NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *25 E 4.3617 8.4449 116.7535 55.7462 31.9308 176.0725 26 T 4.2404 8.0343 117.3261 62.9845 70.2605 171.6475 27 L 4.9651 9.2753 125.6462 53.8698 44.4673 175.6661 28 V 4.9962 9.2231 114.7316 59.8434 36.7377 175.0349 29 R 5.0803 8.9666 122.1437 52.8526 31.9502 173.6615 30 P 4.7126 0.0000 0.0000 62.5903 32.1980 176.8446 31 K 4.2745 8.8824 123.0780 55.5029 33.3551 176.5665 32 P 4.1951 0.0000 0.0000 65.6675 31.1246 178.9186 33 L 3.9322 7.7949 118.9011 57.9025 42.0391 178.5654 34 L 3.8067 7.7630 119.8837 57.9930 42.0423 178.5806 35 L 3.8840 8.0914 119.2157 57.7713 41.5044 179.5106 36 K 3.8787 8.0548 119.3930 59.1829 31.6856 178.5027 37 L 3.7179 7.7429 120.5832 58.1722 41.9930 178.8898 38 L 3.6416 7.9222 119.0733 57.8500 41.5147 179.8495 39 K 4.7072 8.4160 119.9813 58.8007 31.7912 179.4028 40 S 4.3473 8.2018 113.5454 60.3511 62.7072 175.3636 41 V 4.3868 6.9950 114.6971 61.5307 31.9390 176.3699 42 G 4.1030 8.1597 108.1319 45.3485 0.0000 174.8264 43 A 4.0505 7.8146 124.1737 52.0936 18.7559 177.8604 44 Q 4.5321 8.7036 119.4914 55.4398 30.0446 175.3282 45 K 4.4658 7.8427 117.8387 54.8588 34.2309 175.4927 46 D 4.9021 8.2131 116.9157 53.6493 40.7502 175.8352 47 T 4.9961 7.3381 115.9556 62.0207 71.6426 172.7446 48 Y 5.0924 9.1631 122.7567 56.4547 43.1603 174.6662 49 T 5.0350 9.3156 111.4193 60.4318 70.7895 175.9827 50 M 4.1400 8.8166 121.7473 58.4932 31.8709 179.1455 51 K 4.0655 8.1387 118.2420 59.6395 32.2400 179.0272 52 E 4.1697 8.3463 118.7578 59.3211 29.4189 179.6321 53 V 3.5352 7.8812 118.3648 66.0308 31.5808 178.1120 54 L 3.9446 8.3752 119.1965 57.5934 41.3293 179.2787 55 F 4.0972 8.4470 120.6211 61.6670 39.3291 176.8700 56 Y 3.7048 8.2018 116.4299 60.7750 37.5818 178.2796 57 L 4.0287 8.1693 121.5328 57.8917 42.1331 179.1692 58 G 3.6111 8.1978 105.8507 48.0635 0.0000 175.6150 59 Q 3.8559 7.8337 121.1082 58.4950 28.6086 178.3295 60 Y 3.9420 8.3696 120.9026 60.7966 38.8807 178.3153 61 I 3.7646 8.0661 120.6534 64.6104 37.2427 178.3764 62 M 4.3191 8.2547 119.7479 58.8327 31.6655 179.0333 63 T 3.9027 8.0367 108.7654 64.2921 68.9627 175.6263 64 K 4.0591 7.6691 118.3138 55.0102 33.2085 176.5025 65 R 3.3119 7.4828 117.8177 57.2174 28.1373 176.5084 66 L 4.4518 7.8360 115.7960 55.5805 43.0544 177.9640 67 Y 4.8840 7.0639 117.2981 55.4766 40.0638 174.8372 68 D 4.6357 8.9712 121.9206 54.2919 41.8072 177.0409 69 E 4.1652 9.0734 126.8251 59.0437 30.1382 177.8384 70 K 4.2179 8.2350 117.0832 58.1174 32.7896 176.5931 71 Q 4.4853 8.7033 119.0265 53.9959 28.9498 175.6234 72 Q 4.6806 8.6413 117.8556 56.3145 29.1648 176.6530 73 H 4.5629 7.9029 114.1231 56.5883 30.3666 174.7400 74 I 4.2242 7.5531 122.0475 60.3172 38.6008 174.8411 75 V 4.3968 8.0169 127.0416 61.0301 34.2310 173.6187 76 Y 5.1176 8.7338 126.2841 56.7186 38.8469 175.1802 77 C 4.7440 9.2088 120.8814 58.9476 31.5356 175.2803 *78 S 4.4202 7.9845 118.7789 58.4443 63.5508 177.4903 79 N 4.3643 8.7525 117.1489 53.8682 36.2256 173.0998 80 D 4.7853 7.6484 114.8457 51.3694 44.6742 175.3646 81 L 3.9448 8.7906 125.3679 58.4628 41.7478 179.1967 82 L 3.6723 8.9199 120.7116 57.9226 41.9052 179.2471 83 G 3.8842 8.0132 107.0646 47.1190 0.0000 175.5487 84 D 4.4734 7.8645 120.0673 56.9199 41.0002 178.0769 85 L 4.0851 7.8139 120.4602 57.9782 42.2029 178.3937 86 F 4.8397 8.4313 116.3903 57.5175 39.3161 177.2184 87 G 4.0211 8.6770 105.6165 45.4601 0.0000 173.2985 88 V 4.6268 7.4455 110.8799 58.8712 35.5133 173.6263 89 P 4.7929 0.0000 0.0000 63.9246 32.5908 174.8836 90 S 5.2178 7.9851 113.5433 57.8337 65.5076 172.5405 91 F 4.9602 8.5453 118.1523 56.2263 41.8370 172.3273 92 S 5.1080 9.6607 114.5319 56.3017 63.7395 175.2305 93 V 3.7855 9.0069 127.3817 65.9063 31.3856 177.1691 94 K 4.2059 7.8110 117.2706 58.1564 32.6736 178.0934 95 E 4.4290 8.1384 122.2724 54.7282 26.0384 175.8387 96 H 4.1658 8.0617 123.1331 59.6194 30.5553 176.2010 97 R 4.0109 8.0781 119.7540 59.1331 29.9190 178.2239 98 K 3.8893 7.9879 119.2165 59.2906 32.2141 178.6825 99 I 3.1030 7.7418 120.0769 64.5775 36.9738 178.0334 100 Y 3.6124 7.9759 117.3637 61.2301 37.7589 178.9252 101 T 4.0221 7.9664 116.7199 66.8696 68.3139 176.6672 102 M 3.8610 7.6083 119.5750 58.2003 32.0380 178.5307 103 I 3.8214 7.4881 120.0373 64.7790 37.2722 178.1339 104 Y 4.2671 8.0739 117.6402 61.1971 37.4035 179.0081 105 R 4.1021 7.8843 117.8396 58.4966 30.2409 177.0295 