NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.4428 8.1233 123.5768 51.9722 21.2676 178.5884 3 S 4.0351 7.9731 110.1218 61.3030 63.0515 175.4925 4 M 4.0319 8.1453 121.2296 58.3572 32.2219 178.3122 5 R 3.9772 7.8670 118.2395 59.3738 30.3900 178.4214 6 V 3.3641 8.1723 118.4319 65.9682 31.3869 177.9514 7 V 3.6126 8.0333 118.1977 66.1462 31.3367 177.9655 8 K 4.0094 7.7773 117.8100 59.2861 32.1199 178.7124 9 E 4.0654 8.3446 119.1736 59.2014 29.4461 178.8188 10 L 3.0873 8.5121 120.7112 58.1053 42.1438 178.8431 11 E 3.8704 8.3644 118.6405 59.6789 29.5394 179.2715 12 D 4.3899 8.1537 118.7472 57.1200 40.6648 178.7959 13 L 4.0750 7.7886 119.2293 57.5122 41.5427 179.2724 14 Q 3.9153 7.8068 117.1282 58.7616 28.6996 178.7328 15 K 4.1512 7.7137 118.0662 58.3087 33.5744 177.9410 16 K 4.5718 7.4098 116.3878 53.9333 31.9569 174.1216 17 P 4.6995 0.0000 0.0000 60.4562 33.1204 175.5244 18 P 4.2812 0.0000 0.0000 61.7471 31.9089 175.7040 19 P 4.2168 0.0000 0.0000 65.2896 31.4333 176.7798 20 Y 4.6421 7.0971 114.6144 56.2772 38.3823 174.2776 21 L 4.9807 7.7456 122.3606 53.6642 44.3473 175.6415 22 R 4.6797 8.7485 124.5308 54.9133 33.5763 174.8240 23 N 4.2541 8.8070 113.2669 54.0509 36.1843 174.3516 24 L 4.3931 7.9541 120.2309 55.6474 42.6115 175.9215 25 S 4.5860 8.8381 119.9194 57.4184 66.5954 174.0044 26 S 5.0670 8.3503 115.7359 56.9595 64.6235 173.1490 27 D 4.4071 8.6084 121.0157 55.4512 41.0506 176.4597 28 D 4.4856 9.0773 125.5141 57.7523 40.4564 178.1687 29 A 4.1462 8.1707 121.4690 54.2198 19.2731 176.6599 30 N 4.5628 8.0237 111.5815 52.8288 39.6516 176.7151 31 V 4.0144 8.4743 125.0881 63.4432 32.3014 176.5676 32 L 4.5314 8.6531 120.8233 54.4004 41.9533 175.3198 33 V 4.8124 7.6790 118.7340 60.9315 34.2505 174.6716 34 W 5.5495 9.3541 127.2582 55.5156 32.7526 174.4120 35 H 5.8812 9.7541 117.5247 53.4386 32.6410 172.5598 36 A 5.2423 8.3721 120.9197 50.9093 22.9328 174.9844 37 L 4.8173 9.3589 121.4482 53.9831 43.3623 175.8311 38 L 5.0388 9.7578 127.4450 54.2433 44.0111 175.3774 39 L 5.1029 8.8607 126.5581 52.3348 42.1576 174.5903 40 P 4.5850 0.0000 0.0000 62.4800 32.2355 177.1899 41 D 4.7197 8.6938 119.9613 55.0715 41.8607 176.8721 42 Q 4.2905 8.1813 121.6691 54.4342 29.6144 173.3364 43 P 4.7723 0.0000 0.0000 62.4317 32.1933 174.1932 44 P 4.7963 0.0000 0.0000 63.0550 31.7755 177.2421 45 Y 4.5874 7.6392 118.7373 61.0517 37.8419 177.4481 46 H 5.4510 8.3808 113.4745 56.7622 28.9667 176.3496 47 L 4.0469 7.5842 119.7230 56.7321 41.6615 176.0257 48 K 4.8558 7.9774 115.7494 54.5301 36.5444 175.1596 49 A 5.0690 8.5653 121.3101 50.4229 22.7457 175.3962 50 F 5.0323 9.5995 118.4183 55.6284 42.6817 174.0866 51 N 5.3690 9.3674 123.8791 53.2048 40.3669 173.7391 52 L 5.1650 9.0425 125.1979 53.9097 44.5249 175.1286 53 R 4.6836 8.8675 121.8212 54.9109 32.1906 174.7287 54 I 4.3978 8.2373 128.3496 59.8939 39.0788 174.8276 55 S 4.8281 8.8011 124.9037 56.6566 65.0156 173.3539 56 F 4.5673 8.8609 124.6508 54.9598 39.9463 174.5919 57 P 4.4759 0.0000 0.0000 61.5850 31.9742 175.6114 58 P 4.3573 0.0000 0.0000 65.6339 31.5971 177.5018 59 E 4.1810 8.2072 117.9815 58.0530 29.9036 175.8908 60 Y 4.6015 7.8227 119.1827 57.1453 39.1352 174.1449 61 P 4.1226 0.0000 0.0000 62.3549 31.9716 177.2544 62 F 4.6264 7.5093 119.4827 60.6367 39.0859 176.1398 63 K 4.4808 7.9683 119.3130 54.3840 33.3297 174.3916 64 P 2.9700 0.0000 0.0000 60.8160 32.0859 174.1236 65 P 4.1856 0.0000 0.0000 62.5566 32.9155 174.9594 66 M 4.5350 8.4481 118.9002 53.4947 35.2339 174.8784 67 I 4.8377 8.2159 124.4133 59.2741 39.5778 175.1859 68 K 4.7634 8.6533 124.7771 54.9196 36.5520 175.4727 69 F 4.6556 9.2923 121.7798 58.0686 39.5492 176.2402 70 T 4.2696 9.1932 114.0053 63.8867 70.1221 176.1799 71 T 4.0969 8.1046 118.1319 