NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 D 4.5640 8.2185 120.1956 53.6572 41.2414 175.3344 3 A 3.9265 8.4259 127.8499 53.5877 18.8003 177.6797 4 R 4.1460 8.4584 117.0839 59.3330 31.2904 175.4112 5 Q 4.7534 8.2328 116.8354 55.6427 29.6530 175.6203 6 F 5.1017 8.8299 117.2328 55.8707 42.1283 172.8671 7 L 5.2496 8.7408 118.4354 52.7112 44.4269 175.8444 8 I 4.7061 8.3507 122.8145 60.2105 38.7952 173.7396 9 Y 5.3555 9.4015 129.4861 55.7784 41.7308 173.7388 10 N 4.1372 8.4151 125.5708 51.5662 40.0544 174.8695 11 E 3.5326 8.5252 127.8041 59.2620 30.1508 177.3236 12 D 4.4713 8.0529 116.4608 57.5975 41.2871 176.7906 13 H 4.3689 8.6091 114.1754 55.8764 29.3648 175.1439 14 K 3.9068 7.3998 117.4600 56.3064 29.9778 174.4442 15 R 4.9061 7.2323 114.8068 54.8921 35.4441 175.9905 16 C 5.7157 9.0653 117.5800 54.8489 41.6101 174.0802 17 V 4.1149 8.6562 122.0601 63.3855 32.6330 174.6350 18 D 4.9240 9.1377 126.3561 52.4463 44.3592 174.0531 19 A 4.4140 8.9096 129.3837 52.0765 18.1855 176.7523 20 L 4.4082 8.5959 123.6592 56.4397 43.3281 176.5376 21 S 3.9336 6.9554 110.4741 57.0215 65.4293 175.4086 22 A 3.6330 8.1184 122.6609 54.4669 18.0007 178.9065 23 I 4.1233 7.2012 106.8448 60.2610 37.8790 175.5194 24 S 4.4783 7.7558 116.7531 57.8255 65.5217 173.1623 25 V 4.5377 9.0157 127.9697 61.4455 33.8277 172.9689 26 Q 5.2114 9.2726 131.8671 54.3688 32.6600 174.3306 27 T 5.0559 8.1889 112.6231 61.3280 72.5742 172.8827 28 A 4.5836 8.7332 122.2830 50.7578 23.3707 175.8317 29 T 4.1588 8.4469 116.0945 63.9007 68.9719 175.5435 30 C 4.3023 8.8563 124.1215 57.1767 42.0680 172.9540 31 N 4.7642 9.6602 122.8946 51.1407 40.1939 172.9769 32 P 4.4356 0.0000 0.0000 64.5195 31.5911 176.9646 33 E 4.1010 8.5694 118.0578 57.1422 30.1445 176.0920 34 A 4.2926 7.8450 123.6467 50.8765 18.9382 178.0550 35 E 3.9156 8.7530 123.7405 59.6832 30.0367 179.8692 36 S 4.0300 7.9446 112.9106 60.7703 63.0591 175.3162 37 Q 4.6192 7.8330 118.1551 55.1748 29.1115 174.7217 38 K 4.6260 7.5117 119.3527 55.0430 33.9964 175.7889 39 F 5.1093 8.6762 122.6616 55.7343 43.6973 173.9252 40 R 5.0197 8.5025 115.2762 54.7256 32.9380 174.6923 41 W 4.8273 9.3788 122.1274 57.2618 29.6381 176.5265 42 V 4.5798 8.5080 115.1518 60.9191 32.0655 175.0446 43 S 4.6502 7.9495 113.4664 57.8202 64.9489 174.8503 44 D 4.6277 8.9856 119.3783 55.6879 39.3422 176.6553 45 S 5.3433 8.6901 112.5355 57.7038 65.3022 173.4773 46 Q 5.4359 8.7196 120.0854 54.3270 31.9223 174.2840 47 I 4.6718 8.3696 123.1760 59.6533 40.2052 173.8887 48 M 4.9804 9.1247 127.6594 53.6976 34.5252 174.9596 49 S 3.8099 9.2128 121.7788 58.2853 62.9792 174.8701 50 V 3.4904 8.2626 128.4465 66.0809 31.1783 177.3556 51 A 3.8604 7.8490 121.9281 54.2083 18.3620 177.8338 52 F 4.4352 7.8683 112.0645 56.4581 40.4548 175.7723 53 K 3.9540 8.0576 118.9543 57.5638 30.2085 174.7023 54 L 5.0371 7.6451 115.3325 53.2828 46.4908 176.8100 55 C 5.4373 9.2278 118.8192 55.1628 41.2449 173.4791 56 L 4.7699 9.0697 123.6991 55.4494 42.5994 176.6643 57 G 4.3681 9.2462 109.3885 46.1458 0.0000 171.9911 58 V 5.3211 8.3556 112.5963 58.7270 35.0489 175.1328 59 P 4.1273 0.0000 0.0000 65.2830 31.6319 176.3407 60 S 4.4411 7.2247 110.2008 57.7306 65.0128 176.3029 61 K 4.3791 8.7006 122.7825 55.2296 30.5549 176.2154 62 T 4.7058 7.3760 110.7913 58.9224 72.3339 173.9369 63 D 4.6273 8.7316 122.5460 56.0596 41.4704 176.0554 64 W 3.8356 9.4919 134.6504 57.9772 29.9628 173.5982 65 A 4.2400 7.9576 118.9987 51.6878 18.9057 177.9223 66 S 4.4783 8.5139 118.0121 58.2812 63.9896 174.0466 67 V 4.4089 8.3035 125.4480 62.3695 31.7099 174.4969 68 T 4.5860 8.9689 122.6642 60.8068 72.2076 172.2184 69 L 5.3786 8.2003 120.3821 53.4932 44.7292 175.9439 70 Y 4.8670 9.1888 119.8299 55.4910 42.5837 174.6702 71 A 4.3303 8.9580 122.8683 52.7694 18.9348 178.3947 72 C 4.3596 8.9157 120.4005 57.1185 42.2020 173.1445 73 D 4.6091 8.5995 124.1367 52.6908 42.6530 175.8728 74 S 4.3100 8.8407 122.0873 60.2364 63.1592 174.9686 75 K 4.3098 8.4382 119.7501 56.3619 