106 N 5.0331 8.2257 115.0259 52.7669 39.8416 174.4987 107 L 5.0964 7.9137 117.5737 52.9544 45.9300 175.9807 108 V 4.3627 8.5942 122.0758 61.1761 33.6452 174.7916 109 V 4.2720 8.4255 128.4010 62.1368 32.1456 175.7348 110 V 3.6271 8.2236 128.8862 64.5085 32.1085 175.6931 111 N 4.6757 8.8812 123.6548 53.5462 37.8193 174.1756 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 *25 E 8.44 4.36 0.00 1.76 1.84 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 2.17 2.43 0.00 26 T 8.03 4.24 4.35 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 1.27 0.00 0.00 27 L 9.28 4.97 0.00 1.63 1.60 0.93 0.90 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 28 V 9.22 5.00 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 0.90 0.00 0.00 1.12 0.00 0.00 29 R 8.97 5.08 0.00 1.73 1.89 0.00 3.14 0.00 0.00 3.26 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.44 0.00 30 P 0.00 4.71 0.00 1.94 1.93 0.00 4.08 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.10 0.00 31 K 8.88 4.27 0.00 1.80 1.75 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.47 1.44 7.81 32 P 0.00 4.20 0.00 2.15 2.09 0.00 3.59 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 2.11 2.14 0.00 33 L 7.79 3.93 0.00 1.72 1.61 0.88 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 34 L 7.76 3.81 0.00 1.72 1.73 0.75 0.65 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 35 L 8.09 3.88 0.00 1.97 1.70 0.96 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 36 K 8.05 3.88 0.00 1.93 1.90 0.00 1.62 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.43 7.81 37 L 7.74 3.72 0.00 1.35 1.65 0.48 -0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 38 L 7.92 3.64 0.00 1.77 1.35 0.72 0.17 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 39 K 8.42 4.71 0.00 1.84 1.84 0.00 1.68 0.00 0.00 1.80 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.76 1.38 7.81 40 S 8.20 4.35 0.00 4.10 4.20 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 41 V 6.99 4.39 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 0.86 0.00 0.00 1.26 0.00 0.00 42 G 8.16 4.10 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 0.00 0.00 0.00 43 A 7.81 4.05 0.56 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 0.00 0.00 44 Q 8.70 4.53 0.00 2.02 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.75 0.00 0.00 0.00 0.00 0.00 2.26 2.56 0.00 45 K 7.84 4.47 0.00 1.11 1.34 0.00 1.56 0.00 0.00 1.68 0.00 0.00 2.36 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.24 1.25 7.81 46 D 8.21 4.90 0.00 2.82 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 47 T 7.34 5.00 4.13 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 1.21 0.00 0.00 48 Y 9.16 5.09 0.00 2.95 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 49 T 9.32 5.03 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 1.27 0.00 0.00 50 M 8.82 4.14 0.00 2.17 2.28 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.71 0.00 51 K 8.14 4.07 0.00 1.90 1.91 0.00 1.62 0.00 0.00 1.91 0.00 0.00 3.12 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.57 1.66 7.81 52 E 8.35 4.17 0.00 2.52 2.50 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 2.54 2.45 0.00 53 V 7.88 3.54 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 0.92 0.00 0.00 0.88 0.00 0.00 54 L 8.38 3.94 0.00 1.69 1.70 0.58 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 55 F 8.45 4.10 0.00 3.07 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 56 Y 8.20 3.70 0.00 3.11 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 57 L 8.17 4.03 0.00 1.77 1.86 0.72 0.87 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 58 G 8.20 3.61 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 59 Q 7.83 3.86 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.75 0.00 0.00 0.00 0.00 0.00 1.29 1.57 0.00 60 Y 8.37 3.94 0.00 3.11 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 61 I 8.07 3.76 1.97 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.89 1.03 0.00 0.00 62 M 8.25 4.32 0.00 2.06 2.27 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.70 0.00 63 T 8.04 3.90 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 1.21 0.00 0.00 64 K 7.67 4.06 0.00 1.53 1.64 0.00 0.61 0.00 0.00 1.18 0.00 0.00 2.78 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.12 0.97 7.81 65 R 7.48 3.31 0.00 1.74 1.61 0.00 3.15 0.00 0.00 3.22 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.46 0.00 66 L 7.84 4.45 0.00 1.63 1.89 1.