NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 26 G 3.7680 8.3549 109.7125 44.7528 0.0000 173.2454 27 W 4.2404 8.2026 118.6181 55.2261 29.5278 174.0517 28 P 4.3395 0.0000 0.0000 62.6587 32.2828 175.9049 29 K 4.2798 8.2384 120.2197 56.0586 32.7375 176.0611 30 H 4.7574 8.3410 122.9520 54.3274 31.5761 174.4858 31 T 4.6699 8.3208 118.0751 62.6528 68.4816 174.6763 32 A 4.6800 9.5696 130.5484 54.5077 19.7414 174.3736 33 C 5.0589 8.0446 107.2161 55.4889 44.9751 173.5267 34 N 5.1371 8.6339 117.9582 53.6385 39.7879 172.8821 35 S 4.4144 9.5597 119.3187 57.5110 66.8633 174.4695 36 G 4.0554 9.7383 112.2013 46.6431 0.0000 175.1265 37 G 3.9791 8.5193 105.9774 44.5690 0.0000 172.8403 38 L 5.2497 8.0575 122.0242 52.9164 45.1499 174.6832 39 E 5.1603 9.2978 126.9458 54.3342 32.8864 174.4365 40 V 4.9146 8.9720 126.5264 61.1932 34.5021 174.1722 41 V 5.0693 8.8329 127.9395 61.2767 34.6700 173.7964 42 Y 5.4671 8.7559 124.3475 55.4889 42.3630 173.7127 43 Q 4.6276 9.3141 120.8478 54.0841 32.6983 174.0569 44 S 4.9816 9.0253 121.7786 58.8687 62.8957 172.3366 45 C 4.9354 9.2449 121.3666 55.3135 37.8370 173.1408 46 D 4.8371 8.2634 120.8311 52.5278 40.3927 175.2595 47 P 4.6118 0.0000 0.0000 65.5176 31.5251 177.8422 48 L 4.3746 8.3412 119.2398 57.5577 41.7540 176.8793 49 Q 4.1957 8.0469 113.1311 55.2528 31.2482 172.9231 50 D 4.0676 6.9546 119.0941 52.7922 42.9476 174.6347 51 F 4.9221 7.6497 114.8289 55.5333 41.0705 173.5791 52 G 4.3198 9.1256 107.4175 44.6913 0.0000 172.6201 53 L 5.6342 8.9225 125.8167 53.7157 45.8377 174.8120 54 S 5.0575 9.5663 120.2566 56.7476 67.0432 172.7513 55 I 4.9366 8.5671 121.7457 59.6614 39.6700 174.7365 56 D 4.6048 9.1600 127.2637 53.6904 42.4354 175.8082 57 Q 3.5343 8.6796 121.2680 56.9231 26.2735 174.9677 58 C 4.4436 8.1556 113.7721 57.5567 41.0267 173.4784 59 S 4.9210 7.9824 115.2187 57.2802 65.0335 175.2932 60 K 3.9777 8.6708 120.9403 59.6217 32.8927 176.6343 61 Q 4.6088 7.9673 119.3318 54.4610 28.4840 174.8699 62 I 4.0061 8.6855 125.9929 60.6930 38.0887 175.7806 63 Q 4.4934 8.6773 126.1943 55.7097 29.3458 176.3825 64 S 4.2194 8.6291 116.0165 58.7833 63.7967 173.3900 65 N 4.9639 8.3257 116.3898 53.3741 36.1831 174.6821 66 L 4.1838 8.4359 118.8316 55.3429 43.7827 177.8771 67 N 5.3857 8.6624 118.9026 52.0773 40.8060 174.1561 68 I 5.1213 8.9558 115.9657 59.2068 42.1547 174.1274 69 R 4.9173 9.0676 121.1904 54.3256 33.3202 174.7371 70 F 5.4652 9.3828 126.6238 56.4489 42.7421 173.5541 71 G 4.4578 9.0580 113.4270 44.4667 0.0000 171.1396 72 I 4.7748 8.3265 123.4075 59.7906 42.1484 173.1003 73 I 4.6884 8.1453 128.0225 60.0222 38.4651 175.5678 74 L 4.2559 9.2100 128.3492 55.0178 42.3047 177.7338 75 R 4.6243 8.8175 121.2325 56.3126 31.1051 175.9559 76 Q 4.6987 7.7359 116.7313 53.8825 33.0992 174.4891 77 D 4.6554 8.8019 121.7174 54.6036 42.0599 175.9662 78 I 4.3344 8.8362 123.7126 60.0197 39.3609 176.2543 79 R 3.9964 9.2330 128.1644 57.8632 30.7801 176.5306 80 K 4.6119 7.9210 115.4089 54.2979 36.5980 174.9191 81 L 4.9892 7.4707 123.0232 53.3621 45.8561 175.0307 82 F 4.9504 8.6888 122.8632 55.4460 43.7697 173.1927 83 L 5.0430 8.7978 123.6577 53.4178 44.6864 174.6838 84 D 5.5675 9.2846 126.2787 52.7610 43.8438 175.3583 85 I 5.0675 9.0332 122.9555 59.8771 40.9562 174.4409 86 T 5.1220 9.0536 123.6993 61.6287 71.7167 172.7652 87 L 4.8932 9.0003 129.1464 54.3804 43.5152 174.9620 88 M 5.2275 9.0175 126.3654 53.6701 34.6429 175.8733 89 A 4.4162 8.8022 125.4269 51.4698 21.7020 176.4981 90 K 4.1230 9.5608 123.8359 58.0458 29.3663 177.0810 91 G 3.9707 8.5009 104.6732 45.7517 0.0000 173.9692 92 S 4.8368 7.6155 115.8379 56.1163 65.3857 173.8344 93 S 4.7518 8.5723 119.1468 58.3721 63.5227 173.7969 94 I 4.5130 8.6507 115.9150 60.7959 39.7517 175.4073 95 L 4.6551 7.8053 125.0212 53.6718 45.4080 174.0196 96 N 5.2826 8.9970 123.8025 51.7711 40.5341 173.3189 97 Y 4.8801 9.2432 125.6984 55.9045 41.8689 174.2968 98 S 