NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 T 4.2477 8.1744 110.9426 61.1903 70.2274 173.0370 8 D 4.2865 8.5146 125.5987 51.5011 41.3628 174.4567 9 P 4.4154 0.0000 0.0000 65.4153 32.4954 177.0589 10 R 4.1538 8.7947 116.7753 57.0932 30.4522 176.7299 11 A 4.2406 7.6144 120.5877 51.0129 19.0208 177.1845 12 K 3.9340 8.5452 120.8777 56.3369 32.6158 176.5995 13 W 4.2485 8.9035 135.0000 57.3336 31.2076 175.1447 14 V 4.0990 7.6323 125.1432 60.0523 32.3376 173.2432 15 P 4.0251 0.0000 0.0000 62.2080 32.1956 175.3861 16 Q 4.6689 8.5452 117.0416 54.6879 31.8935 174.1859 17 D 5.4813 8.5126 115.7040 54.1838 41.4836 175.3604 18 N 5.0009 9.5303 113.4236 52.0736 38.7944 174.1400 19 D 4.3668 8.0863 119.7696 53.3068 42.6961 175.2480 20 I 3.0155 7.9703 120.6903 62.4135 37.9310 176.5856 21 Q 4.2703 8.3769 119.2077 55.9460 29.2709 175.1969 22 A 4.7911 7.4529 121.5124 50.5096 20.6858 177.8158 23 C 4.7022 8.9100 118.2966 59.0921 41.4062 174.2946 24 D 5.0164 8.1293 118.8449 52.9402 39.5242 175.2809 25 Y 4.7639 8.1553 122.3937 57.4351 39.6153 176.6351 26 W 4.5457 8.7276 124.9691 59.9485 28.0164 178.2119 27 R 3.4120 5.8400 115.1206 57.6875 29.8508 176.3071 28 H 5.1758 8.3706 116.0564 55.8124 28.9261 174.6926 29 C 3.1600 7.8848 116.2657 57.6505 41.3986 174.2488 30 S 4.8951 7.6642 115.1370 56.8330 62.5912 173.6671 31 I 3.4605 7.4189 118.1205 60.1076 39.1063 174.2609 32 D 4.7361 8.8750 126.8027 54.8235 44.2969 172.2428 33 G 4.1262 7.8682 117.9809 44.2524 0.0000 175.5163 34 N 5.3932 9.0216 122.0755 50.9585 42.5806 173.4376 35 I 4.2725 8.2251 122.7717 60.9358 37.5594 176.5826 36 C 4.1792 8.6228 124.4743 59.9846 34.9326 175.8735 37 D 4.1780 8.0901 118.3082 56.8078 40.8927 177.6544 38 C 4.7861 8.1249 114.8714 57.3947 40.3641 173.7549 39 S 4.6212 8.3150 114.1039 58.2419 63.1247 175.0753 40 G 4.0295 8.8094 108.8213 46.0169 0.0000 175.2661 41 G 4.0772 7.5180 110.7625 44.8521 0.0000 171.2928 42 S 4.9898 8.1826 115.1239 56.2129 66.3074 173.2447 43 L 4.0379 8.6868 120.7894 58.0806 41.6592 178.5088 44 T 4.7222 7.8093 104.1340 60.9703 69.6248 172.9342 45 N 5.0682 7.9091 118.9382 51.7200 41.9260 173.3421 46 C 4.7222 8.4142 118.1057 55.7470 36.3716 172.1830 47 P 4.6524 0.0000 0.0000 61.4165 31.7116 174.4424 48 P 4.2236 0.0000 0.0000 64.2175 31.6523 177.1288 49 G 4.0243 8.8563 110.3703 45.4530 0.0000 173.6015 50 T 4.3395 6.7739 109.2434 60.7233 70.7966 174.1984 51 K 4.5893 8.8622 121.3499 54.4231 35.0329 175.4339 52 L 4.5329 8.4108 126.7474 54.2311 43.1437 175.9421 53 A 4.6558 8.5358 128.5337 52.4309 18.9914 176.7944 54 T 4.4211 8.8703 109.0242 62.4553 71.1752 174.8730 55 A 4.9064 7.9555 123.4005 51.1063 21.5341 176.5264 56 S 3.5565 7.2108 118.3655 58.0745 67.6151 177.3091 *58 V 4.4731 8.6202 113.5265 61.6724 32.6468 173.0904 59 A 4.7745 8.2279 120.2739 51.2828 22.5452 175.4987 60 S 5.0445 8.7948 116.0455 57.6258 63.2143 173.8396 61 C 5.2744 9.4654 125.9915 55.3796 42.7707 172.6748 62 Y 4.6722 9.0378 124.9133 57.3630 39.6132 173.9678 63 N 3.5251 8.4766 126.7687 50.7911 39.2270 173.8551 64 P 3.9596 0.0000 0.0000 65.4960 31.8716 178.2355 65 T 3.8530 7.8909 116.2406 66.2179 68.2533 175.0640 66 D 4.5859 7.5840 116.3615 52.2109 40.0447 176.5484 67 G 3.7590 7.7212 107.2678 46.4524 0.0000 173.4910 68 Q 4.5775 8.1242 118.6120 54.1099 31.8098 174.5555 69 S 5.3135 8.1912 116.7151 57.2376 65.4244 172.9003 70 Y 5.1394 9.2965 122.1412 56.0102 41.6297 174.5013 71 L 4.8906 9.3374 125.0723 54.5805 43.6948 175.2670 72 I 4.6430 8.8766 127.7246 59.5587 39.5037 174.6635 73 A 4.3596 8.1151 129.3133 50.5239 19.5174 176.9907 74 Y 4.6914 