NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 V 4.0772 8.0129 117.9081 60.9724 32.2956 174.4828 13 I 4.0831 7.8813 126.5694 57.3496 33.9535 172.0710 *18 S 4.3909 8.4170 123.0675 58.2119 65.0229 173.4531 19 S 4.8389 8.2255 111.2665 59.2503 66.6017 174.2290 20 A 4.7356 8.8474 126.8336 50.0624 21.3362 174.9221 21 E 4.7256 8.8606 125.5292 55.8155 31.7535 176.2458 22 I 4.5888 8.0951 125.4395 60.3599 39.7108 176.0171 23 T 5.1870 8.4303 122.5482 59.4566 71.1484 170.6308 24 C 4.8355 8.5706 116.9163 57.5792 46.2667 173.7451 25 D 4.7592 8.7548 125.0182 53.0208 39.5021 176.0936 26 L 4.0945 7.7497 120.2206 55.7213 43.7976 176.2737 27 A 3.4883 8.8712 127.2862 53.2530 17.5116 178.3657 *32 G 4.0077 8.7251 109.5504 45.5299 0.0000 171.9940 33 Y 5.2543 8.7068 120.0747 56.7218 40.1330 176.6239 34 I 4.5112 8.7423 124.9773 59.9049 37.7979 170.9639 35 H 5.3461 9.7682 121.1909 53.8737 32.9641 173.1939 36 W 5.5796 8.6452 118.9631 55.7255 32.9518 174.4086 37 Y 5.1916 10.3175 125.7973 56.8735 41.3443 175.4977 38 L 5.3052 9.3581 124.8594 54.4718 45.2385 176.0909 *39 H 5.0383 9.5833 124.2474 53.1947 29.5691 171.0264 40 Q 4.9351 8.6921 123.9601 52.3148 32.4459 176.7087 41 E 4.1704 8.2995 116.5341 55.5189 28.3547 174.9080 *45 P 4.7910 0.0000 0.0000 62.9080 33.2154 177.7292 46 Q 4.7915 8.7477 120.3625 55.1200 32.6728 173.1003 47 R 4.1342 8.2274 119.9326 55.1802 30.9004 175.9899 48 L 4.0631 9.2143 128.5478 57.5516 42.3729 176.9206 49 L 4.7908 7.1290 117.9497 54.4695 45.7902 174.8908 50 Y 5.1669 8.0841 113.2208 57.0993 41.7148 173.5240 51 Y 5.1193 9.5332 125.6015 56.6291 41.9642 174.6236 52 D 4.4350 8.4204 130.2814 52.8335 40.8271 175.0494 53 S 3.3352 7.9255 124.6100 61.5799 61.6701 174.2410 *54 Y 3.7205 6.8119 116.7598 60.2600 37.3946 179.0717 55 T 4.3158 7.7765 115.0767 60.6194 69.3294 177.8110 56 S 3.9931 7.8559 118.1655 60.7051 60.5974 177.9211 57 S 4.7042 7.5246 118.5831 59.2758 63.6436 176.6165 58 V 4.6491 8.0429 120.0742 61.3189 34.4758 175.0995 59 V 4.0923 7.7320 126.3709 60.7049 33.1615 174.8434 60 L 4.1651 8.2656 127.1881 54.4929 42.6723 176.6775 61 E 4.4858 8.5258 123.1947 55.7736 31.5878 177.1866 62 S 4.1315 8.4690 117.8885 59.6457 62.7248 173.3168 63 G 4.1918 9.2641 116.3740 45.9430 0.0000 174.7533 64 I 3.9061 6.9052 116.3058 59.6213 35.9740 177.4464 *68 K 3.9324 8.1788 116.5094 57.5244 33.4105 175.4589 69 Y 4.9506 7.3961 121.1366 55.9746 38.1346 172.6527 70 D 4.4166 9.0597 122.9163 53.9182 42.2829 175.1134 71 T 4.2738 7.6480 113.6446 60.5777 70.5567 172.2205 72 Y 4.5779 8.9341 121.7409 59.2189 44.4667 175.6220 *78 N 4.6960 8.1910 123.8483 53.8553 41.1162 175.4085 79 L 4.3073 8.1672 122.5369 56.5562 41.8165 180.4550 80 R 5.0114 8.7432 123.3329 54.6607 34.6835 170.7839 81 M 4.8299 8.9414 121.8786 55.0092 35.0541 174.7986 82 I 4.0735 9.2670 130.7645 60.8683 36.9144 173.4371 83 L 4.6029 9.5117 135.0000 53.0025 40.7921 175.0789 84 R 4.4808 8.6991 135.0000 56.2849 27.2878 173.6039 *87 I 3.9253 7.4713 121.0612 61.0004 37.4294 177.4826 88 E 4.5558 8.4225 111.2410 57.9643 30.4498 173.3117 89 N 4.5952 7.9900 114.7773 56.3101 39.3121 175.9670 90 D 4.2993 8.0976 118.7005 56.8334 41.2889 177.3897 91 S 4.2487 7.4197 116.6605 56.8191 62.7672 180.1197 92 G 4.0627 7.3567 113.1801 44.7377 0.0000 171.8190 93 V 4.1897 7.9112 122.1765 61.1123 32.6584 172.0925 *94 Y 5.0295 7.9831 126.0560 56.0628 38.8956 171.0000 95 Y 5.1100 9.2758 120.3525 56.2133 42.2735 172.2914 96 C 3.9884 8.5526 119.2940 54.8491 41.8342 172.4250 97 A 4.6051 8.4092 124.3050 51.5978 22.5440 175.8793 98 T 4.4664 8.1058 113.0284 59.3805 73.3776 173.8430 99 W 4.4136 8.7155 124.9435 57.0256 30.0359 176.5850 100 D 4.5113 9.8251 127.7391 54.9246 40.2311 178.9337 101 Q 3.9254 8.9588 117.5202 60.1018 27.9343 178.5711 102 N 