NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 G 4.1703 8.3393 109.7437 45.7044 0.0000 174.9827 0 S 4.4937 8.7820 119.1119 57.4609 62.5272 172.9859 1 M 4.2851 9.6948 119.9821 57.3139 33.5723 176.8352 2 A 4.0321 8.0612 120.6355 56.0352 18.4683 178.3173 3 L 3.6583 8.3616 117.3874 58.7198 41.6246 178.6122 4 K 3.8507 8.0524 118.7954 59.5693 32.1917 179.0443 5 R 3.8859 8.4278 119.3325 59.6125 30.0210 178.5764 6 I 3.3537 8.2832 120.3375 64.5063 36.8279 178.1436 7 H 4.1579 8.4166 117.4740 58.6152 28.5164 177.7310 8 K 3.9310 7.9288 121.0585 60.0272 32.0470 178.2819 9 E 3.8539 8.2907 118.4069 59.7852 29.2767 179.1882 10 L 4.2181 8.7026 119.9800 58.7194 41.9181 179.0157 11 N 4.3910 8.5237 116.6856 56.3749 38.6784 176.3463 12 D 4.3140 8.5505 120.7740 56.7495 41.3873 178.3161 13 L 4.0069 8.4168 120.7220 57.5942 41.6931 179.1035 14 A 4.0683 7.6018 120.0210 55.2702 18.5345 179.3539 15 R 4.1799 7.2573 114.7945 58.2283 31.4581 177.3593 16 D 4.7382 8.0679 117.5676 51.5745 41.2047 172.6917 17 P 4.6261 0.0000 0.0000 60.7500 32.5050 175.7504 18 P 4.3521 0.0000 0.0000 62.6743 29.0189 177.3363 19 A 3.7300 7.6034 121.4141 52.4476 18.5087 177.2257 20 Q 4.5750 9.1157 114.2315 56.1114 30.7281 174.3564 21 C 4.8073 7.7021 111.5209 58.5685 32.8568 172.6530 22 S 4.7930 8.7957 111.9088 57.3610 66.3453 172.9528 23 A 5.0277 8.1740 121.4406 49.4213 22.7997 174.7733 24 G 3.0355 7.5527 105.6930 45.0352 0.0000 170.6533 25 P 4.4854 0.0000 0.0000 62.5541 31.7970 176.6392 26 V 3.7029 8.0646 121.1280 64.9342 32.2887 176.8673 27 G 4.2916 7.4573 110.4461 44.7806 0.0000 172.8464 28 D 4.4062 8.6426 118.7742 55.9082 41.4320 175.9635 29 D 4.5733 8.0029 118.7532 54.4651 40.0708 176.2425 30 M 4.4632 8.6197 126.3943 57.2126 32.3425 177.5965 31 F 4.4476 8.4850 117.0302 58.1092 40.1005 174.2989 32 H 5.2208 8.2899 121.4088 54.4728 31.0537 173.2486 33 W 5.3314 9.5253 126.4290 54.8894 32.7780 174.7383 34 Q 5.0312 8.9624 122.8502 54.4137 31.5647 173.9354 35 A 5.0557 8.9707 128.4306 50.5393 21.9991 175.3922 36 T 4.8503 9.2028 111.4244 59.7782 71.6252 172.7214 37 I 4.5489 9.3609 127.3743 59.4033 40.6765 174.2787 38 M 4.4944 9.1346 130.3908 54.4137 31.1677 174.2818 39 G 4.3665 9.1206 106.6834 46.4265 0.0000 169.7336 40 P 5.0237 0.0000 0.0000 61.4223 32.2280 175.9398 41 N 4.4092 8.7193 119.2150 54.6996 39.1100 173.9933 42 D 4.3992 8.7275 119.2231 55.6968 39.9745 172.7226 43 S 4.9447 7.6540 110.6458 55.5299 65.9525 171.9557 44 P 4.5801 0.0000 0.0000 63.3057 30.5081 176.7797 45 Y 5.0347 8.3698 114.7912 57.0813 39.0895 175.8842 46 Q 4.5964 6.9739 116.8549 57.0052 28.3607 175.2719 47 G 4.1577 8.4943 114.8310 44.6949 0.0000 173.7119 48 G 3.8123 7.8530 104.5942 45.9945 0.0000 171.2874 49 V 4.5745 7.8730 120.4441 60.7691 33.6838 174.8404 50 F 5.0177 9.2931 124.9913 55.6570 42.9392 173.8652 51 F 5.4265 9.9852 121.4530 55.7822 41.9306 174.5122 52 L 5.1292 9.3423 122.4741 53.0924 46.0114 175.0690 53 T 4.8253 8.7923 116.2062 60.4963 69.6978 172.8983 54 I 4.7727 8.7529 129.9000 59.7616 40.1464 174.2638 55 H 4.8658 8.8020 125.9627 54.3298 32.7275 172.1114 56 F 4.4880 8.8207 126.1459 56.2614 39.6087 174.5984 57 P 4.5229 0.0000 0.0000 62.3243 31.9178 177.6529 58 T 3.7293 8.4285 110.7062 63.8413 69.1531 174.7609 59 D 5.0830 7.9371 121.3125 52.8479 39.8879 175.1033 60 Y 4.5793 7.9527 120.8942 58.3526 38.8311 174.1414 61 P 3.6020 0.0000 0.0000 62.5738 31.8811 177.5903 62 F 4.4918 7.7918 118.5686 59.5091 39.1575 175.7132 63 K 4.6355 7.8597 118.8352 53.3751 34.3230 174.2026 64 P 2.9700 0.0000 0.0000 61.0504 31.9291 174.4247 65 P 4.3291 0.0000 0.0000 62.5893 32.5843 175.8570 66 K 4.2191 8.9885 121.8974 55.8121 33.0048 176.1035 67 V 