8.0595 121.4268 57.5326 36.3581 174.8818 75 R 4.3924 7.9493 121.2364 55.7796 32.3745 175.7018 76 D 5.2251 8.7577 123.2464 53.7262 43.6090 174.5674 77 C 5.1905 8.9293 118.9394 55.8280 38.2748 172.5823 78 C 5.7920 8.9009 120.6961 54.3772 44.3310 174.8000 79 G 4.1096 9.6401 105.1237 45.9112 0.0000 172.7014 80 Y 4.7262 7.4342 114.5089 55.6829 42.0048 174.5634 81 N 4.6157 8.4810 120.3034 52.7878 39.8300 175.1641 82 V 4.0003 8.6417 121.7205 61.2539 31.7525 176.3845 83 S 4.1404 8.3464 118.6234 60.2506 62.7603 175.9293 84 G 3.9766 7.8038 107.3667 44.9669 0.0000 172.9988 85 R 4.5364 7.7347 118.0582 55.5666 33.3133 175.2879 86 C 4.3080 8.6936 117.2897 57.5632 37.5887 171.0899 87 P 5.1079 0.0000 0.0000 63.2159 32.5639 178.2509 88 C 4.9875 9.1984 118.5185 55.9268 45.4579 173.4133 89 L 4.7943 8.3521 123.6819 54.3766 43.5763 174.4088 90 N 5.0664 9.0208 124.1180 50.8739 42.8599 174.7117 91 T 4.7153 7.5098 109.5324 60.9723 68.9260 174.0807 92 E 3.8734 8.2527 122.5804 58.6349 29.5265 177.8976 93 G 3.7502 8.8125 111.8767 45.3888 0.0000 172.1945 94 E 4.2974 7.8144 121.4432 56.1039 29.9136 176.3408 95 L 4.7155 8.1156 126.4637 52.1601 44.6882 174.2308 96 P 4.5158 0.0000 0.0000 62.2392 32.1001 178.1509 97 V 3.6642 8.5037 120.4483 64.8814 31.1360 176.7203 98 Y 4.4926 7.7905 116.0014 57.7292 38.8437 175.6409 99 R 4.7154 7.7330 119.2099 53.8346 30.8465 174.1079 100 P 4.4747 0.0000 0.0000 65.8442 31.7453 179.0195 101 E 3.7090 8.1995 115.6384 58.3732 29.3255 177.4999 102 F 5.1252 8.3484 115.9406 56.8699 39.9543 173.8479 103 A 5.0152 8.1841 124.9403 51.2258 19.5785 177.5719 104 N 5.0870 9.2929 119.7386 52.8096 37.5873 175.4696 105 D 4.7400 7.8442 118.1754 55.1880 41.5969 177.0622 106 I 3.4683 7.2403 119.9880 60.8171 37.4707 175.9517 107 I 3.8465 7.6270 125.5339 60.5140 36.7062 176.8441 108 W 4.7824 8.6884 130.5316 55.7883 27.5415 176.7180 109 C 4.9312 7.3289 114.6724 56.1639 41.4795 174.4238 110 F 4.5611 7.6169 119.9424 59.3815 38.8986 176.2442 111 G 4.5920 9.4163 112.5141 46.4385 0.0000 173.7346 112 A 4.6408 7.7090 122.4564 51.1552 19.2671 176.8173 113 E 4.0668 8.6004 121.4399 57.5702 30.2764 176.7258 114 D 4.5399 9.1240 121.6198 54.8634 38.3523 173.3621 115 D 4.4042 7.8501 114.3236 54.8727 39.0363 173.9581 116 A 4.1042 7.7473 121.1725 53.0185 18.5752 178.3265 117 M 4.6816 8.4770 120.2380 54.6705 33.9043 175.7018 118 T 4.3306 7.6266 110.1671 61.3646 70.9529 172.9153 119 Y 4.4241 8.5523 125.0017 57.5801 40.1360 173.6959 120 H 4.7875 7.9111 124.8785 57.0614 32.3610 171.1578 121 C 4.9946 6.6704 109.6268 55.0764 39.7188 171.7486 122 T 5.3694 9.1180 115.3776 61.8156 72.1201 173.9264 123 I 4.5198 8.4219 118.3745 58.9811 40.5232 175.3216 124 S 4.7446 8.2463 117.3055 56.6123 63.0988 172.7531 125 P 4.4533 0.0000 0.0000 62.0968 32.8198 176.1510 126 I 4.5018 8.0057 121.2349 60.9984 37.8766 176.2927 127 V 4.2471 9.5719 117.3288 60.2250 32.7835 175.7278 128 G 4.1873 7.3801 109.6668 44.9455 0.0000 171.3452 129 K 4.3927 8.0888 118.6698 55.9162 32.7255 177.7146 130 A 4.9316 8.4683 126.2245 51.6829 22.0662 176.9043 131 S 4.4056 8.6501 110.3835 59.2785 62.9376 174.6969 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 7 T 8.17 4.25 4.27 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 1.22 0.00 0.00 8 D 8.51 4.29 0.00 2.83 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 9 P 0.00 4.42 0.00 2.24 2.20 0.00 3.83 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 10 R 8.79 4.15 0.00 1.99 2.04 0.00 3.17 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 11 A 7.61 4.24 1.30 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 