32.5335 176.3271 76 S 4.3579 7.8752 115.3314 57.8902 62.6236 173.5838 77 E 4.0839 8.6153 126.0038 57.3255 29.7065 176.3886 78 Y 4.4098 8.0094 117.0905 57.7590 38.0465 175.9522 79 Q 5.0063 7.5456 116.3585 54.6812 30.0907 174.4687 80 K 4.7856 7.7581 119.3165 55.4138 34.1172 175.5134 81 W 5.2964 9.3953 125.1571 55.0353 32.6467 174.6605 82 E 4.9663 8.9980 118.6041 55.3212 32.8747 173.5940 83 C 5.0246 8.9583 118.5444 56.9024 41.0631 174.2636 84 K 4.5870 8.9509 124.1274 56.1382 32.9648 175.7407 85 N 4.7031 8.6664 119.9988 53.5669 40.3689 174.0153 86 D 4.3023 9.5412 117.2834 55.8845 38.4700 175.1033 87 T 3.5574 7.9387 106.1912 61.5027 68.1413 171.4434 88 L 4.6961 8.2690 126.0128 55.6566 43.3442 175.4542 89 F 5.3675 9.2849 127.3388 56.9236 43.2398 173.8281 90 G 4.7767 7.9627 110.8736 45.7173 0.0000 172.1611 91 I 3.7244 8.0754 120.8062 60.6514 38.1262 176.4525 92 K 3.9319 8.2302 128.7085 57.7846 32.2578 177.2798 93 G 3.9497 9.3939 114.5626 45.7672 0.0000 173.1349 94 T 4.5407 7.2282 115.1840 61.7518 72.6187 174.6970 95 E 4.0462 8.4118 126.0965 55.3858 28.5881 176.3149 96 L 4.6761 6.8292 118.8954 52.9763 46.2129 176.8192 97 Y 5.5595 8.9908 121.3270 55.8517 41.4770 174.9439 98 F 4.7011 9.7107 125.8349 58.8719 40.4800 173.4860 99 N 6.1268 9.3206 124.7392 52.4458 42.8093 172.3481 100 Y 4.9512 9.5153 124.7610 56.4769 41.6103 173.6439 101 G 2.0000 7.9040 116.2306 44.9761 0.0000 173.8731 102 N 4.7680 7.9832 118.2430 53.6422 39.5211 174.7586 103 R 3.7448 9.3507 117.1245 57.5388 27.8933 176.7424 104 Q 3.4310 8.3161 111.4341 56.5245 26.5914 173.1440 105 E 4.2757 8.0058 119.4212 55.5446 29.9361 176.9519 106 K 4.2709 8.6525 126.1309 58.7849 32.7149 176.7730 107 N 4.6669 8.3511 117.2199 52.4554 39.7488 174.5269 108 I 3.7970 8.1494 125.3167 62.0906 38.2525 175.1853 109 K 4.8418 8.7172 124.6393 54.1176 36.2917 175.5387 110 L 4.8749 8.8122 123.2212 55.2417 42.9179 175.6644 111 Y 5.6706 9.2529 123.3246 56.1489 42.2153 176.2572 112 K 4.2246 8.4268 124.2648 58.7476 32.5410 178.3645 113 G 3.9469 6.9080 107.2145 45.3932 0.0000 173.0974 114 S 4.4802 8.3884 115.0583 57.5398 64.3971 175.6638 115 G 3.9059 7.9344 113.9651 46.3248 0.0000 175.3914 116 L 4.0307 8.2783 119.1603 57.1251 42.1761 177.8548 117 W 4.7243 8.0566 116.8896 57.4782 29.7976 177.2123 118 S 6.0031 8.1805 113.4476 57.5699 62.9461 173.2245 119 R 5.2721 7.6813 119.8766 54.2393 31.7725 175.4399 120 W 5.3628 9.0539 121.8673 55.0668 33.1376 174.6531 121 K 4.9419 9.5291 122.9215 54.0644 36.0634 175.6350 122 V 4.1118 8.5395 122.7218 62.9780 32.3347 175.0413 123 Y 4.1588 8.9022 130.2261 59.5346 38.9593 176.3743 124 G 3.5381 8.9405 114.7458 45.3041 0.0000 172.2124 125 T 4.6469 7.4166 108.2854 60.4402 71.9594 173.5155 126 T 4.5067 8.3664 108.6726 61.5013 69.1212 173.9916 127 D 4.8174 7.9067 122.3249 53.0339 42.7858 176.0334 128 D 5.0673 8.2138 121.1343 52.7235 40.6590 177.2746 129 L 3.9008 8.3346 118.3961 57.5339 41.5420 179.5792 130 C 4.2330 8.2380 115.2166 57.8152 40.0026 175.1356 131 S 4.0552 7.8506 115.6494 59.8326 62.7262 174.8046 132 R 4.4320 7.3868 120.6537 55.7198 30.8244 176.3010 133 G 3.2919 6.9326 108.3192 44.3587 0.0000 172.4941 134 Y 4.6273 7.4593 118.0645 56.7716 41.3757 175.4694 135 E 4.1224 8.8144 119.5386 57.1420 29.5107 174.7034 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 D 8.22 4.56 0.00 2.71 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 3 A 8.43 3.93 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 4 R 8.46 4.15 0.00 2.04 2.14 0.00 3.38 0.00 0.00 3.41 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.72 0.00 5 Q 8.23 4.75 0.00 2.05 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.45 0.00 0.00 0.00 0.00 0.00 2.38 2.33 0.00 6 F 8.83 5.10 0.00 3.14 3.15 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 0.00 0.00 0.00 0.00 7 L 8.74 5.25 0.00 1.81 1.64 0.97 0.69 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 8 I 8.35 4.71 1.54 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.56 0.42 0.00 