NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.6659 8.2649 122.4702 52.2985 18.4861 176.4901 2 T 4.1329 8.1388 119.8016 62.2510 70.6768 174.1609 3 K 5.2524 9.0302 124.7193 54.7862 36.7263 174.5930 4 A 5.3871 9.0392 124.0189 50.6482 23.4865 175.0242 5 V 4.9841 8.9385 117.4616 60.8626 35.4493 173.4147 6 C 4.9792 9.1520 121.8803 57.9688 35.5976 172.5758 7 V 4.6175 8.4358 125.6599 61.3871 33.2773 174.1952 8 L 4.8439 8.9937 129.5175 53.7857 42.8766 176.0502 9 K 4.9328 9.0493 123.2876 54.9271 36.4511 176.4930 10 G 4.4374 8.0217 108.7785 44.3540 0.0000 171.7940 11 D 4.4827 8.8052 118.0257 56.6901 41.5805 177.2541 12 G 4.0669 7.6564 110.1288 44.5412 0.0000 171.5875 13 P 4.4114 0.0000 0.0000 63.7357 32.0915 176.2902 14 V 4.4264 7.8244 120.5199 62.3693 31.9534 174.9272 15 Q 4.8481 8.3897 124.3649 55.6268 32.1185 173.1433 16 G 4.3166 8.4793 106.4672 46.0256 0.0000 172.1039 17 I 5.1259 8.3655 120.0688 59.3928 40.8716 174.9590 18 I 4.6431 8.6382 127.5688 59.4436 40.1952 174.3183 19 N 4.9440 8.5048 124.7871 51.3807 41.0005 173.9942 20 F 5.4088 8.8687 120.3983 55.8461 43.1852 173.9418 21 E 5.2237 9.5165 122.7386 54.9684 33.5642 173.5188 22 Q 4.9549 9.2955 128.0746 54.3396 31.0386 176.0504 23 K 4.1792 8.9545 127.1385 58.7212 32.8249 177.2776 24 E 4.7924 7.7408 116.2967 54.1510 33.5945 174.6404 25 S 4.4290 8.5141 117.3597 59.8868 63.2667 175.1789 26 N 4.3097 9.0960 120.4744 53.5045 36.7322 174.3958 27 G 3.9056 7.5957 107.4000 44.4173 0.0000 171.2842 28 P 4.6621 0.0000 0.0000 62.2181 32.3797 175.9492 29 V 4.5300 9.4860 123.3750 61.3189 33.5681 174.4598 30 K 4.8536 9.3341 131.0615 55.9564 33.4325 175.5541 31 V 5.0117 9.0502 128.3048 59.6355 33.7559 174.7605 32 W 5.9573 7.9735 121.2100 54.8724 31.8531 175.3900 33 G 3.7824 7.7215 106.6406 46.3195 0.0000 170.5301 34 S 5.0641 7.8361 114.3576 56.7691 66.4080 174.3789 35 I 5.1501 8.8895 127.2016 59.3252 40.8482 174.6935 36 K 4.7892 9.1535 125.1163 55.4495 36.2511 176.7259 37 G 3.8807 8.8482 105.6130 45.7693 0.0000 173.0373 38 L 4.6221 7.6905 119.5248 52.3303 43.4572 176.4604 39 T 4.2557 8.2884 112.3439 61.3073 69.3076 173.7713 40 E 4.0964 8.5957 124.7950 58.0360 30.7462 176.7345 41 G 3.8789 8.8507 109.3769 44.0376 0.0000 171.8487 42 L 5.0642 8.0918 119.5293 54.1804 43.3589 176.2799 43 H 5.0589 9.4187 119.6578 53.6360 33.1857 173.2315 44 G 4.1174 9.0876 110.8567 47.0173 0.0000 172.3445 45 F 5.6388 9.3940 126.2349 56.8980 42.7234 173.3027 46 R 4.5706 8.4873 121.5789 55.2449 33.4781 173.7882 47 V 4.5952 8.6738 120.8906 61.7486 32.9917 175.4635 48 Q 4.6911 9.0933 127.3713 55.0044 30.3265 176.7102 49 E 3.7103 8.8375 122.5633 58.7957 29.9143 177.1408 50 F 5.0049 7.8283 116.8017 55.7880 41.3426 176.2411 51 G 4.2028 8.4242 113.0003 44.4737 0.0000 174.7831 52 D 4.7617 7.8781 117.6735 52.7547 42.3669 174.3946 53 N 5.3177 8.6852 124.4875 52.3700 39.2095 176.8992 54 T 3.9798 8.1981 111.4486 63.7499 69.2733 174.3201 55 A 4.7174 7.6923 124.9016 51.3725 19.9268 177.0850 56 G 3.7631 7.9767 111.8082 47.5216 0.0000 175.5455 57 C 4.2453 8.5383 116.4344 62.3744 28.0311 175.5561 58 T 4.0686 7.9600 110.7709 63.9779 68.4011 175.3891 59 S 4.5563 7.8693 114.1202 58.6644 64.0391 174.9228 60 A 4.4469 7.7482 123.4115 54.5302 18.6783 178.4160 61 G 4.1077 8.5147 104.5749 44.4450 0.0000 171.0714 62 P 4.6827 0.0000 0.0000 61.9241 33.6205 175.6294 63 H 4.5617 8.6225 117.0729 55.9022 29.4906 175.2633 64 F 4.2048 9.2161 125.3428 58.6018 40.1538 174.6566 65 N 4.9172 8.0515 125.5701 51.3347 38.8659 172.7834 66 P 4.1539 0.0000 0.0000 64.9620 32.1044 178.0542 67 L 4.3391 7.6299 116.7954 53.5786 42.0100 176.9956 68 S 3.5507 7.2108 112.3612 59.7142 60.2185 170.5341 69 R 4.5921 8.5537 120.3273 54.1133 33.1494 176.0831 70 