NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1839 8.1727 122.0502 56.3037 34.1904 173.9984 2 V 4.5463 8.1012 126.1074 60.7503 32.3168 174.7282 3 F 4.2808 9.8160 128.8666 57.4875 40.0586 175.0340 4 E 4.3048 9.2635 121.3529 55.9414 30.7774 177.9555 5 R 3.2873 8.7627 121.8163 60.0420 30.1436 179.6431 6 C 4.3900 8.0740 115.1767 59.1967 41.3121 175.4765 7 E 3.8847 8.1360 121.0130 59.2080 29.3009 178.3884 8 L 3.5979 8.1799 120.3207 57.9009 41.9954 178.7423 9 A 3.9363 7.7901 120.6815 55.3701 18.3410 179.9163 10 R 3.8776 8.2006 116.6325 59.4472 30.0088 179.5491 11 T 3.8544 7.9301 115.6692 66.6753 68.5259 176.7711 12 L 3.8585 8.2891 121.2131 57.4835 41.5626 179.4985 13 K 3.9337 8.2495 120.0123 59.5150 31.9680 179.1003 14 R 4.0134 7.9729 114.8808 58.5171 29.4254 177.7050 15 L 4.4280 7.3306 117.5460 54.1756 41.7856 176.9242 16 G 3.8825 7.9552 106.9921 46.3883 0.0000 174.8772 17 M 3.9387 7.9389 120.9279 56.2593 32.3709 175.6555 18 D 4.4359 7.9987 117.8898 56.3646 41.0605 175.7974 19 G 3.9844 9.6424 116.3684 45.2310 0.0000 171.4396 20 Y 4.2356 8.2247 121.8576 58.8653 39.1140 176.2475 21 R 3.3791 9.0073 126.2663 57.2071 27.8936 177.1483 22 G 3.8493 8.1246 103.4563 45.5040 0.0000 173.8281 23 I 4.1747 7.4682 121.8308 58.9752 38.6375 175.8543 24 S 4.6145 8.3180 120.0876 57.6282 63.9512 174.6877 25 L 4.2209 9.1717 123.5502 58.8218 41.5897 179.5315 26 A 4.1658 8.1128 119.9429 55.0658 18.3628 179.2798 27 N 4.4502 8.2082 114.9711 56.2962 38.5607 177.6321 28 W 4.2553 8.0492 119.8794 60.0808 29.0804 178.3042 29 M 4.1519 8.5958 118.9772 58.6086 31.4116 178.0047 30 C 3.2145 8.2450 118.7601 59.0102 43.8791 175.3983 31 L 3.9684 7.9979 121.7524 58.2424 41.7618 178.8012 32 A 4.1112 8.3768 120.9164 54.9095 18.2909 179.3598 33 K 2.7442 8.2138 118.3955 59.3428 32.0066 179.0108 34 W 4.2456 7.5914 116.9595 58.9069 29.0801 178.4369 35 E 4.3072 8.3463 118.9447 58.6617 29.2687 177.7288 36 S 4.5115 7.8285 109.7972 56.4930 64.4631 174.7563 37 G 3.5930 8.3062 108.7933 46.7007 0.0000 173.2325 38 Y 3.6624 7.0715 111.7059 58.7963 35.7062 168.5291 39 N 5.4371 7.7610 118.8847 51.8806 40.6385 175.5690 40 T 3.9746 8.8971 116.6121 64.1003 69.1892 175.9577 41 R 4.3852 8.1688 119.2377 55.8617 30.7474 176.3206 42 A 4.3275 7.6575 122.1923 52.6125 19.3169 177.0179 43 T 5.0339 8.3220 110.6119 60.1875 72.5144 173.1023 44 N 4.9789 9.0120 120.3466 51.9601 42.7642 172.6774 45 Y 4.7874 8.7113 125.0974 56.7285 40.9769 173.9572 46 N 4.7043 8.4235 124.8123 51.2663 38.6950 175.3991 47 A 3.5034 8.2738 127.5428 54.7409 18.8979 178.9267 48 G 3.9741 7.9925 104.0566 48.5988 0.0000 173.8763 49 D 4.7689 7.5885 116.2390 51.8304 39.8378 175.9007 50 R 3.9994 8.3177 115.9246 57.1233 28.1554 175.9018 51 S 4.9770 7.6143 111.9465 57.0663 66.4346 172.7187 52 T 5.1326 8.9029 116.1380 61.9382 72.4623 172.8041 53 D 5.5255 9.2168 125.0881 53.2329 43.1276 175.0612 54 Y 4.9084 9.2764 121.0863 57.4846 41.5436 177.2415 55 G 4.5176 9.3609 111.8147 46.3148 0.0000 173.5623 56 I 3.6866 8.2086 117.3235 63.2665 37.9582 177.1867 57 F 4.7050 7.9634 115.9573 56.3642 39.8499 175.1788 58 Q 3.6551 7.9576 119.0479 57.1130 26.5146 173.9895 59 I 4.5072 8.1290 118.8393 61.1053 39.3112 176.7370 60 N 5.5981 9.2229 125.0386 52.9744 40.4111 175.4105 61 S 4.9566 8.9183 118.7641 59.2153 63.6033 175.2214 62 R 3.7532 8.8990 122.9081 58.9245 30.3602 177.6192 63 Y 4.0834 7.5434 115.1064 57.9419 39.7865 176.9008 64 W 4.8401 8.2223 118.8236 57.2677 31.9343 173.8452 65 C 5.5653 8.2013 112.2442 53.5067 46.4314 172.4284 66 N 5.1690 9.1041 119.7447 52.3557 39.8884 174.9430 67 D 4.8076 8.9215 123.6629 52.4347 40.6463 176.6258 68 G 4.1422 8.6567 109.1785 45.6059 0.0000 174.6931 69 K 4.5346 8.0465 116.5357 56.2013 33.2525 175.5684 70 T 4.6268 7.8357 117.2872 61.0956 69.3205 172.7434 