62.9272 69.0912 174.1626 72 K 4.2974 8.5818 125.6376 56.5648 32.7723 176.3201 73 I 4.9044 8.1499 121.7192 59.5004 40.9900 173.9032 74 Y 4.1771 8.7610 127.8169 56.5331 38.6321 174.1712 75 H 4.8783 7.9044 125.8280 54.1416 33.1805 172.5054 76 P 4.1994 0.0000 0.0000 65.1774 30.9917 177.3348 77 N 4.8390 8.3082 112.9032 52.5936 39.1519 173.9143 78 V 4.5703 7.4143 117.8291 60.8517 34.4628 175.1053 79 D 4.7113 8.5459 126.1912 51.9639 40.9701 176.9917 80 E 4.0412 8.5864 117.6717 58.9275 29.1474 177.7264 81 N 4.7506 8.8761 116.5769 52.8959 38.8869 176.7608 82 G 4.6132 8.2019 105.8600 46.3108 0.0000 174.5663 83 Q 4.4225 7.6783 119.3300 55.7660 29.3665 175.2954 84 I 4.9375 7.8102 112.7119 59.5762 40.6963 174.3248 85 C 4.4014 8.5213 119.5703 58.2287 28.8515 173.4324 86 L 4.5941 8.1324 127.0448 52.4180 43.5667 174.6610 87 P 4.2457 0.0000 0.0000 65.8369 31.4004 178.5675 88 I 3.9401 7.9255 116.1735 63.4182 37.7101 175.9891 89 I 4.6759 7.5404 110.5429 60.2171 37.9612 175.7522 90 S 4.4043 8.4536 116.8879 58.3780 63.7110 175.6705 91 S 4.1407 8.8595 117.6880 62.3700 62.8575 175.8214 92 E 4.0125 8.0163 119.2981 59.2719 29.5008 177.6613 93 N 4.6681 7.6200 112.4170 53.7724 39.4731 175.8429 94 W 4.5165 8.2915 128.9272 57.3588 31.3343 175.0849 95 K 4.1650 7.3534 124.0051 53.5464 34.1880 175.2018 96 P 4.4747 0.0000 0.0000 64.5151 31.3124 176.7344 97 C 4.2677 7.4483 109.9940 58.3467 30.2082 173.7413 98 T 4.0049 7.3818 119.4096 63.7885 68.4952 174.8222 99 K 4.6590 9.5270 126.6150 55.6977 34.7847 178.1977 100 T 4.0924 9.4546 119.3515 66.9032 68.2736 176.7985 101 C 4.2459 8.3715 116.1352 61.6363 29.5154 176.0252 102 Q 4.0243 8.1575 119.9565 58.5807 28.4351 178.3216 103 V 3.6778 7.8374 119.1948 66.4163 31.4434 178.1878 104 L 4.1284 8.3373 118.7523 57.4811 41.4466 179.0547 105 E 4.1018 8.9416 120.8618 58.8691 29.5852 178.8720 106 A 4.0139 8.1405 120.7089 54.8712 18.2916 179.4429 107 L 3.8586 8.0234 119.1355 58.1741 42.1183 178.4753 108 N 4.1045 8.2327 117.2247 56.6403 38.6466 176.7643 109 V 3.4779 7.6881 119.3896 66.0285 31.3978 177.6276 110 L 3.8358 7.7952 118.6265 58.1239 41.9440 178.9171 111 V 3.4183 7.6691 117.1042 66.0241 31.5950 177.4285 112 N 4.7272 8.2372 115.1789 54.8443 39.1289 175.4376 113 R 4.4631 8.2919 120.8585 52.8638 30.4274 173.3002 114 P 4.1642 0.0000 0.0000 62.6168 31.9565 176.2519 115 N 4.6258 8.4595 120.9533 52.2706 38.2600 174.6125 116 I 3.9567 8.0955 120.3397 63.2026 38.5954 177.9688 117 R 4.0383 8.2602 119.4654 58.8517 30.2823 176.9520 118 E 4.6279 7.9353 115.6691 53.8558 29.3433 173.6277 119 P 4.9227 0.0000 0.0000 60.8933 33.5215 177.5600 120 L 3.9856 8.4433 118.7867 57.2561 42.0117 177.7966 121 R 4.4060 8.1701 121.7352 54.7804 30.5011 177.0719 122 M 3.9960 8.6131 124.1290 58.2033 32.1837 178.0218 123 D 4.4081 8.1788 118.9679 56.9903 39.2285 178.9914 124 L 4.0976 7.8720 119.6089 57.0765 41.6293 179.1777 125 A 3.8462 7.8254 120.6221 55.2456 18.3086 179.1324 126 D 4.2805 8.5862 117.6703 57.7257 40.9018 178.9395 127 L 3.9926 8.4241 120.8695 58.3114 41.7799 178.8451 128 L 3.7391 7.5506 119.1432 58.1413 42.0047 178.7585 129 T 3.9869 7.6485 115.0667 66.5204 68.4824 176.3364 130 Q 4.4062 8.2215 118.9547 57.0608 30.4468 176.0143 131 N 4.9644 8.7515 118.9717 49.8812 39.5508 172.3100 132 P 4.3067 0.0000 0.0000 65.1005 31.8325 177.3969 133 E 3.9931 8.2078 117.7137 59.0315 29.6438 178.4224 134 L 3.9572 8.3603 120.5209 57.9815 42.0955 178.4484 135 F 4.0299 8.4479 120.7651 61.5667 39.3131 177.1396 136 R 3.8417 8.2207 118.0964 59.3126 29.9368 178.6831 137 K 3.9171 7.9605 118.0384 59.3488 32.0621 178.9954 138 N 3.8913 7.9712 116.4763 56.2498 38.3775 177.3022 139 A 3.7133 7.9392 122.5423 54.8670 18.3119 179.2977 140 E 3.7613 7.9782 117.7618 59.3546 29.7139 178.6840 