NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 28 K 4.2160 8.1727 121.7865 56.5139 33.4804 175.5259 29 T 4.0824 8.1583 115.8532 62.3533 67.7708 172.6105 30 A 4.6475 7.8067 122.8785 51.9314 20.6762 175.7452 31 C 4.6932 8.2292 120.1534 57.5853 38.6520 173.2034 32 R 4.5761 8.9855 121.7796 55.1160 33.3110 173.4189 33 K 4.6150 8.4326 120.9312 56.0015 33.1250 175.1727 34 H 4.6866 8.7494 125.1595 53.6158 30.9173 174.2018 35 E 4.3641 8.6202 122.8807 56.7123 30.4639 176.7380 36 L 4.2860 8.2515 124.8756 54.6308 45.0431 172.9194 37 Y 4.4701 8.6225 128.7737 56.6938 40.6602 173.8801 38 V 4.1850 7.3717 126.6085 60.9044 34.0912 173.8773 39 S 4.7412 8.1471 122.5165 56.8161 63.6801 174.8932 40 F 4.3690 8.5450 126.0966 59.9780 38.5831 177.5987 41 Q 4.2333 7.8767 119.8108 59.2165 28.6621 177.5908 42 D 4.3406 7.6721 119.1659 56.9943 40.9064 178.0331 43 L 4.1059 7.6662 117.0503 54.7184 41.9157 177.7855 44 G 4.2841 7.9466 106.9242 45.6662 0.0000 174.1177 45 W 4.9491 8.5509 119.0990 56.9001 29.4322 177.8277 46 Q 4.1744 8.1826 115.5819 57.5802 28.0529 177.5019 47 D 4.5580 8.2182 119.5541 56.6869 41.8583 177.7475 48 W 4.7305 8.2687 115.7290 59.0903 29.9046 176.4094 49 I 3.8335 6.5407 121.4012 61.0439 36.3144 176.1390 50 I 4.1750 9.0308 129.0573 63.2686 38.1999 176.4924 51 A 4.8007 7.5083 122.0327 50.0161 22.6608 174.9403 52 P 4.6968 0.0000 0.0000 61.9007 33.4026 175.9955 53 K 4.3129 8.6152 115.8504 57.9711 32.4199 176.5696 54 G 3.8627 7.7236 103.4924 47.0923 0.0000 171.4906 55 Y 4.5904 6.3154 115.5167 55.8936 41.6734 173.9604 56 A 4.4035 8.6724 122.4342 51.5302 18.0370 177.1743 57 A 3.9182 7.9645 125.0571 54.2365 19.2548 178.2972 58 N 4.8063 8.3823 113.5114 53.1006 38.6122 172.4336 59 Y 4.8408 7.9640 114.6046 56.7748 41.5944 172.6503 60 C 5.1657 8.7978 117.9775 56.0704 42.0067 172.6960 61 D 4.7007 8.5838 120.8389 53.6978 44.7105 173.4908 62 G 4.5406 8.6026 107.9726 43.8557 0.0000 173.0917 63 E 4.0744 9.1961 122.6653 55.6241 30.3024 175.3405 64 C 4.6829 8.3240 122.9430 55.8038 40.7904 172.9888 65 S 4.1624 7.7574 117.8044 57.0516 65.1247 174.2832 66 F 4.6227 7.9664 119.6546 56.5660 39.2546 174.1062 67 P 4.6120 0.0000 0.0000 62.5578 32.0451 176.1310 68 L 4.4695 8.3202 120.5902 52.7429 41.8744 175.9685 69 N 4.2906 8.5884 122.6868 53.3923 39.7700 175.5880 70 A 3.9908 8.7211 127.5406 55.6865 18.6128 179.4189 71 H 4.3693 7.9614 111.6435 59.0448 28.8399 176.2297 72 M 4.3684 8.5713 117.6803 56.0738 31.6757 176.7041 73 N 3.8730 7.8608 115.4579 53.6413 36.6038 174.7677 74 A 4.5390 8.1308 122.5363 52.2121 19.4486 178.9974 75 T 4.3861 8.2504 113.0267 60.7835 71.5274 175.7872 76 N 4.3422 8.6105 118.3353 56.8376 38.4403 176.9778 77 H 4.0061 8.3513 118.8250 59.2878 29.8868 176.9944 78 A 4.0203 7.9654 122.2967 55.0257 18.1880 179.6812 79 I 3.7104 7.7197 118.1300 64.5280 37.2433 178.7602 80 V 3.5935 7.9756 119.1414 66.1101 31.3888 177.7334 81 Q 3.9339 8.2702 119.5234 59.5356 28.8519 178.3173 82 T 3.7490 8.2453 117.1180 66.4484 68.0843 176.3291 83 L 4.1394 8.0449 122.0563 58.4169 42.2835 179.1372 84 V 3.6165 8.4294 118.5077 66.2508 31.1321 177.4590 85 H 4.2772 8.5548 117.7451 59.1265 29.8532 176.8321 86 L 4.0281 7.8194 120.5747 57.5018 41.9294 177.8418 87 M 4.4840 7.5981 119.4022 56.6727 34.3044 176.9081 88 N 5.0777 8.0765 115.5177 49.6459 38.6957 176.2988 89 P 4.3724 0.0000 0.0000 66.3568 32.0045 180.2915 90 E 4.0646 8.3101 116.1647 59.0387 29.3813 179.7785 *91 Y 4.2800 6.7915 116.2663 57.7053 37.7069 178.9444 92 V 4.3355 7.8763 120.8582 60.2783 33.2150 174.5286 93 P 4.6799 0.0000 0.0000 61.4156 32.7944 175.5132 94 K 4.0530 7.9095 117.5140 55.0335 32.6184 175.5431 95 P 4.4479 0.0000 0.0000 62.9203 32.2887 175.3620 96 C 4.7316 8.1953 114.2716 56.7061 32.3523 173.4254 97 C 4.7672 8.7251 121.7044 56.4893 41.6564 172.1682 98 A 5.0208 8.9661 127.5998 49.2154 23.0675 172.9599 99 P 4.9742 0.0000 0.0000 63.4250 31.5968 176.4587 100 T 4.6481 9.1602 114.5364 62.5072 70.7947 