NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2285 8.3144 121.7901 55.5952 33.1591 175.1322 2 E 3.8393 8.4753 124.8169 54.7906 30.2806 175.1645 3 T 4.1991 8.7281 118.2594 61.3080 72.1074 175.1262 4 A 4.0965 8.5605 124.0093 55.3880 18.3338 180.0944 5 A 4.1253 7.9793 118.6915 55.1254 18.5297 179.5953 6 A 4.0005 8.1807 119.4859 55.0624 18.4137 179.7596 7 K 4.0906 8.4328 120.0229 59.1104 32.2815 178.7096 8 F 4.0946 8.6412 121.3005 61.2634 39.2727 176.7364 9 E 3.9828 8.2206 119.0513 59.2844 29.2858 178.7495 10 R 3.8895 7.9370 117.5214 59.7045 30.2698 178.2143 11 Q 3.9849 7.9410 116.4001 58.0466 29.0692 176.3230 12 H 4.5683 7.8269 113.8646 53.8287 31.5767 173.1332 13 M 4.7990 8.1062 118.7365 53.7095 33.8026 175.7269 14 D 4.8187 9.4268 124.0212 52.4497 42.1023 176.0159 15 S 4.4244 8.7264 119.5921 59.8567 63.4202 175.5971 16 S 4.4592 7.8400 113.9724 59.2843 63.4405 174.3094 17 T 4.7099 7.4954 110.2241 59.7934 71.3526 174.1923 18 S 4.1839 8.6709 119.2332 61.3639 63.2821 173.9247 19 A 3.9248 6.9529 119.2777 50.8252 21.4584 175.2628 20 A 3.3461 7.8756 123.1105 51.7065 18.9919 178.3669 21 S 4.2972 8.5202 116.9495 60.5772 64.1531 173.9858 22 S 4.6010 7.5365 113.6180 56.8018 65.2862 175.1293 23 S 4.2536 8.5974 115.0047 61.1149 62.8297 175.2654 24 N 4.5414 8.0297 118.3666 55.0821 39.0263 176.3176 25 Y 4.0364 8.1063 119.7125 61.0711 38.6306 177.6976 26 C 4.1498 8.2974 116.8995 60.1491 39.7227 175.5969 27 N 4.3653 8.3151 117.5130 56.8372 38.0667 177.2130 28 Q 4.0446 7.9622 118.9228 58.7999 28.9020 178.4740 29 M 3.6585 7.6460 119.8332 58.3953 31.7193 178.6109 30 M 4.0111 8.0864 119.2485 58.1250 32.0908 178.8192 31 K 3.9747 7.5403 118.7461 59.3920 32.2727 179.1751 32 S 4.1515 7.9811 112.7713 60.9520 63.1732 175.2207 33 R 4.0883 7.9241 117.9252 56.4062 30.0631 176.4507 34 N 4.4480 7.9588 114.2510 54.0984 35.8688 175.5264 35 L 4.1782 7.7497 120.1055 56.8427 41.8036 178.5687 36 T 5.9535 7.6079 106.8811 60.3324 69.2491 174.8565 37 K 4.0629 8.4602 123.8012 60.0652 32.0314 177.1816 38 D 4.7848 7.6411 115.0374 54.5010 42.7694 175.8337 39 R 3.6951 7.1403 113.5671 55.4044 31.3065 174.2236 40 C 4.7290 8.8211 116.0458 55.9268 39.5252 173.9002 41 K 4.1194 8.1332 127.1704 56.2933 32.2812 174.8881 42 P 4.8029 0.0000 0.0000 64.0524 33.1183 175.5803 43 V 4.9728 7.6421 119.0685 61.2195 34.8439 174.2378 44 N 4.6753 9.1169 125.0178 52.8532 42.4867 172.8140 45 T 4.7687 7.9569 122.6125 61.9439 70.7448 173.3737 46 F 4.7396 8.7534 125.0690 55.7615 41.7193 174.8627 47 V 4.5130 8.9349 122.7753 60.7572 33.9584 175.7294 48 H 5.6981 8.5220 126.7668 54.5992 26.9247 173.7577 49 E 4.8325 7.7882 116.3033 53.3402 34.3636 176.9577 50 S 4.2829 8.4377 115.7576 58.1595 64.8679 174.6030 51 L 3.9420 7.9450 123.8605 58.6543 41.8309 179.1400 52 A 4.1491 8.1613 119.7978 55.8138 17.9666 179.2743 53 D 4.3696 7.7051 115.6877 57.1438 41.1539 178.7487 54 V 3.8469 7.7574 118.4526 65.6573 31.5343 177.9328 55 Q 3.8639 8.6609 118.0674 58.9716 28.5557 178.8151 56 A 4.0133 8.0418 121.4313 54.8281 18.3105 179.7305 57 V 3.4372 7.6465 117.0444 66.1028 31.2943 177.2130 58 C 3.6896 7.5595 115.2239 58.2754 39.8587 174.4430 59 S 4.7007 7.4277 113.9318 57.9284 63.8061 174.7175 60 Q 4.0886 7.5966 121.9652 56.2032 27.4054 177.5363 61 K 4.2614 7.9736 130.9009 56.7846 32.9301 175.1969 62 N 4.4212 8.7391 127.3908 53.3241 39.8211 174.4724 63 V 4.5675 8.3024 118.2529 59.0700 36.6485 174.8707 64 A 4.2026 8.5365 125.8816 52.3776 18.9609 178.6547 65 C 4.6140 9.0884 119.9084 56.5798 40.9884 175.0616 66 K 3.6720 9.2952 122.7356 59.7212 31.7094 177.7500 67 N 4.6101 8.1004 112.7310 52.6663 37.5887 175.6754 