NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 D 4.6378 8.3644 119.5552 51.4385 42.1263 174.8397 17 L 4.7377 8.0770 117.8019 52.4383 46.0811 173.7325 18 I 4.3256 8.5390 125.7002 60.5227 39.2242 174.1672 19 W 4.8652 9.4796 135.0000 55.9330 34.0729 174.0255 20 G 3.8468 7.0456 110.3331 45.2449 0.0000 171.6329 21 C 4.3643 7.2402 113.2048 56.3871 33.2247 172.1950 22 E 4.9072 8.5154 121.2294 54.7034 30.8504 174.7638 23 L 5.0963 8.5981 127.3176 53.3562 44.8550 175.4676 24 N 5.0493 8.4930 118.9176 52.0453 40.5025 174.5416 25 E 3.8959 9.0551 118.9809 59.7946 29.5805 179.3758 26 Q 4.1990 7.4141 115.7251 58.2537 29.3886 176.4082 27 N 5.0660 8.0772 114.8450 51.6128 39.1796 174.9063 28 K 4.4756 7.9720 117.4980 58.0375 33.5271 177.6146 29 T 5.3747 7.8195 115.9512 61.7805 72.4669 173.1096 30 F 4.8143 9.1569 125.4770 56.6573 43.3734 172.5296 31 E 4.9883 7.8253 126.4299 54.3843 31.5167 174.5361 32 F 5.0823 9.6115 130.6197 57.3565 40.6796 174.2413 33 K 4.3779 7.6995 125.7211 55.5516 34.0728 176.3088 34 V 2.9220 7.0266 117.6377 57.5274 34.3830 174.7863 *42 E 4.1369 8.6018 121.4222 55.6313 30.4257 175.9069 43 H 4.8844 8.8004 113.0074 54.5815 30.8388 175.2828 44 Q 4.5459 8.5330 123.4670 55.5360 30.8042 174.4937 45 L 4.7109 8.7027 123.1970 53.3517 44.0957 174.9773 46 A 4.8388 8.9915 129.6715 50.6090 20.0132 176.3864 47 L 4.4202 8.4645 123.5021 55.6311 42.2017 176.5014 48 R 4.6295 9.6567 120.7701 57.5410 32.7610 175.8638 49 T 5.2324 8.0818 106.9051 60.0968 73.2524 172.2201 50 V 5.0272 8.5159 120.8779 61.4242 34.9617 173.8383 51 C 5.1913 9.0815 120.8528 57.2431 33.3420 172.7869 52 L 4.9189 8.2871 119.9603 53.1409 43.6959 176.8167 53 G 4.1680 8.6301 109.1000 45.6642 0.0000 174.4288 54 D 4.7294 8.8570 118.7922 54.3666 39.8111 177.0077 55 K 4.4471 7.7687 118.0428 56.0750 32.6533 176.0524 56 A 4.4317 7.4344 121.4723 51.5721 18.7111 178.4576 57 K 4.3053 7.8612 119.1672 56.2467 33.2341 177.8104 58 D 4.8388 8.1418 121.5060 52.7245 38.8521 174.6610 59 E 4.6232 7.7423 118.1784 53.6600 33.6498 175.8821 60 F 4.4147 8.5865 119.5889 58.4838 39.5416 174.3566 61 H 5.6678 9.5415 121.2227 53.4386 31.5945 173.6944 62 I 5.3506 8.3553 122.0001 59.4645 41.3066 174.5738 63 V 5.1180 8.7674 125.1483 59.8494 34.4743 174.2859 64 E 5.2345 9.2004 121.4409 54.5371 33.3123 174.9014 65 I 4.1901 8.6887 123.6167 61.3296 38.4991 175.3375 66 V 4.2498 9.0506 131.5899 62.4104 32.2167 175.5945 67 D 4.7433 8.5707 133.4865 53.9073 39.1766 173.1975 68 Q 4.3568 8.4188 128.0143 53.2015 28.9582 172.5311 *74 K 4.0366 8.1580 124.0664 53.9107 32.4766 174.0541 75 S 4.9756 8.3214 119.4926 56.0408 65.1560 174.0206 76 V 4.2909 8.6854 123.9950 60.3229 33.1237 172.9173 77 P 4.9326 0.0000 0.0000 63.0654 31.2692 176.4769 78 I 4.6721 9.3805 116.0792 60.6002 39.8160 175.4456 79 A 4.8058 7.8782 123.6980 50.7310 22.6921 174.9576 80 T 5.2866 8.5697 117.2557 61.8733 71.8731 173.4532 81 L 5.0722 9.2718 124.8825 53.2956 46.9043 175.3936 82 K 4.5988 8.8853 121.5441 54.7657 35.3411 174.8965 83 P 4.1297 0.0000 0.0000 65.6137 31.3425 177.2632 84 S 4.5293 7.7690 109.3128 58.4969 63.6121 173.9938 85 I 4.1876 7.4604 120.0965 62.5664 38.9761 176.1737 86 L 4.2480 8.4956 127.5137 54.0314 42.9420 173.0320 87 P 4.6574 0.0000 0.0000 62.6142 31.8216 174.8882 88 M 5.0222 7.4720 114.7108 55.3659 33.9233 173.1889 89 A 4.7235 8.9131 119.5179 51.0548 23.3508 175.2023 90 T 4.8118 8.3913 116.3668 62.3678 69.9813 174.3315 91 M 4.5119 8.7815 127.1767 54.2290 33.3476 176.2372 92 V 4.2371 7.9883 121.6295 62.2055 34.4112 176.3747 93 G 3.9575 9.0364 114.5509 45.5337 0.0000 173.2140 94 I 4.0149 7.3125 120.0835 61.2778 37.6091 174.6625 95 E 5.2208 8.6970 126.5091 54.3420 32.2867 175.8244 96 L 4.8454 8.7392 123.0814 52.9831 45.9332 175.3125 97 D 5.0461 8.7388 123.4738 52.9959 41.7163 174.5510 98 P 4.7563 0.0000 0.0000 62.1103 32.5331 173.7008 99 P 4.9655 0.0000 0.0000 61.8525 32.7911 175.2254 100 V 4.5502 8.4643 116.5562 59.6890 36.0975 174.6182 101 T 5.0583 7.9249 118.3991 61.8110 72.5086 172.8607 102 F 5.3972 9.1884 124.0174 55.7594 41.9353 174.5568 103 R 5.0428 9.1286 123.4437 54.5268 33.3720 174.4778 104 L 4.7767 8.7567 129.1046 54.1850 39.9128 175.9825 105 K 4.2558 8.7476 125.4171 58.6798 33.2229 176.0269 106 A 4.5816 8.1332 119.5534 51.3978 22.5960 176.0933 107 G 3.9498 8.9448 106.5526 45.0627 0.0000 174.0780 108 S 4.4074 8.3053 113.6784 57.0741 64.1970 175.8898 109 G 4.1539 8.0341 109.5868 43.6231 0.0000 169.8808 110 P 4.2532 0.0000 0.0000 62.8149 32.3403 175.3731 111 L 4.8265 8.4518 125.8693 53.3000 45.0880 