NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3569 8.2649 123.5837 52.3678 19.1071 176.3170 2 T 4.1974 8.3926 119.2402 66.2903 69.6793 173.3378 3 K 5.2927 8.4124 120.6175 54.8241 36.9872 174.5988 4 A 5.1256 8.8488 122.8960 51.4663 23.5279 175.0761 5 V 5.0259 8.8329 117.4992 61.5032 35.5512 173.1199 6 C 4.8205 8.8231 120.7800 58.4725 35.4855 172.5146 7 V 4.6235 8.4581 126.4026 61.6059 33.1896 174.1906 8 L 4.6922 8.8461 129.0167 53.8854 43.1164 176.1355 9 K 4.9348 8.8130 122.1311 55.4155 37.3811 175.2222 10 G 3.9923 8.0511 107.0586 46.1960 0.0000 173.1183 11 D 4.5324 9.0128 119.2337 57.1130 40.9813 177.8074 12 G 3.8743 7.7242 106.8113 44.6715 0.0000 170.8867 13 P 4.5409 0.0000 0.0000 62.7961 31.9338 176.3027 14 V 3.9609 7.5364 119.8705 63.1041 32.3166 174.6202 15 Q 4.6857 8.0936 122.1241 56.0378 32.2655 172.9734 16 G 4.1068 7.4794 106.3063 46.4626 0.0000 171.7212 17 I 5.1497 7.7952 119.1117 59.4463 41.0888 175.3011 18 I 4.7564 8.6493 126.0555 59.6212 41.0934 174.4016 19 N 5.2859 8.7309 124.2696 51.6066 41.6578 173.7924 20 F 5.4891 9.0680 118.3529 56.0928 43.9151 173.8249 21 E 5.1470 9.3937 122.3349 55.2247 33.3038 173.6432 22 Q 5.0621 9.4360 128.7409 53.9031 29.3242 174.7469 23 K 4.1432 8.8350 124.9753 58.0879 32.7670 177.5124 24 E 4.6660 7.8874 117.7375 53.7782 31.7258 175.1951 25 S 4.1605 8.7877 117.3831 60.3263 62.6175 173.3057 26 N 4.2484 8.2169 119.9703 54.0901 37.0590 175.3384 27 G 3.9748 7.8995 109.2427 44.5226 0.0000 171.7463 28 P 4.8017 0.0000 0.0000 62.1206 33.1719 175.9111 29 V 4.6225 8.6122 118.7316 60.9963 34.4138 174.4830 30 K 4.6563 9.0613 128.9571 56.2779 33.5114 176.4272 31 V 4.8176 9.1985 125.3901 60.8311 33.9825 174.2766 32 W 5.4334 8.7158 124.1264 54.6733 32.0213 175.1469 33 G 3.7596 7.3600 106.5423 46.2930 0.0000 171.0133 34 S 4.9827 7.7889 115.1546 57.2276 66.4845 174.4921 35 I 5.0864 8.6579 127.0252 59.3427 40.9514 174.5237 36 K 4.8811 9.3385 124.0137 55.4359 36.6209 175.9889 37 G 3.7096 8.9017 105.9440 46.5766 0.0000 173.3608 38 L 4.7212 7.5922 118.3609 52.1679 44.3243 176.3842 39 T 4.1006 8.2584 111.1680 61.0036 69.5361 174.0210 40 E 4.3948 8.1416 124.6454 57.2927 30.6834 176.0289 41 G 3.9005 8.4493 108.9530 44.0277 0.0000 172.3522 42 L 4.9271 8.1670 119.6797 54.5835 43.2632 176.4047 43 H 5.0756 9.0876 118.6594 53.9965 33.4451 173.5716 44 G 4.0383 9.0801 110.5654 46.8668 0.0000 172.8935 45 F 5.1336 8.3016 123.7042 57.8500 42.1162 172.6315 46 H 5.0651 8.8315 122.9892 54.0765 33.9372 172.7509 47 V 4.3676 8.5378 121.1602 62.5587 32.5683 175.2678 48 H 5.0328 9.0643 125.5960 54.2337 30.3655 175.0071 49 E 3.9061 8.7297 121.3657 58.6764 29.6678 177.2014 50 F 5.2429 8.1719 117.5619 55.6908 41.6101 175.5732 51 G 3.8627 8.5080 111.4342 45.3044 0.0000 173.1338 52 D 4.8785 8.0642 118.6208 52.4860 42.7839 175.1507 53 N 5.4572 8.3950 122.0548 52.1865 40.1992 175.5663 54 T 3.9219 8.1537 116.2557 66.6051 68.8765 175.0646 55 A 4.6302 8.8632 125.2351 51.1399 19.0798 176.4249 56 G 3.8396 7.6637 115.8023 46.3903 0.0000 174.6841 57 C 4.3863 8.5993 116.0280 59.6951 36.3415 175.6070 58 T 3.7442 7.9278 117.1792 66.6144 67.7618 176.3694 59 S 4.1852 7.5075 116.2968 61.1649 63.0149 175.9812 60 A 4.3731 8.0137 123.9973 54.7886 18.1411 178.3355 61 G 4.0983 8.0688 104.7428 43.9565 0.0000 170.5319 62 P 4.6946 0.0000 0.0000 62.1070 33.4812 175.2532 63 H 4.2241 8.6363 116.5462 55.7432 29.5536 175.5761 64 F 4.2832 8.8363 124.7954 58.6747 40.0773 174.2300 65 N 5.1080 8.2009 125.4872 51.5907 39.0532 172.4654 66 P 4.1667 0.0000 0.0000 64.1878 32.3320 178.0295 67 L 4.3465 7.6481 116.9513 53.7025 41.8334 176.1750 68 S 3.5991 7.3388 113.6744 59.5661 60.7732 