141 E 3.8205 7.8899 119.0982 59.2236 29.7255 178.4702 142 F 3.8319 7.9235 120.2055 61.4564 39.3658 177.0898 143 T 4.1833 8.7263 115.7691 66.9517 68.1453 176.5309 144 L 3.8145 8.0115 119.6842 57.7939 41.6720 179.3917 145 R 3.6802 7.7993 117.8065 58.4816 30.0420 177.0577 146 F 4.8589 7.6726 114.4177 57.2365 41.1720 176.1499 147 G 3.5287 8.4163 108.4246 45.8614 0.0000 174.0248 148 V 3.9350 7.8555 121.8552 62.2042 32.8146 175.3159 149 D 4.6621 8.6129 125.6699 54.7710 41.5930 176.0149 150 R 4.1670 8.3870 122.2713 54.9516 30.9715 174.5578 151 P 4.4307 0.0000 0.0000 63.1711 31.3518 176.0005 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 A 8.12 4.44 1.34 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 0.00 0.00 0.00 3 S 7.97 4.04 0.00 3.96 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 4 M 8.15 4.03 0.00 2.05 2.10 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.60 0.00 5 R 7.87 3.98 0.00 1.84 2.03 0.00 3.13 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.76 0.00 6 V 8.17 3.36 1.93 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 0.59 0.00 0.00 0.03 0.00 0.00 7 V 8.03 3.61 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 1.01 0.00 0.00 0.99 0.00 0.00 8 K 7.78 4.01 0.00 1.90 1.81 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.45 1.64 7.81 9 E 8.34 4.07 0.00 2.61 2.35 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 2.48 2.71 0.00 10 L 8.51 3.09 0.00 1.40 1.73 -0.10 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 11 E 8.36 3.87 0.00 2.20 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 2.27 2.31 0.00 12 D 8.15 4.39 0.00 2.91 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 13 L 7.79 4.07 0.00 1.86 1.63 1.16 0.64 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 14 Q 7.81 3.92 0.00 1.91 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.94 0.00 0.00 0.00 0.00 0.00 2.36 2.29 0.00 15 K 7.71 4.15 0.00 1.88 1.85 0.00 1.80 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.45 7.81 16 K 7.41 4.57 0.00 1.86 1.70 0.00 1.70 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.46 7.81 17 P 0.00 4.70 0.00 2.06 2.01 0.00 3.06 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 1.93 2.14 0.00 18 P 0.00 4.28 0.00 0.61 1.90 0.00 3.55 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.75 0.00 19 P 0.00 4.22 0.00 2.14 2.19 0.00 3.52 0.00 0.00 3.61 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 20 Y 7.10 4.64 0.00 3.25 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 21 L 7.75 4.98 0.00 1.40 1.49 1.09 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 22 R 8.75 4.68 0.00 1.84 1.77 0.00 3.50 0.00 0.00 3.16 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.73 0.00 23 N 8.81 4.25 0.00 2.85 2.89 0.00 0.00 6.88 7.85 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 24 L 7.95 4.39 0.00 1.59 1.49 0.87 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 25 S 8.84 4.59 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 26 S 8.35 5.07 0.00 4.03 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 27 D 8.61 4.41 0.00 2.85 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 28 D 9.08 4.49 0.00 2.70 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 29 A 8.17 4.15 1.29 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 30 N 8.02 4.56 0.00 2.77 2.77 0.00 0.00 6.73 7.71 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 31 V 8.47 4.01 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 0.82 0.00 0.00 0.99 0.00 0.00 32 L 8.65 4.53 0.00 1.88 1.92 1.00 0.93 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 33 V 7.68 4.81 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 0.92 0.00 0.00 0.93 0.00 0.00 34 W 9.35 5.55 0.00 3.28 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 