NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1C H 4.7463 8.4449 117.8359 56.2697 29.9880 172.8508 1D H 4.7323 8.6743 118.6611 55.5065 29.5189 172.7343 1E H 5.0911 7.5837 115.9365 53.6325 33.4650 172.1551 1F H 4.6059 8.9349 117.2137 56.0194 28.9331 174.2978 1G F 4.8438 8.4039 119.5344 57.8139 39.8734 174.2851 2 N 4.6452 8.4841 117.4232 52.3595 39.0033 174.5954 3 L 4.8037 8.0579 123.3122 51.9542 44.1558 174.6760 4 P 4.5126 0.0000 0.0000 61.7167 32.3898 174.8529 5 P 4.4461 0.0000 0.0000 62.2451 33.5366 176.4865 6 G 4.0849 8.8090 102.3474 46.2837 0.0000 172.4078 7 N 4.3974 7.9316 115.2691 51.5175 40.0391 174.2580 8 Y 4.9007 7.9657 116.9016 58.2681 38.6936 176.7938 9 K 4.1016 8.6619 122.2178 58.8714 32.1979 177.2754 10 K 4.6851 7.6386 115.0991 53.3644 35.0644 173.6670 11 P 4.8567 0.0000 0.0000 63.1027 32.6298 174.7682 12 K 4.7034 9.2479 119.0150 56.2798 36.7057 174.2050 13 L 4.8701 9.1629 120.1924 53.2899 44.3069 176.5151 14 L 4.9871 8.5540 122.8623 53.5499 42.8114 174.4159 15 Y 4.6857 9.2934 126.9569 57.1121 40.2740 173.5499 16 C 4.0271 8.7345 129.1482 57.7829 32.2372 174.4449 17 S 3.8915 8.2073 122.0784 61.1089 62.6683 175.5359 18 N 4.1976 8.0067 118.9037 56.1335 38.6318 175.4576 19 G 3.8683 7.4679 101.7960 44.4423 0.0000 172.8887 20 G 3.3012 7.6951 107.2435 46.1603 0.0000 173.3385 21 H 4.6762 7.2706 115.6298 54.2383 31.2203 174.0889 22 F 5.2595 8.9702 120.5749 55.9334 40.6954 175.2906 23 L 4.6152 9.0404 126.1970 55.3967 43.2716 175.6134 24 R 4.9557 9.2889 126.0621 54.5869 33.6637 173.9179 25 I 4.6227 8.3152 126.2375 59.3833 39.1947 175.5979 26 A 4.1344 9.1903 130.9804 50.6786 19.1380 176.3738 27 P 4.1697 0.0000 0.0000 65.5775 31.4057 177.4178 28 D 4.5766 8.0382 115.0575 53.1743 39.5971 177.1966 29 G 4.0203 8.5240 108.9355 45.6808 0.0000 174.0036 30 T 4.2991 8.3572 117.5699 63.1425 69.1196 173.6559 31 V 4.8906 8.0464 124.4174 61.1887 34.3810 174.4586 32 D 4.5559 8.4616 125.8756 53.0088 42.7770 174.1501 33 G 4.5788 8.7340 104.9866 45.4266 0.0000 172.2340 34 T 4.9867 8.8364 114.3893 60.6007 71.0822 174.6328 35 R 4.3298 8.8320 124.0163 56.4981 31.1424 176.1831 36 D 4.6456 8.2658 119.5713 53.4059 40.6096 176.9509 37 R 3.8766 8.6053 126.6163 58.0455 30.3188 178.0454 38 S 4.2697 8.5496 112.3243 59.3297 63.6401 174.2694 39 D 4.3063 7.6546 121.2244 55.1998 41.0431 175.9949 40 Q 4.3640 8.6016 123.8836 56.8642 29.2359 175.7465 41 H 4.9412 9.1067 116.3192 55.5330 29.0980 175.5248 42 I 4.6296 7.2076 111.2649 59.7487 38.7574 175.3150 43 Q 4.2181 7.8922 121.9574 55.8460 29.7169 174.7564 44 L 5.2266 8.9199 124.5328 52.7992 45.4050 175.3612 45 Q 4.8404 9.1485 124.6330 54.5155 30.7372 174.5580 46 L 5.4699 8.8252 126.4618 53.3881 43.5586 176.1577 47 S 4.5592 8.1118 114.0250 56.9919 66.5803 172.5315 48 A 4.7110 8.4303 122.8739 52.4025 20.4908 175.0318 49 E 4.0495 8.9557 121.3928 56.7184 29.3095 178.4180 50 S 4.5791 5.8100 114.6503 56.8284 65.0756 173.6133 51 V 3.9149 8.1875 121.3919 64.6752 31.6464 176.2686 52 G 3.9163 9.1005 113.9167 45.5441 0.0000 171.9666 53 E 5.1837 8.1491 119.7905 54.5927 32.1044 175.6213 54 V 4.8883 8.9897 116.3784 59.9255 36.7616 173.9766 55 Y 5.2011 8.7492 119.8838 56.5609 41.1512 175.3140 56 I 4.4187 8.5914 122.0479 59.6654 40.4627 174.0282 57 K 4.6537 8.7982 129.3591 54.0495 34.9490 175.1410 58 S 4.4440 8.7560 123.0366 58.4771 62.5730 174.8864 59 T 3.7925 8.5419 118.9600 64.7742 68.7721 175.9714 60 E 4.0305 8.3888 122.4475 58.6152 29.8150 177.1652 