172.4594 69 R 4.3802 7.9219 117.6419 55.0920 32.0307 176.2771 70 K 4.4806 8.0479 116.8330 55.7330 33.7070 176.6801 71 H 3.9662 8.4766 122.9560 56.9820 30.5763 174.7321 72 G 4.1344 7.2581 109.0712 45.7456 0.0000 172.3798 73 G 4.0767 8.6126 109.3128 43.8208 0.0000 173.3147 74 P 4.4336 0.0000 0.0000 64.6673 31.5165 177.7505 75 K 4.2307 7.8874 115.9167 57.1307 32.5998 176.7257 76 D 4.5345 7.3203 118.8670 54.4363 41.4418 176.1434 77 E 4.0306 8.6178 121.5221 58.6350 29.9494 176.6346 78 E 4.1602 7.9299 124.2705 55.8837 28.7270 175.1237 79 R 4.8121 7.6763 120.2663 55.1292 32.4738 174.5949 80 H 4.4681 9.4349 116.9846 55.2706 29.3926 176.9598 81 V 3.4143 8.4210 123.3167 66.0946 31.3852 176.9175 82 G 3.9369 8.2053 106.5413 45.6846 0.0000 172.8755 83 D 5.0660 8.2698 121.9153 53.4328 39.7756 176.1266 84 L 4.6754 8.3937 122.9546 53.7991 43.0027 178.8253 85 G 3.7993 7.8573 110.5588 47.2746 0.0000 175.0860 86 N 5.6581 8.7810 121.2322 51.2662 42.1771 172.7347 87 V 4.5115 8.7348 112.5015 59.9414 36.6141 174.8573 88 T 5.0836 8.2834 117.9863 61.8239 71.6962 172.8364 89 A 4.9347 9.0951 128.6936 50.4450 21.0884 176.5155 90 D 4.5569 8.8667 122.9893 53.0527 42.6772 178.4895 91 K 3.9445 8.8755 119.0846 60.2538 31.6922 178.8406 92 D 4.4643 8.1196 115.4620 54.5020 40.9545 177.7120 93 G 4.1865 7.7059 106.5206 46.0678 0.0000 172.9925 94 V 4.5457 7.2450 120.2034 61.6035 33.2185 174.4871 95 A 5.2932 8.9148 130.0552 49.7891 21.1744 175.3596 96 D 4.9302 8.6289 123.6589 52.8461 40.6883 176.1887 97 V 3.7163 8.2658 123.7244 62.8594 33.0782 174.8692 98 S 4.8790 8.3304 118.0913 57.8594 65.2844 174.3275 99 I 4.6876 8.6254 127.4025 60.2109 41.8395 173.7306 100 E 5.1279 8.6764 125.2633 55.2937 31.8440 174.7919 101 D 4.7952 8.3630 119.3905 53.3592 45.1621 175.6398 102 S 4.8618 8.6268 117.1710 57.9709 64.1219 175.0382 103 V 3.8017 8.2948 122.6928 65.9005 31.4383 176.8105 104 I 4.2599 7.7769 111.1245 60.7660 38.8480 174.5168 105 S 4.6924 8.1913 113.7619 57.3289 65.0981 174.4216 106 L 4.4153 9.3185 124.5546 55.1016 42.0189 176.1476 107 S 4.6430 7.5285 111.8489 56.8388 66.2669 173.5415 108 G 3.8493 8.4055 108.7307 45.1911 0.0000 173.6293 109 D 4.8814 8.5828 118.2937 53.8194 39.6376 176.2402 110 H 4.9463 8.0501 115.3332 55.8614 28.9953 174.4853 111 C 4.3061 7.7940 121.4788 60.0950 31.7526 173.4362 112 I 3.9926 8.1542 118.6602 60.3325 37.7897 175.2909 113 I 3.7519 7.3039 123.1720 62.9450 37.1464 176.0499 114 G 3.9100 9.1534 113.6737 44.9381 0.0000 172.5248 115 R 4.5831 7.4335 117.5915 54.2161 33.8985 175.1698 116 T 4.6166 8.0244 118.0585 63.1579 70.2000 173.8291 117 L 4.8270 8.6209 128.1147 54.0736 44.3076 175.4101 118 V 4.9410 8.6759 124.6149 61.1731 35.2657 174.0987 119 V 5.1753 8.5615 126.6245 60.4546 34.0974 174.3534 120 H 5.1663 8.6834 119.3298 53.8904 31.6897 173.9940 121 E 4.1610 9.1534 120.9718 59.3692 29.8791 176.3117 122 K 4.8385 8.5827 117.5412 53.9781 36.1403 174.8441 123 A 4.5131 8.3454 121.8773 52.2146 19.5223 176.8380 124 D 4.7249 9.5832 123.0791 54.2547 41.8352 175.7790 125 D 4.6588 9.2217 124.5879 52.6988 39.5093 176.9668 126 L 3.6752 9.4388 118.6262 55.9861 39.5665 176.3647 127 G 4.2408 8.7343 107.9430 45.3991 0.0000 174.7794 128 K 4.4532 7.7420 118.3219 56.4511 32.2846 177.6568 129 G 3.8639 7.6300 108.0966 44.6063 0.0000 176.0343 130 G 3.9649 8.1456 107.0881 45.8281 0.0000 172.8752 131 N 4.9449 7.3112 114.8950 50.2541 40.2036 174.6835 132 E 4.0331 8.7880 119.1109 59.5513 29.9193 178.6489 133 E 3.9589 8.2313 118.3745 59.3344 29.4842 178.5322 134 S 4.2027 8.2346 113.0434 60.8310 62.3205 175.0370 135 T 4.5356 7.6657 111.0744 61.6711 68.4382 174.9671 136 K 4.2556 7.7937 118.0541 