NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 4.8107 8.2833 118.1558 52.1198 38.8819 174.9581 2 L 3.8151 8.2901 118.8493 57.1737 41.3352 178.0738 3 Y 3.9185 8.8031 120.4364 60.8686 39.1042 177.8674 4 Q 3.8588 8.6688 119.2069 58.7001 28.7335 178.4207 5 F 4.3054 8.2642 121.7869 61.1083 39.4013 176.8800 6 K 3.4485 7.9107 119.3388 59.6930 31.8840 178.5024 7 N 4.2885 7.7261 116.4440 56.2816 38.3680 177.3189 8 M 4.0753 8.2022 120.6068 58.4562 32.0497 178.9294 9 I 3.4998 7.4728 119.7521 64.4572 37.0735 178.5124 10 Q 4.2786 8.2131 117.8913 58.8117 28.4970 177.6632 11 C 4.4707 7.8093 118.7414 58.8272 44.0324 175.0096 12 T 4.0461 7.8718 109.9211 62.3459 69.5840 175.2033 13 V 4.4766 8.1190 121.6343 60.5565 31.2570 173.8140 14 P 4.5973 0.0000 0.0000 64.6454 32.4907 178.9121 15 S 4.0798 7.5271 111.3138 60.8479 63.1534 174.4738 *17 R 4.6829 7.5876 117.6450 55.5161 30.6369 175.0793 18 S 4.3217 8.2827 116.1983 58.2818 63.1096 175.0175 19 W 4.4005 8.7597 120.3609 59.2829 28.3032 178.2258 20 A 3.2234 6.1013 121.3361 54.4122 17.2968 179.1292 21 D 4.1357 7.0850 116.3871 56.5213 40.7747 177.7360 22 F 4.6967 8.1886 115.8346 57.2368 39.8965 176.3530 23 A 4.4921 8.0133 122.2497 54.1066 19.0136 177.0172 24 D 4.7144 7.7221 114.9183 53.0209 42.2495 171.7564 25 Y 4.6252 8.8298 123.0040 56.1276 42.8070 175.7366 26 G 3.8654 7.9564 116.1472 46.6616 0.0000 172.7092 27 C 4.4123 9.7862 115.4229 57.9881 40.8946 174.6966 28 Y 4.0770 8.8373 115.2584 57.9520 39.9941 175.0967 29 C 4.6156 8.5251 118.6588 59.1339 40.4179 171.7945 30 G 4.3367 9.2741 111.9404 44.7984 0.0000 171.9685 31 K 4.1347 9.0334 117.7921 59.5826 32.2295 177.6836 32 G 3.8020 8.1232 105.7245 46.4316 0.0000 173.6916 33 G 4.2105 8.0003 111.8932 43.2387 0.0000 171.1142 34 S 4.3425 6.9927 110.8681 58.4060 66.4985 176.2307 35 G 3.7614 8.6515 108.4659 44.9066 0.0000 172.0647 36 T 4.4024 8.2213 115.7107 61.6904 69.2145 173.2093 37 P 4.7723 0.0000 0.0000 63.2078 31.8311 177.0441 38 V 3.8611 8.7561 115.4001 63.2304 32.2747 175.1006 39 D 4.5045 7.4109 117.3647 51.6964 41.7424 175.9770 40 D 4.3937 8.5184 118.1287 57.5646 40.5111 178.6389 41 L 3.9728 7.9778 120.4163 58.1624 42.1091 178.3423 42 D 4.5284 8.8194 118.1547 57.4723 41.1877 178.4077 43 R 3.8675 8.1380 118.6449 59.4655 30.0573 178.3543 44 C 4.4117 8.3225 116.3232 60.2155 37.4477 175.4863 45 C 4.4746 8.1648 117.9722 59.6392 38.8708 175.8721 46 Q 3.5974 8.1060 121.3945 59.3253 28.4649 178.3336 47 T 3.7881 7.8667 116.7317 66.8573 68.4711 175.9976 48 H 3.9618 8.1376 119.9637 59.3289 29.8587 177.0278 49 D 4.2607 8.5182 120.9793 57.5630 40.7319 178.5810 50 N 4.4058 8.5039 117.3143 56.3932 38.4186 176.7033 51 C 4.3334 8.3897 120.2882 59.8069 44.7949 175.2601 52 Y 4.1715 8.2057 118.4862 61.2252 37.2291 178.1772 53 N 4.4196 8.1518 116.4556 56.2476 38.8900 177.0637 54 E 4.1022 8.3810 119.7666 59.4901 29.5936 179.2473 55 A 4.0372 8.2338 120.7665 55.1856 18.1664 179.3775 56 E 4.2507 8.0518 117.2741 58.5597 29.5260 178.8199 57 N 4.4838 7.8442 115.9378 54.6582 39.1418 175.5383 58 I 3.9093 7.4437 122.5818 60.3237 37.8702 175.3326 59 S 4.1203 8.7091 119.4755 60.0261 62.3362 174.1248 60 G 3.8195 8.8231 114.6181 46.1815 0.0000 172.9914 61 C 4.6143 8.0448 120.6826 54.8386 45.0004 172.8938 62 R 4.5329 8.1708 126.0880 53.2854 30.7431 173.9445 63 P 3.9841 0.0000 0.0000 65.4868 31.6657 177.9719 64 Y 4.2134 8.0659 114.9626 59.7969 37.9763 176.9689 65 F 4.6363 8.0297 116.5023 57.1507 41.2300 175.6097 66 K 4.1032 8.0636 122.1354 56.2440 32.2529 176.0148 67 T 4.1643 8.5041 124.1172 63.0284 68.9374 173.6488 68 Y 4.8444 7.6852 124.9387 55.0913 40.9176 174.1625 69 S 5.1014 9.5416 114.8594 56.8723 64.4407 172.6576 70 Y 5.4220 8.5174 123.7492 56.0686 41.2632 173.3690 71 E 4.4251 9.4319 119.9890 54.5456 33.7669 173.3787 72 C 5.4675 8.4774 124.6069 55.4928 47.1567 173.0382 73 T 4.6007 9.1299 115.0242 61.8100 71.3200 173.2967 74 Q 3.5116 9.7565 120.0363 57.2077 26.3422 175.0522 75 G 3.9907 8.6486 103.5404 45.6919 0.0000 174.0219 76 T 4.6253 7.8872 116.3251 61.4381 71.6608 172.5406 77 L 5.3367 8.4404 125.2652 53.5400 43.8506 176.0767 78 T 4.6660 8.8783 119.3002 62.0451 72.6644 172.2724 79 C 4.9049 8.8461 124.0500 56.1810 39.5551 173.9611 80 K 4.3966 8.9996 123.7439 55.6520 32.8897 178.6282 81 G 3.6247 8.7808 110.5665 47.9092 0.0000 