NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 K 4.2937 8.3149 121.7954 55.8116 33.3059 175.6477 7 L 4.2366 8.4818 126.2095 53.2810 42.3205 174.7079 8 H 5.0201 9.2690 116.7001 53.6853 32.3735 172.7967 9 K 4.5914 8.5015 121.3665 56.1026 33.2248 176.0237 10 E 4.9862 9.0258 122.6668 53.7919 33.5571 173.7870 11 P 5.0464 0.0000 0.0000 63.1630 32.5625 174.8332 12 A 4.9370 8.3843 121.5193 51.3687 23.1015 175.5854 13 T 4.6395 8.4784 114.6367 61.3324 72.4324 173.8490 14 L 4.2117 8.7068 128.2359 55.8878 42.3286 175.5908 15 I 4.3545 8.4465 126.0050 62.3158 38.9841 175.9004 16 K 4.5121 8.1764 121.1497 55.3062 36.1045 174.1274 17 A 4.4839 8.7228 130.9031 52.0259 19.3017 176.7903 18 I 4.2207 8.3508 124.3185 62.9690 38.9070 175.2674 19 D 5.0620 6.9594 116.5464 53.7810 41.3585 175.1917 20 G 3.9674 9.3247 106.5362 48.3076 0.0000 173.7216 21 D 4.9769 8.4049 116.2465 52.6774 41.7448 175.2099 22 T 5.2509 8.0716 115.0289 62.0921 71.9447 172.9607 23 L 5.0976 9.4383 125.3426 54.0691 44.9392 174.7637 24 K 5.0127 9.3671 121.8894 55.0366 33.8798 175.1028 25 L 5.2380 8.9965 126.7615 52.9893 46.4081 175.7130 26 M 4.8048 9.2692 122.3238 55.2047 33.2533 174.3889 27 Y 4.9181 9.1296 128.4894 55.9139 41.9955 175.6085 28 K 3.5399 9.2543 127.7377 57.4887 29.6163 175.9598 29 G 3.9987 8.2029 103.9218 45.4986 0.0000 172.9425 30 Q 4.8852 7.6926 118.7497 53.0964 32.4121 173.1619 31 P 5.0877 0.0000 0.0000 63.2175 32.5120 175.4954 32 M 4.9797 9.3458 121.8638 54.0148 37.0091 174.3566 33 T 4.7577 8.5209 118.8000 63.3211 70.4257 173.6164 34 F 5.1299 10.2336 124.8180 55.5843 42.5007 173.9947 35 R 5.0398 8.9041 123.1405 54.2919 32.4607 174.9223 36 L 4.5227 8.7161 127.4055 54.4298 41.8283 177.1569 37 L 3.9287 8.6045 124.8946 56.0007 42.6420 178.4134 38 L 3.9274 9.0172 120.9278 54.9645 39.5094 174.0914 39 V 5.0105 7.3614 109.9376 59.5399 35.6913 174.8497 40 D 5.1362 9.2818 124.1242 52.9375 42.9163 175.9063 41 T 4.6893 8.5683 114.0324 59.3876 71.5389 172.8282 42 P 4.4432 0.0000 0.0000 62.3952 32.2111 175.7189 43 E 4.3460 10.2933 123.3541 55.7538 30.5003 177.0393 44 T 3.7622 8.3750 113.1686 61.7555 70.6592 174.9932 45 K 4.5510 8.8107 122.8803 55.7965 32.7282 176.2326 46 H 4.4571 8.5195 120.5367 54.9827 30.4480 173.9827 47 P 4.2833 0.0000 0.0000 65.3365 31.5533 177.3429 48 K 3.9579 7.5560 117.7754 58.5255 32.3308 177.7590 49 K 4.1170 8.7190 121.9332 56.9038 34.7006 177.5708 50 G 3.9024 8.0021 104.7855 44.3974 0.0000 175.9398 51 V 4.4327 8.3326 129.4267 61.4155 31.7465 174.0052 52 E 4.3464 9.5826 129.6021 55.3163 31.3884 176.3688 53 K 4.1149 8.2367 120.7255 57.9206 32.3348 177.5733 54 Y 4.3739 8.1769 121.1733 59.3719 35.8440 171.1544 55 G 3.7045 8.1399 107.9572 47.5122 0.0000 174.3489 56 P 4.3191 0.0000 0.0000 64.7892 31.4794 178.5945 57 E 3.9957 8.2334 116.8558 59.5770 29.5310 179.1904 58 A 4.0430 8.3928 120.9969 55.0124 18.3468 179.6953 59 S 4.1307 8.0925 111.7455 61.5547 62.4160 176.2890 60 A 4.0627 8.3409 123.7028 54.8091 18.0496 179.4362 61 F 3.9581 8.3769 119.2994 61.8420 39.4602 177.4688 62 T 3.9375 8.2475 115.3787 66.4729 68.1881 176.4624 63 K 3.8932 8.0477 121.4351 59.5193 32.2500 179.0440 64 K 3.9083 8.2418 118.9547 59.6137 31.7565 178.9482 65 M 3.8385 7.6641 117.2620 58.7042 32.2199 177.9872 66 L 4.1308 8.1463 119.2435 57.7493 41.6651 179.2214 67 E 4.0735 8.4573 117.7433 58.4465 29.4647 177.9626 68 N 4.6825 7.8963 114.1993 52.0769 39.3438 174.9140 69 A 4.5219 7.0290 124.1830 51.4199 19.5940 178.3760 70 K 4.1806 9.3032 121.8078 58.8011 32.5254 178.2334 71 K 4.7090 8.9552 117.7647 54.5144 36.4582 175.5664 72 L 5.2716 8.5509 123.5631 53.1538 44.8087 175.2402 73 E 5.1222 9.0324 121.0345 54.7961 34.2998 174.7318 74 V 4.6251 9.0672 116.1909 59.5357 34.7621 174.6471 75 E 4.9577 9.0107 125.3963 54.2793 31.9515 174.9682 76 F 4.6297 8.7501 125.9293 57.7064 39.9166 176.0431 77 D 4.9720 8.5172 121.5829 53.8061 43.1582 175.5774 78 K 4.3439 9.0210 116.3272 58.0875 33.2347 178.0327 79 G 4.1149 8.7865 112.5359 44.6481 0.0000 173.3098 80 Q 4.0375 8.6866 121.3240 56.9034 29.3193 176.5906 81 R 4.7168 