NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3618 8.1233 123.5896 50.4992 22.2274 180.2478 2 D 4.1245 8.7967 117.2999 53.9509 40.2802 174.3389 3 S 4.1830 10.1442 125.6901 61.6918 64.7441 175.4688 4 Q 4.4338 8.1224 118.1811 56.4655 28.8146 175.5534 5 T 5.2266 7.6801 115.0895 62.3091 72.7674 173.3289 6 S 4.9455 9.4686 119.9450 57.2787 67.0539 172.7199 7 S 5.0493 8.3944 114.3304 57.0995 66.4006 171.8763 8 N 5.0577 8.3172 116.9600 51.0690 40.8134 175.6745 9 R 4.0045 8.6065 116.5650 58.7447 30.2507 178.5680 10 A 4.1294 7.9664 119.0867 52.8831 18.7713 177.9536 11 G 3.9055 8.2721 104.6678 45.6763 0.0000 172.6924 12 E 4.7777 8.1203 119.7170 55.5867 30.7301 175.7675 13 F 5.2201 9.6339 123.1539 55.6308 42.7737 174.3642 14 S 5.1667 9.1847 116.9322 56.6002 64.4764 172.8876 15 I 5.1780 8.7169 120.0647 57.9840 41.4644 172.7858 16 P 4.3886 0.0000 0.0000 62.1923 31.6101 175.1187 17 P 4.3229 0.0000 0.0000 63.1243 32.2647 175.2395 18 N 4.3179 8.5161 118.4230 55.1464 37.8867 173.9062 19 T 4.5454 7.8964 113.8588 61.4381 70.1919 174.3276 20 D 5.0680 8.7653 127.3966 54.4038 41.6841 175.7581 21 F 5.2420 8.9197 117.0272 55.6305 42.0262 173.5608 22 R 4.9793 9.1951 118.9663 55.2499 32.4128 175.4102 23 A 5.2331 9.0127 123.3097 50.4020 22.2639 174.8854 24 I 5.0719 9.0765 124.2383 59.7657 39.7309 174.8322 25 F 5.5486 9.6411 126.3976 55.9153 41.9328 174.6066 26 F 5.3948 8.8404 116.1810 56.1733 41.7052 172.5502 27 A 5.0051 8.7490 119.8247 50.3687 22.6071 174.8457 28 N 5.2851 8.5860 117.7811 50.1123 39.2491 173.0128 29 A 4.4986 8.9372 121.3890 51.1537 23.0696 177.4779 30 A 4.0329 8.7536 123.1298 54.4504 19.2992 178.5665 31 E 4.2944 7.7781 113.6071 55.4867 30.5565 175.9818 32 Q 4.1261 8.4925 123.3762 56.4485 29.9400 175.3113 33 Q 4.4151 9.1518 127.0320 55.4289 30.3046 174.9257 34 H 5.2878 9.3715 123.5781 54.8893 30.1216 174.4054 35 I 5.0414 9.1994 126.0551 59.5126 39.5732 175.1562 36 K 5.2040 9.3468 126.7256 54.3572 35.5601 174.9399 37 L 4.8743 8.6962 125.9388 53.1895 44.8497 175.0432 38 F 5.1229 9.2048 124.8176 55.6894 42.6969 174.3491 39 I 4.7607 8.2217 121.7629 59.7113 40.0788 175.4889 40 G 3.7089 9.0806 115.2420 47.4759 0.0000 174.6201 41 D 4.6379 8.6739 123.9004 54.0153 41.2687 176.5238 42 S 4.2561 7.7297 114.5570 58.6946 62.7546 173.8513 43 Q 4.4313 8.6198 123.9530 55.8016 29.4903 175.1701 44 E 4.6764 7.8893 118.6005 53.7129 30.8767 174.3302 45 P 3.6209 0.0000 0.0000 62.3869 31.9143 176.4220 46 A 4.2399 8.4010 123.0268 54.5195 19.0767 177.6755 47 A 4.6333 7.6306 115.7780 50.9066 23.0750 175.0546 48 Y 5.2083 7.9870 121.9726 56.9485 41.6580 173.6789 49 H 4.5952 9.2278 123.3880 53.6987 33.2556 173.0190 50 K 4.9965 8.4175 120.6451 54.7855 33.8423 175.4011 51 L 5.1666 9.0013 125.2840 53.0814 46.1628 176.4293 52 T 4.7602 9.0089 113.0444 59.9863 72.0633 175.1442 53 T 4.3811 8.4072 116.7301 66.4171 68.4381 177.3103 54 R 4.0453 7.3316 118.4188 59.0230 30.1366 177.8580 55 D 4.3935 8.0338 116.7814 54.8115 41.4399 178.1511 56 G 3.8543 7.6232 107.7462 44.9224 0.0000 171.0928 57 P 5.1838 0.0000 0.0000 62.0850 33.4910 175.5871 58 R 4.7917 9.0591 118.5853 54.3918 34.4248 174.0626 59 E 5.3375 8.8321 121.6048 54.5508 32.3593 174.6271 60 A 4.9411 9.5263 128.5561 50.5588 22.4779 175.3032 61 T 4.8059 8.3447 115.7736 61.8296 71.1851 173.4581 62 L 4.6712 8.2657 125.4380 52.7908 46.7351 174.6898 63 N 5.5352 8.2850 118.0727 51.8350 41.2682 174.5871 64 S 4.4761 9.3714 119.8000 58.7325 64.8224 175.5733 65 G 3.8769 8.4073 111.8019 46.8431 0.0000 176.3741 66 N 4.4560 8.8861 122.5368 53.1841 37.3062 175.3230 67 G 4.0328 8.4159 107.2602 45.8400 0.0000 173.3437 68 K 4.8857 8.5635 120.6264 55.3546 33.9296 175.8533 69 I 5.1194 8.8502 125.7144 59.4354 40.7381 174.8124 