NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.3849 8.3049 120.3427 54.9318 33.1168 178.8826 3 L 4.0409 8.8025 111.3124 52.6011 42.5719 175.0541 4 T 4.1184 8.9745 114.0809 61.0466 70.9579 174.9892 5 A 3.9114 8.5927 122.1471 55.2740 18.0074 178.9835 6 E 3.8624 8.1930 117.3189 59.8308 29.6575 178.9302 7 E 3.9450 7.9649 117.9101 59.2166 29.6391 179.2894 8 K 3.9155 7.9910 119.3574 58.9180 32.0770 178.9830 9 A 3.9426 8.1607 121.1909 55.1278 18.4341 179.1690 10 A 4.0170 7.6772 119.4342 55.5537 18.3758 180.3029 11 V 3.7684 7.9517 117.4469 65.3456 31.6471 178.8741 12 T 4.0879 7.9141 115.8654 66.0729 68.0252 176.7109 13 A 4.0580 8.2566 122.3255 55.2637 18.8320 179.1687 14 F 4.1885 8.4891 119.3064 61.1897 39.4962 177.1075 15 W 4.3822 8.8969 128.3054 60.3790 30.2627 177.9353 16 G 3.7657 7.9914 104.7825 47.8571 0.0000 175.1429 17 K 4.1629 7.5172 118.1991 56.3957 32.3426 177.3123 18 V 3.6020 6.4169 120.4298 61.9783 31.8093 176.5900 19 K 4.0986 8.3465 128.5817 55.0455 31.1970 176.7717 20 V 3.4155 7.9718 125.4704 66.1604 31.2744 176.3883 21 D 4.3425 8.2018 117.3602 58.0914 40.5323 178.8654 22 E 3.9569 7.9166 117.5205 59.6207 29.6642 179.6376 23 V 3.6092 7.7444 118.2759 65.7660 31.5112 178.2352 24 G 3.6850 7.9018 105.4727 47.8543 0.0000 175.8363 25 G 3.6182 7.6507 107.5848 47.2284 0.0000 175.2405 26 E 3.8846 8.3925 121.7312 58.8941 29.6835 178.8208 27 A 3.9110 8.1763 120.9470 55.0267 18.4810 179.1712 28 L 3.9339 8.0854 119.1358 58.3954 42.0879 179.5663 29 G 3.5082 8.1057 105.4544 47.7304 0.0000 175.7516 30 R 3.8399 8.2913 121.0807 58.8634 30.1133 178.6264 31 L 3.9985 7.9000 119.8894 58.3989 41.9642 179.1279 32 L 4.0416 7.7312 119.9709 57.2089 41.3058 179.7907 33 V 3.4897 7.6301 117.2063 65.8935 31.5761 177.8129 34 V 3.6748 8.0791 117.0099 63.8532 32.8522 175.5432 35 Y 4.0817 7.2204 115.9246 54.1766 37.8936 174.0576 36 P 4.6381 0.0000 0.0000 64.1889 31.8074 177.8369 37 W 4.3435 8.1485 115.7355 59.5252 27.7717 178.0705 38 T 4.3619 7.5544 111.0657 65.1114 67.8607 175.9461 39 Q 4.1720 8.0415 120.4615 59.0939 28.5054 179.1101 40 R 4.1001 7.9415 118.9434 59.0129 30.1532 177.2714 41 F 4.2314 7.8849 114.7508 58.6446 39.3353 175.6068 42 F 4.8345 8.3051 121.1227 56.7973 40.0492 177.4864 43 E 4.0627 8.6466 120.6167 59.5484 29.5639 178.9559 44 S 4.1952 9.1620 114.6326 60.7668 62.8397 175.6659 45 F 4.0342 8.1810 118.4188 58.6936 39.5081 175.6485 46 G 3.8760 8.3461 106.1418 43.5269 0.0000 173.3326 47 D 4.3568 8.7141 123.9205 55.2652 40.8073 176.1763 48 L 4.8584 8.2893 125.8166 54.4212 43.0813 178.8576 49 S 4.1561 8.0008 116.5443 61.3440 62.8881 175.1223 50 T 4.7119 7.4564 109.4939 58.3132 73.1250 174.0221 51 A 3.9033 8.5968 122.3465 55.8921 18.2918 179.3276 52 D 4.3187 8.2094 115.5686 57.6351 41.0869 179.2816 53 A 3.9781 8.3174 121.1257 55.1106 18.1996 179.8489 54 V 3.5250 7.8982 115.6893 66.6263 31.7690 177.9380 55 M 4.1916 8.4235 117.1950 57.7161 31.8660 177.5269 56 N 4.8115 7.6482 113.1997 51.7596 39.7638 174.7386 57 N 4.4160 7.6761 121.1254 52.9770 39.6322 173.8784 58 P 4.3021 0.0000 0.0000 65.5257 31.4249 178.9248 59 K 3.8322 8.0377 117.0153 59.1496 31.9775 179.0646 60 V 3.7389 8.5428 118.9295 66.3810 31.1874 178.2220 61 K 4.0175 7.7814 115.8582 59.2955 32.0074 179.0685 62 A 4.1290 8.3139 121.1956 55.4286 18.4306 179.0348 63 H 4.1688 9.0464 117.2795 59.5525 29.9682 177.3005 64 G 3.9396 8.6243 107.8269 47.9992 0.0000 175.4037 65 K 3.9393 7.9242 121.4364 59.2881 32.3248 178.7173 66 K 3.8682 8.1861 118.3543 59.8092 31.8643 178.9420 67 