58.0709 34.1404 177.0959 137 T 3.9673 7.9836 106.4027 60.3557 69.6708 175.1905 138 G 3.8010 8.2585 109.9741 46.4561 0.0000 173.7317 139 N 4.3934 7.8344 112.6151 53.7877 36.9165 176.6156 140 A 4.3525 7.0260 121.9594 53.0457 18.8610 179.0775 141 G 3.7582 7.3240 101.7992 43.9872 0.0000 172.5535 142 S 4.3731 8.0953 112.7780 58.7076 64.7844 173.9502 143 R 4.6283 8.2552 119.3483 54.4983 29.0124 176.3677 144 L 4.2595 8.4225 124.3400 57.4332 42.4032 177.2128 145 A 4.9154 7.6254 117.9789 51.2841 22.9364 173.8275 146 C 5.1036 9.4189 113.3353 55.3039 46.8315 172.8235 147 G 4.6259 8.1461 104.0950 46.0463 0.0000 173.1788 148 V 4.2548 8.3805 121.2254 62.7147 32.7706 175.2827 149 I 4.2777 8.2644 127.8593 60.4043 38.5335 175.2417 150 G 4.4388 9.1811 113.3983 43.9767 0.0000 171.4670 151 I 4.3599 8.3010 120.8500 61.0014 37.5479 175.9007 152 A 4.7237 8.0976 128.8811 49.7460 21.6950 176.5649 153 Q 4.0678 8.4602 118.7531 56.4749 29.1967 176.0117 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 4.36 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 2 T 8.39 4.20 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 1.27 0.00 0.00 3 K 8.41 5.29 0.00 1.72 1.74 0.00 1.95 0.00 0.00 1.96 0.00 0.00 3.09 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.54 1.48 7.81 4 A 8.85 5.13 1.09 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 0.00 0.00 5 V 8.83 5.03 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 0.65 0.00 0.00 0.94 0.00 0.00 6 C 8.82 4.82 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 7 V 8.46 4.62 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 0.99 0.00 0.00 0.92 0.00 0.00 8 L 8.85 4.69 0.00 1.76 1.59 1.04 0.56 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 9 K 8.81 4.93 0.00 1.62 1.63 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.34 1.52 7.81 10 G 8.05 3.99 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 0.00 0.00 0.00 11 D 9.01 4.53 0.00 2.68 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 12 G 7.72 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 13 P 0.00 4.54 0.00 2.18 2.16 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 1.94 1.94 0.00 14 V 7.54 3.96 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 0.85 0.00 0.00 0.99 0.00 0.00 15 Q 8.09 4.69 0.00 2.23 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.47 0.00 0.00 0.00 0.00 0.00 2.12 2.18 0.00 16 G 7.48 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 17 I 7.80 5.15 1.79 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 1.12 0.84 0.00 0.00 18 I 8.65 4.76 1.93 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.49 0.64 0.00 0.00 19 N 8.73 5.29 0.00 1.44 1.97 0.00 0.00 6.45 5.30 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 20 F 9.07 5.49 0.00 2.92 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 21 E 9.39 5.15 0.00 2.37 1.94 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 2.30 2.39 0.00 22 Q 9.44 5.06 0.00 2.09 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.75 0.00 0.00 0.00 0.00 0.00 2.44 2.55 0.00 23 K 8.84 4.14 0.00 1.81 1.88 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.47 1.50 7.81 24 E 7.89 4.67 0.00 2.02 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.27 0.00 25 S 8.79 4.16 0.00 3.84 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 8.22 4.25 0.00 2.98 2.88 0.00 0.00 7.01 7.53 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 27 G 7.90 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 28 P 0.00 4.80 0.00 2.12 2.11 0.00 3.74 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 29 V 8.61 4.62 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 1.21 0.00 0.00 1.08 