35 H 9.75 5.88 0.00 3.01 3.17 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 A 8.37 5.24 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 37 L 9.36 4.82 0.00 1.64 1.69 0.94 0.04 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 38 L 9.76 5.04 0.00 1.90 1.99 1.26 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.86 5.10 0.00 1.83 1.74 1.02 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 4.59 0.00 2.41 2.00 0.00 4.24 0.00 0.00 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.22 0.00 41 D 8.69 4.72 0.00 2.74 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 42 Q 8.18 4.29 0.00 2.23 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 7.06 0.00 0.00 0.00 0.00 0.00 2.71 2.71 0.00 43 P 0.00 4.77 0.00 2.09 1.97 0.00 3.75 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.86 0.00 44 P 0.00 4.80 0.00 2.12 2.18 0.00 2.94 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 2.00 0.00 45 Y 7.64 4.59 0.00 3.33 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 46 H 8.38 5.45 0.00 3.38 3.59 0.00 5.13 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 L 7.58 4.05 0.00 1.66 1.72 0.96 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 48 K 7.98 4.86 0.00 1.41 1.48 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.65 7.81 49 A 8.57 5.07 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 50 F 9.60 5.03 0.00 3.16 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 51 N 9.37 5.37 0.00 2.85 2.77 0.00 0.00 6.26 6.28 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 52 L 9.04 5.16 0.00 1.49 1.21 0.98 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 53 R 8.87 4.68 0.00 1.86 1.75 0.00 3.10 0.00 0.00 3.14 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.40 0.00 54 I 8.24 4.40 1.68 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.54 0.05 0.00 0.00 55 S 8.80 4.83 0.00 3.47 3.57 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 0.00 0.00 0.00 56 F 8.86 4.57 0.00 2.61 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.48 0.00 2.44 2.11 0.00 3.54 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.00 0.00 58 P 0.00 4.36 0.00 2.23 2.25 0.00 3.77 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 59 E 8.21 4.18 0.00 2.19 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 0.00 2.49 2.43 0.00 60 Y 7.82 4.60 0.00 2.94 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.12 0.00 2.08 1.42 0.00 2.63 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.48 0.00 62 F 7.51 4.63 0.00 3.20 3.12 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 63 K 7.97 4.48 0.00 1.85 1.63 0.00 1.64 0.00 0.00 1.84 0.00 0.00 3.28 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.53 1.48 7.81 64 P 0.00 2.97 0.00 1.70 1.11 0.00 3.53 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.75 0.00 65 P 0.00 4.19 0.00 1.11 0.77 0.00 2.77 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.50 0.00 66 M 8.45 4.53 0.00 1.71 1.71 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 67 I 8.22 4.84 1.67 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.33 0.61 0.00 0.00 68 K 8.65 4.76 0.00 1.84 1.76 0.00 1.27 0.00 0.00 1.62 0.00 0.00 3.00 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.23 1.37 7.81 69 F 9.29 4.66 0.00 3.02 3.35 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 70 T 9.19 4.27 4.31 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 1.26 0.00 0.00 71 T 8.10 4.10 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 1.38 0.00 0.00 72 K 8.58 4.30 0.00 1.59 1.97 0.00 1.79 0.00 0.00 1.62 0.00 0.00 2.82 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.11 0.71 7.81 73 I 8.15 4.90 1.38 0.00 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.41 0.32 0.00 0.00 