71 P 4.4447 0.0000 0.0000 63.7756 31.9663 176.9906 72 G 3.7637 8.7812 107.5407 45.3449 0.0000 173.6951 73 A 4.0297 7.4402 122.3840 52.7557 18.7230 177.8878 74 V 3.8683 8.5249 121.8633 62.1683 33.3393 175.2554 75 N 4.1823 8.0344 117.2257 54.4182 36.9978 175.0416 76 A 4.0043 8.0668 120.7610 55.1293 19.0116 178.5092 77 C 4.5456 8.7360 111.9737 57.3971 41.1017 173.0436 78 H 4.0292 7.9030 116.5111 56.7666 26.4122 174.6627 79 L 4.8341 8.2859 117.5554 52.5376 46.1172 177.0164 80 S 4.5769 8.4489 116.6313 58.4210 63.1861 175.9740 81 C 4.1576 8.7936 124.7472 59.5354 38.9365 176.4557 82 S 3.9296 7.8461 115.1818 60.6807 62.3089 175.9245 83 A 4.1952 7.9600 123.5576 53.9013 18.2195 177.6806 84 L 4.5058 7.6741 117.0501 54.7011 41.8499 177.5039 85 L 5.1228 7.7386 117.1580 54.5541 42.3206 176.7385 86 Q 4.3641 7.7918 117.7634 55.4855 29.4950 175.9564 87 D 4.4405 8.4868 119.5153 56.9418 41.2186 176.8339 88 N 4.5342 8.1003 118.2823 53.4030 39.2160 174.6008 89 I 4.3025 8.4001 118.6951 60.9439 38.0705 176.9714 90 A 3.9402 8.4611 125.2585 56.0130 18.1847 180.2113 91 D 4.2922 8.0798 116.5237 57.2013 40.9240 178.5383 92 A 4.0878 8.0130 120.9461 55.3811 18.3570 179.7401 93 V 3.4223 8.2409 116.8366 65.9155 31.5682 178.0458 94 A 3.8224 8.0641 120.6630 55.1921 18.1426 178.8501 95 C 4.1826 8.3329 116.7269 59.6270 38.0016 175.4782 96 A 3.9190 8.2868 122.8221 55.1657 17.5913 179.7358 97 K 3.7232 7.6930 116.1549 59.4219 32.4080 179.1309 98 R 4.0576 7.7478 118.9005 59.4210 30.0644 178.5984 99 V 2.4514 7.4438 117.9296 65.6290 31.1647 177.6574 100 V 4.0249 7.2953 107.9672 62.0528 31.7685 177.7753 101 R 4.1989 7.7107 117.7834 57.0603 30.5291 176.5012 102 D 4.7089 7.3644 118.8993 52.9761 41.7361 175.5592 103 P 4.2749 0.0000 0.0000 65.9040 31.1537 178.3715 104 Q 4.0107 8.1257 116.8082 56.7637 29.7623 177.4233 105 G 4.0268 7.9753 106.9645 46.0745 0.0000 175.3749 106 I 3.8107 7.7195 118.9872 63.2586 38.1605 178.2592 107 R 4.2519 7.1631 117.8802 58.3854 29.9680 177.6331 108 A 4.1528 7.5229 119.6675 53.2964 18.6816 177.3433 109 W 4.7783 8.2087 117.0138 55.1683 30.0097 177.4657 110 V 3.7566 8.6738 123.7619 65.7795 30.9023 177.4223 111 A 4.0987 8.3827 120.4079 55.0271 18.0393 179.2180 112 W 3.9642 8.4889 126.6799 60.6847 30.5413 178.5224 113 R 3.6853 8.0545 116.4707 59.2957 29.6840 178.3557 114 N 4.3930 8.4703 115.7317 55.3492 38.6685 176.7147 115 R 4.1895 7.7721 116.0254 55.9176 31.2246 175.8835 116 C 4.5568 7.1364 113.8793 57.8677 43.3215 174.2947 117 Q 3.2288 6.7984 119.8821 57.3299 28.8183 175.5868 118 N 4.1746 8.5412 120.9979 54.5746 36.3906 173.8623 119 R 4.5780 7.2136 113.2939 53.8386 33.9468 175.3438 120 D 4.4610 8.5898 119.0322 54.7408 41.0128 175.9958 121 V 4.6174 8.3003 119.0413 61.2444 32.5173 178.1054 122 R 4.0821 8.1944 122.0874 59.1494 29.8515 178.8041 123 Q 3.9979 8.0743 115.6484 59.1932 28.5332 178.3300 124 Y 3.9185 7.8233 115.6632 60.0935 38.2351 176.8221 125 V 4.3250 7.8416 111.1791 60.7398 32.8130 175.6584 126 Q 4.1509 7.3930 120.1466 57.6263 28.7372 177.2107 127 G 3.9780 9.0416 111.1469 45.6575 0.0000 174.3835 128 C 4.4263 7.8747 115.3864 56.9404 40.5929 174.2372 129 G 3.8605 8.1940 107.3556 46.3529 0.0000 174.1061 130 V 3.9823 7.7909 118.0366 61.0832 31.8865 175.8968 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 K 8.17 4.18 0.00 1.71 1.81 0.00 1.29 0.00 0.00 1.13 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.90 0.97 7.81 2 V 8.10 4.55 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 0.91 0.00 0.00 0.94 0.00 0.00 3 F 9.82 4.28 0.00 2.88 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 4 E 9.26 4.30 0.00 1.89 1.86 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 2.29 2.38 0.00 5 R 8.76 3.29 0.00 1.94 1.93 0.00 3.46 0.00 0.00 3.49 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 