0.00 9 Y 9.40 5.36 0.00 3.27 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 10 N 8.42 4.14 0.00 1.44 2.17 0.00 0.00 6.55 8.41 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 11 E 8.53 3.53 0.00 1.98 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 2.30 2.38 0.00 12 D 8.05 4.47 0.00 2.71 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 13 H 8.61 4.37 0.00 3.12 3.33 0.00 6.06 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 K 7.40 3.91 0.00 1.97 2.03 0.00 1.67 0.00 0.00 1.65 0.00 0.00 3.07 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.47 7.81 15 R 7.23 4.91 0.00 1.62 1.78 0.00 3.10 0.00 0.00 3.38 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.87 0.00 16 C 9.07 5.72 0.00 2.87 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 17 V 8.66 4.11 1.84 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 0.70 0.00 0.00 0.59 0.00 0.00 18 D 9.14 4.92 0.00 2.73 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 19 A 8.91 4.41 1.35 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 20 L 8.60 4.41 0.00 1.64 1.70 0.94 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 21 S 6.96 3.93 0.00 3.81 3.85 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 0.00 0.00 0.00 0.00 22 A 8.12 3.63 1.13 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 0.00 0.00 23 I 7.20 4.12 1.76 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.63 0.77 0.00 0.00 24 S 7.76 4.48 0.00 3.82 3.59 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 25 V 9.02 4.54 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 0.93 0.00 0.00 0.85 0.00 0.00 26 Q 9.27 5.21 0.00 1.90 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.40 0.00 0.00 0.00 0.00 0.00 2.29 2.03 0.00 27 T 8.19 5.06 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 0.41 0.00 0.00 28 A 8.73 4.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 T 8.45 4.16 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 1.23 0.00 0.00 30 C 8.86 4.30 0.00 2.73 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 0.00 0.00 0.00 0.00 31 N 9.66 4.76 0.00 2.55 2.57 0.00 0.00 6.62 7.69 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 32 P 0.00 4.44 0.00 2.29 2.34 0.00 3.82 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 2.03 2.12 0.00 33 E 8.57 4.10 0.00 2.07 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 2.30 2.25 0.00 34 A 7.84 4.29 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 35 E 8.75 3.92 0.00 1.87 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 0.00 2.31 2.15 0.00 36 S 7.94 4.03 0.00 4.29 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 37 Q 7.83 4.62 0.00 2.22 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.03 6.87 0.00 0.00 0.00 0.00 0.00 2.50 2.24 0.00 38 K 7.51 4.63 0.00 1.62 1.51 0.00 1.64 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.32 1.48 7.81 39 F 8.68 5.11 0.00 2.03 2.39 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 40 R 8.50 5.02 0.00 1.99 2.00 0.00 2.80 0.00 0.00 3.20 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.69 0.00 41 W 9.38 4.83 0.00 3.37 3.58 0.00 0.00 0.00 0.00 0.00 0.00 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 8.51 4.58 2.21 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 0.90 0.00 0.00 1.08 0.00 0.00 43 S 7.95 4.65 0.00 4.02 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 44 D 8.99 4.63 0.00 2.93 2.99 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 45 S 8.69 5.34 0.00 4.04 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 46 Q 8.72 5.44 0.00 2.22 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.89 0.00 0.00 0.00 0.00 0.00 2.62 2.52 0.00 47 I 8.37 4.67 1.35 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.49 0.00 0.00 48 M 9.12 4.98 0.00 2.07 1.98 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 2.69 2.48 0.00 49 S 9.21 3.81 0.00 3.92 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 50 V 8.26 3.49 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 0.71 