4.9480 8.1602 114.9538 52.8382 38.0444 176.5194 103 Y 4.3314 7.0791 114.1986 60.1130 36.4240 172.7921 104 Y 4.6213 7.9667 123.0189 60.0106 39.7120 175.5392 105 K 4.9318 7.9551 123.1259 53.8160 36.8751 176.9075 106 K 4.6927 8.1113 124.4635 54.9981 32.8932 177.2163 107 L 4.3450 8.5070 128.2154 53.9180 42.1967 172.5393 108 F 4.8385 8.5373 118.4684 55.4528 42.8311 175.8738 109 G 3.9774 8.8655 110.9474 46.8262 0.0000 174.1936 110 S 4.6275 9.0880 115.4158 57.2748 62.7528 170.4286 111 G 4.1204 8.9708 110.2192 46.9645 0.0000 174.7012 112 T 4.3847 7.6106 115.5405 60.8961 71.4496 174.9377 113 S 4.7167 8.7942 128.5731 58.7206 62.9194 171.2565 114 L 5.1921 8.4141 124.1372 53.1594 45.3754 178.3202 115 V 4.8218 7.7836 117.5802 60.8800 32.5670 172.1270 *167 Y 5.6315 7.3727 122.1769 57.6017 40.1181 175.2028 168 Y 4.8075 9.5925 117.6258 57.3825 42.5955 175.4178 169 I 5.2756 8.3085 121.2301 59.2027 39.4026 173.9552 170 F 4.9525 8.8359 120.1705 56.9797 43.6495 175.7744 171 W 4.9968 8.5669 117.9441 55.3943 29.9283 174.4430 *227 A 4.0518 8.1374 126.9373 51.9123 20.4575 176.7947 228 L 4.9362 8.1149 120.2476 55.0300 42.9960 177.6910 229 G 4.5323 9.6932 109.1682 46.7442 0.0000 174.2349 230 E 4.2868 9.5246 122.9068 58.3249 30.2884 172.9951 231 S 5.0528 8.0367 115.4472 56.5582 65.4795 175.3579 232 L 3.7551 7.8464 125.7893 52.8609 39.2742 176.8244 233 T 3.9351 6.7819 115.8109 59.4575 72.0382 176.5977 234 R 4.1331 8.1315 122.0212 59.6447 29.3608 178.0763 235 A 3.9882 7.6146 118.9829 53.6646 18.8885 177.4194 236 D 4.4909 8.4660 119.7852 54.4433 41.2125 177.4228 237 K 4.4868 8.6338 125.8068 54.2353 32.6402 172.7393 238 L 5.0397 8.4757 119.7682 56.0191 42.4048 177.2064 239 I 4.3286 8.8703 126.7134 59.9123 36.1675 172.7405 *240 F 4.3246 8.5040 128.6454 54.8700 40.0635 173.7268 241 G 3.6695 8.2399 104.9719 47.0713 0.0000 173.8838 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 12 V 8.01 4.08 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 0.71 0.00 0.00 0.93 0.00 0.00 13 I 7.88 4.08 1.87 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 1.27 1.05 0.91 0.00 0.00 *18 S 8.42 4.39 0.00 3.65 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 19 S 8.23 4.84 0.00 3.66 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 20 A 8.85 4.74 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 E 8.86 4.73 0.00 1.95 1.82 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 2.23 2.28 0.00 22 I 8.10 4.59 1.87 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 1.09 0.61 0.91 0.00 0.00 23 T 8.43 5.19 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 1.21 0.00 0.00 24 C 8.57 4.84 0.00 3.05 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 25 D 8.75 4.76 0.00 2.83 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 26 L 7.75 4.09 0.00 1.58 1.58 0.71 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 27 A 8.87 3.49 1.11 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 *32 G 8.73 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 0.00 0.00 0.00 33 Y 8.71 5.25 0.00 2.85 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 34 I 8.74 4.51 1.87 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 1.23 0.77 0.91 0.00 0.00 35 H 9.77 5.35 0.00 3.05 3.23 0.00 5.53 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 W 8.65 5.58 0.00 3.09 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 37 Y 10.32 5.19 0.00 2.98 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 38 L 9.36 5.31 0.00 1.23 1.47 0.92 1.04 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 *39 H 9.58 5.04 0.00 2.56 2.97 0.00 7.11 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 Q 8.69 4.94 0.00 1.92 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 7.65 0.00 0.00 0.00 0.00 0.00 2.41 2.37 0.00 