6 C 8.07 4.39 0.00 3.00 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 7 E 8.14 3.88 0.00 2.05 2.21 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 2.62 2.41 0.00 8 L 8.18 3.60 0.00 1.35 1.32 -0.12 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.79 3.94 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 R 8.20 3.88 0.00 1.87 1.99 0.00 3.13 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 11 T 7.93 3.85 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 1.19 0.00 0.00 12 L 8.29 3.86 0.00 1.55 1.56 0.91 0.52 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 13 K 8.25 3.93 0.00 1.94 1.99 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 7.97 4.01 0.00 2.00 2.18 0.00 3.10 0.00 0.00 3.21 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.64 0.00 15 L 7.33 4.43 0.00 1.48 1.60 0.84 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.96 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 17 M 7.94 3.94 0.00 1.26 1.97 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.22 0.00 18 D 8.00 4.44 0.00 2.68 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 19 G 9.64 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 8.22 4.24 0.00 3.37 3.19 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 21 R 9.01 3.38 0.00 1.88 1.82 0.00 3.23 0.00 0.00 2.98 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.30 0.00 22 G 8.12 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 23 I 7.47 4.17 1.80 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.59 -0.30 0.00 0.00 24 S 8.32 4.61 0.00 4.07 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 25 L 9.17 4.22 0.00 2.07 1.83 0.99 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.11 4.17 1.54 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 27 N 8.21 4.45 0.00 2.83 2.71 0.00 0.00 6.92 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 W 8.05 4.26 0.00 3.52 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 29 M 8.60 4.15 0.00 2.14 2.36 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.94 0.00 30 C 8.24 3.21 0.00 2.62 3.20 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 31 L 8.00 3.97 0.00 1.80 1.85 0.53 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.38 4.11 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.21 2.74 0.00 1.46 1.45 0.00 0.74 0.00 0.00 1.46 0.00 0.00 2.70 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.31 0.32 7.81 34 W 7.59 4.25 0.00 3.36 3.22 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 35 E 8.35 4.31 0.00 1.98 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 2.54 2.54 0.00 36 S 7.83 4.51 0.00 4.08 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 37 G 8.31 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 Y 7.07 3.66 0.00 3.33 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 39 N 7.76 5.44 0.00 2.74 2.80 0.00 0.00 7.02 7.86 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 40 T 8.90 3.97 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 1.45 0.00 0.00 41 R 8.17 4.39 0.00 2.00 2.03 0.00 3.19 0.00 0.00 3.25 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 42 A 7.66 4.33 1.31 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 0.00 0.00 0.00 0.00 0.00 0.00 43 T 8.32 5.03 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 1.28 0.00 0.00 44 N 9.01 4.98 0.00 2.84 2.71 0.00 0.00 6.66 8.24 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 45 Y 8.71 4.79 0.00 2.97 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 46 N 8.42 4.70 0.00 2.63 2.60 0.00 0.00 6.59 6.94 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 47 A 8.27 3.50 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 48 G 7.99 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 49 D 7.59 4.77 