61 T 4.3046 7.8783 105.9070 60.7326 70.0722 175.4926 62 G 3.7939 8.2494 110.1391 45.4073 0.0000 173.6922 63 Q 4.4718 7.4813 118.9908 55.8237 30.4470 174.4233 64 Y 4.8696 8.8123 118.9519 55.8557 40.9148 175.3294 65 L 4.3916 8.9515 125.8867 55.3985 43.4963 175.6116 66 A 5.1047 8.7804 125.9363 50.6516 23.2292 174.3546 67 M 5.4062 8.7024 119.2701 53.9080 34.9323 175.6217 68 D 5.1486 9.1895 126.4215 52.3827 41.2973 176.9952 69 T 4.1900 8.4968 108.2246 63.9835 68.7498 174.5627 70 D 4.6391 8.4061 120.6813 54.1111 41.4646 176.9659 71 G 3.1032 8.5921 108.6591 45.2137 0.0000 172.8666 72 L 4.7481 7.8773 119.6476 52.8708 43.1277 176.2121 73 L 5.0922 8.3029 122.5803 55.2868 42.7822 175.5316 74 Y 4.7967 8.7248 118.4028 56.2556 41.8452 173.2728 75 G 4.2317 8.9087 108.6916 45.3209 0.0000 173.2072 76 S 5.0372 9.1847 121.2644 56.7882 63.9891 175.3353 77 Q 4.2780 9.0365 125.1390 58.1573 28.9286 176.4417 78 T 4.6342 7.5767 106.2069 58.9161 71.5421 172.4364 79 P 3.8774 0.0000 0.0000 61.1874 30.4454 174.1558 80 N 5.2434 7.8089 124.7994 50.9619 40.0326 174.8442 81 E 3.9170 8.8070 114.6409 59.7595 29.7335 177.5634 82 E 4.1522 8.9486 118.1854 57.7095 29.7793 177.0316 83 C 5.0496 7.9629 115.6986 58.7047 29.3698 173.5875 84 L 4.3555 7.3191 120.4351 53.5749 43.0371 175.6362 85 F 5.1687 8.9513 121.5828 55.5548 43.5000 174.3164 86 L 4.8434 9.1119 122.5727 53.8051 42.6981 175.5330 87 E 4.4698 8.8170 126.8469 55.2885 30.2670 175.7550 88 R 4.8180 8.6558 125.6968 54.0205 34.7240 174.7482 89 L 4.6780 8.7308 124.2384 55.3155 43.1141 175.8159 90 E 4.6938 9.1665 124.6494 55.3251 33.6336 174.7806 91 E 4.0266 9.8440 123.1743 57.3729 27.3492 174.3118 92 N 4.3198 8.5050 111.1970 54.1742 36.3138 173.7321 93 H 4.7814 8.4321 118.0445 57.3146 37.7015 173.4880 94 Y 4.7371 7.7304 116.1486 57.2985 40.2407 173.8630 95 N 5.5168 9.7434 118.6179 52.0036 41.0317 174.6166 96 T 5.2357 8.9980 112.8357 60.1621 72.9291 172.8018 97 Y 4.9041 8.5311 118.6864 56.6141 41.5628 174.1701 98 I 4.5384 8.5443 126.0542 59.1901 39.5291 175.5656 99 S 4.0655 8.8802 122.1198 58.6978 62.3881 174.0713 100 K 3.9713 8.7354 129.2923 59.3500 32.2669 178.7327 101 K 3.8034 7.9079 118.2771 59.0225 32.2770 176.6735 102 H 4.8073 8.4029 114.5427 54.2273 29.5100 176.2444 103 A 3.9642 7.7791 125.9123 55.3140 18.5230 180.8215 104 E 4.0145 8.1063 112.8817 58.5146 29.8019 178.1539 105 K 4.1767 7.6806 117.4388 55.4832 32.8163 175.7712 106 N 3.9246 7.6299 115.8185 53.9459 36.5197 174.7975 107 W 5.0176 7.6876 117.4982 55.8255 30.9664 177.3584 108 F 5.3827 9.1805 124.1110 55.4815 41.0156 175.8257 109 V 3.9294 8.9183 121.8019 63.0993 32.5405 175.2290 110 G 4.4636 8.5749 112.5966 45.3140 0.0000 171.4999 111 L 5.2932 8.4461 121.4016 52.4276 45.3078 177.1588 112 K 4.2095 9.1075 123.1380 55.5287 32.8882 178.3874 113 K 3.9912 8.3960 119.3316 59.2043 31.9590 177.9331 114 N 4.5961 8.0947 114.3073 52.5440 37.5619 176.0015 115 G 3.4959 8.0825 108.4873 45.2163 0.0000 173.6967 116 S 4.8487 8.2268 115.4251 57.4343 64.9167 173.6198 117 C 4.7456 8.4364 116.3614 58.1774 30.4216 173.4065 118 K 4.3454 8.8284 121.0394 56.1175 33.0364 176.6945 119 R 4.3962 8.3409 120.8696 54.6480 31.8005 177.6514 120 G 3.2641 8.7335 112.8214 48.2786 0.0000 174.2064 121 P 4.3916 0.0000 0.0000 64.3768 31.4002 177.4153 122 R 4.4647 7.8453 115.8228 55.9275 30.2449 175.9996 123 T 5.1527 7.5381 108.2140 59.7193 70.8750 173.3709 124 H 4.7560 7.8916 114.7739 54.9469 30.5082 173.1396 125 Y 3.9085 