K 4.4947 7.8413 117.5688 55.6430 33.9543 176.4577 71 H 3.9650 8.4517 122.7339 56.9247 30.3584 174.8840 72 G 4.1748 8.3668 111.3642 44.6130 0.0000 172.2264 73 G 4.0599 8.8482 108.5796 43.8326 0.0000 173.3892 74 P 4.3203 0.0000 0.0000 65.1255 31.3691 177.7378 75 K 4.2113 7.8808 116.6343 57.7186 32.5837 176.8964 76 D 4.5964 7.5012 118.6169 53.7399 41.5416 176.3281 77 E 3.9121 8.7296 122.8731 59.2886 29.9070 177.2373 78 E 4.2750 7.9950 122.4583 55.7779 28.7348 175.5353 79 R 4.8948 7.6410 117.9247 55.6018 32.4434 174.7329 80 H 4.4744 8.4760 115.7634 55.3560 29.4909 176.9716 81 V 3.4998 8.1796 121.9165 66.1968 31.5559 177.2079 82 G 3.8957 8.3658 105.1987 47.2525 0.0000 173.4679 83 D 5.0115 7.9861 120.8405 54.0502 40.2556 175.7410 84 L 4.4988 8.3110 121.5000 53.4519 42.4496 178.8965 85 G 3.9608 8.3475 107.5053 46.5838 0.0000 173.1939 86 N 5.6325 8.6794 120.9559 51.5745 41.7695 174.1351 87 V 4.4357 8.6907 114.0103 59.9317 35.6012 174.8413 88 T 5.0835 8.1876 118.0106 61.8307 71.4336 173.0299 89 A 4.7449 9.1185 129.7731 50.9312 20.5963 177.3104 90 D 5.0037 8.7554 122.4344 51.9591 41.2593 176.8543 91 K 3.7672 8.7661 119.4363 60.0982 31.7862 177.2820 92 D 4.4506 8.0742 114.7674 55.1128 41.1759 176.9378 93 G 4.3183 8.7257 108.7064 44.4077 0.0000 172.4489 94 V 4.7723 8.1657 120.0842 60.8757 33.5014 174.4363 95 A 5.0918 8.8837 130.9602 50.0722 20.4384 175.7855 96 D 4.9090 8.5940 123.6568 53.4226 40.9917 176.1522 97 V 3.6526 8.5054 124.6615 62.6337 32.9101 175.0496 98 S 4.7099 8.4306 122.6442 57.5529 64.4726 172.8193 99 I 4.7992 9.2002 128.4206 59.3650 41.3501 174.2543 100 E 5.1771 8.8484 125.4148 54.5523 31.8418 174.3591 101 D 5.0163 9.3174 125.7281 52.8398 44.6256 175.7897 102 S 4.6682 8.8005 118.1356 58.3678 64.6522 176.2327 103 V 3.7541 8.0108 120.4100 65.0760 31.7116 176.4548 104 I 4.2075 8.1091 112.2188 60.7067 38.6068 174.7783 105 S 4.6771 8.4531 114.6982 57.3437 65.4880 174.0989 106 L 4.4554 8.8846 123.6358 54.2070 41.4510 176.2659 107 S 4.4894 7.9295 112.5975 58.3299 66.0335 175.5260 108 G 3.8561 8.4842 107.5202 45.5763 0.0000 173.9299 109 D 4.5568 8.7249 117.7850 56.6249 41.4212 176.7054 110 H 5.0786 8.1089 115.4935 55.5070 29.0463 173.8883 111 C 4.5824 7.7850 120.2765 59.6470 31.8309 173.4280 112 I 3.9363 8.0169 118.5154 60.2358 38.2291 175.5596 113 I 3.6848 7.3415 123.1410 63.0283 37.5065 176.1692 114 G 3.7990 9.3601 113.6612 45.3159 0.0000 172.5800 115 R 4.9594 7.5537 118.7057 54.5795 33.8110 174.5584 116 T 4.8784 7.9276 116.3694 62.1268 70.6727 173.9979 117 L 4.8631 8.7305 129.0834 53.6760 44.3285 175.5298 118 V 5.0613 8.5049 124.3934 60.0173 35.2686 174.2270 119 V 5.1141 8.7042 122.2250 60.4898 34.2150 174.3106 120 H 5.4828 8.8578 119.9155 53.8375 31.2411 174.2996 121 E 4.2844 9.1138 118.3905 58.6786 30.2516 176.6469 122 K 4.7623 8.4965 118.3490 53.5601 36.4783 175.7971 123 A 4.4014 8.3159 123.4752 52.1089 18.8742 176.4496 124 D 4.7386 9.6409 122.7981 54.1247 41.2412 176.1517 125 D 4.5366 9.3340 125.9163 53.3469 39.8234 176.8977 126 L 3.4224 9.4638 119.1416 56.0754 39.4867 175.3953 127 G 3.9529 8.5425 104.6303 45.7359 0.0000 174.7910 128 K 4.4969 7.8418 116.3577 55.9668 32.3612 177.4512 129 G 3.6936 8.1503 108.4263 45.3806 0.0000 175.0668 130 G 3.8867 8.3476 107.4471 46.0653 0.0000 172.5388 131 N 5.0935 7.7294 115.0896 50.2015 40.9229 173.9141 132 E 4.0406 8.7539 118.4929 59.3148 30.0284 178.4215 133 E 4.0225 8.2072 118.7686 59.0446 29.2860 178.2302 134 S 4.0999 8.6760 114.0369 61.5044 62.4194 175.5385 135 T 4.4458 7.4901 108.4622 61.7692 68.5784 175.8485 136 K 4.1768 7.6645 120.6252 58.3027 33.2331 177.3760 137 T 4.1618 8.3039 105.0895 60.1528 70.2839 174.8920 138 G 3.7914 7.8547 110.3460 45.1887 0.0000 173.3148 