5.3284 8.3705 124.5226 59.9723 34.2974 174.5741 68 A 4.7971 8.1813 127.3310 50.4850 22.4163 175.2605 69 F 4.5749 9.1190 121.5997 58.1696 39.3704 176.8340 70 T 4.1702 9.0108 114.7113 64.2835 69.3817 175.9736 71 T 4.2293 8.0212 117.3851 63.1697 69.1834 173.9134 72 R 4.2437 8.4298 124.4892 56.4691 30.8977 175.5873 73 I 4.6709 8.1387 121.2152 60.4363 40.6442 173.6321 74 Y 4.0048 8.7075 128.4330 56.3853 38.0856 173.8782 75 H 4.6408 7.7005 125.6207 53.8083 33.1029 172.6993 76 P 4.0400 0.0000 0.0000 65.2254 31.2974 177.1602 77 N 4.9205 8.2132 114.9469 52.6383 38.8009 173.7403 78 I 4.8718 7.6945 119.5847 59.3681 40.4725 175.3199 79 N 4.7295 8.5051 122.8661 51.6303 38.3305 176.2569 80 S 4.2983 8.5604 112.9537 60.4123 63.0200 174.3657 81 N 4.6299 7.9853 117.9920 52.7244 39.7296 174.5256 82 G 4.2784 8.2696 105.4466 47.1318 0.0000 174.6242 83 S 4.4154 8.6846 116.8032 58.9579 63.3926 173.2771 84 I 4.6074 8.1727 124.4281 60.0042 38.6249 175.8171 85 C 4.5418 8.5484 126.0728 57.3414 30.0442 171.7294 86 L 4.8243 7.6868 125.1933 52.4060 45.3312 176.6104 87 D 4.4722 9.0367 125.9931 57.6164 40.8180 179.1140 88 I 3.8195 7.8726 111.9308 63.7750 37.7948 177.9925 89 L 4.0199 7.6692 119.3973 56.7066 43.3247 177.8963 90 R 4.5028 7.7807 113.3309 55.9301 30.2355 177.9159 91 S 4.1732 9.5866 120.3443 62.1257 63.1078 175.3651 92 Q 4.3697 8.2361 117.2840 55.0658 28.8718 175.7718 93 W 4.3886 7.7345 128.6341 57.8637 31.4652 175.0929 94 S 4.2363 6.5942 117.2963 55.3600 64.9625 173.0149 95 P 4.0855 0.0000 0.0000 64.8854 31.0586 177.3595 96 A 3.8894 7.2787 121.0244 53.8417 18.3833 177.1919 97 L 4.5197 6.9037 115.5637 54.2247 42.5831 176.9246 98 T 4.7777 7.9413 111.5590 60.3788 72.0038 175.5550 99 I 3.7857 8.4437 122.0545 64.5794 37.8005 177.6552 100 S 4.1582 8.3731 113.3243 61.7870 62.0072 176.2249 101 K 4.0373 7.9696 121.3818 59.3070 31.7670 179.3199 102 V 3.7385 7.6936 114.1990 63.6774 31.4867 178.0895 103 L 3.9423 7.9017 118.8401 58.0234 41.4503 179.3992 104 L 3.9963 7.6856 118.6462 58.2084 41.4119 180.0602 105 S 4.4459 7.8579 114.6211 60.7012 62.7924 176.5747 106 I 3.7392 7.9631 123.8690 64.5917 36.9685 177.5480 107 C 3.9374 8.3828 118.0680 63.3871 28.0341 176.6875 108 S 4.2098 8.5435 115.6074 61.3121 62.2235 176.2528 109 L 4.1195 7.8566 123.6727 58.0450 41.8790 178.5901 110 L 4.0800 7.8208 118.3331 57.8603 41.5356 178.9173 111 C 4.7260 7.8855 115.9121 61.3398 28.7962 173.5090 112 D 4.6599 8.0079 119.2839 51.6819 41.9786 173.8597 113 P 4.4926 0.0000 0.0000 62.0070 32.2055 175.3677 114 N 5.1388 7.8809 115.0192 51.5601 41.9970 172.7368 115 P 4.5579 0.0000 0.0000 64.2057 32.4807 176.2740 116 D 4.5989 7.9241 116.3490 55.0925 41.8657 176.5762 117 D 4.4109 8.5377 117.1021 55.7076 41.3280 175.0630 118 P 3.9708 0.0000 0.0000 61.6342 28.5834 175.1969 119 L 3.8986 8.5015 125.7987 57.3743 42.4403 177.3893 120 V 4.1668 7.7332 123.1815 60.3807 31.1622 174.0666 121 P 4.3077 0.0000 0.0000 65.0600 30.9248 178.1048 122 E 3.9969 8.1970 116.7175 59.6582 29.6684 178.9433 123 I 3.9330 7.6704 118.9955 63.8104 37.2830 177.9118 124 A 3.9432 7.9547 121.4567 55.2908 17.8826 179.5655 125 R 3.8679 7.4657 113.0339 59.7650 29.7343 178.7713 126 I 3.8932 7.7904 120.2119 64.0872 36.9326 177.6546 127 Y 3.8838 7.8606 119.5574 60.5053 38.6194 177.4308 128 K 3.9265 7.9622 118.4042 59.2489 32.5448 178.8607 129 T 4.6303 7.4253 114.1275 62.6206 70.5390 174.6143 130 D 4.7273 7.5958 115.5628 52.2698 42.5257 175.6795 131 R 3.9178 8.2820 124.0280 60.7100 30.6736 178.8573 132 E 3.6407 7.7452 117.0702 58.7990 30.2760 178.7681 133 K 3.9936 8.1742 118.9713 59.7908 32.5450 177.7934 134 Y 4.3289 8.0570 119.6827 61.5098 38.6671 178.2261 135 N 