8.8051 118.7136 60.0411 38.1221 176.9500 126 G 4.1134 9.0166 111.0273 45.6100 0.0000 174.0728 127 Q 4.2431 7.4365 118.4848 55.1723 29.8973 177.0705 128 K 3.8679 8.2870 119.0757 58.5210 32.8833 179.4037 129 A 3.9767 8.0160 121.1567 53.8946 18.3763 178.4370 130 I 4.4263 7.1991 106.1514 60.4341 38.4123 175.3682 131 L 4.3329 7.2758 122.8382 54.0855 42.3720 175.7947 132 F 5.4182 9.3727 122.7045 55.4743 43.3123 174.2520 133 L 5.1930 9.2520 122.5718 52.7624 45.1791 173.6783 134 P 5.0963 0.0000 0.0000 62.7915 31.7332 175.4240 135 L 4.8884 9.1517 126.1956 52.1636 44.0237 174.9056 136 P 4.6209 0.0000 0.0000 62.8862 32.3318 176.7434 137 V 3.7744 8.1717 113.3297 61.8107 31.6361 176.2576 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 1C H 8.44 4.75 0.00 3.11 3.45 0.00 5.66 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1D H 8.67 4.73 0.00 3.17 3.22 0.00 5.64 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E H 7.58 5.09 0.00 3.13 3.28 0.00 5.71 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1F H 8.93 4.61 0.00 3.32 3.40 0.00 5.66 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1G F 8.40 4.84 0.00 2.92 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 2 N 8.48 4.65 0.00 2.96 2.79 0.00 0.00 6.86 6.74 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 3 L 8.06 4.80 0.00 1.47 1.40 0.57 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.51 0.00 2.17 2.16 0.00 3.69 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.92 0.00 5 P 0.00 4.45 0.00 2.17 2.11 0.00 3.78 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 1.95 1.93 0.00 6 G 8.81 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 0.00 0.00 0.00 7 N 7.93 4.40 0.00 2.56 2.62 0.00 0.00 5.90 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 8 Y 7.97 4.90 0.00 3.04 3.21 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 9 K 8.66 4.10 0.00 1.83 1.90 0.00 1.64 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.50 1.56 7.81 10 K 7.64 4.69 0.00 1.72 1.70 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.39 7.81 11 P 0.00 4.86 0.00 2.06 2.06 0.00 3.79 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 1.98 1.96 0.00 12 K 9.25 4.70 0.00 1.98 1.96 0.00 1.36 0.00 0.00 1.90 0.00 0.00 2.96 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.38 1.51 7.81 13 L 9.16 4.87 0.00 1.72 1.71 0.39 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.55 4.99 0.00 1.60 1.67 0.33 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 15 Y 9.29 4.69 0.00 3.28 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 C 8.73 4.03 0.00 2.34 2.38 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 17 S 8.21 3.89 0.00 3.87 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 18 N 8.01 4.20 0.00 2.52 2.63 0.00 0.00 6.71 7.98 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 19 G 7.47 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 0.00 0.00 0.00 20 G 7.70 3.30 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 0.00 21 H 7.27 4.68 0.00 3.00 3.23 0.00 5.80 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 22 F 8.97 5.26 0.00 3.02 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 23 L 9.04 4.62 0.00 1.88 1.55 0.96 0.18 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 24 R 9.29 4.96 0.00 1.92 2.04 0.00 3.13 0.00 0.00 3.41 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.81 0.00 25 I 8.32 4.62 1.83 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.75 0.88 0.00 0.00 26 