173.7184 82 D 4.7584 7.2540 121.5212 53.3577 39.2403 176.4697 83 N 5.0115 7.6492 115.3038 51.7175 42.0565 175.6651 84 N 4.6719 8.5517 120.5095 52.1718 39.9088 175.7260 85 A 3.9652 8.4212 120.9953 55.4645 18.2836 180.1886 86 C 4.1627 8.1959 116.1500 59.7958 41.5883 175.3026 87 A 4.0255 8.8421 122.5212 55.3002 17.9935 179.4676 88 A 3.9026 8.5527 119.5144 55.1879 18.4539 179.8385 89 S 3.9673 8.1560 111.6324 61.4946 62.5301 176.5919 90 V 3.5366 7.9279 121.0789 66.1428 31.2335 176.9396 91 C 2.8844 8.1822 118.6170 59.3575 44.4462 175.0910 92 D 4.1307 7.9943 119.3843 57.4543 40.8052 177.5107 93 C 4.2206 8.1410 116.9473 60.2163 40.2962 175.9871 94 D 3.7911 7.9445 120.3374 57.0027 40.4085 178.7437 95 R 3.7798 8.0335 119.4568 59.4866 30.1359 178.4824 96 L 3.9128 7.9168 118.4767 57.7864 41.5409 179.5051 97 A 3.7343 7.8781 120.3987 54.8904 18.2881 179.5680 98 A 3.3780 8.0054 119.5279 55.1157 18.1947 179.9290 99 I 3.6146 7.4407 117.2836 64.5463 37.5688 177.4734 100 C 4.4260 8.2037 119.2889 59.8285 38.0389 175.5658 101 F 4.3198 8.5387 119.5333 60.7537 38.2043 177.5739 102 A 4.2217 7.9194 119.0237 54.5442 18.2627 179.0212 103 G 3.8165 7.8426 101.2139 44.2859 0.0000 173.3553 104 A 4.7762 7.1674 124.2134 49.4476 20.8028 175.2260 105 P 4.4137 0.0000 0.0000 62.6606 32.0883 175.2234 106 Y 4.2546 8.4761 123.4139 55.9956 40.0973 174.2286 107 N 4.9101 8.5017 125.5120 51.6193 40.2038 174.2392 108 D 4.6595 9.0141 126.9437 57.4932 41.1328 179.3794 109 A 4.0348 8.5714 121.3716 54.5432 18.5326 177.7682 110 N 4.3365 8.3279 112.2749 53.1986 39.0283 174.3048 111 Y 4.1365 7.2703 120.5871 58.1980 39.4952 174.6833 112 N 4.1101 8.1544 125.2680 53.4351 37.7523 174.0488 113 I 3.8062 7.1834 109.0979 60.1907 39.0448 175.6926 114 D 4.4916 8.2337 121.1558 53.1697 40.2368 176.6582 115 L 3.9106 8.3967 127.2945 57.5252 42.0459 179.8583 116 K 3.7986 8.2044 117.8077 59.1611 32.2026 177.3172 117 A 4.2811 8.0744 120.1415 53.4369 18.9973 177.9339 118 R 4.5312 7.9299 112.0703 56.4015 31.4210 175.8846 119 C 4.9751 7.9128 114.8447 56.5170 41.1784 173.7910 120 N 4.5053 8.2372 122.8942 53.6736 38.1481 175.0639 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 N 8.28 4.81 0.00 3.04 3.05 0.00 0.00 6.13 5.79 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 2 L 8.29 3.82 0.00 1.57 1.67 0.45 0.51 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 3 Y 8.80 3.92 0.00 2.95 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 4 Q 8.67 3.86 0.00 1.90 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.58 0.00 0.00 0.00 0.00 0.00 2.52 2.52 0.00 5 F 8.26 4.31 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 6 K 7.91 3.45 0.00 1.41 1.52 0.00 1.09 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.57 0.21 7.81 7 N 7.73 4.29 0.00 2.74 2.83 0.00 0.00 7.08 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 8 M 8.20 4.08 0.00 1.97 2.19 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 2.54 2.53 0.00 9 I 7.47 3.50 1.78 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 -0.16 0.79 0.00 0.00 10 Q 8.21 4.28 0.00 2.04 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.91 0.00 0.00 0.00 0.00 0.00 2.51 2.53 0.00 11 C 7.81 4.47 0.00 3.08 3.30 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 12 T 7.87 4.05 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 13 V 8.12 4.48 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.91 0.00 0.00 14 P 0.00 4.60 0.00 2.23 2.26 0.00 3.84 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 1.99 1.96 0.00 15 S 7.53 4.08 0.00 4.02 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 0.00 *17 R 7.59 4.68 0.00 1.76 1.79 0.00 3.08 0.00 0.00 3.51 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.63 0.00 18 S 8.28 4.32 0.00 3.76 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 19 W 8.76 4.40 0.00 3.72 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 20 A 6.10 3.22 0.52 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 21 D 7.08 4.14 0.00 1.96 1.79 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 22 F 8.19 4.70 0.00 3.16 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 23 A 8.01 4.49 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 D 7.72 4.71 0.00 2.65 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 0.00 0.00 0.00 0.00 25 Y 8.83 4.63 0.00 2.97 