0.00 0.00 30 K 9.06 4.66 0.00 1.86 1.83 0.00 1.56 0.00 0.00 1.46 0.00 0.00 2.90 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.44 1.40 7.81 31 V 9.20 4.82 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 0.68 0.00 0.00 0.94 0.00 0.00 32 W 8.72 5.43 0.00 3.61 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 7.36 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 34 S 7.79 4.98 0.00 3.89 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 35 I 8.66 5.09 1.81 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.50 0.94 0.00 0.00 36 K 9.34 4.88 0.00 1.71 1.85 0.00 1.32 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.35 1.34 7.81 37 G 8.90 3.71 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 0.00 0.00 0.00 38 L 7.59 4.72 0.00 1.83 1.41 0.83 0.36 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 39 T 8.26 4.10 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 1.24 0.00 0.00 40 E 8.14 4.39 0.00 2.01 1.94 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 2.31 2.46 0.00 41 G 8.45 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 42 L 8.17 4.93 0.00 1.49 1.59 0.91 0.93 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 43 H 9.09 5.08 0.00 3.03 3.27 0.00 5.62 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 9.08 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 0.00 0.00 0.00 45 F 8.30 5.13 0.00 2.98 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 H 8.83 5.07 0.00 3.08 3.06 0.00 5.85 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 47 V 8.54 4.37 2.16 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 0.83 0.00 0.00 0.93 0.00 0.00 48 H 9.06 5.03 0.00 2.95 3.26 0.00 5.74 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.73 3.91 0.00 1.61 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 1.70 2.25 0.00 50 F 8.17 5.24 0.00 3.22 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 51 G 8.51 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 52 D 8.06 4.88 0.00 2.66 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 53 N 8.40 5.46 0.00 2.68 2.73 0.00 0.00 7.27 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 8.15 3.92 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 55 A 8.86 4.63 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 56 G 7.66 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 0.00 0.00 0.00 57 C 8.60 4.39 0.00 2.95 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 58 T 7.93 3.74 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 1.23 0.00 0.00 59 S 7.51 4.19 0.00 4.03 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 60 A 8.01 4.37 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 G 8.07 4.10 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 62 P 0.00 4.69 0.00 2.07 2.20 0.00 3.46 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.94 0.00 63 H 8.64 4.22 0.00 2.92 3.25 0.00 5.72 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 8.84 4.28 0.00 2.98 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 65 N 8.20 5.11 0.00 2.48 2.39 0.00 0.00 6.92 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 4.17 0.00 2.05 1.86 0.00 3.30 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.15 0.00 67 L 7.65 4.35 0.00 1.58 1.68 0.84 0.91 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 68 S 7.34 3.60 0.00 3.92 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 69 R 7.92 4.38 0.00 1.89 1.87 0.00 3.57 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 1.56 1.67 0.00 70 K 8.05 4.48 0.00 1.69 1.69 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.75 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.51 7.81 71 H 8.48 