A 9.19 4.13 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 27 P 0.00 4.17 0.00 2.01 2.12 0.00 3.50 0.00 0.00 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.97 0.00 28 D 8.04 4.58 0.00 2.78 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 G 8.52 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 0.00 0.00 0.00 30 T 8.36 4.30 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 1.22 0.00 0.00 31 V 8.05 4.89 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.94 0.00 0.00 32 D 8.46 4.56 0.00 2.88 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 33 G 8.73 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 34 T 8.84 4.99 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 1.36 0.00 0.00 35 R 8.83 4.33 0.00 1.86 1.99 0.00 3.18 0.00 0.00 3.09 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.36 0.00 36 D 8.27 4.65 0.00 2.83 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 37 R 8.61 3.88 0.00 1.81 1.80 0.00 3.41 0.00 0.00 3.30 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.77 0.00 38 S 8.55 4.27 0.00 3.93 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 39 D 7.65 4.31 0.00 2.83 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 40 Q 8.60 4.36 0.00 1.90 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.25 0.00 0.00 0.00 0.00 0.00 2.28 2.25 0.00 41 H 9.11 4.94 0.00 3.31 3.47 0.00 5.76 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.21 4.63 1.91 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.96 1.05 0.00 0.00 43 Q 7.89 4.22 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.89 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 44 L 8.92 5.23 0.00 1.61 1.44 0.82 0.63 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 45 Q 9.15 4.84 0.00 2.09 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.82 0.00 0.00 0.00 0.00 0.00 2.27 2.37 0.00 46 L 8.83 5.47 0.00 1.67 1.31 0.91 1.08 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 47 S 8.11 4.56 0.00 3.90 3.94 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 48 A 8.43 4.71 1.33 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 0.00 0.00 49 E 8.96 4.05 0.00 1.69 1.64 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 2.16 2.28 0.00 50 S 5.81 4.58 0.00 4.10 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 51 V 8.19 3.91 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 0.97 0.00 0.00 1.03 0.00 0.00 52 G 9.10 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 0.00 0.00 0.00 53 E 8.15 5.18 0.00 2.13 1.69 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 2.18 2.27 0.00 54 V 8.99 4.89 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 0.58 0.00 0.00 1.17 0.00 0.00 55 Y 8.75 5.20 0.00 3.00 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 56 I 8.59 4.42 1.75 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.73 0.68 0.00 0.00 57 K 8.80 4.65 0.00 1.38 1.51 0.00 1.23 0.00 0.00 1.11 0.00 0.00 2.67 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.90 0.24 7.81 58 S 8.76 4.44 0.00 3.83 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 T 8.54 3.79 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 1.17 0.00 0.00 60 E 8.39 4.03 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 2.36 0.00 61 T 7.88 4.30 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 1.24 0.00 0.00 62 G 8.25 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 63 Q 7.48 4.47 0.00 1.92 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 