175.3067 101 K 4.6572 7.8120 126.1445 54.0706 35.8303 180.4110 102 L 5.3592 8.6455 124.6006 52.1448 45.4817 175.6845 103 N 5.0824 9.6289 119.4751 51.8201 41.8233 173.6702 104 A 5.2862 8.4499 121.7442 50.5999 21.7357 176.1273 105 I 4.7228 8.7118 111.7976 59.4216 41.4041 174.3569 106 S 5.2929 8.6809 119.3222 57.3188 64.8498 173.9720 107 V 4.7244 9.0935 116.4458 59.5086 35.9306 174.2068 108 L 5.2130 9.2820 126.7585 53.6204 43.9916 174.8193 109 Y 5.1132 8.7092 123.7849 55.7781 42.2497 173.5306 110 F 5.9997 9.5262 119.0044 55.6969 41.0411 176.1925 111 D 5.1068 8.5453 124.4967 52.6174 42.0293 176.8121 112 D 4.3897 8.7607 116.5484 56.7777 39.7788 172.4685 113 N 4.7651 8.2610 114.4641 52.9742 38.4795 175.2413 114 S 3.7385 7.9712 111.7428 59.4441 61.2853 171.8218 115 N 4.6874 8.5433 118.3479 53.1202 39.7705 174.5264 116 V 4.2343 8.3772 122.7412 62.0189 32.3709 174.9473 117 I 4.3314 8.4707 129.3226 59.2099 40.2836 174.8330 118 L 4.9442 8.4040 127.4976 53.4274 43.5274 174.8685 119 K 4.5529 9.0138 128.3263 54.2622 34.9350 174.6171 120 K 4.6869 8.5062 128.6524 55.8423 33.1991 175.0450 121 Y 4.5607 9.4397 127.1366 56.5283 39.4876 175.9615 122 R 4.4410 8.7722 123.4875 55.2047 31.6032 175.9046 123 N 4.2220 8.3313 115.5628 55.3946 35.9677 174.3271 124 M 4.6518 8.6506 116.9677 55.5882 35.2298 178.4641 125 V 4.6012 7.6906 118.7581 60.8512 34.2761 174.8536 126 V 4.1030 8.5870 129.0766 63.1419 31.3160 175.4507 127 R 4.5072 9.1891 127.4886 57.6341 31.4781 176.8361 128 A 4.8035 7.7857 118.4181 50.3566 22.8808 175.5764 129 C 5.3984 8.6698 116.6403 55.6476 45.2044 173.2831 130 G 4.0677 8.9214 107.5067 46.8481 0.0000 170.7945 131 C 5.3380 8.5677 116.8930 55.4773 42.2478 174.6216 132 H 4.5367 8.2668 119.8274 55.9033 28.7248 173.9886 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 28 K 8.17 4.22 0.00 1.80 1.74 0.00 1.68 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.49 1.44 7.81 29 T 8.16 4.08 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 1.21 0.00 0.00 30 A 7.81 4.65 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 C 8.23 4.69 0.00 3.12 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 32 R 8.99 4.58 0.00 1.81 1.96 0.00 2.75 0.00 0.00 3.05 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.53 0.00 33 K 8.43 4.61 0.00 1.74 1.69 0.00 1.67 0.00 0.00 1.84 0.00 0.00 2.79 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.31 1.37 7.81 34 H 8.75 4.69 0.00 1.66 2.65 0.00 5.87 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 35 E 8.62 4.36 0.00 1.83 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 2.23 0.00 36 L 8.25 4.29 0.00 2.02 1.72 0.88 0.71 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 37 Y 8.62 4.47 0.00 2.99 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 38 V 7.37 4.19 1.08 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 0.43 0.00 0.00 0.51 0.00 0.00 39 S 8.15 4.74 0.00 4.03 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 40 F 8.54 4.37 0.00 3.14 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 41 Q 7.88 4.23 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.79 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 42 D 7.67 4.34 0.00 2.67 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 43 L 7.67 4.11 0.00 1.00 0.54 -0.04 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 44 G 7.95 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 0.00 0.00 0.00 0.00 45 W 8.55 4.95 0.00 3.38 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 46 Q 8.18 4.17 0.00 2.27 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.79 0.00 0.00 0.00 0.00 0.00 2.49 2.40 0.00 47 D 8.22 4.56 0.00 2.96 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 48 W 8.27 4.73 0.00 3.82 3.36 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 49 I 6.54 3.83 1.12 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 -0.05 -0.36 0.43 0.00 0.00 50 I 9.03 4.17 1.83 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.37 