0.00 0.00 0.00 12 K 8.55 3.93 0.00 1.76 1.79 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.51 1.51 7.81 13 W 8.90 4.25 0.00 3.29 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 14 V 7.63 4.10 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 0.83 0.00 0.00 0.95 0.00 0.00 15 P 0.00 4.03 0.00 2.22 1.74 0.00 3.67 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.17 0.00 16 Q 8.55 4.67 0.00 2.29 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 7.00 0.00 0.00 0.00 0.00 0.00 2.27 2.43 0.00 17 D 8.51 5.48 0.00 2.58 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 N 9.53 5.00 0.00 2.77 2.89 0.00 0.00 6.51 8.08 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 19 D 8.09 4.37 0.00 2.66 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 20 I 7.97 3.02 1.34 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 1.20 0.54 0.09 0.00 0.00 21 Q 8.38 4.27 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.71 0.00 0.00 0.00 0.00 0.00 2.32 2.24 0.00 22 A 7.45 4.79 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 C 8.91 4.70 0.00 3.13 3.35 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 0.00 24 D 8.13 5.02 0.00 2.62 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 25 Y 8.16 4.76 0.00 3.36 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 26 W 8.73 4.55 0.00 3.72 3.24 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 27 R 5.84 3.41 0.00 1.38 1.54 0.00 2.99 0.00 0.00 2.83 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 28 H 8.37 5.18 0.00 3.54 3.36 0.00 5.63 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 C 7.88 3.16 0.00 2.76 3.57 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 30 S 7.66 4.90 0.00 3.78 3.57 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 31 I 7.42 3.46 1.86 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 1.09 1.23 0.90 0.00 0.00 32 D 8.88 4.74 0.00 2.79 2.38 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.87 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 0.00 0.00 0.00 0.00 34 N 9.02 5.39 0.00 2.70 2.83 0.00 0.00 7.38 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 I 8.23 4.27 1.86 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 1.12 0.69 0.93 0.00 0.00 36 C 8.62 4.18 0.00 2.91 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 37 D 8.09 4.18 0.00 2.71 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 38 C 8.12 4.79 0.00 3.10 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 39 S 8.31 4.62 0.00 3.98 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 40 G 8.81 4.03 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 0.00 0.00 0.00 41 G 7.52 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 S 8.18 4.99 0.00 3.89 3.80 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 43 L 8.69 4.04 0.00 1.66 1.67 0.92 0.59 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 44 T 7.81 4.72 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 1.17 0.00 0.00 45 N 7.91 5.07 0.00 2.74 2.67 0.00 0.00 7.02 8.00 0.00 0.00 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 C 8.41 4.72 0.00 2.90 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 47 P 0.00 4.65 0.00 1.94 2.06 0.00 3.46 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 2.07 2.12 0.00 48 P 0.00 4.22 0.00 2.00 1.96 0.00 3.62 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 2.00 2.05 0.00 49 G 8.86 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 50 T 6.77 4.34 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 0.32 0.00 0.00 51 K 8.86 4.59 0.00 1.62 1.73 