3.9914 8.8658 117.2483 55.9688 38.5491 177.2986 136 R 3.7705 7.5210 118.7555 59.7532 30.2113 178.7090 137 I 3.4967 7.3197 119.1179 63.8799 36.9302 178.3112 138 A 3.8125 7.5393 121.8012 55.3723 18.1870 180.0339 139 R 4.0943 8.2459 118.0403 58.5593 30.0614 178.9212 140 E 3.9576 8.5196 119.7503 59.2340 29.5808 179.0410 141 W 4.3544 8.6458 118.9741 59.9599 28.6505 178.4615 142 T 4.1148 8.1431 115.7399 67.0084 67.7634 176.0788 143 Q 4.0136 8.2419 118.5336 59.4235 28.9055 179.4203 144 K 3.8050 7.6868 117.7137 58.6177 32.0154 177.6984 145 Y 4.6119 7.9798 114.5630 58.6779 40.5331 177.1955 146 A 3.9439 8.1909 122.1732 54.8611 18.7356 177.1469 147 M 4.1404 7.7737 115.8571 55.4057 31.6262 175.8725 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 G 8.34 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 0 S 8.78 4.49 0.00 4.07 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1 M 9.69 4.29 0.00 2.16 2.14 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.56 0.00 2 A 8.06 4.03 1.72 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 0.00 0.00 3 L 8.36 3.66 0.00 1.85 1.66 1.04 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 4 K 8.05 3.85 0.00 1.84 1.83 0.00 1.81 0.00 0.00 1.92 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.47 7.81 5 R 8.43 3.89 0.00 1.87 2.10 0.00 3.13 0.00 0.00 3.00 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 6 I 8.28 3.35 1.47 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.14 0.10 0.27 0.00 0.00 7 H 8.42 4.16 0.00 3.30 3.34 0.00 5.62 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 K 7.93 3.93 0.00 1.82 1.98 0.00 1.68 0.00 0.00 1.64 0.00 0.00 3.08 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.55 7.81 9 E 8.29 3.85 0.00 2.15 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 10 L 8.70 4.22 0.00 2.24 2.11 1.02 0.51 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 11 N 8.52 4.39 0.00 3.13 2.90 0.00 0.00 7.30 9.28 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 12 D 8.55 4.31 0.00 2.96 2.72 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 13 L 8.42 4.01 0.00 1.98 1.92 1.11 1.08 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 14 A 7.60 4.07 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 15 R 7.26 4.18 0.00 1.77 2.02 0.00 3.12 0.00 0.00 3.31 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.80 0.00 16 D 8.07 4.74 0.00 2.54 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 17 P 0.00 4.63 0.00 2.10 1.98 0.00 3.79 0.00 0.00 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.34 0.00 18 P 0.00 4.35 0.00 2.20 2.04 0.00 3.93 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.12 0.00 19 A 7.60 3.73 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 20 Q 9.12 4.58 0.00 2.17 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.44 0.00 0.00 0.00 0.00 0.00 2.34 2.53 0.00 21 C 7.70 4.81 0.00 3.06 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 22 S 8.80 4.79 0.00 3.87 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 23 A 8.17 5.03 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 24 G 7.55 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 0.00 0.00 0.00 25 P 0.00 4.49 0.00 2.34 2.09 0.00 3.22 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.82 0.00 26 V 8.06 3.70 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 0.70 0.00 0.00 0.77 0.00 0.00 27 G 7.46 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 D 8.64 4.41 0.00 2.72 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 29 D 8.00 4.57 0.00 2.82 2.72 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 30 M 8.62 4.46 0.00 1.73 1.91 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.52 