4.9772 7.5638 118.2204 56.9202 66.2131 172.3451 99 Y 4.7434 8.8494 126.2159 55.3326 42.2384 172.0077 100 P 4.5475 0.0000 0.0000 62.5965 31.9508 176.0904 101 L 4.3619 8.5298 123.4357 55.3556 42.5587 176.2260 102 C 4.6943 7.3860 115.6305 54.6276 43.4430 173.1062 *109 F 4.5323 8.4267 124.9712 58.1601 39.9382 173.8423 110 S 4.4117 6.8810 119.6371 56.7046 65.3057 173.6328 111 F 4.0684 8.4837 122.2433 58.3051 39.3955 176.9286 112 C 4.6348 7.8423 118.6628 57.2061 40.9100 174.2383 113 G 3.6970 9.1683 111.9178 45.2854 0.0000 173.9317 114 R 4.5258 7.4731 118.3795 55.1049 31.7813 175.4753 115 R 5.0045 8.7675 118.9887 53.6186 32.8969 175.6801 116 K 3.9429 9.1952 121.3026 58.7201 32.4099 176.5606 117 G 4.1095 9.1098 114.3287 45.3350 0.0000 173.9380 118 E 4.1445 7.9729 119.4913 56.6101 30.7435 176.1782 119 Q 5.0283 8.6775 122.5862 54.5541 30.4299 174.9440 120 I 4.6858 8.7878 125.4191 59.5363 40.7929 174.4572 121 Y 4.8995 8.5648 125.8037 56.2326 41.4242 173.5400 122 Y 4.1908 9.1412 129.2272 55.6971 40.9106 174.1688 123 A 4.5426 7.2508 128.8094 50.7519 20.9075 174.6380 124 G 3.6235 7.7416 107.9496 45.8224 0.0000 169.4011 125 P 5.1907 0.0000 0.0000 62.7451 32.5709 175.9734 126 V 4.4909 8.6912 113.9962 59.1598 35.5487 174.7443 127 N 5.0266 8.3618 118.6386 54.0345 39.3511 174.7157 128 N 4.5724 8.0478 114.6949 51.5447 38.7829 172.6027 129 P 4.7612 0.0000 0.0000 62.0172 32.8500 175.9968 130 G 3.8165 8.4825 107.8791 46.7160 0.0000 172.8739 131 L 4.9317 8.9139 122.1110 52.7894 46.8552 174.9637 132 D 5.0624 8.5370 120.3681 52.5406 43.3790 175.3905 133 V 3.9603 8.6542 128.0983 61.0991 31.7535 174.3381 134 P 4.4643 0.0000 0.0000 61.9512 31.9770 176.1850 135 Q 4.0967 8.7057 121.4879 56.1415 29.4106 177.1876 136 G 3.9407 7.3694 111.3731 43.9867 0.0000 170.4566 137 E 5.0524 7.6119 120.4123 54.3902 32.1260 174.9373 138 Y 4.8198 9.3358 123.7690 56.3271 42.0219 174.2304 139 Q 5.0927 8.8176 122.5136 54.4396 31.0651 174.5625 140 L 5.3578 9.2363 124.0951 52.7661 45.7866 175.0608 141 L 5.1980 9.0373 123.9880 53.3958 44.5529 174.9677 142 L 5.3386 9.3423 126.3242 53.1389 44.7889 175.4071 143 E 5.1832 9.3092 121.7322 54.7739 34.1609 174.2004 144 L 5.1803 8.9317 124.5726 53.1939 44.1780 175.2090 145 Y 5.3404 8.2341 120.7284 55.9066 42.4048 174.7244 146 N 5.7792 8.5184 116.8718 51.2318 39.9300 175.2479 147 E 4.2778 9.0164 116.2108 59.8689 29.6061 177.4767 148 N 4.7431 8.5108 113.8512 52.0935 38.6575 174.4363 149 R 3.6841 7.7704 116.0562 56.9433 29.5162 175.8673 150 A 4.3547 8.0841 118.0365 51.1434 19.4701 177.9864 151 T 4.4148 8.4755 119.6668 63.8078 69.1690 174.2928 152 V 4.2179 8.9367 126.9072 64.5401 32.7336 175.7660 153 A 4.7934 7.6118 119.5396 50.9307 22.8532 175.5526 154 C 5.4188 8.8328 118.6396 55.2764 42.9091 172.6269 155 A 5.5128 9.4109 126.8998 50.7191 23.0006 174.4785 156 N 5.2599 9.2206 118.7331 52.3682 40.4231 174.2753 157 A 5.3847 9.3919 125.2745 50.4438 22.9787 174.7038 158 T 5.0527 9.0876 117.8543 61.7872 71.4493 173.4803 159 V 4.9515 9.0680 127.0451 61.4186 34.1598 174.2275 160 T 5.1249 9.1595 124.9119 61.8432 71.5801 172.7578 161 S 5.2824 9.3884 122.3536 56.5009 64.6910 174.0205 162 S 4.3294 9.0571 121.7359 58.6267 62.6289 173.7982 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 26 G 8.35 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 27 W 8.20 4.24 0.00 3.39 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 28 P 0.00 4.34 0.00 1.84 1.93 0.00 4.10 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.17 0.00 29 K 8.24 4.28 0.00 1.54 1.64 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.41 7.81 30 H 8.34 4.76 0.00 1.86 2.96 0.00 5.60 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 31 T 8.32 4.67 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 1.27 0.00 0.00 32 A 9.57 4.68 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 33 C 8.04 5.06 0.00 2.98 3.35 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 