0.00 0.00 0.75 0.00 0.00 51 A 7.85 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 F 7.87 4.44 0.00 3.02 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 53 K 8.06 3.95 0.00 1.89 1.89 0.00 1.63 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.34 7.81 54 L 7.65 5.04 0.00 1.59 1.68 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 55 C 9.23 5.44 0.00 3.09 3.15 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 0.00 0.00 0.00 0.00 56 L 9.07 4.77 0.00 1.49 1.60 0.26 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 57 G 9.25 4.37 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 0.00 58 V 8.36 5.32 2.21 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 0.86 0.00 0.00 1.01 0.00 0.00 59 P 0.00 4.13 0.00 2.11 2.20 0.00 3.88 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 60 S 7.22 4.44 0.00 3.95 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 61 K 8.70 4.38 0.00 1.77 1.76 0.00 1.50 0.00 0.00 1.56 0.00 0.00 2.50 0.00 0.00 2.15 0.00 0.00 0.00 0.00 1.28 1.45 7.81 62 T 7.38 4.71 4.30 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 1.24 0.00 0.00 63 D 8.73 4.63 0.00 2.70 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 64 W 9.49 3.84 0.00 3.57 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 65 A 7.96 4.24 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 66 S 8.51 4.48 0.00 3.71 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 67 V 8.30 4.41 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 0.92 0.00 0.00 1.03 0.00 0.00 68 T 8.97 4.59 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 1.15 0.00 0.00 69 L 8.20 5.38 0.00 1.40 1.51 0.63 0.72 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 70 Y 9.19 4.87 0.00 2.94 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 71 A 8.96 4.33 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 72 C 8.92 4.36 0.00 3.05 3.14 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 73 D 8.60 4.61 0.00 2.69 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.84 4.31 0.00 4.05 4.03 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 75 K 8.44 4.31 0.00 1.92 1.89 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.37 7.81 76 S 7.88 4.36 0.00 3.88 3.90 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 77 E 8.62 4.08 0.00 1.38 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.07 0.00 78 Y 8.01 4.41 0.00 2.91 2.93 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 0.00 0.00 0.00 79 Q 7.55 5.01 0.00 2.25 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.84 6.72 0.00 0.00 0.00 0.00 0.00 2.23 2.26 0.00 80 K 7.76 4.79 0.00 1.52 1.69 0.00 1.66 0.00 0.00 1.79 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.55 7.81 81 W 9.40 5.30 0.00 3.28 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 82 E 9.00 4.97 0.00 2.00 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 2.17 2.33 0.00 83 C 8.96 5.02 0.00 3.01 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 84 K 8.95 4.59 0.00 1.85 1.83 0.00 1.91 0.00 0.00 1.82 0.00 0.00 3.07 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.68 1.93 7.81 85 N 8.67 4.70 0.00 2.82 2.76 0.00 0.00 7.12 8.08 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 86 D 9.54 4.30 0.00 2.75 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 T 7.94 3.56 4.54 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 1.27 0.00 0.00 88 L 8.27 4.70 0.00 1.79 1.81 0.58 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 89 F 9.28 5.37 0.00 3.35 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 90 G 7.96 4.78 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 0.00 0.00 0.00 91 I 8.08 3.72 1.63 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.64 0.59 0.00 0.00 92 K 8.23 3.93 0.00 1.64 1.59 0.00 1.86 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.53 7.81 93 G 9.39 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 94 T 7.23 4.54 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 1.10 0.00 0.00 95 E 8.41 