 2.20 2.18 0.00 3.55 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.89 0.00 135 A 8.89 3.96 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 0.00 136 N 8.11 4.64 0.00 2.81 2.94 0.00 0.00 5.84 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 0.00 137 K 7.85 4.43 0.00 1.71 1.71 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.30 1.42 7.81 138 R 7.67 3.54 0.00 1.44 0.66 0.00 3.07 0.00 0.00 3.18 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.54 0.00 139 S 7.44 5.07 0.00 4.08 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 0.00 140 V 8.52 3.99 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 0.61 0.00 0.00 0.91 0.00 0.00