34 N 8.63 5.14 0.00 2.72 2.76 0.00 0.00 6.72 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 35 S 9.56 4.41 0.00 3.92 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 36 G 9.74 4.06 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 0.00 0.00 0.00 37 G 8.52 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 0.00 0.00 0.00 38 L 8.06 5.25 0.00 1.75 1.50 0.95 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 39 E 9.30 5.16 0.00 2.17 1.77 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 2.22 2.24 0.00 40 V 8.97 4.91 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 1.06 0.00 0.00 0.97 0.00 0.00 41 V 8.83 5.07 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 0.99 0.00 0.00 0.95 0.00 0.00 42 Y 8.76 5.47 0.00 3.16 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 43 Q 9.31 4.63 0.00 2.05 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 7.02 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 44 S 9.03 4.98 0.00 3.91 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 45 C 9.24 4.94 0.00 3.10 3.27 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 46 D 8.26 4.84 0.00 2.87 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 47 P 0.00 4.61 0.00 2.30 2.25 0.00 3.95 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.07 0.00 48 L 8.34 4.37 0.00 2.00 1.89 0.99 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 49 Q 8.05 4.20 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.73 0.00 0.00 0.00 0.00 0.00 2.29 2.26 0.00 50 D 6.95 4.07 0.00 1.58 2.09 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 51 F 7.65 4.92 0.00 3.07 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 52 G 9.13 4.32 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 0.00 53 L 8.92 5.63 0.00 2.07 1.25 0.97 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 54 S 9.57 5.06 0.00 3.93 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 55 I 8.57 4.94 1.90 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.72 0.91 0.00 0.00 56 D 9.16 4.60 0.00 2.65 2.54 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 57 Q 8.68 3.53 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.73 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 58 C 8.16 4.44 0.00 2.97 3.03 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 59 S 7.98 4.92 0.00 3.92 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 60 K 8.67 3.98 0.00 1.75 1.92 0.00 1.98 0.00 0.00 1.66 0.00 0.00 2.91 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.52 1.60 7.81 61 Q 7.97 4.61 0.00 1.90 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 6.97 0.00 0.00 0.00 0.00 0.00 2.31 2.64 0.00 62 I 8.69 4.01 1.90 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.61 0.86 0.00 0.00 63 Q 8.68 4.49 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.99 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 64 S 8.63 4.22 0.00 3.97 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 65 N 8.33 4.96 0.00 2.87 2.89 0.00 0.00 6.98 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 66 L 8.44 4.18 0.00 1.55 1.58 0.91 0.57 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 67 N 8.66 5.39 0.00 2.62 2.68 0.00 0.00 6.45 7.36 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 68 I 8.96 5.12 2.01 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.11 0.92 0.00 0.00 69 R 9.07 4.92 0.00 1.78 1.87 0.00 3.15 0.00 0.00 3.23 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.50 0.00 70 F 9.38 5.47 0.00 3.05 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 71 G 9.06 4.46 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 0.00 0.00 0.00 0.00 0.00 0.00 72 I 8.33 4.77 1.29 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.40 0.83 0.00 0.00 73 I 8.15 4.69 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.70 0.93 0.00 0.00 74 L 9.21 4.26 0.00 1.60 1.81 1.07 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 