V 3.7042 7.7531 117.8422 66.2519 31.4845 177.9760 68 L 4.2405 8.2681 118.6576 58.0088 41.4154 179.5577 69 D 4.4952 8.8153 119.4856 57.4605 40.7505 178.8747 70 S 4.2028 8.4402 114.8857 61.3701 62.9111 176.1987 71 F 3.8921 8.9256 124.5376 61.3835 39.0056 177.3666 72 S 4.7381 8.6323 113.7513 61.6753 62.8482 175.9331 73 N 4.5630 8.4078 120.2281 56.4393 38.5623 177.1068 74 G 3.5732 8.2239 107.5079 48.1460 0.0000 175.3600 75 M 3.9537 8.1552 119.7846 57.1642 31.8896 178.0113 76 K 4.2652 7.8705 117.7216 56.9604 33.1673 176.6444 77 H 4.9599 7.4992 116.9484 54.9412 29.2829 175.9880 78 L 4.0526 8.0753 120.2264 56.9538 41.6706 177.8700 79 D 4.6948 7.9269 116.5473 54.3203 43.1680 175.9965 80 D 4.9665 7.8440 118.3974 52.6145 41.0175 176.3118 81 L 4.1163 7.6771 123.2417 57.4969 42.0382 179.0233 82 K 3.8991 8.1725 117.5495 59.7138 32.1712 178.9870 83 G 4.1031 8.4872 107.2165 47.6584 0.0000 175.9840 84 T 3.7566 7.7707 116.9466 65.1070 68.6118 175.7166 85 F 4.6798 7.8715 117.2341 56.6382 39.8988 176.8686 86 A 3.9342 7.7462 122.4012 55.2626 18.0692 179.4236 87 A 3.9087 7.9957 118.4538 55.6058 18.4601 179.5617 88 L 3.9576 7.9409 116.3969 57.9215 41.7947 179.3932 89 S 4.2977 8.6978 114.7696 60.7715 62.2712 175.8881 90 E 4.1017 8.0132 122.9516 58.5618 29.2487 178.6406 91 L 3.9098 8.1160 120.3283 58.6210 42.2777 178.7018 92 H 4.2446 8.7589 116.4964 59.2474 28.5978 177.3642 93 C 4.9466 8.1554 120.0824 62.4258 27.8142 175.8935 94 D 4.3949 8.4316 120.1648 56.8326 40.7716 178.3782 95 K 4.1514 7.6831 118.4429 58.4090 32.9545 177.5760 96 L 4.1089 8.1707 118.7551 56.1603 41.8579 177.0663 97 H 4.2502 7.4896 112.5931 56.7621 26.3412 175.2361 98 V 3.7626 7.8920 119.1014 61.8588 32.3705 175.0143 99 D 4.2611 8.5872 127.3531 53.3792 41.6907 175.0639 100 P 3.4710 0.0000 0.0000 64.6623 31.3437 178.1885 101 E 3.8980 8.6685 120.0767 59.4390 29.1853 178.7641 102 N 4.3092 7.8197 116.3768 56.1685 38.5233 177.2999 103 F 4.4978 7.2628 119.3765 60.5970 38.8351 177.8512 104 K 4.1061 8.0661 117.7389 59.2633 31.8875 179.2339 105 L 3.9035 7.4498 118.4362 57.7467 41.4310 178.9064 106 L 4.0571 8.1602 120.3118 58.2410 42.1382 178.8943 107 G 4.0018 8.0964 104.8531 48.3437 0.0000 175.0320 108 N 4.4385 8.5846 119.1447 55.9637 38.4887 177.7237 109 V 3.5943 8.2335 120.0159 65.9282 31.7092 177.4802 110 L 3.8139 8.6671 120.9113 58.4598 41.8625 179.3186 111 V 3.5089 7.6302 117.4330 66.0143 31.5611 178.1743 112 V 3.6255 7.7468 117.8977 65.8816 31.2452 178.2322 113 V 3.5295 7.9752 118.2219 65.9106 31.3552 177.9264 114 L 3.9846 7.6225 118.4418 57.8704 41.3170 179.4914 115 A 4.0140 7.4717 120.2261 54.9070 18.0401 179.7054 116 R 3.8018 7.7318 116.6257 59.7390 30.3096 178.2125 117 N 4.3600 8.2266 114.5317 54.7608 38.9677 176.3666 118 F 4.7140 8.5666 117.4714 55.3109 41.0603 176.9873 119 G 3.8745 8.9822 108.2340 46.2993 0.0000 177.7364 120 K 4.1574 8.9149 123.6987 58.5114 31.9908 177.5139 121 E 4.0998 8.3078 119.6608 58.3967 29.6457 176.3344 122 F 4.3552 8.0969 121.8008 56.8557 38.2856 175.6294 123 T 4.2841 7.5082 117.8608 59.5904 71.4656 173.4350 124 P 4.0792 0.0000 0.0000 65.9220 30.8092 178.8629 125 V 3.4939 7.6399 116.0643 66.0901 31.4915 177.6995 126 L 3.8474 7.5313 119.8946 57.8416 41.7797 178.5302 127 Q 3.4031 7.9409 119.6810 58.8435 28.6934 177.8939 128 A 3.9663 7.6195 120.4379 55.6763 18.3280 179.0744 129 D 4.3750 7.7008 116.2478 57.5623 40.8367 179.1440 130 F 3.8570 8.0336 117.8442 60.3876 38.9420 177.7479 131 Q 4.1668 8.5420 118.0992 58.8241 28.4395 178.9981 132 K 3.9681 