8.4756 119.2840 56.5156 31.7509 175.7958 82 T 5.1977 7.6816 108.3710 59.8572 72.2361 173.4812 83 D 4.8988 8.6978 123.7503 51.8070 41.9096 177.1228 84 K 3.7986 8.5527 116.6774 59.8043 32.4718 177.2214 85 Y 4.2380 7.8993 115.1571 58.1549 38.0803 176.1375 86 G 3.9315 8.3713 108.8133 45.1556 0.0000 173.6252 87 R 4.3533 8.3710 119.8704 54.9204 31.6050 176.5257 88 G 3.3562 8.2690 111.1662 46.2841 0.0000 172.3225 89 L 5.3676 8.8391 123.4597 53.0428 43.6777 175.6193 90 A 4.3845 8.3380 124.2074 51.1915 23.6654 173.8968 91 Y 4.8590 8.7738 117.4222 57.1066 39.7516 175.2884 92 I 4.7616 8.6430 124.9937 59.7103 40.1366 174.1071 93 Y 5.0719 9.2430 124.0735 56.0759 40.8763 174.5230 94 A 4.7890 9.2736 126.2598 50.0539 21.1467 176.3979 95 D 4.2672 9.7639 125.4717 56.0842 39.0065 175.4787 96 G 3.9803 8.3481 104.4833 45.3442 0.0000 173.1536 97 K 4.5391 8.0428 120.5215 54.6598 33.9289 175.3480 98 M 4.0062 8.5152 123.2717 54.9367 33.0149 176.8660 99 V 3.6247 8.6137 127.4832 66.3532 31.4760 177.7319 100 N 4.3481 7.9582 115.6360 56.2667 38.3571 176.8850 101 E 3.8697 8.0474 120.0887 58.9610 29.8213 178.3290 102 A 4.0164 8.0865 120.9099 55.2373 18.3765 179.5337 103 L 3.5059 7.9204 117.3442 57.8911 41.7359 180.0516 104 V 3.7184 7.4379 117.8694 66.0324 31.2748 178.0014 105 R 3.9403 8.4942 117.8951 59.2426 29.9380 177.5262 106 Q 4.3244 7.7671 115.2365 55.0547 28.9790 176.0462 107 G 3.9095 8.0060 108.4542 46.7794 0.0000 174.8279 108 L 4.3413 7.7599 116.7044 53.7599 42.2607 176.0883 109 A 4.6182 7.4743 118.5870 51.0852 22.1017 176.2014 110 K 4.9031 8.5033 118.9593 54.4577 35.1643 176.2623 111 V 4.2261 9.1960 123.8711 62.7412 31.9593 175.8850 112 A 4.3213 8.9447 130.4685 51.6872 19.4849 176.1581 113 Y 3.7892 8.3568 120.3284 57.4175 39.3211 174.9636 114 V 3.7618 7.1630 126.7075 61.6955 32.9379 174.8686 115 Y 4.9118 7.9651 124.0058 55.7463 38.7426 175.3336 116 K 4.4530 8.6236 124.2782 56.2904 32.7258 175.0721 117 P 4.8037 0.0000 0.0000 63.1769 31.8681 177.0017 118 N 4.9151 7.9753 118.4312 52.3551 37.0100 175.3748 119 N 5.0768 7.7840 112.4497 53.5160 39.2534 177.3846 120 T 3.8360 8.3648 118.2148 67.3810 68.6671 174.8819 121 H 4.8570 7.9657 116.2280 55.6948 29.2804 176.3880 122 E 3.9405 8.2850 123.0552 59.8033 29.2274 179.0771 123 Q 3.9798 8.0076 117.3458 59.0127 28.8807 177.7162 124 H 4.1509 8.2766 118.8275 59.5780 29.7960 177.0630 125 L 3.9114 8.0904 120.5688 57.8767 41.4044 179.7892 126 R 3.9042 8.5502 118.3405 59.0199 29.9063 179.2516 127 K 3.9418 8.3000 118.6708 59.6583 32.0813 179.5986 128 S 4.1699 7.9644 115.3437 61.2990 62.7109 176.3532 129 E 3.9605 8.3339 122.2425 59.0503 29.3035 178.6606 130 A 3.7777 8.0722 121.0290 54.8488 18.3306 179.5195 131 Q 3.7682 7.8838 117.5346 59.3438 29.2448 178.0501 132 A 4.1051 7.9657 121.7364 55.1587 18.3111 179.8737 133 K 3.5686 7.7463 116.9493 59.2655 31.8432 179.4086 134 K 3.8667 7.9776 119.1443 59.2263 32.1566 177.7008 135 E 4.2883 8.4167 116.1748 55.2142 29.9323 176.1742 136 K 4.2424 7.7332 116.9044 56.2873 30.4795 175.6169 137 L 4.2411 8.1862 117.7489 55.7639 44.2143 179.1471 138 N 3.4869 9.3817 117.4822 54.0498 38.6585 176.1917 139 I 3.0922 4.0000 124.7841 64.9991 37.6733 176.9191 140 W 4.8739 8.0111 118.4041 56.7006 28.8013 176.7753 141 S 4.4324 8.0987 120.0917 58.4373 62.4691 173.7900 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 6 K 8.31 4.29 0.00 1.73 1.82 0.00 1.65 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.57 7.81 7 L 8.48 4.24 0.00 1.85 1.74 1.07 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 8 H 9.27 5.02 0.00 3.25 3.24 0.00 5.52 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 K 8.50 4.59 0.00 1.59 1.70 0.00 1.40 0.00 0.00 0.98 0.00 0.00 2.43 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.16 1.27 7.81 10 E 9.03 4.99 0.00 2.13 1.97 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 2.35 2.24 0.00 11 P 0.00 5.05 0.00 2.09 2.06 0.00 3.82 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 12 A 8.38 4.94 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 13 T 8.48 4.64 4.26 