70 R 5.2476 8.9597 121.9085 54.5613 33.3571 173.9055 71 F 5.6227 8.4734 115.3335 55.8521 42.8232 174.6082 72 E 4.8379 9.4948 120.9773 54.7020 32.6953 174.9213 73 V 5.0918 8.6308 124.7028 61.1466 34.1292 174.3903 74 S 5.2373 9.2827 121.6531 56.7499 67.2080 173.0842 75 V 4.5724 8.5362 120.6502 61.9118 34.7718 175.0987 76 N 4.1166 9.9027 125.4846 54.4770 36.1594 174.8516 77 G 3.9252 8.4109 101.5557 45.8957 0.0000 173.8206 78 K 4.6064 7.7610 119.1981 53.0775 34.7464 174.1521 79 P 4.7114 0.0000 0.0000 62.9448 31.9143 176.2368 80 S 4.6669 8.6420 118.2049 57.7335 64.1047 174.0347 81 A 4.4339 8.3531 124.0176 52.3645 19.3590 176.7640 82 T 5.2968 8.4044 109.6571 60.3884 72.5664 171.9617 83 D 5.1143 9.0706 119.9856 53.7505 45.3399 173.2811 84 A 5.2094 8.2538 121.4722 51.3989 22.1403 175.3292 85 R 4.7058 9.0966 115.0498 55.2465 33.4615 173.8278 86 L 5.2211 8.5480 119.0855 53.2170 43.3953 177.1921 87 A 4.8802 8.5366 123.0377 50.2577 18.0925 174.5002 88 P 4.6144 0.0000 0.0000 62.3732 33.2256 177.6539 89 I 4.3871 8.9197 123.1492 60.0074 39.1308 174.3031 90 N 4.9622 8.7779 124.5877 51.5836 40.7996 173.7208 91 G 3.6642 7.4393 111.5776 43.9994 0.0000 170.3185 92 K 5.1988 8.3446 117.7393 54.3694 35.1204 177.2359 93 K 4.4814 9.4863 124.7739 55.5492 32.9442 178.2993 94 S 4.1236 8.5889 114.6768 61.2586 62.7953 174.8659 95 D 4.5630 8.1145 118.2246 53.1964 39.4985 177.0755 96 G 3.9981 8.4319 110.0476 45.4849 0.0000 174.4184 97 S 4.4406 8.3014 114.8341 57.1337 63.9991 171.7697 98 P 5.0897 0.0000 0.0000 62.5992 32.4058 175.0074 99 F 5.2061 8.5500 115.3203 55.5670 41.8492 173.6462 100 T 5.0746 8.6241 115.0066 61.8930 72.2808 173.4651 101 V 4.2971 8.9389 125.7837 61.1585 34.4256 173.9853 102 N 4.6970 8.3308 125.6811 51.9226 40.3352 174.2384 103 F 5.0958 8.1327 119.4840 55.7064 43.8714 173.7963 104 G 4.6066 9.1803 108.4465 44.6318 0.0000 171.6798 105 I 5.2664 9.2597 121.9619 59.3323 41.7009 174.4377 106 V 4.8385 8.8592 126.5441 61.2111 34.4561 174.6976 107 V 4.9878 8.6187 119.7752 59.9943 36.2943 174.2575 108 S 5.0231 8.0878 113.9007 57.6498 66.8201 173.2613 109 E 4.8391 8.6425 122.2849 54.4297 31.6325 176.0288 110 D 4.4799 9.5419 126.5860 53.8068 40.0829 177.2577 111 G 3.9924 8.5078 108.6192 45.6071 0.0000 174.2877 112 H 4.3932 8.1002 119.3645 58.5487 30.6991 174.7968 113 D 4.4695 7.6123 118.6713 53.0977 41.2186 175.4717 114 S 4.8454 8.4272 109.8784 58.2678 63.4329 174.8728 115 D 4.5060 8.5213 121.6975 55.4444 39.7667 175.9167 116 Y 3.4675 8.5240 117.3437 59.0396 35.9853 170.6953 117 N 5.0699 7.8821 112.4010 52.7887 38.0864 175.0819 118 D 4.8482 8.0419 121.3015 56.7004 41.9213 176.5737 119 G 4.3663 7.7948 104.7987 44.3473 0.0000 172.2740 120 I 4.7757 8.4903 125.9473 59.2866 41.2168 174.7661 121 V 4.6872 8.2876 125.1153 60.9195 35.1231 174.1310 122 V 4.8384 8.8691 127.3344 61.2013 34.0089 174.1538 123 L 5.2775 9.0228 128.4815 53.8085 43.8228 175.5136 124 Q 4.6597 9.2556 123.2362 54.3655 32.7972 173.5406 125 W 5.4101 8.0509 121.4342 54.8939 31.9309 172.3195 126 P 5.0402 0.0000 0.0000 62.7070 31.7617 175.9686 127 I 4.4031 8.1387 109.7270 60.2736 38.1613 175.8574 128 G 3.8302 8.1815 115.3695 46.3354 0.0000 173.5387 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 A 8.12 4.36 1.47 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 0.00 0.00 2 D 8.80 4.12 0.00 2.91 2.39 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 3 S 10.14 4.18 0.00 3.99 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 4 Q 8.12 4.43 0.00 2.29 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.59 0.00 0.00 0.00 0.00 0.00 2.40 2.51 0.00 5 T 7.68 5.23 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 1.44 0.00 0.00 6 S 9.47 4.95 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 