174.5362 112 Y 5.2168 9.2189 123.4090 56.2792 41.4999 174.7095 113 I 5.1227 8.4808 123.0097 59.4743 41.1242 174.7064 114 S 5.0541 8.8966 119.8496 56.9865 66.8228 172.8218 115 G 4.3370 9.0997 107.1301 46.1781 0.0000 171.9381 116 Q 5.4110 8.7294 118.5220 52.8312 32.5028 175.2394 117 H 4.6631 8.7034 120.2648 56.1966 29.3630 175.8727 118 V 4.0121 8.2929 116.5487 61.3385 31.2613 176.0552 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 16 D 8.36 4.64 0.00 2.71 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 17 L 8.08 4.74 0.00 1.88 1.64 0.96 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 18 I 8.54 4.33 1.88 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 1.19 0.78 0.90 0.00 0.00 19 W 9.48 4.87 0.00 3.25 2.99 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 20 G 7.05 3.85 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 0.00 0.00 0.00 21 C 7.24 4.36 0.00 2.19 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 22 E 8.52 4.91 0.00 2.12 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 2.11 2.01 0.00 23 L 8.60 5.10 0.00 1.61 1.57 1.03 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 24 N 8.49 5.05 0.00 2.84 2.84 0.00 0.00 6.45 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 25 E 9.06 3.90 0.00 2.21 1.99 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 2.31 2.34 0.00 26 Q 7.41 4.20 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 7.02 0.00 0.00 0.00 0.00 0.00 2.40 2.48 0.00 27 N 8.08 5.07 0.00 2.76 2.75 0.00 0.00 6.85 7.05 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 28 K 7.97 4.48 0.00 1.75 1.88 0.00 1.62 0.00 0.00 1.84 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.67 1.58 7.81 29 T 7.82 5.37 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 1.25 0.00 0.00 30 F 9.16 4.81 0.00 3.34 3.11 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 31 E 7.83 4.99 0.00 1.89 1.58 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 2.12 2.22 0.00 32 F 9.61 5.08 0.00 3.46 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 33 K 7.70 4.38 0.00 1.49 1.53 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.22 1.32 7.81 34 V 7.03 2.92 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 0.58 0.00 0.00 0.82 0.00 0.00 *42 E 8.60 4.14 0.00 1.88 1.65 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 1.84 2.26 0.00 43 H 8.80 4.88 0.00 3.21 3.27 0.00 5.75 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 Q 8.53 4.55 0.00 2.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.87 0.00 0.00 0.00 0.00 0.00 2.48 2.38 0.00 45 L 8.70 4.71 0.00 0.92 1.13 -0.65 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 46 A 8.99 4.84 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 47 L 8.46 4.42 0.00 1.57 1.62 1.02 0.85 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 48 R 9.66 4.63 0.00 1.66 1.91 0.00 3.22 0.00 0.00 3.21 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.68 0.00 49 T 8.08 5.23 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 1.20 0.00 0.00 50 V 8.52 5.03 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 1.10 0.00 0.00 0.92 0.00 0.00 51 C 9.08 5.19 0.00 3.03 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 52 L 8.29 4.92 0.00 1.51 1.50 0.79 0.62 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 53 G 8.63 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 0.00 0.00 0.00 54 D 8.86 4.73 0.00 2.80 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 55 K 7.77 4.45 0.00 1.73 1.82 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.34 1.34 7.81 56 A 7.43 4.43 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 57 K 7.86 4.31 0.00 1.79 1.75 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.36 7.81 58 D 8.14 4.84 0.00 2.63 2.53 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 59 E 7.74 4.62 0.00 1.92 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 2.31 2.24 0.00 60 F 8.59 4.41 0.00 3.02 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 H 9.54 5.67 0.00 3.07 3.22 0.00 5.76 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 I 8.36 5.35 1.91 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 1.47 1.21 1.00 0.00 0.00 63 V 8.77 5.12 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 0.87 0.00 0.00 1.09 0.00 0.00 64 E 9.20 5.23 0.00 2.07 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 0.00 2.40 2.30 0.00 65 I 8.69 4.19 1.88 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.90 0.83 0.00 0.00 66 V 9.05 4.25 2.05 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 0.89 0.00 0.00 