139 N 4.1722 7.4826 113.5758 54.1746 36.5813 174.6884 140 A 4.5656 7.3580 117.2445 51.1092 19.7189 179.5789 141 G 3.9093 7.9038 104.8068 45.3720 0.0000 173.7387 142 S 4.3424 8.6971 116.0419 58.7911 64.2854 174.3121 143 R 4.0644 8.4804 122.4095 56.3834 29.4831 176.3357 144 L 4.4585 8.9473 124.5459 56.6873 43.6142 176.6718 145 A 4.8119 7.6825 117.5880 51.2887 22.6898 175.0424 146 C 5.0241 8.8221 114.7905 57.6014 33.9835 172.5547 147 G 4.5804 8.4514 104.3510 46.3909 0.0000 172.6300 148 V 4.4788 8.2826 120.4760 61.9490 32.8927 175.4459 149 I 4.1435 8.6708 129.2481 60.9868 37.9991 175.3177 150 G 4.4373 9.1505 114.7730 43.8867 0.0000 172.3303 151 I 4.4084 8.3311 121.7573 61.2805 37.6168 175.4836 152 A 4.7876 8.3972 127.8634 49.8259 22.1569 176.2873 153 Q 4.0834 8.4726 118.6348 56.4417 29.2264 175.6798 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 A 8.26 4.67 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 2 T 8.14 4.13 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 3 K 9.03 5.25 0.00 1.72 1.73 0.00 1.70 0.00 0.00 2.06 0.00 0.00 2.93 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.56 1.50 7.81 4 A 9.04 5.39 1.11 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 5 V 8.94 4.98 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 0.69 0.00 0.00 0.93 0.00 0.00 6 C 9.15 4.98 0.00 3.15 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 7 V 8.44 4.62 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 0.94 0.00 0.00 0.92 0.00 0.00 8 L 8.99 4.84 0.00 1.71 1.62 1.06 0.48 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 9 K 9.05 4.93 0.00 1.67 1.64 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.35 7.81 10 G 8.02 4.44 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 0.00 0.00 0.00 11 D 8.81 4.48 0.00 2.68 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 12 G 7.66 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 0.00 0.00 0.00 13 P 0.00 4.41 0.00 2.19 2.17 0.00 3.77 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 2.13 1.94 0.00 14 V 7.82 4.43 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 1.11 0.00 0.00 0.93 0.00 0.00 15 Q 8.39 4.85 0.00 2.18 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.49 0.00 0.00 0.00 0.00 0.00 2.47 2.36 0.00 16 G 8.48 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 0.00 0.00 0.00 0.00 17 I 8.37 5.13 1.81 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.63 0.81 0.00 0.00 18 I 8.64 4.64 1.83 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.22 0.47 0.00 0.00 19 N 8.50 4.94 0.00 1.44 1.43 0.00 0.00 6.37 7.51 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 20 F 8.87 5.41 0.00 2.93 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 21 E 9.52 5.22 0.00 2.55 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 2.33 2.43 0.00 22 Q 9.30 4.95 0.00 2.20 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.58 0.00 0.00 0.00 0.00 0.00 2.49 2.52 0.00 23 K 8.95 4.18 0.00 1.81 1.88 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.47 1.49 7.81 24 E 7.74 4.79 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 2.30 2.27 0.00 25 S 8.51 4.43 0.00 3.87 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 26 N 9.10 4.31 0.00 2.89 2.98 0.00 0.00 7.02 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 G 7.60 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 28 P 0.00 4.66 0.00 2.13 2.10 0.00 3.38 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.83 0.00 29 V 9.49 4.53 2.24 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 1.24 0.00 0.00 1.07 0.00 0.00 30 K 9.33 4.85 0.00 1.93 1.97 0.00 1.54 0.00 0.00 1.48 0.00 0.00 2.62 0.00 0.00 2.49 0.00 0.00 0.00 0.00 1.66 1.45 7.81 31 V 9.05 5.01 