68 G 3.9691 8.3140 108.9917 45.5405 0.0000 174.4605 69 Q 4.1762 8.1115 119.0465 56.6487 29.1736 176.7450 70 T 4.6843 8.2907 108.8826 61.5147 69.5873 173.9180 71 N 5.0285 7.9514 118.2235 53.9573 37.7152 174.5422 72 C 5.5241 7.5051 114.7991 56.5921 44.9184 173.6103 73 Y 5.0720 9.1963 119.3429 56.2613 41.9851 173.9016 74 Q 5.1878 9.1455 124.7081 53.8750 31.7362 174.9125 75 S 4.3542 8.8402 121.8824 58.7213 63.0974 174.3308 76 Y 4.5152 9.2273 121.8141 60.3945 37.8880 176.3048 77 S 5.0904 7.8219 112.5526 56.2446 65.8397 174.3641 78 T 4.1327 8.2866 110.6325 62.0848 69.6182 173.4464 79 M 5.0260 9.3084 122.6516 53.5064 36.4958 174.6507 80 S 5.0475 9.2818 116.9536 57.8057 63.6623 173.0452 81 I 5.0835 8.9084 120.6818 59.3954 41.3192 174.3506 82 T 4.9689 8.7275 120.4387 61.8860 71.0947 172.8317 83 D 4.8387 9.1108 127.6245 53.8131 42.7582 174.1705 84 C 5.5795 9.0748 123.6461 55.3399 44.3539 173.2053 85 R 5.2830 8.7820 122.2395 54.0136 33.5268 174.7506 86 E 4.0724 9.1832 125.6601 56.5073 30.5590 176.3717 87 T 4.4523 8.2990 116.7915 59.8756 71.2456 175.9108 88 G 3.6450 8.7699 110.3791 47.8462 0.0000 174.4373 89 S 4.5249 7.3922 112.2358 57.7355 63.5197 174.3941 90 S 4.0579 7.6058 116.9623 58.7192 62.5622 173.9743 91 K 4.2149 8.9564 129.0096 55.3034 33.1457 173.8749 92 Y 4.1446 8.6922 127.0349 57.8867 38.7799 174.4823 93 P 3.0003 0.0000 0.0000 62.6583 32.5414 176.4626 94 N 4.6279 7.7769 119.9783 52.3127 36.9787 173.4730 95 C 4.6681 7.8270 116.5358 56.4640 42.6051 173.3793 96 A 4.8739 8.6043 125.0019 50.3564 21.8903 174.5930 97 Y 5.0911 8.4941 118.3546 55.8461 42.3768 174.9624 98 K 4.2469 8.9540 124.7799 56.3793 33.6676 175.9833 99 T 4.4309 8.7108 124.8321 63.4259 68.8448 173.9364 100 T 4.6384 8.9711 124.4413 61.7280 71.1262 173.6308 101 Q 5.0396 8.6991 124.9054 54.5355 30.9885 174.5535 102 A 4.6389 8.7943 123.4221 50.9757 23.8116 174.4943 103 N 5.3073 8.6459 116.6324 52.2068 41.0133 173.2591 104 K 4.7810 8.8879 124.7128 54.8958 37.6470 175.6666 105 H 4.8538 9.2901 119.1615 55.9043 29.9873 174.8658 106 I 4.9621 8.9055 114.8270 59.1991 40.9347 174.3853 107 I 4.8948 8.0471 124.1900 59.7695 40.1075 175.0899 108 V 4.7101 8.5822 119.3817 59.3401 35.8245 174.4349 109 A 5.1745 8.5782 123.5317 50.8152 21.2894 175.5220 110 C 5.1744 8.6662 117.1819 55.4020 41.8081 173.2572 111 E 4.7786 8.4441 118.9674 56.2217 34.6190 175.6964 112 G 4.0297 9.9643 107.6908 44.7517 0.0000 171.5166 113 N 5.2747 8.1680 116.0483 50.8312 41.4169 172.2241 114 P 4.1569 0.0000 0.0000 63.1803 31.6431 175.0893 115 Y 5.1807 8.3240 121.4085 56.7843 39.0434 174.5374 116 V 4.4211 8.1509 119.4873 58.4470 36.4069 173.6510 117 P 4.4178 0.0000 0.0000 62.8583 31.6351 177.4131 118 V 4.5747 8.2265 112.5349 61.6020 35.3192 174.3432 119 H 4.9525 7.9316 119.2868 55.1762 33.3243 172.1034 120 F 4.3593 8.8525 127.9870 57.5727 39.2204 174.3805 121 D 4.5684 8.2166 126.8977 55.8662 41.8931 176.1349 122 A 4.6733 6.7089 116.8945 51.3868 22.2943 174.8255 123 S 5.3287 8.9994 113.8636 56.6821 65.9191 174.5645 124 V 4.1639 8.8826 115.0042 61.7341 32.6040 175.3308 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 8.31 4.23 0.00 1.74 1.78 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.44 7.81 2 E 8.48 3.84 0.00 2.13 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 2.40 2.38 0.00 3 T 8.73 4.20 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 4 A 8.56 4.10 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 5 A 7.98 4.13 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 A 8.18 4.00 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 7 K 8.43 4.09 0.00 2.03 1.96 0.00 1.74 