0.95 0.00 0.00 67 D 8.57 4.74 0.00 2.46 2.49 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 0.00 0.00 0.00 0.00 68 Q 8.42 4.36 0.00 1.79 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.77 0.00 0.00 0.00 0.00 0.00 2.16 1.89 0.00 *74 K 8.16 4.04 0.00 1.70 1.82 0.00 1.74 0.00 0.00 1.87 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.01 7.81 75 S 8.32 4.98 0.00 4.01 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 76 V 8.69 4.29 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 1.06 0.00 0.00 0.94 0.00 0.00 77 P 0.00 4.93 0.00 1.99 2.00 0.00 3.68 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 78 I 9.38 4.67 1.93 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.74 1.04 0.00 0.00 79 A 7.88 4.81 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 80 T 8.57 5.29 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 1.32 0.00 0.00 81 L 9.27 5.07 0.00 1.51 1.62 0.91 0.54 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 82 K 8.89 4.60 0.00 1.34 1.39 0.00 0.61 0.00 0.00 0.81 0.00 0.00 2.72 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.11 1.07 7.81 83 P 0.00 4.13 0.00 2.02 2.06 0.00 3.77 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 2.13 2.00 0.00 84 S 7.77 4.53 0.00 3.91 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 85 I 7.46 4.19 1.89 0.00 0.00 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 1.17 0.96 0.98 0.00 0.00 86 L 8.50 4.25 0.00 1.66 1.55 0.93 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 87 P 0.00 4.66 0.00 2.24 2.38 0.00 3.78 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.93 0.00 88 M 7.47 5.02 0.00 1.99 2.15 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.51 0.00 89 A 8.91 4.72 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 T 8.39 4.81 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 91 M 8.78 4.51 0.00 1.90 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 2.60 2.63 0.00 92 V 7.99 4.24 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 1.02 0.00 0.00 0.93 0.00 0.00 93 G 9.04 3.96 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 0.00 94 I 7.31 4.01 1.89 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 1.25 0.61 0.95 0.00 0.00 95 E 8.70 5.22 0.00 1.80 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 2.17 2.28 0.00 96 L 8.74 4.85 0.00 1.51 1.49 0.99 0.83 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 97 D 8.74 5.05 0.00 2.57 2.62 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 98 P 0.00 4.76 0.00 1.97 2.10 0.00 3.81 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.07 0.00 99 P 0.00 4.97 0.00 2.05 2.04 0.00 3.69 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.95 0.00 100 V 8.46 4.55 1.70 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 0.61 0.00 0.00 0.92 0.00 0.00 101 T 7.92 5.06 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 1.24 0.00 0.00 102 F 9.19 5.40 0.00 3.26 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 0.00 103 R 9.13 5.04 0.00 1.89 1.78 0.00 3.12 0.00 0.00 3.31 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 104 L 8.76 4.78 0.00 1.74 1.63 1.06 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 105 K 8.75 4.26 0.00 1.97 1.86 0.00 1.97 0.00 0.00 1.72 0.00 0.00 2.93 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.47 1.42 7.81 106 A 8.13 4.58 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 0.00 107 G 8.94 3.95 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 0.00 0.00 0.00 108 S 8.31 4.41 0.00 4.00 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 0.00 109 G 8.03 4.15 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 0.00 0.00 0.00 110 P 0.00 4.25 0.00 1.50 1.73 0.00 3.46 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.00 0.00 111 L 8.45 4.83 0.00 1.64 1.37 0.93 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 112 Y 9.22 5.22 0.00 2.84 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 0.00 113 I 8.48 5.12 1.59 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.15 0.75 0.00 0.00 114 S 8.90 5.05 0.00 3.77 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 0.00 115 G 9.10 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 0.00 116 Q 8.73 5.41 0.00 1.90 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.93 0.00 0.00 0.00 0.00 0.00 2.40 2.14 0.00 117 H 8.70 4.66 0.00 3.07 3.27 0.00 5.67 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.29 4.01 2.06 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 0.60 0.00 0.00 0.91 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.