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 50 R 8.32 4.00 0.00 2.02 2.19 0.00 3.12 0.00 0.00 3.20 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.54 0.00 51 S 7.61 4.98 0.00 3.85 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 52 T 8.90 5.13 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 0.66 0.00 0.00 53 D 9.22 5.53 0.00 2.71 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 54 Y 9.28 4.91 0.00 2.96 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 55 G 9.36 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.21 3.69 1.68 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.71 0.11 0.00 0.00 57 F 7.96 4.71 0.00 3.21 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 58 Q 7.96 3.66 0.00 2.53 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 6.81 0.00 0.00 0.00 0.00 0.00 2.50 2.80 0.00 59 I 8.13 4.51 2.15 0.00 0.00 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 1.42 1.18 1.15 0.00 0.00 60 N 9.22 5.60 0.00 3.12 3.06 0.00 0.00 6.95 7.75 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 61 S 8.92 4.96 0.00 4.08 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 62 R 8.90 3.75 0.00 1.54 1.08 0.00 2.72 0.00 0.00 2.88 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.26 0.00 63 Y 7.54 4.08 0.00 1.60 1.63 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 64 W 8.22 4.84 0.00 3.50 3.20 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 65 C 8.20 5.57 0.00 3.06 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 66 N 9.10 5.17 0.00 2.83 2.69 0.00 0.00 7.00 8.17 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 67 D 8.92 4.81 0.00 2.82 2.63 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 68 G 8.66 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 0.00 0.00 0.00 69 K 8.05 4.53 0.00 1.77 1.79 0.00 1.66 0.00 0.00 1.77 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.36 1.43 7.81 70 T 7.84 4.63 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 1.17 0.00 0.00 71 P 0.00 4.44 0.00 2.15 2.04 0.00 3.85 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 1.97 1.97 0.00 72 G 8.78 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 73 A 7.44 4.03 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 74 V 8.52 3.87 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 0.66 0.00 0.00 0.85 0.00 0.00 75 N 8.03 4.18 0.00 2.90 2.68 0.00 0.00 7.12 7.70 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 76 A 8.07 4.00 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 77 C 8.74 4.55 0.00 3.27 3.24 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 78 H 7.90 4.03 0.00 3.31 3.37 0.00 5.79 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.29 4.83 0.00 1.69 1.50 1.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.45 4.58 0.00 3.83 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 81 C 8.79 4.16 0.00 2.29 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 82 S 7.85 3.93 0.00 4.07 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 83 A 7.96 4.20 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 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.67 4.51 0.00 1.94 1.81 1.05 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.74 5.12 0.00 1.78 1.71 1.14 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.79 4.36 0.00 2.18 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.48 7.12 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 87 D 8.49 4.44 0.00 2.63 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 88 N 8.10 4.53 0.00 2.70 2.75 0.00 0.00 6.92 7.94 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 89 I 8.40 4.30 1.75 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.00 0.95 0.00 0.00 90 A 8.46 3.94 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 91 D 8.08 4.29 0.00 2.75 