2.64 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 26 G 7.96 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 27 C 9.79 4.41 0.00 3.06 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 28 Y 8.84 4.08 0.00 3.21 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 29 C 8.53 4.62 0.00 3.45 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 G 9.27 4.34 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 0.00 31 K 9.03 4.13 0.00 1.80 1.99 0.00 1.83 0.00 0.00 1.79 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.58 1.56 7.81 32 G 8.12 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.00 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 0.00 0.00 0.00 0.00 34 S 6.99 4.34 0.00 3.74 3.74 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 35 G 8.65 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 T 8.22 4.40 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 1.25 0.00 0.00 37 P 0.00 4.77 0.00 2.07 2.04 0.00 3.73 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.93 0.00 38 V 8.76 3.86 2.04 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 0.69 0.00 0.00 0.97 0.00 0.00 39 D 7.41 4.50 0.00 2.88 2.78 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 40 D 8.52 4.39 0.00 2.74 2.80 0.00 0.00 0.00 0.00 0.00 0.00 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 7.98 3.97 0.00 1.64 1.70 0.58 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 42 D 8.82 4.53 0.00 3.17 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 R 8.14 3.87 0.00 2.12 1.96 0.00 3.20 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.80 0.00 44 C 8.32 4.41 0.00 3.43 3.42 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 45 C 8.16 4.47 0.00 3.31 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 Q 8.11 3.60 0.00 0.99 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 1.99 1.38 0.00 47 T 7.87 3.79 4.23 0.00 0.00 0.00 0.00 0.00 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 48 H 8.14 3.96 0.00 3.19 3.40 0.00 5.59 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 8.52 4.26 0.00 2.94 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 50 N 8.50 4.41 0.00 2.91 2.87 0.00 0.00 6.71 7.40 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 51 C 8.39 4.33 0.00 3.09 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 Y 8.21 4.17 0.00 3.20 2.93 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 53 N 8.15 4.42 0.00 2.91 2.92 0.00 0.00 7.10 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 54 E 8.38 4.10 0.00 2.19 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 2.51 2.48 0.00 55 A 8.23 4.04 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 56 E 8.05 4.25 0.00 2.15 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 2.37 2.35 0.00 57 N 7.84 4.48 0.00 2.89 2.88 0.00 0.00 7.01 7.51 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 58 I 7.44 3.91 1.98 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 1.18 0.68 0.91 0.00 0.00 59 S 8.71 4.12 0.00 3.82 3.80 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.82 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 0.00 0.00 0.00 61 C 8.04 4.61 0.00 3.00 3.17 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 62 R 8.17 4.53 0.00 1.97 1.99 0.00 3.08 0.00 0.00 3.27 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 63 P 0.00 3.98 0.00 0.87 0.81 0.00 3.73 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 1.86 1.85 0.00 64 Y 8.07 4.21 0.00 2.44 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 0.00 0.00 0.00 0.00 65 F 8.03 4.64 0.00 3.01 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 66 K 8.06 4.10 0.00 1.74 1.77 0.00 1.70 0.00 0.00 1.74 0.00 0.00 3.12 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.49 1.60 7.81 67 T 8.50 4.16 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 1.18 0.00 0.00 68 Y 7.69 4.84 0.00 3.16 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 69 S 9.54 5.10 0.00 3.96 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 70 Y 8.52 5.42 0.00 3.19 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.43 4.43 0.00 1.91 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 2.13 2.13 0.00 72 C 8.48 5.47 0.00 3.09 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 73 T 9.13 4.60 4.23 0.00 0.00 0.00 0.00 0.00 