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.45 7.81 8 F 8.64 4.09 0.00 3.16 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 9 E 8.22 3.98 0.00 2.16 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 10 R 7.94 3.89 0.00 1.85 2.09 0.00 3.42 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 11 Q 7.94 3.98 0.00 1.63 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.48 0.00 0.00 0.00 0.00 0.00 2.25 2.47 0.00 12 H 7.83 4.57 0.00 1.96 2.69 0.00 5.59 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 8.11 4.80 0.00 1.97 2.19 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.71 0.00 14 D 9.43 4.82 0.00 2.73 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 15 S 8.73 4.42 0.00 3.94 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 16 S 7.84 4.46 0.00 4.00 4.01 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 0.00 0.00 0.00 0.00 17 T 7.50 4.71 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 18 S 8.67 4.18 0.00 3.83 3.93 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 19 A 6.95 3.92 1.04 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 20 A 7.88 3.35 0.76 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 21 S 8.52 4.30 0.00 3.99 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 22 S 7.54 4.60 0.00 3.99 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 23 S 8.60 4.25 0.00 4.03 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 24 N 8.03 4.54 0.00 2.78 3.03 0.00 0.00 6.43 7.34 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 25 Y 8.11 4.04 0.00 3.15 2.98 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 26 C 8.30 4.15 0.00 3.17 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 N 8.32 4.37 0.00 2.94 2.92 0.00 0.00 7.08 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 28 Q 7.96 4.04 0.00 1.91 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.82 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 29 M 7.65 3.66 0.00 0.72 1.13 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.51 0.00 30 M 8.09 4.01 0.00 1.72 1.93 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 2.52 0.00 31 K 7.54 3.97 0.00 1.90 1.95 0.00 1.60 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.56 7.81 32 S 7.98 4.15 0.00 3.95 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 33 R 7.92 4.09 0.00 1.95 2.11 0.00 3.55 0.00 0.00 3.21 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.96 0.00 34 N 7.96 4.45 0.00 2.94 2.99 0.00 0.00 6.97 7.60 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 35 L 7.75 4.18 0.00 1.72 1.66 0.71 0.58 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 36 T 7.61 5.95 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 1.43 0.00 0.00 37 K 8.46 4.06 0.00 1.97 1.93 0.00 1.79 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.47 1.60 7.81 38 D 7.64 4.78 0.00 2.65 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 39 R 7.14 3.70 0.00 1.82 1.75 0.00 2.96 0.00 0.00 3.30 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.51 0.00 40 C 8.82 4.73 0.00 3.09 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 41 K 8.13 4.12 0.00 1.71 1.76 0.00 1.75 0.00 0.00 1.66 0.00 0.00 3.24 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.40 7.81 42 P 0.00 4.80 0.00 2.20 2.32 0.00 3.74 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.98 0.00 43 V 7.64 4.97 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 0.81 0.00 0.00 0.98 0.00 0.00 44 N 9.12 4.68 0.00 2.63 2.29 0.00 0.00 6.86 6.97 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 45 T 7.96 4.77 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 0.74 0.00 0.00 46 F 