7.8139 119.3461 59.4675 32.0376 179.0708 133 V 3.4722 7.7335 117.9169 66.4474 31.4961 178.3322 134 V 3.9014 8.3490 111.6461 64.1749 31.4237 178.5728 135 A 4.1895 8.1242 120.9737 54.7859 18.3509 179.7608 136 G 3.5379 8.0772 104.3322 48.0534 0.0000 176.1388 137 V 3.1728 7.8827 120.5015 65.0854 31.2906 178.0756 138 A 3.8855 7.7891 120.4879 55.1830 18.0767 179.2645 139 N 4.3346 8.4696 113.6364 56.4910 39.0640 177.0804 140 A 4.1536 8.4393 122.3786 55.2758 18.3224 179.7003 141 L 3.6920 8.0218 117.5612 57.5830 41.5377 178.8727 142 A 4.7425 8.1807 118.2659 52.9467 17.2598 178.3986 143 H 3.8930 7.9224 120.2582 59.7919 29.6782 177.2033 144 R 3.9591 7.7290 117.3969 58.0261 30.3763 176.8421 145 Y 4.6020 7.7982 116.2808 59.5759 39.0519 175.5423 146 H 4.5883 7.2633 115.0946 55.5606 28.7888 174.3474 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 2 M 8.30 4.38 0.00 1.94 1.37 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.50 0.00 3 L 8.80 4.04 0.00 1.69 1.52 0.85 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.97 4.12 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 1.24 0.00 0.00 5 A 8.59 3.91 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 6 E 8.19 3.86 0.00 2.03 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 0.00 2.37 2.41 0.00 7 E 7.96 3.95 0.00 1.99 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.28 0.00 8 K 7.99 3.92 0.00 2.16 1.77 0.00 1.77 0.00 0.00 1.62 0.00 0.00 3.06 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.38 7.81 9 A 8.16 3.94 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 10 A 7.68 4.02 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 11 V 7.95 3.77 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 0.64 0.00 0.00 -0.28 0.00 0.00 12 T 7.91 4.09 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 13 A 8.26 4.06 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 F 8.49 4.19 0.00 3.34 3.40 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.90 4.38 0.00 3.95 3.38 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 16 G 7.99 3.77 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 0.00 0.00 0.00 17 K 7.52 4.16 0.00 1.39 1.77 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.73 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.36 7.81 18 V 6.42 3.60 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.00 0.00 0.30 0.00 0.00 19 K 8.35 4.10 0.00 1.74 1.60 0.00 1.73 0.00 0.00 1.78 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.35 7.81 20 V 7.97 3.42 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.80 0.00 0.00 21 D 8.20 4.34 0.00 2.67 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 22 E 7.92 3.96 0.00 2.06 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.31 0.00 23 V 7.74 3.61 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.91 0.00 0.00 24 G 7.90 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 7.65 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.39 3.88 0.00 1.99 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 2.26 2.28 0.00 27 A 8.18 3.91 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 28 L 8.09 3.93 0.00 1.84 1.61 0.65 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.11 3.51 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.29 3.84 0.00 1.90 1.94 0.00 3.10 0.00 0.00 3.05 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 31 L 7.90 4.00 0.00 1.93 1.89 1.04 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.73 4.04 0.00 1.82 1.66 0.77 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.63 