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 1.07 0.00 0.00 0.91 0.00 0.00 32 W 7.97 5.96 0.00 3.44 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 33 G 7.72 3.78 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 34 S 7.84 5.06 0.00 3.87 3.62 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.89 5.15 1.81 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.50 0.90 0.00 0.00 36 K 9.15 4.79 0.00 1.74 1.88 0.00 1.33 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.45 1.34 7.81 37 G 8.85 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 0.00 0.00 0.00 38 L 7.69 4.62 0.00 1.95 1.50 0.79 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.29 4.26 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 1.24 0.00 0.00 40 E 8.60 4.10 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.47 0.00 41 G 8.85 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 0.00 0.00 0.00 42 L 8.09 5.06 0.00 1.51 1.59 0.92 0.93 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 43 H 9.42 5.06 0.00 3.00 3.35 0.00 5.63 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 44 G 9.09 4.12 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 0.00 0.00 0.00 45 F 9.39 5.64 0.00 3.07 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 46 R 8.49 4.57 0.00 1.93 1.90 0.00 3.01 0.00 0.00 3.13 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.30 0.00 47 V 8.67 4.60 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 0.78 0.00 0.00 0.86 0.00 0.00 48 Q 9.09 4.69 0.00 1.96 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.29 0.00 49 E 8.84 3.71 0.00 1.77 1.12 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 1.51 2.19 0.00 50 F 7.83 5.00 0.00 3.09 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 51 G 8.42 4.20 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 0.00 0.00 0.00 52 D 7.88 4.76 0.00 2.62 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 53 N 8.69 5.32 0.00 2.72 2.78 0.00 0.00 7.30 7.54 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 54 T 8.20 3.98 4.23 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 1.23 0.00 0.00 55 A 7.69 4.72 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 56 G 7.98 3.76 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 0.00 0.00 0.00 57 C 8.54 4.25 0.00 2.97 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 58 T 7.96 4.07 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 59 S 7.87 4.56 0.00 4.15 4.02 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 60 A 7.75 4.45 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 0.00 0.00 0.00 0.00 0.00 0.00 61 G 8.51 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 62 P 0.00 4.68 0.00 2.06 2.17 0.00 3.65 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.99 0.00 63 H 8.62 4.56 0.00 2.93 3.30 0.00 5.73 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 64 F 9.22 4.20 0.00 2.86 2.97 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 65 N 8.05 4.92 0.00 2.60 2.44 0.00 0.00 6.91 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 66 P 0.00 4.15 0.00 2.07 2.01 0.00 3.03 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.28 0.00 67 L 7.63 4.34 0.00 1.57 1.67 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.21 3.55 0.00 3.88 3.82 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 69 R 8.55 4.59 0.00 1.84 2.05 0.00 3.55 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.81 0.00 70 K 7.84 4.49 0.00 1.58 1.70 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.78 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.38 7.81 71 H 8.45 3.97 0.00 3.27 3.20 0.00 5.91 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 G 8.37 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.85 4.06 