0.00 31 F 8.49 4.45 0.00 3.25 3.11 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 32 H 8.29 5.22 0.00 3.18 3.30 0.00 5.55 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 W 9.53 5.33 0.00 3.05 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 34 Q 8.96 5.03 0.00 2.04 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.78 0.00 0.00 0.00 0.00 0.00 2.43 2.30 0.00 35 A 8.97 5.06 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 36 T 9.20 4.85 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 1.46 0.00 0.00 37 I 9.36 4.55 1.82 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.45 1.01 0.00 0.00 38 M 9.13 4.49 0.00 2.32 1.97 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.54 0.00 39 G 9.12 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 5.02 0.00 2.30 2.25 0.00 3.99 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 1.99 0.00 41 N 8.72 4.41 0.00 2.76 2.84 0.00 0.00 7.02 8.06 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 42 D 8.73 4.40 0.00 2.81 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 43 S 7.65 4.94 0.00 4.25 4.09 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 44 P 0.00 4.58 0.00 1.83 2.30 0.00 3.64 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 2.09 0.00 45 Y 8.37 5.03 0.00 3.17 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 46 Q 6.97 4.60 0.00 2.29 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.49 0.00 0.00 0.00 0.00 0.00 2.59 2.34 0.00 47 G 8.49 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 0.00 0.00 0.00 0.00 48 G 7.85 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 0.00 0.00 0.00 49 V 7.87 4.57 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.00 0.00 0.85 0.00 0.00 50 F 9.29 5.02 0.00 2.96 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 51 F 9.99 5.43 0.00 3.06 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 52 L 9.34 5.13 0.00 1.35 1.24 0.59 -0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 53 T 8.79 4.83 4.29 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 1.31 0.00 0.00 54 I 8.75 4.77 1.86 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 0.92 0.71 -0.05 0.00 0.00 55 H 8.80 4.87 0.00 3.09 3.03 0.00 5.77 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 F 8.82 4.49 0.00 2.97 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 P 0.00 4.52 0.00 2.37 1.98 0.00 3.76 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.03 0.00 58 T 8.43 3.73 4.09 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 0.98 0.00 0.00 59 D 7.94 5.08 0.00 3.00 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 Y 7.95 4.58 0.00 3.09 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 61 P 0.00 3.60 0.00 1.77 1.38 0.00 2.90 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.42 0.00 62 F 7.79 4.49 0.00 3.28 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 63 K 7.86 4.64 0.00 1.73 1.64 0.00 1.83 0.00 0.00 1.83 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.59 1.36 7.81 64 P 0.00 2.97 0.00 1.83 1.36 0.00 3.56 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.81 0.00 65 P 0.00 4.33 0.00 1.59 1.53 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.88 0.00 66 K 8.99 4.22 0.00 1.58 1.71 0.00 1.55 0.00 0.00 1.50 0.00 0.00 2.71 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.33 1.45 7.81 67 V 8.37 5.33 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 0.76 0.00 0.00 0.77 0.00 0.00 68 A 8.18 4.80 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 69 F 9.12 4.57 0.00 3.02 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 T 9.01 4.17 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 1.27 0.00 0.00 71 T 8.02 4.23 4.72 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 1.40 0.00 0.00 72 R 8.43 4.24 0.00 1.59 1.58 0.00 2.21 0.00 0.00 2.