7 S 8.39 5.05 0.00 3.11 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 N 8.32 5.06 0.00 2.76 2.84 0.00 0.00 7.41 7.67 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 9 R 8.61 4.00 0.00 1.87 2.00 0.00 3.09 0.00 0.00 3.31 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.59 0.00 10 A 7.97 4.13 1.33 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 0.00 0.00 11 G 8.27 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 E 8.12 4.78 0.00 2.08 1.87 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 2.33 2.31 0.00 13 F 9.63 5.22 0.00 2.83 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 14 S 9.18 5.17 0.00 3.85 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 15 I 8.72 5.18 1.41 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.39 0.60 0.00 0.00 16 P 0.00 4.39 0.00 1.95 2.05 0.00 3.61 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.19 0.00 17 P 0.00 4.32 0.00 1.93 2.06 0.00 3.80 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.21 0.00 18 N 8.52 4.32 0.00 2.84 2.89 0.00 0.00 7.08 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 19 T 7.90 4.55 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 0.97 0.00 0.00 20 D 8.77 5.07 0.00 2.59 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 21 F 8.92 5.24 0.00 3.31 2.95 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 22 R 9.20 4.98 0.00 1.86 1.96 0.00 3.47 0.00 0.00 3.18 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.78 0.00 23 A 9.01 5.23 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 24 I 9.08 5.07 2.03 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.12 1.05 0.00 0.00 25 F 9.64 5.55 0.00 2.85 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 26 F 8.84 5.39 0.00 3.19 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 A 8.75 5.01 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 N 8.59 5.29 0.00 2.99 2.75 0.00 0.00 6.69 6.58 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 29 A 8.94 4.50 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 30 A 8.75 4.03 1.25 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 0.00 0.00 0.00 31 E 7.78 4.29 0.00 1.97 1.89 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 2.27 2.22 0.00 32 Q 8.49 4.13 0.00 2.11 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.91 0.00 0.00 0.00 0.00 0.00 2.42 2.42 0.00 33 Q 9.15 4.42 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.61 0.00 0.00 0.00 0.00 0.00 2.62 2.67 0.00 34 H 9.37 5.29 0.00 3.39 3.54 0.00 5.59 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 I 9.20 5.04 2.29 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.22 1.33 0.00 0.00 36 K 9.35 5.20 0.00 1.75 1.12 0.00 1.52 0.00 0.00 1.36 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.71 1.10 7.81 37 L 8.70 4.87 0.00 1.89 1.53 1.23 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 38 F 9.20 5.12 0.00 2.86 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 39 I 8.22 4.76 1.91 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 1.39 1.13 1.01 0.00 0.00 40 G 9.08 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 D 8.67 4.64 0.00 2.68 2.70 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 42 S 7.73 4.26 0.00 3.90 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 43 Q 8.62 4.43 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.51 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 44 E 7.89 4.68 0.00 1.99 1.89 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 2.31 2.39 0.00 45 P 0.00 3.62 0.00 1.96 1.01 0.00 3.72 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.58 0.00 46 A 8.40 4.24 1.25 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 0.00 0.00 0.00 47 A 7.63 4.63 