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 0.00 0.00 0.00 74 P 0.00 4.32 0.00 2.23 2.38 0.00 3.77 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.04 0.00 75 K 7.88 4.21 0.00 1.77 1.90 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.47 7.81 76 D 7.50 4.60 0.00 2.81 2.57 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 77 E 8.73 3.91 0.00 1.90 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 2.28 2.38 0.00 78 E 8.00 4.27 0.00 2.01 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 0.00 2.36 2.22 0.00 79 R 7.64 4.89 0.00 1.93 1.90 0.00 2.84 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 80 H 8.48 4.47 0.00 3.46 3.42 0.00 5.65 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.18 3.50 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 0.83 0.00 0.00 0.52 0.00 0.00 82 G 8.37 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 83 D 7.99 5.01 0.00 2.74 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 84 L 8.31 4.50 0.00 1.84 1.94 0.93 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.35 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 0.00 0.00 0.00 86 N 8.68 5.63 0.00 2.61 2.74 0.00 0.00 6.58 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 87 V 8.69 4.44 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 -0.08 0.00 0.00 0.88 0.00 0.00 88 T 8.19 5.08 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 1.21 0.00 0.00 89 A 9.12 4.74 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 90 D 8.76 5.00 0.00 2.91 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 91 K 8.77 3.77 0.00 1.73 1.90 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.43 1.49 7.81 92 D 8.07 4.45 0.00 2.82 2.69 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 0.00 0.00 0.00 0.00 93 G 8.73 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 0.00 0.00 0.00 0.00 94 V 8.17 4.77 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 0.96 0.00 0.00 0.92 0.00 0.00 95 A 8.88 5.09 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 96 D 8.59 4.91 0.00 2.56 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 97 V 8.51 3.65 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 0.54 0.00 0.00 0.62 0.00 0.00 98 S 8.43 4.71 0.00 3.90 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 99 I 9.20 4.80 1.98 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.64 1.02 0.00 0.00 100 E 8.85 5.18 0.00 1.96 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.31 0.00 101 D 9.32 5.02 0.00 2.88 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 0.00 102 S 8.80 4.67 0.00 3.91 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 0.00 103 V 8.01 3.75 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 0.84 0.00 0.00 0.95 0.00 0.00 104 I 8.11 4.21 1.95 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.82 1.05 0.00 0.00 105 S 8.45 4.68 0.00 3.82 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 0.00 106 L 8.88 4.46 0.00 1.78 1.64 1.04 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.93 4.49 0.00 3.90 3.80 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 0.00 108 G 8.48 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 109 D 8.72 4.56 0.00 2.75 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 0.00 110 H 8.11 5.08 0.00 3.23 3.45 0.00 5.64 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 C 7.79 4.58 0.00 3.12 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 0.00 112 I 8.02 3.94 1.61 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.26 0.91 0.00 0.00 113 I 7.34 3.68 1.77 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 1.19 0.35 0.88 0.00 0.00 114 G 9.36 3.80 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 0.00 0.00 0.00 115 R 7.55 