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.26 0.00 73 I 8.14 4.67 1.89 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.77 0.40 0.00 0.00 74 Y 8.71 4.00 0.00 1.69 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 75 H 7.70 4.64 0.00 2.98 2.81 0.00 5.73 0.00 0.00 0.00 0.00 6.73 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 4.04 0.00 2.03 2.03 0.00 3.07 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 1.58 1.23 0.00 77 N 8.21 4.92 0.00 2.79 2.96 0.00 0.00 6.92 7.23 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 78 I 7.69 4.87 1.62 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.36 0.78 0.00 0.00 79 N 8.51 4.73 0.00 2.91 2.94 0.00 0.00 6.32 6.93 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 80 S 8.56 4.30 0.00 4.07 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 81 N 7.99 4.63 0.00 2.71 2.88 0.00 0.00 7.20 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 82 G 8.27 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 0.00 0.00 0.00 0.00 83 S 8.68 4.42 0.00 4.03 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 84 I 8.17 4.61 1.91 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 1.66 0.69 0.98 0.00 0.00 85 C 8.55 4.54 0.00 2.89 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 L 7.69 4.82 0.00 1.71 1.45 0.93 1.25 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 87 D 9.04 4.47 0.00 2.84 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 88 I 7.87 3.82 2.08 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.19 0.96 0.00 0.00 89 L 7.67 4.02 0.00 1.94 1.79 0.87 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 90 R 7.78 4.50 0.00 1.68 1.25 0.00 3.15 0.00 0.00 3.23 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 91 S 9.59 4.17 0.00 4.01 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 92 Q 8.24 4.37 0.00 2.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.84 0.00 0.00 0.00 0.00 0.00 2.43 2.52 0.00 93 W 7.73 4.39 0.00 3.66 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 94 S 6.59 4.24 0.00 3.59 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 95 P 0.00 4.09 0.00 1.89 1.95 0.00 3.25 0.00 0.00 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.90 0.00 96 A 7.28 3.89 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 L 6.90 4.52 0.00 1.57 1.47 0.28 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 98 T 7.94 4.78 4.53 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 1.26 0.00 0.00 99 I 8.44 3.79 2.06 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 1.60 1.35 1.15 0.00 0.00 100 S 8.37 4.16 0.00 4.01 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 0.00 101 K 7.97 4.04 0.00 1.92 1.89 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.48 7.81 102 V 7.69 3.74 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 1.23 0.00 0.00 1.03 0.00 0.00 103 L 7.90 3.94 0.00 1.89 1.75 1.00 0.63 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 0.00 104 L 7.69 4.00 0.00 1.90 1.75 0.94 1.16 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 0.00 105 S 7.86 4.45 0.00 4.04 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 7.96 3.74 2.03 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 1.51 0.73 0.93 0.00 0.00 107 C 8.38 3.94 0.00 3.18 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 0.00 108 S 8.54 4.21 0.00 4.04 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 L 7.86 4.12 0.00 1.71 1.91 0.96 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 110 L 7.82 4.08 0.00 1.72 1.44 0.63 