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 1.22 0.00 0.00 14 L 8.71 4.21 0.00 1.62 1.57 0.90 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 15 I 8.45 4.35 2.05 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.84 0.94 0.00 0.00 16 K 8.18 4.51 0.00 1.81 1.62 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.36 1.39 7.81 17 A 8.72 4.48 1.26 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 0.00 0.00 18 I 8.35 4.22 2.04 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 1.37 0.66 0.91 0.00 0.00 19 D 6.96 5.06 0.00 2.78 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 20 G 9.32 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 21 D 8.40 4.98 0.00 2.71 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 22 T 8.07 5.25 4.36 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 1.27 0.00 0.00 23 L 9.44 5.10 0.00 1.62 1.71 0.86 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 24 K 9.37 5.01 0.00 1.89 1.75 0.00 1.50 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.52 7.81 25 L 9.00 5.24 0.00 1.65 1.49 0.33 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 26 M 9.27 4.80 0.00 2.14 2.01 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 2.61 2.56 0.00 27 Y 9.13 4.92 0.00 3.16 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 28 K 9.25 3.54 0.00 1.57 1.57 0.00 1.63 0.00 0.00 1.52 0.00 0.00 2.70 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.34 0.21 7.81 29 G 8.20 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 30 Q 7.69 4.89 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.96 0.00 0.00 0.00 0.00 0.00 2.29 2.45 0.00 31 P 0.00 5.09 0.00 2.13 2.10 0.00 3.76 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.04 0.00 32 M 9.35 4.98 0.00 1.82 2.24 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.57 0.00 33 T 8.52 4.76 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 1.28 0.00 0.00 34 F 10.23 5.13 0.00 2.92 2.85 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 35 R 8.90 5.04 0.00 1.89 1.77 0.00 3.35 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.64 0.00 36 L 8.72 4.52 0.00 1.56 1.60 0.97 1.27 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 37 L 8.60 3.93 0.00 1.08 1.22 0.32 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 38 L 9.02 3.93 0.00 2.00 1.89 1.08 0.95 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 39 V 7.36 5.01 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 0.81 0.00 0.00 0.94 0.00 0.00 40 D 9.28 5.14 0.00 2.52 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 41 T 8.57 4.69 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 1.22 0.00 0.00 42 P 0.00 4.44 0.00 2.30 1.98 0.00 3.56 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 2.20 2.01 0.00 43 E 10.29 4.35 0.00 2.11 1.76 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 2.31 2.33 0.00 44 T 8.38 3.76 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 45 K 8.81 4.55 0.00 1.87 1.81 0.00 1.70 0.00 0.00 1.78 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.33 7.81 46 H 8.52 4.46 0.00 3.29 3.36 0.00 5.61 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.28 0.00 2.17 2.13 0.00 3.66 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.89 0.00 48 K 7.56 3.96 0.00 1.87 1.70 0.00 1.44 0.00 0.00 1.35 0.00 0.00 2.85 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.20 0.57 7.81 49 K 8.72 4.12 0.00 1.90 1.88 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.43 1.34 7.81 50 G 8.00 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 0.00 0.00 0.00 51 V 8.33 4.43 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 0.79 0.00 0.00 0.96 0.00 0.00 52 E 9.58 4.35 0.00 1.81 1.78 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 2.16 2.47 0.00 53 K 8.24 4.11 0.00 1.55 1.61 0.00 0.93 0.00 0.00 1.28 0.00 0.00 2.22 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.26 1.24 7.81 54 Y 8.18 4.37 0.00 3.12 3.02 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 0.00 0.00 0.00 55 G 8.14 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 P 0.00 4.32 0.00 2.16 2.11 0.00 