41 E 8.30 4.17 0.00 1.98 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.91 0.00 *45 P 0.00 4.79 0.00 1.95 2.12 0.00 3.63 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.12 0.00 46 Q 8.75 4.79 0.00 2.06 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.84 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 47 R 8.23 4.13 0.00 0.84 1.72 0.00 3.32 0.00 0.00 3.02 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.50 0.00 48 L 9.21 4.06 0.00 1.61 1.12 0.85 0.47 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 49 L 7.13 4.79 0.00 1.29 1.49 0.92 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 50 Y 8.08 5.17 0.00 2.90 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 51 Y 9.53 5.12 0.00 2.89 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 D 8.42 4.44 0.00 2.42 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 53 S 7.93 3.34 0.00 3.76 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 *54 Y 6.81 3.72 0.00 2.33 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 T 7.78 4.32 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 1.21 0.00 0.00 56 S 7.86 3.99 0.00 3.79 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 S 7.52 4.70 0.00 3.38 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 58 V 8.04 4.65 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 0.79 0.00 0.00 0.86 0.00 0.00 59 V 7.73 4.09 0.67 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 0.93 0.00 0.00 0.63 0.00 0.00 60 L 8.27 4.17 0.00 1.54 1.58 0.92 1.04 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 61 E 8.53 4.49 0.00 1.87 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 2.32 2.38 0.00 62 S 8.47 4.13 0.00 3.63 3.67 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 63 G 9.26 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 0.00 0.00 0.00 0.00 64 I 6.91 3.91 1.87 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 1.18 0.73 0.91 0.00 0.00 *68 K 8.18 3.93 0.00 1.63 1.41 0.00 1.04 0.00 0.00 1.50 0.00 0.00 2.92 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.75 0.21 7.81 69 Y 7.40 4.95 0.00 2.72 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 D 9.06 4.42 0.00 2.81 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 71 T 7.65 4.27 3.58 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 0.88 0.00 0.00 72 Y 8.93 4.58 0.00 2.84 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 *78 N 8.19 4.70 0.00 2.81 3.02 0.00 0.00 6.72 7.85 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 79 L 8.17 4.31 0.00 1.33 1.61 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 80 R 8.74 5.01 0.00 1.42 1.74 0.00 3.18 0.00 0.00 3.26 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.17 0.00 81 M 8.94 4.83 0.00 1.05 0.86 0.00 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.18 0.00 82 I 9.27 4.07 1.87 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 1.09 0.56 0.91 0.00 0.00 83 L 9.51 4.60 0.00 1.29 1.63 0.92 0.67 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 84 R 8.70 4.48 0.00 1.53 1.80 0.00 3.27 0.00 0.00 3.26 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.46 0.00 *87 I 7.47 3.93 1.87 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 1.27 1.11 0.91 0.00 0.00 88 E 8.42 4.56 0.00 1.97 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 2.15 1.84 0.00 89 N 7.99 4.60 0.00 2.80 2.84 0.00 0.00 7.24 8.49 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 90 D 8.10 4.30 0.00 2.88 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 91 S 7.42 4.25 0.00 3.46 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 G 7.36 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 93 V 7.91 4.19 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 0.68 0.00 0.00 0.93 0.00 0.00 *94 Y 7.98 5.03 0.00 