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 48 Y 7.99 5.21 0.00 2.65 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 49 H 9.23 4.60 0.00 2.76 2.92 0.00 5.61 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 8.42 5.00 0.00 1.39 1.60 0.00 1.46 0.00 0.00 1.42 0.00 0.00 2.37 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.87 0.65 7.81 51 L 9.00 5.17 0.00 1.61 1.55 1.02 0.31 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 52 T 9.01 4.76 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 1.33 0.00 0.00 53 T 8.41 4.38 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 1.25 0.00 0.00 54 R 7.33 4.05 0.00 1.65 2.01 0.00 3.17 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.62 0.00 55 D 8.03 4.39 0.00 2.89 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 56 G 7.62 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 57 P 0.00 5.18 0.00 2.12 2.01 0.00 3.72 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 1.94 1.95 0.00 58 R 9.06 4.79 0.00 1.42 1.45 0.00 3.10 0.00 0.00 3.03 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.34 0.00 59 E 8.83 5.34 0.00 1.99 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 2.23 2.37 0.00 60 A 9.53 4.94 1.41 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 0.00 0.00 0.00 61 T 8.34 4.81 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 1.13 0.00 0.00 62 L 8.27 4.67 0.00 0.27 1.12 0.94 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 63 N 8.29 5.54 0.00 2.75 2.62 0.00 0.00 6.99 7.63 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 64 S 9.37 4.48 0.00 3.89 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 65 G 8.41 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 66 N 8.89 4.46 0.00 2.82 2.95 0.00 0.00 6.09 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 67 G 8.42 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 68 K 8.56 4.89 0.00 1.77 1.73 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.51 1.55 7.81 69 I 8.85 5.12 1.82 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.49 0.63 0.00 0.00 70 R 8.96 5.25 0.00 1.88 2.00 0.00 2.59 0.00 0.00 3.10 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.66 0.00 71 F 8.47 5.62 0.00 3.15 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 72 E 9.49 4.84 0.00 2.22 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 2.30 0.00 73 V 8.63 5.09 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 1.18 0.00 0.00 1.03 0.00 0.00 74 S 9.28 5.24 0.00 3.98 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 75 V 8.54 4.57 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 0.96 0.00 0.00 1.02 0.00 0.00 76 N 9.90 4.12 0.00 2.86 2.85 0.00 0.00 7.14 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 77 G 8.41 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 0.00 0.00 0.00 78 K 7.76 4.61 0.00 1.89 1.68 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.48 7.81 79 P 0.00 4.71 0.00 2.19 2.07 0.00 3.76 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 1.99 1.99 0.00 80 S 8.64 4.67 0.00 3.77 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 81 A 8.35 4.43 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 82 T 8.40 5.30 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 1.32 0.00 0.00 83 D 9.07 5.11 0.00 2.72 2.49 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 84 A 8.25 5.21 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 0.00 0.00 0.00 0.00 0.00 85 R 9.10 4.71 0.00 1.89 2.02 0.00 2.78 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.70 0.00 86 L 8.55 5.22 0.00 1.66 1.75 1.09 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 87 A 8.54 4.88 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 88 P 0.00 4.61 0.00 2.06 