3.49 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 0.71 0.00 0.00 0.92 0.00 0.00 34 V 8.08 3.67 1.61 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 -0.13 0.00 0.00 0.74 0.00 0.00 35 Y 7.22 4.08 0.00 2.33 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.64 0.00 2.25 2.13 0.00 3.89 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 2.14 2.10 0.00 37 W 8.15 4.34 0.00 3.57 3.52 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 38 T 7.55 4.36 4.42 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 0.00 0.00 0.00 1.06 0.00 0.00 39 Q 8.04 4.17 0.00 2.25 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.56 0.00 40 R 7.94 4.10 0.00 1.76 1.72 0.00 3.17 0.00 0.00 3.00 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.50 0.00 41 F 7.88 4.23 0.00 2.41 2.51 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 0.00 0.00 0.00 0.00 42 F 8.31 4.83 0.00 2.88 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 43 E 8.65 4.06 0.00 2.25 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 0.00 2.37 2.47 0.00 44 S 9.16 4.20 0.00 3.99 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 F 8.18 4.03 0.00 3.47 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 46 G 8.35 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 47 D 8.71 4.36 0.00 2.65 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 48 L 8.29 4.86 0.00 1.76 1.62 1.13 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.00 4.16 0.00 3.95 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 50 T 7.46 4.71 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 1.21 0.00 0.00 51 A 8.60 3.90 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 52 D 8.21 4.32 0.00 2.69 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 53 A 8.32 3.98 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 54 V 7.90 3.53 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 1.01 0.00 0.00 55 M 8.42 4.19 0.00 1.95 2.15 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 2.60 2.83 0.00 56 N 7.65 4.81 0.00 2.83 2.84 0.00 0.00 6.97 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 N 7.68 4.42 0.00 2.99 2.89 0.00 0.00 7.15 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 P 0.00 4.30 0.00 2.16 2.06 0.00 3.64 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.16 0.00 59 K 8.04 3.83 0.00 1.69 0.82 0.00 0.83 0.00 0.00 1.23 0.00 0.00 2.69 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.31 1.25 7.81 60 V 8.54 3.74 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 0.92 0.00 0.00 1.09 0.00 0.00 61 K 7.78 4.02 0.00 1.96 1.86 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.47 1.46 7.81 62 A 8.31 4.13 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 H 9.05 4.17 0.00 3.85 3.50 0.00 5.82 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 64 G 8.62 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 65 K 7.92 3.94 0.00 1.84 1.87 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.48 7.81 66 K 8.19 3.87 0.00 2.00 1.90 0.00 1.78 0.00 0.00 1.80 0.00 0.00 3.01 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.58 1.56 7.81 67 V 7.75 3.70 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 1.25 0.00 0.00 1.02 0.00 0.00 68 L 8.27 4.24 0.00 2.00 1.83 1.03 0.96 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 69 D 8.82 4.50 0.00 2.97 2.79 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 70 S 8.44 4.20 0.00 4.15 4.39 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 71 F 8.93 3.89 0.00 3.56 3.53 