0.82 0.00 0.00 51 A 7.51 4.80 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 52 P 0.00 4.70 0.00 2.49 2.20 0.00 3.95 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.10 0.00 53 K 8.62 4.31 0.00 1.98 1.99 0.00 1.70 0.00 0.00 1.88 0.00 0.00 3.02 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.56 1.57 7.81 54 G 7.72 3.86 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 0.00 0.00 0.00 55 Y 6.32 4.59 0.00 2.91 2.85 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 56 A 8.67 4.40 1.29 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 0.00 0.00 0.00 57 A 7.96 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 N 8.38 4.81 0.00 2.91 2.92 0.00 0.00 6.90 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 59 Y 7.96 4.84 0.00 2.98 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 60 C 8.80 5.17 0.00 2.91 3.05 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 0.00 0.00 0.00 61 D 8.58 4.70 0.00 2.82 2.21 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 62 G 8.60 4.54 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 0.00 0.00 0.00 63 E 9.20 4.07 0.00 1.95 1.80 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 2.25 2.24 0.00 64 C 8.32 4.68 0.00 3.06 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 65 S 7.76 4.16 0.00 3.84 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 66 F 7.97 4.62 0.00 3.13 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 67 P 0.00 4.61 0.00 2.23 2.11 0.00 3.79 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.02 0.00 68 L 8.32 4.47 0.00 1.75 1.70 0.93 0.96 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 69 N 8.59 4.29 0.00 2.80 2.70 0.00 0.00 6.98 7.80 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 70 A 8.72 3.99 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 71 H 7.96 4.37 0.00 3.17 3.35 0.00 5.70 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 M 8.57 4.37 0.00 2.05 2.19 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.50 0.00 73 N 7.86 3.87 0.00 2.81 3.08 0.00 0.00 6.84 6.76 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 74 A 8.13 4.54 1.24 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 0.00 0.00 75 T 8.25 4.39 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 1.32 0.00 0.00 76 N 8.61 4.34 0.00 2.79 2.94 0.00 0.00 6.42 8.16 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 77 H 8.35 4.01 0.00 3.22 3.34 0.00 5.67 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 A 7.97 4.02 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 79 I 7.72 3.71 2.12 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 1.60 0.70 1.08 0.00 0.00 80 V 7.98 3.59 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 0.98 0.00 0.00 1.01 0.00 0.00 81 Q 8.27 3.93 0.00 2.18 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.56 0.00 0.00 0.00 0.00 0.00 2.47 2.41 0.00 82 T 8.25 3.75 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 0.14 0.00 0.00 83 L 8.04 4.14 0.00 2.18 1.96 0.99 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 84 V 8.43 3.62 2.10 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 0.95 0.00 0.00 1.00 0.00 0.00 85 H 8.55 4.28 0.00 3.27 3.60 0.00 6.01 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 L 7.82 4.03 0.00 2.04 1.84 0.97 1.24 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 87 M 7.60 4.48 0.00 2.02 2.20 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.55 0.00 88 N 8.08 5.08 0.00 2.60 2.64 0.00 0.00 6.67 7.43 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 89 P 0.00 4.37 0.00 2.17 2.16 0.00 3.63 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.92 0.00 90 E 8.31 4.06 0.00 2.01 1.92 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 2.23 1.88 0.00 *91 Y 6.79 4.28 0.00 2.41 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 0.00 0.00 0.00 0.00 92 V 7.88 4.34 2.12 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 0.98 0.00 0.00 0.95 0.00 0.00 93 P 