NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 R 4.4718 8.2393 119.7071 56.3597 32.6806 174.0028 13 S 4.4024 9.3955 113.3914 56.4625 62.6068 174.6400 14 L 4.7849 7.9533 133.1985 54.7170 42.8690 172.0730 15 N 4.9158 7.9185 124.7489 51.1762 40.6121 171.8822 16 R 4.9818 8.3248 123.6760 54.1542 33.6826 174.0342 17 V 4.4348 9.3100 124.8552 61.3913 35.3682 173.7085 18 H 5.3303 8.5582 122.6319 54.0801 31.9635 172.7858 19 L 4.8503 8.0857 121.5110 53.1588 46.4191 175.4140 20 L 5.2237 7.3709 122.5042 54.6845 45.3189 174.7031 21 G 4.1610 8.2968 111.5193 46.8063 0.0000 171.3437 22 R 5.2593 7.8707 118.1350 54.3995 32.6380 176.4326 23 V 4.3282 8.6190 123.8260 63.0994 32.3610 177.0139 24 G 4.0384 8.9937 115.0422 48.7258 0.0000 173.8236 25 Q 4.6868 7.9077 118.6791 53.5010 32.3973 173.4441 26 D 4.2640 8.4860 121.8550 53.3973 41.4711 175.2922 27 P 4.8265 0.0000 0.0000 62.1022 33.4855 174.8725 28 V 4.3407 8.0417 118.2882 61.1593 35.0797 173.3718 29 L 5.4377 8.2757 127.1795 53.3893 44.4803 174.9086 30 R 4.6574 8.4692 121.7190 57.4096 37.7400 174.9258 *36 N 4.7333 7.7965 117.1041 51.7541 37.1590 172.0600 37 P 4.7113 0.0000 0.0000 63.6702 32.6546 175.9500 38 V 4.5783 7.8333 111.0398 60.5639 36.4824 173.7944 39 T 5.0281 8.1807 119.7391 61.9813 71.6152 173.6206 40 I 5.0379 8.8282 125.7764 59.8649 41.3355 174.3645 41 F 5.2182 8.6107 122.3187 55.1810 42.0669 173.3555 42 S 5.2350 8.8569 111.3813 56.7341 66.2600 172.8791 43 L 5.3307 9.0271 121.3947 53.0758 44.8876 175.2722 44 A 4.2346 8.6273 124.6634 50.6094 21.4046 176.1273 45 T 4.5670 8.4137 117.0450 61.7811 72.4423 172.6996 46 N 5.4119 8.8581 123.1743 51.3283 41.5343 173.4313 47 E 4.7645 9.4059 124.6665 54.7655 31.9628 174.3805 48 M 5.2707 8.6694 126.2233 53.1055 35.6155 176.5736 49 W 4.7570 7.9636 118.3069 56.0097 29.1151 173.9033 *62 V 4.1546 7.8185 118.1463 62.7540 31.8844 174.9046 63 S 4.4203 7.8920 120.5927 56.9355 65.2536 172.8649 64 Q 4.5841 7.6147 121.1352 54.5250 32.5598 174.0555 65 K 4.6568 9.0021 125.2431 55.4420 35.9874 174.3557 66 T 4.9987 8.6717 121.9712 60.6189 69.6114 173.2652 67 T 4.5988 8.7838 124.7556 61.5400 71.8874 172.7531 68 W 4.9742 8.8590 126.3901 55.5990 30.5995 175.2293 69 H 4.9877 9.9122 123.5980 54.0596 31.1974 174.2209 70 R 4.4893 8.5323 122.8993 55.4367 30.9535 174.6877 71 I 4.6514 8.0187 128.6054 59.9578 39.2228 175.4241 72 S 4.9810 8.8300 120.6127 56.6862 66.3711 172.7528 73 V 4.2164 8.6676 124.5419 61.5714 32.7483 174.8096 74 F 4.5583 9.5056 126.5367 58.1441 40.8449 175.7250 75 R 3.6090 6.9270 116.2321 53.4931 30.6788 175.7602 76 P 4.3603 0.0000 0.0000 65.3497 32.1696 178.2621 77 G 3.6687 8.2466 106.9075 48.6893 0.0000 174.8987 78 L 3.8968 8.3083 122.4445 58.1607 41.7317 178.7993 79 R 3.9204 7.8440 118.1461 59.5477 29.8652 177.2802 80 D 4.5646 8.3992 117.4859 55.5731 41.7614 178.7481 81 V 3.8203 7.9121 118.3612 66.3426 31.3795 177.8623 82 A 4.0348 9.1899 121.2241 55.2269 17.9642 179.0427 83 Y 3.9844 7.5495 117.4742 60.8652 39.0010 177.5268 84 Q 4.0488 8.8324 119.8770 58.2330 29.0876 176.0827 85 Y 4.5679 7.3684 114.8970 58.8502 40.5341 176.4680 86 V 3.6190 7.8890 120.1411 62.4495 32.0178 175.0639 87 K 4.5073 8.3575 127.5686 54.2776 35.3888 174.7122 88 K 4.2964 8.1030 123.7205 57.0919 32.2328 176.5420 89 G 4.0462 8.8851 115.4922 45.3298 0.0000 173.6661 90 S 4.3939 7.9144 116.7317 58.3593 64.4169 173.2227 91 R 5.0196 8.5423 123.9627 55.6664 31.8220 175.0559 92 I 4.3415 8.7212 125.8440 60.0533 42.2600 173.0484 93 Y 5.0826 8.3620 127.6662 56.4864 41.0234 174.2901 94 L 4.9485 7.4233 124.5098 55.4692 44.6311 173.2883 95 E 5.5374 