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 92 A 8.01 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 93 V 8.24 3.42 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 0.80 0.00 0.00 0.90 0.00 0.00 94 A 8.06 3.82 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 95 C 8.33 4.18 0.00 3.12 3.27 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 96 A 8.29 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.69 3.72 0.00 1.60 1.40 0.00 1.31 0.00 0.00 0.94 0.00 0.00 2.28 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.30 0.92 7.81 98 R 7.75 4.06 0.00 1.97 2.14 0.00 3.27 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.90 0.00 99 V 7.44 2.45 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 -0.55 0.00 0.00 100 V 7.30 4.02 2.34 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 1.04 0.00 0.00 1.43 0.00 0.00 101 R 7.71 4.20 0.00 2.06 2.04 0.00 3.24 0.00 0.00 3.43 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.12 0.00 102 D 7.36 4.71 0.00 2.95 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.27 0.00 2.02 2.10 0.00 3.68 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 104 Q 8.13 4.01 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.76 0.00 0.00 0.00 0.00 0.00 2.43 2.33 0.00 105 G 7.98 4.03 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 0.00 0.00 0.00 106 I 7.72 3.81 1.08 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.92 -0.74 0.00 0.00 107 R 7.16 4.25 0.00 2.04 2.07 0.00 3.25 0.00 0.00 3.33 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.66 0.00 108 A 7.52 4.15 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.21 4.78 0.00 3.64 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 0.00 110 V 8.67 3.76 2.17 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 1.09 0.00 0.00 1.01 0.00 0.00 111 A 8.38 4.10 1.53 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 0.00 0.00 112 W 8.49 3.96 0.00 3.44 3.44 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 0.00 113 R 8.05 3.69 0.00 1.97 1.98 0.00 3.38 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.03 0.00 114 N 8.47 4.39 0.00 2.55 2.75 0.00 0.00 6.92 7.50 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 0.00 115 R 7.77 4.19 0.00 1.18 0.88 0.00 2.88 0.00 0.00 2.92 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.28 0.00 116 C 7.14 4.56 0.00 1.61 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 0.00 117 Q 6.80 3.23 0.00 0.93 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.71 0.00 0.00 0.00 0.00 0.00 2.19 2.13 0.00 118 N 8.54 4.17 0.00 2.77 2.80 0.00 0.00 6.81 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 0.00 119 R 7.21 4.58 0.00 1.80 1.76 0.00 3.18 0.00 0.00 3.07 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.55 0.00 120 D 8.59 4.46 0.00 2.62 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.30 4.62 2.27 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 0.95 0.00 0.00 1.08 0.00 0.00 122 R 8.19 4.08 0.00 1.88 2.01 0.00 3.61 0.00 0.00 3.32 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.68 0.00 123 Q 8.07 4.00 0.00 2.06 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.91 0.00 0.00 0.00 0.00 0.00 1.45 1.82 0.00 124 Y 7.82 3.92 0.00 3.16 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 0.00 125 V 7.84 4.33 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 0.98 0.00 0.00 1.05 0.00 0.00 126 Q 7.39 4.15 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.50 0.00 0.00 0.00 0.00 0.00 2.52 2.46 0.00 127 G 9.04 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 C 7.87 4.43 0.00 3.11 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 0.00 129 G 8.19 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 V 7.79 3.98 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 0.96 0.00 0.00