8.75 4.74 0.00 3.03 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.93 4.51 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 1.08 0.00 0.00 1.05 0.00 0.00 48 H 8.52 5.70 0.00 3.20 3.38 0.00 5.61 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.79 4.83 0.00 1.95 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 2.26 2.26 0.00 50 S 8.44 4.28 0.00 4.07 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 51 L 7.94 3.94 0.00 1.87 1.77 1.03 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.16 4.15 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 53 D 7.71 4.37 0.00 2.86 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 V 7.76 3.85 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 1.20 0.00 0.00 1.10 0.00 0.00 55 Q 8.66 3.86 0.00 2.04 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.31 2.47 0.00 56 A 8.04 4.01 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 57 V 7.65 3.44 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 0.88 0.00 0.00 0.95 0.00 0.00 58 C 7.56 3.69 0.00 2.65 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 S 7.43 4.70 0.00 3.92 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 60 Q 7.60 4.09 0.00 1.72 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.95 0.00 0.00 0.00 0.00 0.00 1.93 2.22 0.00 61 K 7.97 4.26 0.00 1.86 1.76 0.00 1.60 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.42 7.81 62 N 8.74 4.42 0.00 2.75 2.63 0.00 0.00 7.00 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 63 V 8.30 4.57 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 0.71 0.00 0.00 0.82 0.00 0.00 64 A 8.54 4.20 1.19 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 65 C 9.09 4.61 0.00 3.08 3.01 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 0.00 0.00 0.00 0.00 66 K 9.30 3.67 0.00 1.80 1.92 0.00 1.72 0.00 0.00 1.78 0.00 0.00 3.04 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.49 1.42 7.81 67 N 8.10 4.61 0.00 2.81 2.90 0.00 0.00 6.26 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 8.31 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 69 Q 8.11 4.18 0.00 2.18 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.79 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 70 T 8.29 4.68 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 1.17 0.00 0.00 71 N 7.95 5.03 0.00 3.08 3.14 0.00 0.00 5.98 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 72 C 7.51 5.52 0.00 3.02 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 Y 9.20 5.07 0.00 2.73 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 74 Q 9.15 5.19 0.00 1.99 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.99 0.00 0.00 0.00 0.00 0.00 2.23 2.24 0.00 75 S 8.84 4.35 0.00 3.97 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 76 Y 9.23 4.52 0.00 3.04 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 77 S 7.82 5.09 0.00 3.89 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 78 T 8.29 4.13 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 0.99 0.00 0.00 79 M 9.31 5.03 0.00 1.96 2.01 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.48 0.00 80 S 9.28 5.05 0.00 3.91 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 8.91 5.08 1.88 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.74 1.01 0.00 0.00 82 T 8.73 4.97 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 1.37 0.00 0.00 83 D 9.11 4.84 0.00 2.72 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 84 C 9.07 5.58 0.00 3.00 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 85 R 8.78 5.28 0.00 1.83 1.83 0.00 3.22 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 86 E 9.18 4.07 