4.96 0.00 1.55 1.79 0.00 2.21 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.30 0.00 116 T 7.93 4.88 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 1.25 0.00 0.00 117 L 8.73 4.86 0.00 1.74 1.51 0.39 1.15 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 0.00 118 V 8.50 5.06 2.13 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 0.81 0.00 0.00 0.93 0.00 0.00 119 V 8.70 5.11 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 0.83 0.00 0.00 1.09 0.00 0.00 120 H 8.86 5.48 0.00 3.23 3.56 0.00 5.65 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.11 4.28 0.00 2.03 2.13 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 2.51 2.33 0.00 122 K 8.50 4.76 0.00 1.71 1.72 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.83 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.34 1.37 7.81 123 A 8.32 4.40 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 0.00 124 D 9.64 4.74 0.00 2.67 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 0.00 125 D 9.33 4.54 0.00 2.90 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 0.00 126 L 9.46 3.42 0.00 1.80 1.79 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.54 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 0.00 128 K 7.84 4.50 0.00 1.86 1.81 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.80 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.34 7.81 129 G 8.15 3.69 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 G 8.35 3.89 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 0.00 131 N 7.73 5.09 0.00 2.76 2.76 0.00 0.00 6.16 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 0.00 132 E 8.75 4.04 0.00 2.02 1.98 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 2.37 2.30 0.00 133 E 8.21 4.02 0.00 2.11 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.40 0.00 134 S 8.68 4.10 0.00 4.05 4.04 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 0.00 135 T 7.49 4.45 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 1.22 0.00 0.00 136 K 7.66 4.18 0.00 1.89 1.84 0.00 1.68 0.00 0.00 1.85 0.00 0.00 3.12 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.35 1.39 7.81 137 T 8.30 4.16 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 1.16 0.00 0.00 138 G 7.85 3.79 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 0.00 0.00 0.00 139 N 7.48 4.17 0.00 3.04 2.89 0.00 0.00 6.81 7.01 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 0.00 140 A 7.36 4.57 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 0.00 141 G 7.90 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 0.00 142 S 8.70 4.34 0.00 3.81 3.82 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 0.00 143 R 8.48 4.06 0.00 1.66 1.80 0.00 3.20 0.00 0.00 3.21 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.64 0.00 144 L 8.95 4.46 0.00 1.73 1.70 0.94 0.70 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 0.00 145 A 7.68 4.81 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 0.00 146 C 8.82 5.02 0.00 3.08 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 0.00 147 G 8.45 4.58 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 0.00 0.00 0.00 148 V 8.28 4.48 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 0.77 0.00 0.00 0.91 0.00 0.00 149 I 8.67 4.14 1.79 0.00 0.00 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 1.03 0.46 0.43 0.00 0.00 150 G 9.15 4.44 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 0.00 0.00 0.00 151 I 8.33 4.41 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.54 0.91 0.00 0.00 152 A 8.40 4.79 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 0.00 153 Q 8.47 4.08 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.76 6.60 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00