2.06 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 0.00 0.00 0.00 0.00 95 Y 9.28 5.11 0.00 3.05 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 96 C 8.55 3.99 0.00 1.73 1.18 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 97 A 8.41 4.61 -0.14 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 0.00 0.00 98 T 8.11 4.47 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 1.21 0.00 0.00 99 W 8.72 4.41 0.00 2.84 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 D 9.83 4.51 0.00 2.25 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 Q 8.96 3.93 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.76 7.63 0.00 0.00 0.00 0.00 0.00 2.28 1.93 0.00 102 N 8.16 4.95 0.00 2.64 2.80 0.00 0.00 7.03 7.57 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 0.00 103 Y 7.08 4.33 0.00 2.99 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 0.00 104 Y 7.97 4.62 0.00 2.94 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 K 7.96 4.93 0.00 1.43 1.61 0.00 1.82 0.00 0.00 1.85 0.00 0.00 2.78 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.32 0.97 7.81 106 K 8.11 4.69 0.00 1.52 1.62 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.80 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.28 0.99 7.81 107 L 8.51 4.34 0.00 1.33 1.57 0.92 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 108 F 8.54 4.84 0.00 2.59 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 0.00 109 G 8.87 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 0.00 110 S 9.09 4.63 0.00 3.65 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 0.00 111 G 8.97 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 112 T 7.61 4.38 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 1.21 0.00 0.00 113 S 8.79 4.72 0.00 3.39 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 0.00 114 L 8.41 5.19 0.00 1.24 1.48 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 115 V 7.78 4.82 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 0.84 0.00 0.00 0.93 0.00 0.00 *167 Y 7.37 5.63 0.00 3.16 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 0.00 168 Y 9.59 4.81 0.00 3.17 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 0.00 169 I 8.31 5.28 1.87 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 1.34 0.76 0.91 0.00 0.00 170 F 8.84 4.95 0.00 2.78 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 0.00 171 W 8.57 5.00 0.00 3.10 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *227 A 8.14 4.05 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 L 8.11 4.94 0.00 1.39 1.55 0.92 0.81 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 0.00 229 G 9.69 4.53 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 0.00 230 E 9.52 4.29 0.00 1.91 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 2.31 1.87 0.00 231 S 8.04 5.05 0.00 3.69 3.58 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 0.00 232 L 7.85 3.76 0.00 1.71 1.47 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 233 T 6.78 3.94 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 1.04 0.00 0.00 234 R 8.13 4.13 0.00 1.88 1.94 0.00 3.26 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.50 0.00 235 A 7.61 3.99 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 0.00 236 D 8.47 4.49 0.00 2.67 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 0.00 237 K 8.63 4.49 0.00 1.77 1.62 0.00 1.75 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.36 1.00 7.81 238 L 8.48 5.04 0.00 1.73 1.58 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 239 I 8.87 4.33 1.87 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 1.09 0.76 0.91 0.00 0.00 *240 F 8.50 4.32 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 241 G 8.24 3.67 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.