75 R 8.82 4.62 0.00 1.72 1.99 0.00 3.37 0.00 0.00 3.26 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.63 0.00 76 Q 7.74 4.70 0.00 1.90 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.93 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 77 D 8.80 4.66 0.00 2.58 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 78 I 8.84 4.33 2.04 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.85 0.91 0.00 0.00 79 R 9.23 4.00 0.00 1.76 2.25 0.00 3.20 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 80 K 7.92 4.61 0.00 1.72 1.23 0.00 1.57 0.00 0.00 1.59 0.00 0.00 2.72 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.39 7.81 81 L 7.47 4.99 0.00 1.50 1.13 0.81 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 82 F 8.69 4.95 0.00 1.56 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 83 L 8.80 5.04 0.00 1.61 1.50 0.88 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 84 D 9.28 5.57 0.00 2.89 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 85 I 9.03 5.07 2.02 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 1.27 0.88 0.92 0.00 0.00 86 T 9.05 5.12 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 1.35 0.00 0.00 87 L 9.00 4.89 0.00 1.78 1.58 1.14 0.85 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 88 M 9.02 5.23 0.00 1.93 1.99 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.66 0.00 89 A 8.80 4.42 1.23 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 0.00 0.00 0.00 90 K 9.56 4.12 0.00 1.93 1.91 0.00 1.83 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.34 1.42 7.81 91 G 8.50 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 92 S 7.62 4.84 0.00 4.05 3.75 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 93 S 8.57 4.75 0.00 4.12 3.89 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 94 I 8.65 4.51 1.90 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 1.27 0.78 0.94 0.00 0.00 95 L 7.81 4.66 0.00 1.72 1.53 0.93 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 96 N 9.00 5.28 0.00 2.65 2.75 0.00 0.00 6.89 7.46 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 97 Y 9.24 4.88 0.00 2.95 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 98 S 7.56 4.98 0.00 3.84 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 99 Y 8.85 4.74 0.00 2.89 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 0.00 100 P 0.00 4.55 0.00 1.86 2.13 0.00 2.86 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.82 0.00 101 L 8.53 4.36 0.00 1.35 1.62 0.66 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 102 C 7.39 4.69 0.00 2.64 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 F 8.43 4.53 0.00 3.04 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 0.00 110 S 6.88 4.41 0.00 3.63 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 0.00 111 F 8.48 4.07 0.00 2.96 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 0.00 112 C 7.84 4.63 0.00 2.86 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 0.00 113 G 9.17 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 0.00 0.00 0.00 114 R 7.47 4.53 0.00 1.98 1.95 0.00 2.88 0.00 0.00 3.39 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.52 0.00 115 R 8.77 5.00 0.00 1.79 1.88 0.00 3.33 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.66 0.00 116 K 9.20 3.94 0.00 1.77 1.77 0.00 1.79 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.49 1.36 7.81 117 G 9.11 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 118 E 7.97 4.14 0.00 1.94 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 0.00 2.34 2.44 0.00 119 Q 8.68 5.03 0.00 1.94 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.71 0.00 0.00 0.00 0.00 0.00 2.29 2.53 0.00 120 I 8.79 4.69 2.07 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.01 0.95 0.00 0.00 121 Y 8.56 4.90 0.00 2.86 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 0.00 122 Y 9.14 4.19 0.00 2.99 3.04 