0.00 4.68 0.00 2.19 2.06 0.00 3.83 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 1.96 1.98 0.00 94 K 7.91 4.05 0.00 1.64 1.77 0.00 1.69 0.00 0.00 1.62 0.00 0.00 3.08 0.00 0.00 3.16 0.00 0.00 0.00 0.00 0.76 1.17 7.81 95 P 0.00 4.45 0.00 1.98 2.12 0.00 3.68 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 96 C 8.20 4.73 0.00 2.98 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 97 C 8.73 4.77 0.00 3.11 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 98 A 8.97 5.02 1.24 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 0.00 0.00 99 P 0.00 4.97 0.00 2.12 2.10 0.00 3.77 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 2.02 2.01 0.00 100 T 9.16 4.65 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 1.30 0.00 0.00 101 K 7.81 4.66 0.00 1.41 1.66 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.77 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.34 1.04 7.81 102 L 8.65 5.36 0.00 1.49 1.66 0.95 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 103 N 9.63 5.08 0.00 2.65 2.75 0.00 0.00 6.87 5.12 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 0.00 104 A 8.45 5.29 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 0.00 105 I 8.71 4.72 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 1.04 0.89 0.81 0.00 0.00 106 S 8.68 5.29 0.00 3.79 3.84 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 0.00 107 V 9.09 4.72 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 0.79 0.00 0.00 1.17 0.00 0.00 108 L 9.28 5.21 0.00 1.68 1.46 0.87 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 109 Y 8.71 5.11 0.00 3.27 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 0.00 110 F 9.53 6.00 0.00 3.09 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 0.00 111 D 8.55 5.11 0.00 2.97 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 0.00 112 D 8.76 4.39 0.00 2.72 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 0.00 113 N 8.26 4.77 0.00 2.81 2.85 0.00 0.00 6.91 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 0.00 114 S 7.97 3.74 0.00 3.98 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 0.00 115 N 8.54 4.69 0.00 2.89 2.72 0.00 0.00 6.61 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 0.00 116 V 8.38 4.23 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 0.50 0.00 0.00 1.11 0.00 0.00 117 I 8.47 4.33 0.71 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.37 0.80 0.00 0.00 118 L 8.40 4.94 0.00 1.54 1.52 1.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 119 K 9.01 4.55 0.00 2.02 1.78 0.00 1.64 0.00 0.00 1.12 0.00 0.00 2.13 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.59 1.11 7.81 120 K 8.51 4.69 0.00 1.78 1.64 0.00 1.80 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.38 1.47 7.81 121 Y 9.44 4.56 0.00 3.00 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 0.00 122 R 8.77 4.44 0.00 1.72 1.89 0.00 3.39 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 123 N 8.33 4.22 0.00 2.89 2.89 0.00 0.00 6.80 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 0.00 124 M 8.65 4.65 0.00 1.77 2.10 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.91 0.00 125 V 7.69 4.60 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 1.12 0.00 0.00 1.21 0.00 0.00 126 V 8.59 4.10 2.21 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 0.80 0.00 0.00 0.99 0.00 0.00 127 R 9.19 4.51 0.00 1.87 1.96 0.00 3.55 0.00 0.00 3.24 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.79 0.00 128 A 7.79 4.80 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 0.00 0.00 129 C 8.67 5.40 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 0.00 130 G 8.92 4.07 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 0.00 0.00 0.00 131 C 8.57 5.34 0.00 2.81 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 0.00 132 H 8.27 4.54 0.00 3.24 3.13 0.00 5.69 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 * Residues marked with a * may have inaccurate shift predictions.