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 67 Y 7.06 4.88 0.00 2.91 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 68 D 8.97 4.64 0.00 2.81 2.84 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 69 E 9.07 4.17 0.00 1.97 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 2.32 2.45 0.00 70 K 8.24 4.22 0.00 2.22 1.87 0.00 1.86 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.42 1.02 7.81 71 Q 8.70 4.49 0.00 1.95 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.94 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 72 Q 8.64 4.68 0.00 1.93 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.99 0.00 0.00 0.00 0.00 0.00 2.70 2.29 0.00 73 H 7.90 4.56 0.00 3.24 3.51 0.00 5.64 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 I 7.55 4.22 1.69 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.64 0.29 0.00 0.00 75 V 8.02 4.40 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 0.89 0.00 0.00 0.59 0.00 0.00 76 Y 8.73 5.12 0.00 2.84 2.84 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 77 C 9.21 4.74 0.00 3.06 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 *78 S 7.98 4.42 0.00 3.66 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 79 N 8.75 4.36 0.00 2.87 2.93 0.00 0.00 6.85 8.06 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 80 D 7.65 4.79 0.00 2.74 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.79 3.94 0.00 1.85 1.70 0.92 0.21 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 82 L 8.92 3.67 0.00 1.73 1.73 -0.26 1.12 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 83 G 8.01 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 84 D 7.86 4.47 0.00 2.81 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 85 L 7.81 4.09 0.00 1.66 1.64 0.87 0.30 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 86 F 8.43 4.84 0.00 3.00 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 87 G 8.68 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 0.00 0.00 0.00 88 V 7.45 4.63 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 0.84 0.00 0.00 1.20 0.00 0.00 89 P 0.00 4.79 0.00 2.20 2.35 0.00 3.81 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.01 0.00 90 S 7.99 5.22 0.00 4.01 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 91 F 8.55 4.96 0.00 3.33 3.12 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 92 S 9.66 5.11 0.00 3.90 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 93 V 9.01 3.79 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 0.88 0.00 0.00 0.98 0.00 0.00 94 K 7.81 4.21 0.00 1.78 1.85 0.00 1.54 0.00 0.00 1.62 0.00 0.00 2.86 0.00 0.00 2.43 0.00 0.00 0.00 0.00 1.43 1.35 7.81 95 E 8.14 4.43 0.00 2.19 1.94 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 2.34 2.48 0.00 96 H 8.06 4.17 0.00 3.35 3.36 0.00 5.87 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 97 R 8.08 4.01 0.00 1.98 1.95 0.00 3.25 0.00 0.00 3.28 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.72 0.00 98 K 7.99 3.89 0.00 1.84 1.87 0.00 1.74 0.00 0.00 1.79 0.00 0.00 2.95 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.32 1.41 7.81 99 I 7.74 3.10 1.85 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.45 0.61 0.00 0.00 100 Y 7.98 3.61 0.00 3.02 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 0.00 101 T 7.97 4.02 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 1.21 0.00 0.00 102 M 7.61 3.86 0.00 0.90 1.06 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.27 0.00 103 I 7.49 3.82 1.58 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 1.52 0.58 0.67 0.00 0.00 104 Y 8.07 4.27 0.00 3.18 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 0.00 105 R 7.88 4.10 0.00 2.06 2.02 0.00 3.14 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.81 0.00 106 N 8.23 5.03 0.00 2.85 2.79 0.00 0.00 6.63 7.58 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 0.00 107 L 7.91 5.10 0.00 1.60 1.62 0.84 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.59 4.36 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 0.92 0.00 0.00 0.96 0.00 0.00 109 V 8.43 4.27 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 0.84 0.00 0.00 1.03 0.00 0.00 110 V 8.22 3.63 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 0.81 0.00 0.00 0.99 0.00 0.00 111 N 8.88 4.68 0.00 2.82 3.12 0.00 0.00 6.90 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.