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 0.00 123 A 7.25 4.54 0.94 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 0.00 124 G 7.74 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 0.00 125 P 0.00 5.19 0.00 2.13 2.07 0.00 3.79 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 2.07 2.02 0.00 126 V 8.69 4.49 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 0.74 0.00 0.00 0.94 0.00 0.00 127 N 8.36 5.03 0.00 2.67 2.60 0.00 0.00 7.03 7.79 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 0.00 128 N 8.05 4.57 0.00 2.68 2.80 0.00 0.00 5.90 7.76 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 0.00 129 P 0.00 4.76 0.00 2.05 2.05 0.00 3.63 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.90 0.00 130 G 8.48 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 0.00 131 L 8.91 4.93 0.00 1.47 1.41 0.78 0.56 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 0.00 132 D 8.54 5.06 0.00 2.60 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 0.00 133 V 8.65 3.96 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 0.69 0.00 0.00 0.82 0.00 0.00 134 P 0.00 4.46 0.00 2.22 2.03 0.00 3.77 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 2.08 2.10 0.00 135 Q 8.71 4.10 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.18 0.00 0.00 0.00 0.00 0.00 2.35 2.48 0.00 136 G 7.37 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 0.00 137 E 7.61 5.05 0.00 1.87 1.66 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 2.11 2.28 0.00 138 Y 9.34 4.82 0.00 2.84 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 0.00 139 Q 8.82 5.09 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.34 0.00 140 L 9.24 5.36 0.00 1.57 1.57 0.92 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 141 L 9.04 5.20 0.00 1.76 1.55 1.07 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 142 L 9.34 5.34 0.00 1.66 1.52 0.97 0.66 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 0.00 143 E 9.31 5.18 0.00 2.05 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 2.30 2.35 0.00 144 L 8.93 5.18 0.00 1.51 1.37 0.43 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 145 Y 8.23 5.34 0.00 3.18 3.04 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 0.00 146 N 8.52 5.78 0.00 3.15 3.08 0.00 0.00 6.90 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 0.00 147 E 9.02 4.28 0.00 2.05 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 0.00 2.38 2.57 0.00 148 N 8.51 4.74 0.00 2.75 2.84 0.00 0.00 6.98 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 0.00 149 R 7.77 3.68 0.00 1.69 1.77 0.00 2.78 0.00 0.00 2.93 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.50 0.00 150 A 8.08 4.35 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 0.00 151 T 8.48 4.41 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 1.31 0.00 0.00 152 V 8.94 4.22 2.08 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 0.69 0.00 0.00 0.95 0.00 0.00 153 A 7.61 4.79 0.84 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 0.00 0.00 0.00 0.00 0.00 154 C 8.83 5.42 0.00 3.06 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 0.00 155 A 9.41 5.51 1.59 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 0.00 0.00 156 N 9.22 5.26 0.00 2.77 2.83 0.00 0.00 6.60 7.20 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 0.00 157 A 9.39 5.38 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 0.00 158 T 9.09 5.05 4.29 0.00 0.00 0.00 0.00 0.00 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 0.00 159 V 9.07 4.95 2.23 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 0.87 0.00 0.00 0.98 0.00 0.00 160 T 9.16 5.12 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 1.22 0.00 0.00 161 S 9.39 5.28 0.00 3.97 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 0.00 162 S 9.06 4.33 0.00 3.82 3.75 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 * Residues marked with a * may have inaccurate shift predictions.