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.37 1.65 7.81 52 L 8.41 4.53 0.00 1.75 1.53 0.92 1.20 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 A 8.54 4.66 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.87 4.42 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 1.30 0.00 0.00 55 A 7.96 4.91 1.43 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 0.00 0.00 56 S 7.21 3.56 0.00 3.97 3.19 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 *58 V 8.62 4.47 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 0.91 0.00 0.00 0.98 0.00 0.00 59 A 8.23 4.77 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.79 5.04 0.00 3.96 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 61 C 9.47 5.27 0.00 3.28 3.55 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 62 Y 9.04 4.67 0.00 3.01 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 63 N 8.48 3.53 0.00 1.44 2.29 0.00 0.00 6.56 7.73 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 64 P 0.00 3.96 0.00 2.12 2.14 0.00 3.11 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.88 0.00 65 T 7.89 3.85 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 1.12 0.00 0.00 66 D 7.58 4.59 0.00 2.68 2.66 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 0.00 0.00 0.00 0.00 67 G 7.72 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 0.00 0.00 0.00 68 Q 8.12 4.58 0.00 1.85 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.33 6.73 0.00 0.00 0.00 0.00 0.00 2.39 2.35 0.00 69 S 8.19 5.31 0.00 3.76 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 70 Y 9.30 5.14 0.00 3.28 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 9.34 4.89 0.00 1.80 1.60 1.09 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 72 I 8.88 4.64 1.44 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.01 0.17 0.00 0.00 73 A 8.12 4.36 1.12 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 74 Y 8.06 4.69 0.00 2.96 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 75 R 7.95 4.39 0.00 1.79 1.88 0.00 3.08 0.00 0.00 3.31 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 76 D 8.76 5.23 0.00 2.81 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 8.93 5.19 0.00 2.71 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 78 C 8.90 5.79 0.00 2.78 3.10 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 79 G 9.64 4.11 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 0.00 80 Y 7.43 4.73 0.00 2.64 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 81 N 8.48 4.62 0.00 2.64 2.73 0.00 0.00 7.01 7.71 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 82 V 8.64 4.00 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 1.02 0.00 0.00 1.11 0.00 0.00 83 S 8.35 4.14 0.00 3.98 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 84 G 7.80 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 85 R 7.73 4.54 0.00 1.79 1.83 0.00 3.33 0.00 0.00 3.46 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.71 0.00 86 C 8.69 4.31 0.00 3.10 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 87 P 0.00 5.11 0.00 2.08 2.06 0.00 3.78 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 88 C 9.20 4.99 0.00 2.84 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 89 L 8.35 4.79 0.00 1.52 1.48 0.84 0.85 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 90 N 9.02 5.07 0.00 2.38 2.00 0.00 0.00 6.19 6.58 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 91 T 7.51 4.72 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 1.17 0.00 0.00 92 E 8.25 3.87 0.00 1.91 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 1.94 2.26 