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 72 S 8.63 4.74 0.00 4.37 4.33 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 73 N 8.41 4.56 0.00 2.87 2.92 0.00 0.00 7.00 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 74 G 8.22 3.57 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 0.00 0.00 0.00 75 M 8.16 3.95 0.00 1.64 2.10 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 2.38 0.00 76 K 7.87 4.27 0.00 1.70 1.59 0.00 1.62 0.00 0.00 1.72 0.00 0.00 3.10 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.39 1.46 7.81 77 H 7.50 4.96 0.00 3.02 3.17 0.00 5.63 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.08 4.05 0.00 1.56 1.66 0.82 0.92 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 79 D 7.93 4.69 0.00 2.62 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 80 D 7.84 4.97 0.00 2.67 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 L 7.68 4.12 0.00 1.74 1.81 0.85 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.17 3.90 0.00 1.65 1.73 0.00 1.77 0.00 0.00 1.69 0.00 0.00 3.12 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.44 7.81 83 G 8.49 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 84 T 7.77 3.76 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 0.75 0.00 0.00 85 F 7.87 4.68 0.00 3.13 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 86 A 7.75 3.93 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 87 A 8.00 3.91 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 88 L 7.94 3.96 0.00 2.06 1.89 1.19 0.86 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 89 S 8.70 4.30 0.00 3.88 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 90 E 8.01 4.10 0.00 2.29 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 0.00 2.55 2.15 0.00 91 L 8.12 3.91 0.00 1.77 1.73 0.91 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.76 4.24 0.00 3.35 3.63 0.00 5.86 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 8.16 4.95 0.00 2.81 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 0.00 0.00 0.00 0.00 94 D 8.43 4.39 0.00 2.87 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 95 K 7.68 4.15 0.00 1.72 1.82 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.51 7.81 96 L 8.17 4.11 0.00 1.94 1.78 0.80 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.49 4.25 0.00 3.55 3.54 0.00 5.65 0.00 0.00 0.00 0.00 8.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.89 3.76 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 0.20 0.00 0.00 0.52 0.00 0.00 99 D 8.59 4.26 0.00 2.65 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 3.47 0.00 2.33 2.59 0.00 3.34 0.00 0.00 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.45 0.00 101 E 8.67 3.90 0.00 2.12 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 0.00 2.26 2.43 0.00 102 N 7.82 4.31 0.00 2.53 2.76 0.00 0.00 6.93 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 F 7.26 4.50 0.00 3.12 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 0.00 104 K 8.07 4.11 0.00 2.08 1.88 0.00 1.79 0.00 0.00 2.01 0.00 0.00 3.08 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.56 1.64 7.81 105 L 7.45 3.90 0.00 1.64 1.13 0.56 0.19 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 0.00 106 L 8.16 4.06 0.00 1.85 1.91 0.95 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.10 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.58 4.44 0.00 3.08 2.98 0.00 0.00 6.71 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 0.00 109 V 8.23 3.59 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 