4.05 0.00 1.88 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 0.00 2.32 2.30 0.00 96 L 6.83 4.68 0.00 1.42 1.49 0.90 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 8.99 5.56 0.00 3.27 3.22 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 98 F 9.71 4.70 0.00 3.43 3.28 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 99 N 9.32 6.13 0.00 3.34 3.03 0.00 0.00 6.15 7.17 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 0.00 100 Y 9.52 4.95 0.00 3.11 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 0.00 101 G 7.90 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 0.00 0.00 0.00 0.00 0.00 0.00 102 N 7.98 4.77 0.00 2.95 2.65 0.00 0.00 7.30 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 0.00 103 R 9.35 3.74 0.00 2.10 2.03 0.00 3.46 0.00 0.00 3.18 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.21 0.00 104 Q 8.32 3.43 0.00 2.22 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.96 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00 105 E 8.01 4.28 0.00 2.22 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 1.84 2.31 0.00 106 K 8.65 4.27 0.00 1.86 1.98 0.00 1.71 0.00 0.00 1.89 0.00 0.00 2.84 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.57 1.45 7.81 107 N 8.35 4.67 0.00 2.60 2.56 0.00 0.00 7.20 8.66 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 0.00 108 I 8.15 3.80 1.40 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 1.11 0.13 -0.41 0.00 0.00 109 K 8.72 4.84 0.00 1.17 1.17 0.00 0.61 0.00 0.00 1.17 0.00 0.00 2.22 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.79 0.21 7.81 110 L 8.81 4.87 0.00 1.80 1.72 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 111 Y 9.25 5.67 0.00 3.32 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 0.00 112 K 8.43 4.22 0.00 1.54 1.76 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.78 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.43 1.64 7.81 113 G 6.91 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 0.00 114 S 8.39 4.48 0.00 3.49 3.33 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.93 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 0.00 116 L 8.28 4.03 0.00 1.46 1.74 0.84 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 117 W 8.06 4.72 0.00 3.42 3.38 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 0.00 118 S 8.18 6.00 0.00 4.02 4.14 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 0.00 119 R 7.68 5.27 0.00 1.89 1.82 0.00 3.17 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.70 0.00 120 W 9.05 5.36 0.00 2.95 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 0.00 121 K 9.53 4.94 0.00 1.88 1.84 0.00 1.78 0.00 0.00 1.73 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.43 7.81 122 V 8.54 4.11 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 0.92 0.00 0.00 0.71 0.00 0.00 123 Y 8.90 4.16 0.00 3.00 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 0.00 124 G 8.94 3.54 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 0.00 125 T 7.42 4.65 4.34 0.00 0.00 0.00 0.00 0.00 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 0.00 126 T 8.37 4.51 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 0.00 127 D 7.91 4.82 0.00 2.70 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 D 8.21 5.07 0.00 3.01 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 0.00 129 L 8.33 3.90 0.00 1.59 1.64 -0.52 0.75 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 0.00 130 C 8.24 4.23 0.00 3.04 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 0.00 131 S 7.85 4.06 0.00 3.98 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 0.00 132 R 7.39 4.43 0.00 1.29 1.92 0.00 3.52 0.00 0.00 3.16 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.34 0.00 133 G 6.93 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 0.00 0.00 0.00 134 Y 7.46 4.63 0.00 2.93 2.80 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 0.00 135 E 8.81 4.12 0.00 2.10 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 2.23 2.34 0.00