0.00 93 G 8.81 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 94 E 7.81 4.30 0.00 1.96 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 2.60 2.58 0.00 95 L 8.12 4.72 0.00 1.57 1.47 0.89 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 96 P 0.00 4.52 0.00 1.41 2.01 0.00 3.25 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.06 0.00 97 V 8.50 3.66 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 0.84 0.00 0.00 0.95 0.00 0.00 98 Y 7.79 4.49 0.00 3.11 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 99 R 7.73 4.72 0.00 1.80 1.91 0.00 3.40 0.00 0.00 3.34 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.56 0.00 100 P 0.00 4.47 0.00 2.50 2.49 0.00 3.81 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.07 0.00 101 E 8.20 3.71 0.00 1.51 1.85 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 1.47 1.47 0.00 102 F 8.35 5.13 0.00 3.10 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 0.00 103 A 8.18 5.02 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.29 5.09 0.00 2.79 2.90 0.00 0.00 7.02 8.73 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 0.00 105 D 7.84 4.74 0.00 2.61 2.67 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 0.00 106 I 7.24 3.47 0.92 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.29 -0.31 0.00 0.00 107 I 7.63 3.85 1.63 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.65 0.95 0.00 0.00 108 W 8.69 4.78 0.00 3.61 3.33 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 0.00 109 C 7.33 4.93 0.00 2.75 3.19 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 0.00 110 F 7.62 4.56 0.00 3.31 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 0.00 111 G 9.42 4.59 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 0.00 0.00 0.00 112 A 7.71 4.64 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.60 4.07 0.00 2.02 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 2.39 2.35 0.00 114 D 9.12 4.54 0.00 2.89 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 0.00 115 D 7.85 4.40 0.00 2.87 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 0.00 116 A 7.75 4.10 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 0.00 117 M 8.48 4.68 0.00 1.87 2.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.58 0.00 118 T 7.63 4.33 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 1.22 0.00 0.00 119 Y 8.55 4.42 0.00 3.13 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 0.00 120 H 7.91 4.79 0.00 3.24 3.22 0.00 5.87 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 C 6.67 4.99 0.00 3.13 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 0.00 122 T 9.12 5.37 4.40 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 1.52 0.00 0.00 123 I 8.42 4.52 1.96 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 1.43 0.90 0.87 0.00 0.00 124 S 8.25 4.74 0.00 3.85 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 0.00 125 P 0.00 4.45 0.00 2.15 2.11 0.00 3.77 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.92 0.00 126 I 8.01 4.50 1.85 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 1.40 0.44 1.08 0.00 0.00 127 V 9.57 4.25 2.07 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 0.63 0.00 0.00 1.00 0.00 0.00 128 G 7.38 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 0.00 129 K 8.09 4.39 0.00 1.62 1.64 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.92 1.31 7.81 130 A 8.47 4.93 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 0.00 131 S 8.65 4.41 0.00 3.75 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 * Residues marked with a * may have inaccurate shift predictions.