6.71 0.00 0.00 0.00 0.00 0.00 2.51 2.31 0.00 64 Y 8.81 4.87 0.00 2.89 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 65 L 8.95 4.39 0.00 1.64 1.51 0.81 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 66 A 8.78 5.10 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 M 8.70 5.41 0.00 2.22 2.24 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.64 0.00 68 D 9.19 5.15 0.00 2.99 2.86 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 69 T 8.50 4.19 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 1.34 0.00 0.00 70 D 8.41 4.64 0.00 2.79 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 71 G 8.59 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 L 7.88 4.75 0.00 2.02 1.60 0.88 0.57 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 73 L 8.30 5.09 0.00 1.57 1.62 0.89 0.91 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 74 Y 8.72 4.80 0.00 3.01 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 75 G 8.91 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 0.00 0.00 0.00 0.00 76 S 9.18 5.04 0.00 3.66 3.83 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 77 Q 9.04 4.28 0.00 2.15 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.56 0.00 0.00 0.00 0.00 0.00 2.43 2.34 0.00 78 T 7.58 4.63 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 1.22 0.00 0.00 79 P 0.00 3.88 0.00 0.57 0.49 0.00 3.44 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.28 0.00 80 N 7.81 5.24 0.00 2.92 2.94 0.00 0.00 5.89 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 81 E 8.81 3.92 0.00 2.05 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 0.00 2.28 2.32 0.00 82 E 8.95 4.15 0.00 2.23 2.28 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 2.38 2.45 0.00 83 C 7.96 5.05 0.00 3.10 3.25 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 84 L 7.32 4.36 0.00 1.33 1.30 0.77 0.08 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 85 F 8.95 5.17 0.00 3.14 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 86 L 9.11 4.84 0.00 1.50 1.58 0.87 0.82 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 87 E 8.82 4.47 0.00 2.12 1.90 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 2.19 1.91 0.00 88 R 8.66 4.82 0.00 1.75 1.79 0.00 3.10 0.00 0.00 2.87 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.62 0.00 89 L 8.73 4.68 0.00 1.59 1.69 1.01 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 90 E 9.17 4.69 0.00 2.22 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 2.31 2.46 0.00 91 E 9.84 4.03 0.00 2.37 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 2.30 2.41 0.00 92 N 8.50 4.32 0.00 2.86 2.90 0.00 0.00 6.86 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 93 H 8.43 4.78 0.00 2.88 3.01 0.00 5.94 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 7.73 4.74 0.00 3.02 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 95 N 9.74 5.52 0.00 3.01 2.53 0.00 0.00 6.94 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 96 T 9.00 5.24 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 97 Y 8.53 4.90 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 98 I 8.54 4.54 1.68 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.23 0.64 0.00 0.00 99 S 8.88 4.07 0.00 4.08 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 0.00 100 K 8.74 3.97 0.00 1.68 1.68 0.00 1.69 0.00 0.00 1.45 0.00 0.00 2.79 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.30 7.81 101 K 7.91 3.80 0.00 1.75 1.64 