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 74 Q 9.76 3.51 0.00 2.18 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.83 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 75 G 8.65 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 76 T 7.89 4.63 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 1.21 0.00 0.00 77 L 8.44 5.34 0.00 1.52 1.60 0.90 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 78 T 8.88 4.67 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 1.22 0.00 0.00 79 C 8.85 4.90 0.00 2.81 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 80 K 9.00 4.40 0.00 1.93 1.81 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.79 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.47 1.44 7.81 81 G 8.78 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 82 D 7.25 4.76 0.00 2.99 2.76 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 83 N 7.65 5.01 0.00 2.71 2.85 0.00 0.00 7.23 8.00 0.00 0.00 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 N 8.55 4.67 0.00 3.00 3.01 0.00 0.00 6.15 7.14 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 85 A 8.42 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 86 C 8.20 4.16 0.00 3.01 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 87 A 8.84 4.03 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 A 8.55 3.90 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 89 S 8.16 3.97 0.00 3.96 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 90 V 7.93 3.54 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 1.05 0.00 0.00 0.90 0.00 0.00 91 C 8.18 2.88 0.00 2.20 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 92 D 7.99 4.13 0.00 2.91 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 93 C 8.14 4.22 0.00 3.23 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 94 D 7.94 3.79 0.00 2.74 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 95 R 8.03 3.78 0.00 1.82 2.01 0.00 3.21 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.64 0.00 96 L 7.92 3.91 0.00 1.66 1.65 0.93 0.56 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 97 A 7.88 3.73 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 A 8.01 3.38 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 99 I 7.44 3.61 1.97 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 1.38 0.61 0.89 0.00 0.00 100 C 8.20 4.43 0.00 3.17 3.31 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 0.00 101 F 8.54 4.32 0.00 2.90 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 0.00 102 A 7.92 4.22 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 0.00 103 G 7.84 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 0.00 0.00 0.00 104 A 7.17 4.78 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 0.00 105 P 0.00 4.41 0.00 2.10 2.04 0.00 3.71 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.10 0.00 106 Y 8.48 4.25 0.00 2.85 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 0.00 107 N 8.50 4.91 0.00 2.76 2.77 0.00 0.00 6.86 7.82 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 0.00 108 D 9.01 4.66 0.00 2.87 2.78 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 0.00 109 A 8.57 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 0.00 110 N 8.33 4.34 0.00 2.09 1.82 0.00 0.00 6.49 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 Y 7.27 4.14 0.00 2.98 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.15 4.11 0.00 1.79 2.51 0.00 0.00 7.18 8.75 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 0.00 113 I 7.18 3.81 1.75 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.58 0.75 0.00 0.00 114 D 8.23 4.49 0.00 2.65 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 0.00 115 L 8.40 3.91 0.00 1.69 1.63 0.87 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 116 K 8.20 3.80 0.00 1.68 1.95 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 1.43 7.81 117 A 8.07 4.28 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 0.00 118 R 7.93 4.53 0.00 1.90 1.90 0.00 3.06 0.00 0.00 3.16 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.52 0.00 119 C 7.91 4.98 0.00 3.03 3.06 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 0.00 0.00 0.00 120 N 8.24 4.51 0.00 2.70 2.72 0.00 0.00 6.95 7.56 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 * Residues marked with a * may have inaccurate shift predictions.