NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 T 4.0912 8.1744 117.3595 63.1967 69.7668 172.5340 4 K 4.2217 8.3014 127.7856 54.5535 33.2637 173.9067 5 Y 4.6151 9.1049 124.9593 56.6454 40.5686 175.0631 6 N 4.5866 8.6887 120.8973 53.3191 40.7006 176.0628 7 K 3.9796 8.8748 128.0686 59.7835 32.2661 178.7685 8 E 3.9317 8.1398 118.5494 59.0608 29.3994 178.7803 9 F 4.2247 8.2253 120.3248 61.3797 39.5181 177.0844 10 L 3.7742 8.1490 118.6166 57.4802 41.2922 179.5897 11 L 3.5769 7.7202 118.9824 57.7529 41.5185 178.8136 12 Y 3.9427 7.8344 119.3858 60.7201 38.7905 177.8907 13 L 3.9221 8.1535 121.2383 58.0946 42.0008 178.7902 14 A 4.2576 8.3327 121.1702 54.9105 18.3934 179.9346 15 G 3.4013 7.8382 104.1188 47.8578 0.0000 175.7778 16 F 3.7458 8.1158 123.5089 60.8019 39.3524 177.4374 17 V 3.6673 8.4875 118.3217 66.1825 31.1990 177.7638 18 D 4.4797 8.2841 117.8262 57.5471 40.6005 177.9350 19 G 3.5598 7.5976 105.8661 45.4855 0.0000 174.3414 20 D 4.6561 8.1255 119.3277 52.5813 41.5207 176.7984 21 G 4.2950 7.4320 107.8958 45.5487 0.0000 173.3397 22 S 4.6541 8.7582 113.4166 57.0816 66.3138 172.9851 23 I 4.9922 8.5086 127.8375 59.8716 38.9327 174.8229 24 I 4.6858 9.1925 128.3559 59.2214 40.3950 174.7070 25 A 5.2056 8.6428 127.1156 50.3285 21.5147 175.2292 26 Q 4.6195 9.6099 120.7267 54.0853 33.6909 174.6880 27 I 4.8004 8.3892 122.0076 59.8287 39.3093 175.1864 28 K 4.5075 8.9940 128.4505 53.7195 33.8625 174.6285 29 P 4.5068 0.0000 0.0000 63.3090 32.2728 175.8364 30 N 4.4883 8.9251 121.0169 53.1401 41.6772 175.2124 31 Q 4.1787 9.1400 126.9084 58.3447 29.0074 177.8700 32 S 4.3222 8.4825 111.4779 59.6331 63.7271 173.9120 33 Y 4.4231 7.9660 119.7202 56.2054 39.1774 176.5013 34 K 3.6904 8.4723 122.0199 59.6014 32.4990 177.6990 35 F 4.7110 7.6718 116.0838 56.4301 38.9755 176.1420 36 K 4.6865 8.3162 118.1258 56.4113 30.1042 174.2388 37 H 5.2476 7.7316 113.5837 54.5911 33.2350 172.6862 38 Q 4.0891 8.6918 123.8159 54.4434 31.0897 174.5226 39 L 4.8568 8.5999 126.1383 53.9542 42.4195 175.6229 40 S 4.9053 9.1380 120.1482 56.3987 64.8194 172.8216 41 L 5.3845 8.4815 125.1681 53.4686 45.2785 176.0390 42 T 4.9047 9.3831 118.8067 62.0953 73.6298 172.3626 43 F 5.4247 9.1431 128.4760 56.5457 41.6136 174.3203 44 Q 4.7914 8.6368 123.3760 54.5580 32.9047 173.9368 45 V 4.5634 8.4637 119.2632 61.6942 34.6961 174.1029 46 T 5.0764 8.2240 124.4278 62.3006 70.4851 173.7509 47 E 4.6994 9.0451 124.5742 54.5244 33.8744 174.3628 48 K 4.2648 8.7306 125.7710 56.9552 32.9594 177.9088 49 T 4.0053 9.0872 122.7938 66.7026 68.5015 176.1709 50 Q 4.2589 8.1375 117.1152 57.7202 28.9079 176.4016 51 R 4.6568 8.2892 119.7914 55.8829 30.6197 177.3116 52 R 4.0563 8.2553 116.7026 58.1451 29.1535 178.2350 53 W 4.3637 8.3313 117.7084 59.7905 27.7655 177.8228 54 F 3.3541 6.8632 121.1611 60.8213 38.7282 177.1915 55 L 4.0190 7.7116 118.1239 57.7769 41.3107 179.0078 56 D 4.4592 8.8792 119.5958 57.1459 40.7435 178.6871 57 K 3.9371 8.2606 120.3523 59.3657 32.1871 178.7339 58 L 3.7593 7.3284 118.9350 57.6308 41.3656 179.5000 59 V 3.7461 7.5501 117.5645 66.1656 31.2265 177.5359 60 D 4.2919 7.5029 115.8791 57.5824 41.2131 177.7923 61 E 3.8811 8.3329 117.8745 59.2853 29.4771 179.0083 62 I 4.1154 8.1971 118.9741 61.6922 37.3911 177.4051 63 G 4.0214 9.5671 107.1596 45.4149 0.0000 173.0686 64 V 4.3700 7.5308 116.9706 61.0499 34.1111 174.1002 65 G 3.7230 10.4508 107.5386 45.2973 0.0000 170.8934 66 Y 4.8063 7.1295 115.3569 56.4484 41.7884 173.2597 67 V 4.9875 8.6461 119.0994 61.0354 33.9437 174.6607 68 R 4.8743 8.9799 124.0753 54.4935 32.3487 174.0047 69 D 5.2746 8.7195 120.9887 52.0607 43.1174 176.3058 70 R 4.7587 8.3725 121.8711 55.4729 31.1758 175.9734 71 G 3.9973 8.1622 112.5940 46.0405 0.0000 176.3942 72 S 4.2814 9.2050 