3.58 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 2.08 2.16 0.00 57 E 8.23 4.00 0.00 2.39 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 0.00 2.60 2.53 0.00 58 A 8.39 4.04 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 59 S 8.09 4.13 0.00 4.18 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 60 A 8.34 4.06 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 61 F 8.38 3.96 0.00 3.21 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 62 T 8.25 3.94 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 K 8.05 3.89 0.00 1.92 2.04 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.48 7.81 64 K 8.24 3.91 0.00 1.67 1.75 0.00 1.81 0.00 0.00 1.49 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.55 7.81 65 M 7.66 3.84 0.00 1.87 1.70 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.51 0.00 66 L 8.15 4.13 0.00 1.69 1.66 0.91 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 67 E 8.46 4.07 0.00 1.92 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 2.33 2.60 0.00 68 N 7.90 4.68 0.00 2.76 2.80 0.00 0.00 6.96 6.96 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 69 A 7.03 4.52 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 70 K 9.30 4.18 0.00 1.95 1.88 0.00 1.64 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.47 1.52 7.81 71 K 8.96 4.71 0.00 1.61 1.64 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.39 7.81 72 L 8.55 5.27 0.00 1.73 1.50 0.91 0.94 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 73 E 9.03 5.12 0.00 1.94 1.78 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 2.22 2.27 0.00 74 V 9.07 4.63 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 0.77 0.00 0.00 75 E 9.01 4.96 0.00 2.28 2.33 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 2.48 2.39 0.00 76 F 8.75 4.63 0.00 3.07 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 77 D 8.52 4.97 0.00 2.68 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 78 K 9.02 4.34 0.00 1.97 1.89 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.45 7.81 79 G 8.79 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 Q 8.69 4.04 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.78 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 81 R 8.48 4.72 0.00 1.45 1.31 0.00 2.53 0.00 0.00 2.25 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.45 0.00 82 T 7.68 5.20 4.19 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 1.13 0.00 0.00 83 D 8.70 4.90 0.00 2.85 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 84 K 8.55 3.80 0.00 1.56 1.79 0.00 0.79 0.00 0.00 1.40 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.15 0.56 7.81 85 Y 7.90 4.24 0.00 3.19 3.02 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 0.00 0.00 0.00 86 G 8.37 3.93 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 0.00 0.00 0.00 87 R 8.37 4.35 0.00 2.13 1.82 0.00 3.14 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 88 G 8.27 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 0.00 0.00 0.00 89 L 8.84 5.37 0.00 1.54 1.59 0.96 0.61 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 90 A 8.34 4.38 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Y 8.77 4.86 0.00 2.98 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 I 8.64 4.76 1.77 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.78 0.86 0.00 0.00 93 Y 9.24 5.07 0.00 2.87 2.85 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 94 A 9.27 4.79 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 95 D 9.76 4.27 0.00 2.77 2.70 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 96 G 8.35 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 97 K 8.04 4.54 0.00 1.96 1.76 0.00 1.75 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.43 7.81 98 M 8.52 4.01 0.00 1.91 1.66 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 2.45 0.00 99 V 8.61 3.62 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 1.02 0.00 0.00 0.93 0.00 0.00 100 N 7.96 4.35 0.00 2.89 2.89 0.00 0.00 6.77 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 0.00 101 E 8.05 3.87 0.00 1.88 