74 Y 8.76 4.18 0.00 2.16 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 75 H 7.90 4.88 0.00 2.86 2.82 0.00 5.74 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 P 0.00 4.20 0.00 2.13 2.01 0.00 3.16 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 1.89 1.88 0.00 77 N 8.31 4.84 0.00 2.71 2.77 0.00 0.00 6.55 7.68 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 78 V 7.41 4.57 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 0.87 0.00 0.00 0.58 0.00 0.00 79 D 8.55 4.71 0.00 2.91 2.78 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 80 E 8.59 4.04 0.00 1.97 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 2.24 2.29 0.00 81 N 8.88 4.75 0.00 2.89 2.80 0.00 0.00 6.78 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 82 G 8.20 4.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.68 4.42 0.00 2.03 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.64 0.00 0.00 0.00 0.00 0.00 2.47 2.53 0.00 84 I 7.81 4.94 1.89 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.57 1.10 0.00 0.00 85 C 8.52 4.40 0.00 2.96 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 86 L 8.13 4.59 0.00 1.65 1.48 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 87 P 0.00 4.25 0.00 2.23 2.12 0.00 3.69 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 88 I 7.93 3.94 1.93 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 1.62 0.81 0.98 0.00 0.00 89 I 7.54 4.68 1.84 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.92 0.95 0.00 0.00 90 S 8.45 4.40 0.00 3.99 4.05 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 91 S 8.86 4.14 0.00 3.91 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 92 E 8.02 4.01 0.00 1.95 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 2.33 2.41 0.00 93 N 7.62 4.67 0.00 3.07 2.90 0.00 0.00 7.10 7.55 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 94 W 8.29 4.52 0.00 3.43 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 95 K 7.35 4.16 0.00 1.40 1.33 0.00 1.68 0.00 0.00 1.78 0.00 0.00 2.75 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.27 1.26 7.81 96 P 0.00 4.47 0.00 1.97 2.20 0.00 3.52 0.00 0.00 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.36 0.00 97 C 7.45 4.27 0.00 2.99 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 T 7.38 4.00 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 1.37 0.00 0.00 99 K 9.53 4.66 0.00 1.93 1.85 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.49 1.52 7.81 100 T 9.45 4.09 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 1.24 0.00 0.00 101 C 8.37 4.25 0.00 3.25 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 0.00 102 Q 8.16 4.02 0.00 2.40 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.88 0.00 0.00 0.00 0.00 0.00 2.50 2.49 0.00 103 V 7.84 3.68 2.31 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 1.01 0.00 0.00 1.18 0.00 0.00 104 L 8.34 4.13 0.00 2.02 1.92 1.15 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 105 E 8.94 4.10 0.00 2.17 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 2.34 2.20 0.00 106 A 8.14 4.01 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 0.00 107 L 8.02 3.86 0.00 1.77 1.84 0.95 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 108 N 8.23 4.10 0.00 2.39 2.43 0.00 0.00 6.87 7.74 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 0.00 109 V 7.69 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 0.91 0.00 0.00 0.91 0.00 0.00 110 L 7.80 3.84 0.00 1.85 1.75 0.95 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.67 3.42 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 0.53 0.00 0.00 0.88 0.00 0.00 112 N 8.24 4.73 0.00 2.75 2.87 0.00 0.00 6.92 7.32 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 0.00 113 R 8.29 4.46 0.00 1.69 1.83 0.00 