123.0285 59.9105 63.9194 173.9118 73 V 5.0263 7.5538 112.7951 59.5663 35.8969 174.3825 74 S 5.1685 9.3484 116.7766 57.2066 67.6726 173.0630 75 D 5.3253 8.9354 120.0195 52.8450 45.2240 174.1561 76 Y 4.7861 9.1089 123.8069 56.5698 40.7026 174.2196 77 I 4.5847 7.7568 126.8768 59.0987 41.1599 174.3426 78 L 4.6732 8.6078 127.5752 53.8624 44.2328 176.5259 79 S 4.6963 8.8175 122.1140 59.0155 65.5421 174.9431 80 E 3.9864 8.3807 120.1191 56.7540 29.9337 177.5983 81 I 3.7698 8.5889 118.9907 64.0407 37.5484 177.8891 82 K 3.9517 8.0802 120.7126 59.0488 32.2220 176.9681 83 P 4.4265 0.0000 0.0000 65.1701 31.2939 178.5035 84 L 4.0719 8.2430 119.5878 58.4146 42.0886 178.4777 85 H 4.0669 8.6746 118.5565 59.2354 29.6017 176.5690 86 N 4.3760 8.3570 118.8085 56.7418 38.8065 176.5473 87 F 4.3979 8.8999 122.1615 61.5447 39.5450 177.1496 88 L 3.5390 8.4724 118.8266 57.7468 41.0746 179.6153 89 T 3.7309 7.5383 115.0871 66.8195 68.4877 176.2859 90 Q 4.1169 7.4483 116.9646 58.1088 29.0983 177.8067 91 L 4.1029 7.3878 121.8798 57.5367 42.2381 178.4067 92 Q 3.8880 8.1716 118.1057 59.0890 27.9441 177.3018 93 P 4.0656 0.0000 0.0000 64.2402 31.3318 176.7662 94 F 4.8874 7.4590 114.1630 57.1630 39.8633 176.1604 95 L 4.3352 7.4282 120.8354 54.5356 42.0771 176.8465 96 K 4.4671 9.6647 120.0430 57.0406 34.6892 177.5652 97 L 4.3825 8.4000 116.7226 55.7065 42.7275 177.4126 98 K 4.5894 8.2157 116.7258 56.0877 32.8423 178.1085 99 Q 3.9144 8.1471 122.7022 59.2550 28.9857 177.8501 100 K 3.8940 7.9956 119.0609 59.4961 32.0800 179.1666 101 Q 3.9644 8.0197 117.5560 58.7986 28.7080 178.2756 102 A 4.0040 7.8863 121.7095 55.5511 18.5737 179.5326 103 N 4.2197 8.3548 114.9532 56.3529 38.4844 177.7404 104 L 3.8989 7.9013 120.6002 57.4727 41.5923 179.6605 105 V 3.6400 7.9762 118.3858 66.0059 31.5443 178.0842 106 L 3.9945 8.0880 118.8734 57.5434 41.1673 179.4566 107 K 3.8173 7.5625 118.3898 59.4842 32.5237 178.6129 108 I 4.2292 7.9870 120.0498 64.6280 37.1073 178.1050 109 I 3.7669 8.0475 120.7017 64.9309 36.8364 178.3310 110 E 4.0623 8.1094 117.7561 58.9318 29.6138 178.3389 111 Q 4.4572 7.9590 117.2705 56.0799 29.4815 176.9107 112 L 4.0398 7.8623 120.2791 58.4989 41.5625 177.2731 113 P 4.3119 0.0000 0.0000 65.9867 31.4595 178.3842 114 S 4.2734 8.1863 110.8649 61.1785 62.1241 175.7873 115 A 4.1135 7.9002 122.9438 54.6488 18.1823 179.1177 116 K 4.3693 7.9656 117.2759 59.2239 32.3237 178.4208 117 E 4.2889 7.8586 118.3865 57.0690 30.2089 176.7710 118 S 4.8608 7.5315 112.1979 55.2924 65.5284 172.8145 119 P 3.2473 0.0000 0.0000 65.3995 31.1072 178.8299 120 D 4.2446 7.8916 117.4244 56.9197 40.7441 178.6169 121 K 3.7620 7.8401 119.7048 59.3961 32.3461 178.1475 122 F 3.8315 8.1085 121.1551 61.5468 38.9181 177.0148 123 L 3.7811 7.8107 118.3113 57.8145 42.1533 178.1666 124 E 3.7135 7.7692 119.4595 59.0954 29.5140 179.0109 125 V 2.1841 7.3699 118.5364 65.6824 31.4890 177.7461 126 C 3.8955 7.5598 116.4975 62.9558 27.7011 176.2222 127 T 4.0170 7.3248 117.2618 66.2865 67.9580 176.5189 128 W 4.5230 7.7737 120.7784 59.1574 29.1298 178.9269 129 V 3.6405 7.6345 118.2530 65.9860 31.0880 177.4197 130 D 4.3980 8.0705 118.6817 57.6810 40.7357 178.9684 131 Q 4.0534 7.9217 118.2205 58.9131 28.7075 178.8902 132 I 3.6867 7.8348 120.5780 64.4047 36.9650 178.3240 133 A 4.0053 7.8849 120.0236 55.1723 18.2761 179.3307 134 A 4.0822 7.9599 118.1806 54.9334 18.4658 179.4711 135 L 4.1473 7.5754 116.9722 56.7560 41.9733 177.2839 136 N 4.6643 7.6512 115.6238 52.7967 39.9877 175.3964 137 D 4.6094 8.0878 119.9795 53.2288 39.4714 177.1482 138 S 4.2340 7.6797 113.6817 58.3570 63.2305 173.4741 139 K 4.6178 8.6733 125.5024 56.1792 34.2361 176.7029 140 T 4.6458 7.6911 107.4408 60.9455 69.3334 173.9261 141 R 4.1189 8.0746 121.3523 57.2527 30.8908 