1.88 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 2.20 1.97 0.00 102 A 8.09 4.02 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 L 7.92 3.51 0.00 1.84 1.63 0.98 0.80 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 0.00 104 V 7.44 3.72 2.18 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 1.08 0.00 0.00 0.97 0.00 0.00 105 R 8.49 3.94 0.00 2.02 2.08 0.00 3.34 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 106 Q 7.77 4.32 0.00 1.60 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.40 0.00 0.00 0.00 0.00 0.00 2.40 2.12 0.00 107 G 8.01 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 0.00 108 L 7.76 4.34 0.00 1.29 1.46 0.39 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.47 4.62 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 0.00 110 K 8.50 4.90 0.00 1.75 1.82 0.00 1.57 0.00 0.00 1.60 0.00 0.00 3.20 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.50 1.20 7.81 111 V 9.20 4.23 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 0.75 0.00 0.00 0.95 0.00 0.00 112 A 8.94 4.32 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 0.00 113 Y 8.36 3.79 0.00 2.86 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 0.00 114 V 7.16 3.76 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 0.81 0.00 0.00 0.84 0.00 0.00 115 Y 7.97 4.91 0.00 3.11 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 K 8.62 4.45 0.00 1.80 1.80 0.00 1.76 0.00 0.00 1.79 0.00 0.00 3.02 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.48 1.50 7.81 117 P 0.00 4.80 0.00 2.21 2.16 0.00 3.80 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 1.97 2.00 0.00 118 N 7.98 4.92 0.00 3.00 2.87 0.00 0.00 6.63 7.27 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 0.00 119 N 7.78 5.08 0.00 2.90 2.96 0.00 0.00 6.10 7.22 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 0.00 120 T 8.36 3.84 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 1.13 0.00 0.00 121 H 7.97 4.86 0.00 2.90 3.13 0.00 5.63 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 E 8.28 3.94 0.00 2.21 1.96 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 2.29 2.34 0.00 123 Q 8.01 3.98 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.63 0.00 0.00 0.00 0.00 0.00 2.44 2.35 0.00 124 H 8.28 4.15 0.00 3.20 3.47 0.00 5.87 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 0.00 125 L 8.09 3.91 0.00 1.87 1.69 1.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 126 R 8.55 3.90 0.00 1.97 1.94 0.00 3.09 0.00 0.00 3.12 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 127 K 8.30 3.94 0.00 2.04 1.86 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.62 7.81 128 S 7.96 4.17 0.00 3.95 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 0.00 129 E 8.33 3.96 0.00 2.13 2.01 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 2.13 2.53 0.00 130 A 8.07 3.78 1.27 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 0.00 131 Q 7.88 3.77 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.71 0.00 0.00 0.00 0.00 0.00 2.33 2.50 0.00 132 A 7.97 4.11 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 0.00 133 K 7.75 3.57 0.00 1.47 1.23 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.37 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.30 0.71 7.81 134 K 7.98 3.87 0.00 1.70 1.92 0.00 1.77 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.59 7.81 135 E 8.42 4.29 0.00 1.94 1.97 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 2.30 2.49 0.00 136 K 7.73 4.24 0.00 1.94 1.94 0.00 1.68 0.00 0.00 1.58 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.55 1.51 7.81 137 L 8.19 4.24 0.00 1.76 1.65 0.97 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 138 N 9.38 3.49 0.00 2.51 1.42 0.00 0.00 7.05 7.21 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 0.00 139 I 4.00 3.09 1.17 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.24 -0.75 0.00 0.00 140 W 8.01 4.87 0.00 3.50 3.09 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 0.00 0.00 0.00 0.00 141 S 8.10 4.43 0.00 3.95 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00