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 111 C 7.89 4.73 0.00 3.19 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 D 8.01 4.66 0.00 2.64 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 0.00 113 P 0.00 4.49 0.00 1.01 1.39 0.00 3.57 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 1.20 1.81 0.00 114 N 7.88 5.14 0.00 2.71 2.64 0.00 0.00 6.94 9.28 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 0.00 115 P 0.00 4.56 0.00 2.17 2.18 0.00 3.75 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 1.93 1.95 0.00 116 D 7.92 4.60 0.00 2.65 2.72 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 0.00 117 D 8.54 4.41 0.00 2.68 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 0.00 118 P 0.00 3.97 0.00 2.04 1.97 0.00 3.67 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 2.00 2.10 0.00 119 L 8.50 3.90 0.00 1.57 1.76 0.98 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 120 V 7.73 4.17 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 0.90 0.00 0.00 0.92 0.00 0.00 121 P 0.00 4.31 0.00 2.19 2.08 0.00 3.66 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.16 0.00 122 E 8.20 4.00 0.00 1.93 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 0.00 2.34 2.39 0.00 123 I 7.67 3.93 1.60 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.42 0.31 0.00 0.00 124 A 7.95 3.94 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 R 7.47 3.87 0.00 1.95 2.10 0.00 3.10 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.72 0.00 126 I 7.79 3.89 2.18 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 1.75 1.22 1.08 0.00 0.00 127 Y 7.86 3.88 0.00 2.54 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 0.00 128 K 7.96 3.93 0.00 1.86 1.84 0.00 1.75 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.70 1.67 7.81 129 T 7.43 4.63 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 1.16 0.00 0.00 130 D 7.60 4.73 0.00 2.79 2.72 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 0.00 131 R 8.28 3.92 0.00 1.81 1.96 0.00 2.91 0.00 0.00 2.61 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.45 0.00 132 E 7.75 3.64 0.00 2.09 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.49 0.00 133 K 8.17 3.99 0.00 1.98 1.98 0.00 1.98 0.00 0.00 1.77 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.55 1.51 7.81 134 Y 8.06 4.33 0.00 3.19 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 0.00 135 N 8.87 3.99 0.00 2.77 2.83 0.00 0.00 6.77 7.20 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 0.00 136 R 7.52 3.77 0.00 1.89 2.10 0.00 3.08 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.64 0.00 137 I 7.32 3.50 1.01 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.28 -0.37 0.00 0.00 138 A 7.54 3.81 0.73 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 0.00 0.00 139 R 8.25 4.09 0.00 1.84 1.97 0.00 3.12 0.00 0.00 3.16 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.45 0.00 140 E 8.52 3.96 0.00 2.31 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 0.00 2.34 2.36 0.00 141 W 8.65 4.35 0.00 3.77 3.63 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 0.00 142 T 8.14 4.11 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 1.47 0.00 0.00 143 Q 8.24 4.01 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.99 0.00 0.00 0.00 0.00 0.00 2.41 2.56 0.00 144 K 7.69 3.80 0.00 0.79 0.74 0.00 1.21 0.00 0.00 1.50 0.00 0.00 2.96 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.17 1.43 7.81 145 Y 7.98 4.61 0.00 2.96 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 0.00 146 A 8.19 3.94 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 M 7.77 4.14 0.00 2.09 2.02 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.66 0.00