7.6948 116.7408 55.3941 34.4752 176.3372 96 G 4.2551 7.4581 106.9881 46.0363 0.0000 171.5668 97 K 5.1322 7.9869 118.0784 53.6143 36.3007 175.7848 98 I 3.9960 8.7526 122.9364 61.4003 37.8687 175.3970 99 D 4.3274 8.9277 125.9869 52.5973 44.3071 174.2004 100 Y 4.5962 8.2625 124.4964 57.3846 37.5312 174.9619 101 G 3.7513 10.7306 112.4639 46.2054 0.0000 169.7866 102 E 5.0824 9.1360 127.8581 54.6628 30.8372 174.5976 103 Y 5.0547 7.9455 123.6227 55.7041 42.3750 173.4180 104 M 5.2118 8.7994 117.4373 52.4851 35.8866 176.8630 105 D 5.0238 8.3314 119.5202 52.6221 38.9797 178.6441 106 K 4.0921 8.8353 114.6534 57.0040 31.6107 175.7151 107 N 4.2412 9.2485 109.9421 55.2012 37.1208 174.3357 108 N 4.9499 8.5116 115.1740 50.7665 39.5013 173.9368 109 V 3.8548 8.2463 115.9538 61.2467 32.2470 175.4145 110 R 4.8638 8.0325 125.2975 54.5980 33.9881 174.0847 111 R 5.1344 8.4006 114.8695 55.6399 32.6665 174.6247 112 Q 4.7707 9.2650 120.5169 54.0626 32.0045 174.4486 113 A 4.7191 8.8313 126.6507 51.8770 19.5748 176.2664 114 T 4.8025 9.6009 117.2074 60.5331 71.6548 172.8488 115 T 4.8075 9.5452 124.7094 62.1821 70.5056 173.7181 116 I 4.7297 8.6390 129.3535 59.8856 38.7941 174.7632 117 I 4.7720 8.2732 128.3804 59.7967 38.4181 175.3112 118 A 4.5030 8.6766 130.8355 53.1523 19.8291 176.5258 119 D 4.5370 7.5934 112.2195 54.1181 44.3667 174.6708 120 N 5.4681 8.8692 119.7432 51.9190 43.3987 173.7890 121 I 4.6748 8.8043 121.1381 59.7766 41.2600 174.8295 122 I 3.9714 8.3390 127.0964 60.3938 38.5750 175.8777 123 F 4.8148 7.3118 123.0013 57.7389 38.6444 175.6372 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 R 8.24 4.47 0.00 1.82 1.94 0.00 3.13 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 13 S 9.40 4.40 0.00 4.03 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 14 L 7.95 4.78 0.00 1.74 1.79 0.93 0.82 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 15 N 7.92 4.92 0.00 2.83 2.62 0.00 0.00 6.47 7.65 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 16 R 8.32 4.98 0.00 1.79 1.72 0.00 3.33 0.00 0.00 3.24 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 17 V 9.31 4.43 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 0.89 0.00 0.00 0.86 0.00 0.00 18 H 8.56 5.33 0.00 3.03 3.23 0.00 5.72 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 L 8.09 4.85 0.00 1.33 1.34 0.78 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 20 L 7.37 5.22 0.00 1.83 1.62 1.22 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 21 G 8.30 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 R 7.87 5.26 0.00 1.73 1.88 0.00 3.33 0.00 0.00 3.41 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.55 0.00 23 V 8.62 4.33 2.13 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 1.14 0.00 0.00 1.04 0.00 0.00 24 G 8.99 4.04 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 0.00 0.00 0.00 25 Q 7.91 4.69 0.00 1.93 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.70 0.00 0.00 0.00 0.00 0.00 2.21 2.27 0.00 26 D 8.49 4.26 0.00 2.63 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 27 P 0.00 4.83 0.00 1.76 1.96 0.00 3.55 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.73 0.00 28 V 8.04 4.34 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 0.94 0.00 0.00 0.86 0.00 0.00 29 L 8.28 5.44 0.00 1.93 1.87 1.05 1.02 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 30 R 8.47 4.66 0.00 1.85 1.86 0.00 3.19 0.00 0.00 3.36 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 *36 N 7.80 4.73 0.00 2.98 2.98 0.00 0.00 6.04 7.75 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 37 P 0.00 4.71 0.00 2.08 