3.97 0.00 3.05 3.11 0.00 5.97 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 7.26 4.13 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 0.00 73 G 8.61 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 74 P 0.00 4.43 0.00 2.23 2.36 0.00 3.38 0.00 0.00 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 75 K 7.89 4.23 0.00 1.77 1.90 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.47 7.81 76 D 7.32 4.53 0.00 2.89 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 E 8.62 4.03 0.00 1.91 1.94 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 2.24 2.28 0.00 78 E 7.93 4.16 0.00 2.06 1.83 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 2.35 2.47 0.00 79 R 7.68 4.81 0.00 1.84 1.86 0.00 2.94 0.00 0.00 3.88 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.58 0.00 80 H 9.43 4.47 0.00 3.51 3.39 0.00 5.66 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.42 3.41 1.51 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 0.73 0.00 0.00 0.51 0.00 0.00 82 G 8.21 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 0.00 0.00 0.00 83 D 8.27 5.07 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 84 L 8.39 4.68 0.00 2.03 1.89 0.98 0.96 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 85 G 7.86 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 86 N 8.78 5.66 0.00 2.59 2.72 0.00 0.00 6.53 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 8.73 4.51 1.79 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 -0.09 0.00 0.00 0.77 0.00 0.00 88 T 8.28 5.08 4.21 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 1.20 0.00 0.00 89 A 9.10 4.93 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 D 8.87 4.56 0.00 3.01 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 91 K 8.88 3.94 0.00 1.78 1.87 0.00 1.68 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.68 1.43 7.81 92 D 8.12 4.46 0.00 2.91 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 93 G 7.71 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 0.00 0.00 0.00 0.00 94 V 7.25 4.55 2.25 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 0.91 0.00 0.00 0.92 0.00 0.00 95 A 8.91 5.29 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 96 D 8.63 4.93 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 8.27 3.72 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 0.57 0.00 0.00 98 S 8.33 4.88 0.00 3.92 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 99 I 8.63 4.69 1.94 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.25 0.98 0.00 0.00 100 E 8.68 5.13 0.00 1.86 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 2.25 2.29 0.00 101 D 8.36 4.80 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 8.63 4.86 0.00 3.99 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 0.00 103 V 8.29 3.80 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 0.82 0.00 0.00 0.96 0.00 0.00 104 I 7.78 4.26 2.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.84 1.07 0.00 0.00 105 S 8.19 4.69 0.00 3.89 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 0.00 106 L 9.32 4.42 0.00 1.85 1.69 1.03 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.53 4.64 0.00 3.93 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 0.00 108 G 8.41 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 0.00 0.00 0.00 109 D 8.58 4.88 0.00 2.87 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 8.05 4.95 0.00 3.19 3.44 0.00 5.73 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 4.31 0.00 3.08 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 0.00 112 I 8.15 3.99 1.70 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.29 1.07 0.00 0.00 113 I 7.30 3.75 