175.1049 142 K 4.3803 8.5638 121.0854 58.1848 34.4648 176.7166 143 T 4.3107 7.8251 114.4341 62.8172 69.4702 174.6355 144 T 4.7276 9.1423 117.5662 59.0886 73.3214 174.9081 145 S 4.0642 8.8688 115.3603 61.5696 62.6315 176.4041 146 E 3.9528 8.1017 121.9397 59.4844 28.8496 179.2239 147 T 3.9069 7.7505 109.3519 64.8199 68.7628 176.7565 148 V 3.5727 7.6249 120.7530 65.4611 31.4237 178.0333 149 R 3.8399 8.1198 118.4239 59.3870 29.7404 178.3197 150 A 3.9686 7.5687 118.9663 55.2548 18.4086 179.5017 151 V 3.7326 7.3815 115.3104 65.8964 31.6658 178.0758 152 L 4.1685 7.8328 118.0627 57.7845 41.6205 177.3862 153 D 4.6722 8.1336 122.0810 54.7331 40.9454 176.2554 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 3 T 8.17 4.09 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 0.68 0.00 0.00 4 K 8.30 4.22 0.00 1.73 1.63 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.53 7.81 5 Y 9.10 4.62 0.00 3.21 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 6 N 8.69 4.59 0.00 2.89 2.83 0.00 0.00 6.63 6.44 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 7 K 8.87 3.98 0.00 1.95 1.82 0.00 1.92 0.00 0.00 1.92 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.27 1.52 7.81 8 E 8.14 3.93 0.00 2.10 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 0.00 2.39 2.37 0.00 9 F 8.23 4.22 0.00 3.14 3.39 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 10 L 8.15 3.77 0.00 1.87 1.81 1.26 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.72 3.58 0.00 1.62 1.53 0.67 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 12 Y 7.83 3.94 0.00 3.03 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 13 L 8.15 3.92 0.00 1.34 1.34 0.99 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 14 A 8.33 4.26 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 15 G 7.84 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 0.00 0.00 0.00 16 F 8.12 3.75 0.00 2.88 3.15 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 17 V 8.49 3.67 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 1.19 0.00 0.00 1.45 0.00 0.00 18 D 8.28 4.48 0.00 2.86 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 7.60 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.13 4.66 0.00 2.03 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 21 G 7.43 4.30 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 0.00 22 S 8.76 4.65 0.00 3.77 3.56 0.00 0.00 0.00 0.00 0.00 0.00 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 8.51 4.99 1.93 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.91 1.01 0.00 0.00 24 I 9.19 4.69 1.88 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.68 0.92 0.00 0.00 25 A 8.64 5.21 1.21 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 0.00 0.00 26 Q 9.61 4.62 0.00 1.92 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.69 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 27 I 8.39 4.80 1.85 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.54 0.88 0.00 0.00 28 K 8.99 4.51 0.00 1.56 1.69 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.36 1.37 7.81 29 P 0.00 4.51 0.00 1.92 1.99 0.00 3.72 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.17 0.00 30 N 8.93 4.49 0.00 2.69 2.44 0.00 0.00 6.85 6.39 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 31 Q 9.14 4.18 0.00 2.10 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.84 0.00 0.00 0.00 0.00 0.00 2.37 2.30 0.00 32 S 8.48 4.32 0.00 3.91 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 33 Y 7.97 4.42 0.00 3.11 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 34 K 8.47 3.69 0.00 1.38 1.64 0.00 1.20 0.00 0.00 1.26 0.00 0.00 2.13 0.00 0.00 2.61 0.00 0.00 0.00 0.00 0.92 0.21 7.81 35 F 7.67 4.71 0.00 2.21 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 0.00 0.00 