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.02 1.31 7.81 102 H 8.40 4.81 0.00 3.23 2.55 0.00 5.70 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 7.78 3.96 1.38 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 0.00 0.00 104 E 8.11 4.01 0.00 1.97 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 0.00 2.19 2.15 0.00 105 K 7.68 4.18 0.00 0.79 1.13 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.45 0.00 0.00 2.58 0.00 0.00 0.00 0.00 1.00 0.91 7.81 106 N 7.63 3.92 0.00 3.01 3.05 0.00 0.00 6.89 7.00 0.00 0.00 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 W 7.69 5.02 0.00 3.34 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 0.00 108 F 9.18 5.38 0.00 2.87 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 V 8.92 3.93 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 0.58 0.00 0.00 0.49 0.00 0.00 110 G 8.57 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 L 8.45 5.29 0.00 1.43 1.43 0.96 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 112 K 9.11 4.21 0.00 1.93 1.68 0.00 1.62 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.44 7.81 113 K 8.40 3.99 0.00 1.70 1.84 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.58 1.39 7.81 114 N 8.09 4.60 0.00 2.78 2.88 0.00 0.00 6.17 7.00 0.00 0.00 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 8.08 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.23 4.85 0.00 3.86 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 0.00 117 C 8.44 4.75 0.00 3.00 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 0.00 118 K 8.83 4.35 0.00 1.71 1.74 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.37 7.81 119 R 8.34 4.40 0.00 1.73 1.61 0.00 3.07 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.54 0.00 120 G 8.73 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 0.00 0.00 0.00 121 P 0.00 4.39 0.00 1.97 2.23 0.00 3.04 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 1.76 1.88 0.00 122 R 7.85 4.46 0.00 1.85 1.92 0.00 3.30 0.00 0.00 3.29 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.66 0.00 123 T 7.54 5.15 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 1.40 0.00 0.00 124 H 7.89 4.76 0.00 3.46 3.53 0.00 5.67 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 8.81 3.91 0.00 3.13 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 0.00 126 G 9.02 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 0.00 127 Q 7.44 4.24 0.00 1.86 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.73 0.00 0.00 0.00 0.00 0.00 2.15 1.99 0.00 128 K 8.29 3.87 0.00 1.75 1.64 0.00 1.55 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.28 7.81 129 A 8.02 3.98 1.20 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 0.00 130 I 7.20 4.43 1.65 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.83 0.53 0.00 0.00 131 L 7.28 4.33 0.00 1.11 0.53 0.52 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 132 F 9.37 5.42 0.00 3.37 3.13 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 0.00 133 L 9.25 5.19 0.00 2.12 1.75 0.84 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 5.10 0.00 2.22 2.26 0.00 3.93 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 2.06 2.10 0.00 135 L 9.15 4.89 0.00 1.71 1.66 0.98 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 136 P 0.00 4.62 0.00 2.07 2.06 0.00 3.77 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.00 0.00 137 V 8.17 3.77 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 0.66 0.00 0.00 0.91 0.00 0.00