2.06 0.00 3.71 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 38 V 7.83 4.58 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 0.02 0.00 0.00 0.84 0.00 0.00 39 T 8.18 5.03 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 40 I 8.83 5.04 1.83 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 1.32 0.68 0.88 0.00 0.00 41 F 8.61 5.22 0.00 3.06 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 42 S 8.86 5.23 0.00 4.00 3.99 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 43 L 9.03 5.33 0.00 1.60 1.57 0.90 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 44 A 8.63 4.23 0.09 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 0.00 0.00 45 T 8.41 4.57 4.39 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 1.23 0.00 0.00 46 N 8.86 5.41 0.00 2.51 2.68 0.00 0.00 6.86 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 47 E 9.41 4.76 0.00 2.19 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 2.32 2.33 0.00 48 M 8.67 5.27 0.00 1.78 1.91 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.41 0.00 49 W 7.96 4.76 0.00 3.54 3.43 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 *62 V 7.82 4.15 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 0.63 0.00 0.00 0.82 0.00 0.00 63 S 7.89 4.42 0.00 2.72 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 64 Q 7.61 4.58 0.00 1.78 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.66 0.00 0.00 0.00 0.00 0.00 2.12 2.18 0.00 65 K 9.00 4.66 0.00 2.29 1.96 0.00 1.76 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.43 1.53 7.81 66 T 8.67 5.00 4.04 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 1.19 0.00 0.00 67 T 8.78 4.60 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 1.09 0.00 0.00 68 W 8.86 4.97 0.00 3.16 3.16 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 0.00 0.00 0.00 0.00 69 H 9.91 4.99 0.00 3.00 3.14 0.00 5.80 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 R 8.53 4.49 0.00 1.88 1.94 0.00 3.15 0.00 0.00 3.31 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.58 0.00 71 I 8.02 4.65 0.56 0.00 0.00 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 0.91 0.42 0.56 0.00 0.00 72 S 8.83 4.98 0.00 3.65 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 73 V 8.67 4.22 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 1.05 0.00 0.00 1.07 0.00 0.00 74 F 9.51 4.56 0.00 3.07 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 75 R 6.93 3.61 0.00 1.98 1.93 0.00 3.16 0.00 0.00 3.38 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.76 0.00 76 P 0.00 4.36 0.00 2.07 2.13 0.00 3.72 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.13 0.00 77 G 8.25 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 78 L 8.31 3.90 0.00 1.77 1.77 0.99 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 79 R 7.84 3.92 0.00 2.18 2.22 0.00 3.31 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.88 0.00 80 D 8.40 4.56 0.00 2.71 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 81 V 7.91 3.82 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 1.13 0.00 0.00 1.09 0.00 0.00 82 A 9.19 4.03 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.55 3.98 0.00 2.94 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 84 Q 8.83 4.05 0.00 2.20 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.52 0.00 0.00 0.00 0.00 0.00 2.08 2.30 0.00 85 Y 7.37 4.57 0.00 3.14 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 86 V 7.89 3.62 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 -0.08 0.00 0.00 0.69 0.00 0.00 87 K 8.36 4.51 0.00 1.91 1.54 0.00 1.59 0.00 0.00 1.53 