0.00 0.00 36 K 8.32 4.69 0.00 2.01 1.76 0.00 1.75 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.36 1.39 7.81 37 H 7.73 5.25 0.00 3.26 3.24 0.00 5.83 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 38 Q 8.69 4.09 0.00 0.93 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.86 0.00 0.00 0.00 0.00 0.00 2.23 2.35 0.00 39 L 8.60 4.86 0.00 1.64 1.62 0.62 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 40 S 9.14 4.91 0.00 3.86 3.70 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 0.00 0.00 0.00 0.00 41 L 8.48 5.38 0.00 1.59 1.58 0.98 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 42 T 9.38 4.90 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 1.17 0.00 0.00 43 F 9.14 5.42 0.00 3.33 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 44 Q 8.64 4.79 0.00 1.99 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.54 0.00 0.00 0.00 0.00 0.00 2.10 2.13 0.00 45 V 8.46 4.56 2.22 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 1.21 0.00 0.00 0.89 0.00 0.00 46 T 8.22 5.08 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 1.26 0.00 0.00 47 E 9.05 4.70 0.00 2.09 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.22 0.00 48 K 8.73 4.26 0.00 1.81 1.67 0.00 1.78 0.00 0.00 1.84 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.48 7.81 49 T 9.09 4.01 4.27 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 1.29 0.00 0.00 50 Q 8.14 4.26 0.00 2.25 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.36 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 51 R 8.29 4.66 0.00 1.82 1.78 0.00 3.12 0.00 0.00 3.30 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.56 0.00 52 R 8.26 4.06 0.00 2.13 2.30 0.00 2.91 0.00 0.00 3.30 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.87 0.00 53 W 8.33 4.36 0.00 3.64 3.45 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 54 F 6.86 3.35 0.00 1.51 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.71 4.02 0.00 1.91 1.82 0.98 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.88 4.46 0.00 2.90 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 57 K 8.26 3.94 0.00 1.99 1.72 0.00 1.75 0.00 0.00 1.54 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.47 7.81 58 L 7.33 3.76 0.00 1.57 0.86 0.67 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 59 V 7.55 3.75 2.35 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 1.19 0.00 0.00 1.22 0.00 0.00 60 D 7.50 4.29 0.00 2.67 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 61 E 8.33 3.88 0.00 1.74 1.17 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 2.10 2.35 0.00 62 I 8.20 4.12 1.82 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.45 0.63 0.00 0.00 63 G 9.57 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 0.00 0.00 0.00 64 V 7.53 4.37 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 0.78 0.00 0.00 1.03 0.00 0.00 65 G 10.45 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 7.13 4.81 0.00 3.12 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 67 V 8.65 4.99 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 0.95 0.00 0.00 1.13 0.00 0.00 68 R 8.98 4.87 0.00 2.03 2.21 0.00 2.88 0.00 0.00 3.14 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 69 D 8.72 5.27 0.00 2.72 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 70 R 8.37 4.76 0.00 1.92 1.91 0.00 3.11 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 71 G 8.16 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 72 S 9.20 4.28 0.00 4.02 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 73 V 7.55 5.03 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 0.74 0.00 0.00 0.93 0.00 0.00 74 S 9.35 5.17 0.00 3.69 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 75 D 8.94 5.33 0.00 2.55 2.42 