3.34 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.68 0.00 114 P 0.00 4.16 0.00 1.89 1.85 0.00 3.60 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 1.86 1.96 0.00 115 N 8.46 4.63 0.00 2.65 2.92 0.00 0.00 7.08 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 I 8.10 3.96 1.81 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 1.35 0.54 0.81 0.00 0.00 117 R 8.26 4.04 0.00 1.95 2.01 0.00 3.13 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 118 E 7.94 4.63 0.00 1.91 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 0.00 2.21 2.23 0.00 119 P 0.00 4.92 0.00 2.27 2.11 0.00 3.34 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 1.90 0.00 120 L 8.44 3.99 0.00 1.78 1.72 0.97 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 121 R 8.17 4.41 0.00 1.68 1.75 0.00 3.06 0.00 0.00 3.17 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.48 0.00 122 M 8.61 4.00 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.63 0.00 123 D 8.18 4.41 0.00 2.86 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 0.00 124 L 7.87 4.10 0.00 1.77 1.76 0.51 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 125 A 7.83 3.85 1.32 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 0.00 0.00 126 D 8.59 4.28 0.00 2.80 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 0.00 127 L 8.42 3.99 0.00 1.92 2.06 1.01 0.75 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 0.00 128 L 7.55 3.74 0.00 1.03 1.57 0.38 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 129 T 7.65 3.99 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 1.18 0.00 0.00 130 Q 8.22 4.41 0.00 2.09 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 7.10 0.00 0.00 0.00 0.00 0.00 2.51 2.50 0.00 131 N 8.75 4.96 0.00 2.64 2.67 0.00 0.00 7.20 7.88 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 0.00 132 P 0.00 4.31 0.00 2.22 2.09 0.00 3.67 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.26 0.00 133 E 8.21 3.99 0.00 2.10 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 2.39 2.44 0.00 134 L 8.36 3.96 0.00 1.91 1.86 0.92 0.71 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 0.00 135 F 8.45 4.03 0.00 3.30 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 0.00 136 R 8.22 3.84 0.00 2.31 2.08 0.00 3.17 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 137 K 7.96 3.92 0.00 1.98 1.77 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.61 7.81 138 N 7.97 3.89 0.00 2.47 1.66 0.00 0.00 6.94 7.37 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 0.00 139 A 7.94 3.71 1.04 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 0.00 140 E 7.98 3.76 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 2.25 2.27 0.00 141 E 7.89 3.82 0.00 2.02 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 0.00 2.20 2.23 0.00 142 F 7.92 3.83 0.00 3.20 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 0.00 143 T 8.73 4.18 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 144 L 8.01 3.81 0.00 1.62 1.65 0.87 0.77 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 0.00 145 R 7.80 3.68 0.00 1.44 1.38 0.00 2.80 0.00 0.00 2.57 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.89 0.00 146 F 7.67 4.86 0.00 3.08 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 0.00 147 G 8.42 3.53 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 0.00 0.00 0.00 148 V 7.86 3.93 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 0.98 0.00 0.00 0.91 0.00 0.00 149 D 8.61 4.66 0.00 2.58 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 0.00 150 R 8.39 4.17 0.00 2.01 1.83 0.00 3.37 0.00 0.00 3.50 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.75 0.00 151 P 0.00 4.43 0.00 2.10 1.99 0.00 3.79 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.11 0.00