1.14 0.00 0.00 1.16 0.00 0.00 110 L 8.67 3.81 0.00 1.82 1.74 0.16 0.35 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 0.00 111 V 7.63 3.51 2.32 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 1.29 0.00 0.00 1.20 0.00 0.00 112 V 7.75 3.63 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 0.94 0.00 0.00 1.00 0.00 0.00 113 V 7.98 3.53 2.15 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 1.04 0.00 0.00 0.96 0.00 0.00 114 L 7.62 3.98 0.00 0.88 1.07 0.60 0.68 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 0.00 115 A 7.47 4.01 1.52 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 0.00 116 R 7.73 3.80 0.00 1.96 1.97 0.00 3.22 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 117 N 8.23 4.36 0.00 2.77 2.30 0.00 0.00 6.92 6.98 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 0.00 118 F 8.57 4.71 0.00 3.44 3.34 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 0.00 119 G 8.98 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 0.00 120 K 8.91 4.16 0.00 1.82 1.95 0.00 1.79 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.48 7.81 121 E 8.31 4.10 0.00 2.34 2.46 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 2.66 2.45 0.00 122 F 8.10 4.36 0.00 2.97 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 0.00 123 T 7.51 4.28 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 1.27 0.00 0.00 124 P 0.00 4.08 0.00 2.12 2.12 0.00 3.55 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.14 0.00 125 V 7.64 3.49 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.89 0.00 0.00 126 L 7.53 3.85 0.00 1.62 1.37 0.96 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 127 Q 7.94 3.40 0.00 1.23 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.50 0.00 0.00 0.00 0.00 0.00 2.38 2.55 0.00 128 A 7.62 3.97 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 0.00 129 D 7.70 4.37 0.00 2.80 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 0.00 130 F 8.03 3.86 0.00 3.31 3.32 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 0.00 131 Q 8.54 4.17 0.00 2.22 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.71 2.60 0.00 132 K 7.81 3.97 0.00 1.83 1.81 0.00 1.63 0.00 0.00 1.54 0.00 0.00 2.87 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.44 1.61 7.81 133 V 7.73 3.47 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 1.00 0.00 0.00 0.51 0.00 0.00 134 V 8.35 3.90 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 1.26 0.00 0.00 1.14 0.00 0.00 135 A 8.12 4.19 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.08 3.54 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 0.00 137 V 7.88 3.17 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 -0.13 0.00 0.00 0.40 0.00 0.00 138 A 7.79 3.89 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.47 4.33 0.00 2.86 2.92 0.00 0.00 7.07 7.21 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 0.00 140 A 8.44 4.15 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 0.00 141 L 8.02 3.69 0.00 1.26 0.39 0.29 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 142 A 8.18 4.74 1.74 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 0.00 0.00 143 H 7.92 3.89 0.00 3.44 3.27 0.00 5.79 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 R 7.73 3.96 0.00 1.36 1.73 0.00 3.29 0.00 0.00 3.15 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 145 Y 7.80 4.60 0.00 3.11 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 0.00 146 H 7.26 4.59 0.00 3.26 3.34 0.00 5.59 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