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 0.00 76 Y 9.11 4.79 0.00 3.04 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 77 I 7.76 4.58 0.63 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.86 0.64 0.00 0.00 78 L 8.61 4.67 0.00 1.65 1.76 1.06 0.66 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 79 S 8.82 4.70 0.00 3.93 3.92 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 80 E 8.38 3.99 0.00 2.08 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 0.00 2.48 2.48 0.00 81 I 8.59 3.77 1.95 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 1.59 1.26 1.04 0.00 0.00 82 K 8.08 3.95 0.00 1.89 1.90 0.00 1.76 0.00 0.00 1.86 0.00 0.00 3.02 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.56 1.57 7.81 83 P 0.00 4.43 0.00 2.29 2.19 0.00 3.90 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 2.19 2.21 0.00 84 L 8.24 4.07 0.00 2.03 1.98 1.12 0.87 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 85 H 8.67 4.07 0.00 3.35 3.50 0.00 5.65 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 N 8.36 4.38 0.00 3.01 3.12 0.00 0.00 6.91 7.08 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 87 F 8.90 4.40 0.00 3.15 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 88 L 8.47 3.54 0.00 1.69 1.58 0.99 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 89 T 7.54 3.73 4.40 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 1.17 0.00 0.00 90 Q 7.45 4.12 0.00 2.27 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.95 0.00 0.00 0.00 0.00 0.00 2.47 2.56 0.00 91 L 7.39 4.10 0.00 0.96 1.00 0.81 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 92 Q 8.17 3.89 0.00 2.21 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.57 0.00 0.00 0.00 0.00 0.00 2.22 2.48 0.00 93 P 0.00 4.07 0.00 0.79 1.68 0.00 3.40 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.90 0.00 94 F 7.46 4.89 0.00 3.01 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 95 L 7.43 4.34 0.00 1.74 1.64 0.95 0.88 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 96 K 9.66 4.47 0.00 1.73 1.79 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.36 1.38 7.81 97 L 8.40 4.38 0.00 1.79 1.68 0.88 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 98 K 8.22 4.59 0.00 1.82 1.78 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.34 1.32 7.81 99 Q 8.15 3.91 0.00 2.24 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.85 6.90 0.00 0.00 0.00 0.00 0.00 2.36 2.59 0.00 100 K 8.00 3.89 0.00 1.81 1.81 0.00 1.70 0.00 0.00 1.79 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.50 7.81 101 Q 8.02 3.96 0.00 2.33 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.87 0.00 0.00 0.00 0.00 0.00 2.62 2.49 0.00 102 A 7.89 4.00 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 0.00 103 N 8.35 4.22 0.00 2.90 2.78 0.00 0.00 7.12 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 0.00 104 L 7.90 3.90 0.00 1.84 1.72 0.91 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 105 V 7.98 3.64 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 1.18 0.00 0.00 1.05 0.00 0.00 106 L 8.09 3.99 0.00 1.67 1.66 0.81 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 107 K 7.56 3.82 0.00 1.72 1.77 0.00 1.21 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.45 1.02 7.81 108 I 7.99 4.23 2.14 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 1.91 1.26 1.00 0.00 0.00 109 I 8.05 3.77 2.15 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.30 0.99 0.00 0.00 110 E 8.11 4.06 0.00 2.02 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 0.00 2.36 2.64 0.00 111 Q 7.96 4.46 0.00 2.73 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.74 0.00 0.00 0.00 0.00 0.00 2.66 2.56 0.00 112 L 7.86 4.04 0.00 1.99 1.81 1.01 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 113 P 