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.31 1.60 7.81 88 K 8.10 4.30 0.00 1.89 1.80 0.00 2.09 0.00 0.00 1.72 0.00 0.00 2.83 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.49 7.81 89 G 8.89 4.05 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 0.00 0.00 0.00 90 S 7.91 4.39 0.00 3.82 3.73 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 R 8.54 5.02 0.00 2.06 2.22 0.00 3.30 0.00 0.00 3.48 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.83 0.00 92 I 8.72 4.34 1.82 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 0.86 0.94 0.90 0.00 0.00 93 Y 8.36 5.08 0.00 3.62 3.16 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 0.00 0.00 0.00 0.00 94 L 7.42 4.95 0.00 1.87 1.65 0.77 0.70 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 95 E 7.69 5.54 0.00 1.92 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 2.43 2.36 0.00 96 G 7.46 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.99 5.13 0.00 1.71 1.94 0.00 1.55 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.18 7.81 98 I 8.75 4.00 1.65 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.78 0.27 0.00 0.00 99 D 8.93 4.33 0.00 2.64 2.40 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.26 4.60 0.00 2.96 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 0.00 101 G 10.73 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 0.00 0.00 0.00 102 E 9.14 5.08 0.00 2.01 1.90 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 2.25 2.07 0.00 103 Y 7.95 5.05 0.00 3.11 3.14 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 0.00 104 M 8.80 5.21 0.00 1.86 1.98 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.41 0.00 105 D 8.33 5.02 0.00 2.85 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 0.00 0.00 0.00 106 K 8.84 4.09 0.00 1.89 1.97 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.49 7.81 107 N 9.25 4.24 0.00 2.71 2.93 0.00 0.00 6.62 7.88 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 0.00 108 N 8.51 4.95 0.00 2.85 2.87 0.00 0.00 7.06 7.25 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 0.00 109 V 8.25 3.85 1.98 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 0.67 0.00 0.00 0.86 0.00 0.00 110 R 8.03 4.86 0.00 0.67 1.53 0.00 3.17 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.53 0.00 111 R 8.40 5.13 0.00 1.81 1.83 0.00 3.01 0.00 0.00 3.40 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.77 0.00 112 Q 9.27 4.77 0.00 2.10 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.04 0.00 0.00 0.00 0.00 0.00 2.21 2.28 0.00 113 A 8.83 4.72 1.36 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 0.00 0.00 114 T 9.60 4.80 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 1.27 0.00 0.00 115 T 9.55 4.81 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 1.11 0.00 0.00 116 I 8.64 4.73 1.90 0.00 0.00 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 1.31 0.94 1.08 0.00 0.00 117 I 8.27 4.77 1.86 0.00 0.00 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 1.28 0.84 0.99 0.00 0.00 118 A 8.68 4.50 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 D 7.59 4.54 0.00 2.83 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 0.00 120 N 8.87 5.47 0.00 2.59 2.65 0.00 0.00 6.73 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 I 8.80 4.67 2.11 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.29 1.04 0.00 0.00 122 I 8.34 3.97 1.76 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 1.23 0.63 0.79 0.00 0.00 123 F 7.31 4.81 0.00 2.92 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 * Residues marked with a * may have inaccurate shift predictions.