1.79 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 0.39 0.83 0.00 0.00 114 G 9.15 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 0.00 115 R 7.43 4.58 0.00 1.59 1.78 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.36 0.00 116 T 8.02 4.62 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 1.19 0.00 0.00 117 L 8.62 4.83 0.00 1.76 1.50 0.53 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.68 4.94 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 0.74 0.00 0.00 0.70 0.00 0.00 119 V 8.56 5.18 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 0.91 0.00 0.00 1.05 0.00 0.00 120 H 8.68 5.17 0.00 3.21 3.50 0.00 5.66 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.15 4.16 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 2.36 2.34 0.00 122 K 8.58 4.84 0.00 1.67 1.69 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.38 7.81 123 A 8.35 4.51 1.23 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 0.00 124 D 9.58 4.72 0.00 2.77 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 D 9.22 4.66 0.00 2.94 2.88 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 0.00 126 L 9.44 3.68 0.00 1.91 1.78 0.93 1.04 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 0.00 127 G 8.73 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 0.00 0.00 0.00 0.00 128 K 7.74 4.45 0.00 1.78 1.82 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.80 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.52 7.81 129 G 7.63 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 0.00 130 G 8.15 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 0.00 131 N 7.31 4.94 0.00 2.87 2.81 0.00 0.00 6.79 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 0.00 132 E 8.79 4.03 0.00 2.06 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 2.38 2.37 0.00 133 E 8.23 3.96 0.00 2.11 2.05 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 2.38 2.47 0.00 134 S 8.23 4.20 0.00 4.16 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 0.00 135 T 7.67 4.54 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 1.20 0.00 0.00 136 K 7.79 4.26 0.00 1.77 1.77 0.00 1.86 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.31 1.48 7.81 137 T 7.98 3.97 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 1.26 0.00 0.00 138 G 8.26 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 0.00 139 N 7.83 4.39 0.00 3.08 2.89 0.00 0.00 6.94 7.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 A 7.03 4.35 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 0.00 141 G 7.32 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 0.00 142 S 8.10 4.37 0.00 3.97 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 0.00 143 R 8.26 4.63 0.00 1.65 1.82 0.00 3.19 0.00 0.00 3.13 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.62 0.00 144 L 8.42 4.26 0.00 1.63 1.73 1.00 0.70 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 0.00 145 A 7.63 4.92 1.16 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 0.00 146 C 9.42 5.10 0.00 3.05 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 0.00 147 G 8.15 4.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 V 8.38 4.25 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 0.75 0.00 0.00 0.93 0.00 0.00 149 I 8.26 4.28 1.85 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.59 0.44 0.00 0.00 150 G 9.18 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 8.30 4.36 1.85 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 1.24 0.53 0.90 0.00 0.00 152 A 8.10 4.72 1.24 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 0.00 0.00 0.00 153 Q 8.46 4.07 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00