0.00 1.89 1.78 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 2.11 1.85 0.00 87 T 8.30 4.45 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 88 G 8.77 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 S 7.39 4.52 0.00 3.98 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 90 S 7.61 4.06 0.00 3.85 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 91 K 8.96 4.21 0.00 1.78 1.61 0.00 1.71 0.00 0.00 1.56 0.00 0.00 2.85 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.36 1.39 7.81 92 Y 8.69 4.14 0.00 3.02 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 93 P 0.00 3.00 0.00 1.80 1.27 0.00 3.64 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.75 0.00 94 N 7.78 4.63 0.00 2.79 2.75 0.00 0.00 6.98 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 95 C 7.83 4.67 0.00 3.16 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 96 A 8.60 4.87 1.08 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 97 Y 8.49 5.09 0.00 2.89 2.87 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 98 K 8.95 4.25 0.00 1.89 1.75 0.00 1.65 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.46 7.81 99 T 8.71 4.43 4.31 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 1.30 0.00 0.00 100 T 8.97 4.64 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 1.23 0.00 0.00 101 Q 8.70 5.04 0.00 1.89 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.75 0.00 0.00 0.00 0.00 0.00 2.14 2.28 0.00 102 A 8.79 4.64 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 0.00 103 N 8.65 5.31 0.00 2.69 2.70 0.00 0.00 6.72 6.68 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 0.00 104 K 8.89 4.78 0.00 1.74 1.89 0.00 1.85 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.61 7.81 105 H 9.29 4.85 0.00 3.09 3.24 0.00 5.56 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 0.00 106 I 8.91 4.96 1.86 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.31 1.15 0.00 0.00 107 I 8.05 4.89 1.70 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 1.15 0.73 0.84 0.00 0.00 108 V 8.58 4.71 1.91 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 0.56 0.00 0.00 0.77 0.00 0.00 109 A 8.58 5.17 1.27 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 0.00 0.00 110 C 8.67 5.17 0.00 1.61 1.76 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 0.00 111 E 8.44 4.78 0.00 1.87 1.81 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 2.29 2.26 0.00 112 G 9.96 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 0.00 113 N 8.17 5.27 0.00 2.65 2.67 0.00 0.00 6.84 7.69 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 0.00 114 P 0.00 4.16 0.00 2.21 2.09 0.00 3.82 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 2.01 2.00 0.00 115 Y 8.32 5.18 0.00 2.81 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 0.00 116 V 8.15 4.42 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 0.75 0.00 0.00 0.91 0.00 0.00 117 P 0.00 4.42 0.00 0.49 1.11 0.00 3.35 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.72 0.00 118 V 8.23 4.57 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 0.59 0.00 0.00 0.93 0.00 0.00 119 H 7.93 4.95 0.00 3.30 3.12 0.00 5.85 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.85 4.36 0.00 2.48 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 0.00 121 D 8.22 4.57 0.00 2.58 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 0.00 122 A 6.71 4.67 1.19 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 0.00 123 S 9.00 5.33 0.00 3.97 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 0.00 124 V 8.88 4.16 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 0.72 0.00 0.00 0.95 0.00 0.00