0.00 4.31 0.00 2.07 2.18 0.00 3.89 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 2.08 2.21 0.00 114 S 8.19 4.27 0.00 3.95 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 0.00 115 A 7.90 4.11 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 0.00 116 K 7.97 4.37 0.00 1.95 2.14 0.00 1.84 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.49 7.81 117 E 7.86 4.29 0.00 2.16 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 2.56 0.00 118 S 7.53 4.86 0.00 3.84 3.68 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 0.00 119 P 0.00 3.25 0.00 2.07 1.79 0.00 3.64 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.37 0.00 120 D 7.89 4.24 0.00 2.64 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 0.00 121 K 7.84 3.76 0.00 1.85 1.92 0.00 1.67 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.52 1.48 7.81 122 F 8.11 3.83 0.00 3.14 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 0.00 123 L 7.81 3.78 0.00 1.80 1.72 0.82 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 124 E 7.77 3.71 0.00 1.96 1.68 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 1.47 2.11 0.00 125 V 7.37 2.18 1.70 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 0.84 0.00 0.00 0.53 0.00 0.00 126 C 7.56 3.90 0.00 2.93 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 0.00 127 T 7.32 4.02 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 1.25 0.00 0.00 128 W 7.77 4.52 0.00 3.53 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 V 7.63 3.64 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 1.06 0.00 0.00 0.89 0.00 0.00 130 D 8.07 4.40 0.00 2.95 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 Q 7.92 4.05 0.00 2.30 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.65 0.00 132 I 7.83 3.69 2.05 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.09 0.93 0.00 0.00 133 A 7.88 4.01 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 0.00 134 A 7.96 4.08 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 0.00 135 L 7.58 4.15 0.00 1.85 1.87 0.91 1.01 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 0.00 136 N 7.65 4.66 0.00 2.87 2.76 0.00 0.00 7.01 7.44 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 0.00 137 D 8.09 4.61 0.00 2.64 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 0.00 138 S 7.68 4.23 0.00 3.99 3.78 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 0.00 139 K 8.67 4.62 0.00 1.72 1.77 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.31 1.55 7.81 140 T 7.69 4.65 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 0.00 141 R 8.07 4.12 0.00 1.79 1.86 0.00 3.17 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 142 K 8.56 4.38 0.00 1.73 1.78 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.32 1.41 7.81 143 T 7.83 4.31 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 1.27 0.00 0.00 144 T 9.14 4.73 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 1.24 0.00 0.00 145 S 8.87 4.06 0.00 3.99 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 0.00 146 E 8.10 3.95 0.00 1.98 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 2.38 2.30 0.00 147 T 7.75 3.91 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 1.21 0.00 0.00 148 V 7.62 3.57 2.18 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 1.12 0.00 0.00 0.81 0.00 0.00 149 R 8.12 3.84 0.00 2.02 2.01 0.00 3.12 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.62 0.00 150 A 7.57 3.97 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 0.00 151 V 7.38 3.73 2.30 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 0.92 0.00 0.00 1.04 0.00 0.00 152 L 7.83 4.17 0.00 1.82 1.70 0.78 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 153 D 8.13 4.67 0.00 2.79 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