2.15 0.00 3.77 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.00 0.00 89 I 8.92 4.39 2.05 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.72 1.02 0.00 0.00 90 N 8.78 4.96 0.00 2.45 2.56 0.00 0.00 6.84 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 91 G 7.44 3.66 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 0.00 0.00 0.00 92 K 8.34 5.20 0.00 1.61 1.72 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.30 1.35 7.81 93 K 9.49 4.48 0.00 2.08 1.80 0.00 1.79 0.00 0.00 2.06 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.66 7.81 94 S 8.59 4.12 0.00 3.99 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 95 D 8.11 4.56 0.00 2.82 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 96 G 8.43 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 97 S 8.30 4.44 0.00 4.05 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 98 P 0.00 5.09 0.00 2.05 2.04 0.00 3.73 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 99 F 8.55 5.21 0.00 3.13 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 0.00 100 T 8.62 5.07 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 1.20 0.00 0.00 101 V 8.94 4.30 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 0.84 0.00 0.00 1.07 0.00 0.00 102 N 8.33 4.70 0.00 1.44 1.42 0.00 0.00 6.32 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 0.00 103 F 8.13 5.10 0.00 3.04 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 0.00 104 G 9.18 4.61 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 0.00 0.00 0.00 105 I 9.26 5.27 1.96 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.80 0.94 0.00 0.00 106 V 8.86 4.84 1.62 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 0.86 0.00 0.00 0.65 0.00 0.00 107 V 8.62 4.99 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 0.74 0.00 0.00 1.05 0.00 0.00 108 S 8.09 5.02 0.00 4.00 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 0.00 109 E 8.64 4.84 0.00 1.16 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 2.00 0.00 110 D 9.54 4.48 0.00 2.74 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.51 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 H 8.10 4.39 0.00 3.03 3.33 0.00 5.99 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 0.00 113 D 7.61 4.47 0.00 2.78 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 0.00 114 S 8.43 4.85 0.00 4.13 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 0.00 115 D 8.52 4.51 0.00 2.88 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 0.00 116 Y 8.52 3.47 0.00 3.25 3.10 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 0.00 117 N 7.88 5.07 0.00 2.85 2.89 0.00 0.00 6.85 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 0.00 118 D 8.04 4.85 0.00 2.65 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 0.00 119 G 7.79 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.49 4.78 0.56 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.54 0.62 0.00 0.00 121 V 8.29 4.69 1.44 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 0.66 0.00 0.00 0.55 0.00 0.00 122 V 8.87 4.84 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 1.11 0.00 0.00 1.12 0.00 0.00 123 L 9.02 5.28 0.00 1.68 1.62 0.14 0.76 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 0.00 124 Q 9.26 4.66 0.00 1.97 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.60 0.00 0.00 0.00 0.00 0.00 1.28 2.09 0.00 125 W 8.05 5.41 0.00 3.53 3.25 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 0.00 126 P 0.00 5.04 0.00 2.27 2.24 0.00 3.63 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 127 I 8.14 4.40 1.90 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.75 0.99 0.00 0.00 128 G 8.18 3.83 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 0.00 0.00 0.00