NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 L 4.3171 8.0276 122.7404 55.3082 43.5360 175.7233 3 T 4.8490 8.4198 116.4137 59.8109 71.6334 172.0734 4 Y 4.7823 8.6248 123.0112 56.2967 43.0461 174.5188 5 Q 4.5112 8.1679 128.3837 55.0303 30.1312 175.3526 6 V 3.8172 8.3360 127.6771 63.2168 32.6254 175.4142 7 K 4.6684 9.2375 127.5815 54.9428 34.2887 176.4621 8 Q 4.1377 8.5192 121.5866 57.9654 28.8329 177.4852 9 G 4.0252 9.0011 111.8770 45.0537 0.0000 173.2910 10 D 4.5026 7.7345 119.8818 54.9320 41.4331 176.3051 11 T 4.7394 8.4179 112.8234 59.2647 72.9229 175.4474 12 L 4.0014 8.3064 120.3460 58.1913 41.5349 179.6129 13 N 4.4171 8.1560 116.1379 56.0989 38.6075 177.5623 14 S 4.1421 8.1436 115.8014 61.5404 63.3085 176.6319 15 I 3.7063 8.0480 123.6925 63.9437 36.9003 178.2149 16 A 4.0731 8.4563 121.7498 55.2257 17.8469 179.5875 17 A 4.0014 8.3924 119.4838 55.3621 18.5450 179.6002 18 D 4.3571 8.1674 117.3042 56.8797 40.5995 178.0413 19 F 4.6145 7.7970 114.6383 56.3924 39.3311 175.7824 20 R 3.8659 7.5364 118.4676 57.5409 27.8523 175.4402 21 I 4.6769 7.7055 108.6045 58.7606 41.0336 174.9678 22 S 4.5911 8.1960 115.6591 57.4272 64.5755 175.4397 23 T 3.9513 8.4078 110.4290 64.5634 68.9954 176.5704 24 A 3.9619 7.9193 124.6636 53.3614 19.2277 175.9868 25 A 4.9798 7.4383 116.8343 50.4412 21.0632 177.1774 26 L 4.3652 8.3426 121.7865 55.3033 41.9524 178.9897 27 L 3.8923 7.2807 119.4563 58.3903 42.2766 178.4165 28 Q 4.1139 7.7829 116.3281 58.8625 28.6927 178.4008 29 A 4.0976 8.2163 121.3574 54.5675 18.3585 178.6245 30 N 4.7200 7.6699 114.5308 54.9347 39.8040 174.7796 31 P 4.4502 0.0000 0.0000 62.1321 31.3072 177.1370 32 S 4.2087 8.4673 120.1036 60.6253 63.3887 175.8280 33 L 4.2384 7.8399 119.2193 57.0548 40.3829 177.1721 34 Q 4.6307 7.5473 119.1447 56.5616 29.0670 176.4001 35 A 4.3230 7.7534 118.5222 50.7580 18.2430 177.9308 36 G 3.6920 7.6535 108.6174 44.0999 0.0000 172.7234 37 L 4.6616 8.3918 126.6791 54.0230 42.4339 175.9386 38 T 4.5100 8.1442 110.8092 59.2018 71.0854 173.1468 39 A 4.1860 8.6087 129.2457 53.7178 18.7934 177.0863 40 G 4.0016 8.8369 111.8401 45.0940 0.0000 173.9541 41 Q 4.3299 7.7430 117.8428 55.8820 30.5687 174.6818 42 S 5.3639 8.4477 114.5071 56.6441 64.1152 172.9769 43 I 4.7405 8.5143 119.4265 59.2244 41.0432 174.4733 44 V 4.6530 8.2482 116.0450 60.1313 33.4575 175.4858 45 I 4.1972 8.1000 126.0988 58.9847 37.7522 174.3730 46 P 4.2767 0.0000 0.0000 63.6920 31.9459 176.6676 47 G 3.9966 10.0333 107.7134 45.4362 0.0000 173.1859 48 L 4.6495 7.2034 117.5773 52.3616 45.6300 174.0519 49 P 4.5426 0.0000 0.0000 61.3353 32.7775 175.2602 50 D 4.3518 8.4870 118.4236 53.7028 41.5457 175.2380 51 P 4.3337 0.0000 0.0000 65.8126 31.4976 177.7498 52 Y 4.2275 8.1688 119.5309 60.0554 38.7498 176.6949 53 T 3.9191 7.8542 108.7405 62.9753 69.1220 174.5434 54 I 4.1251 7.3836 124.7546 59.7789 37.6349 174.1457 55 P 4.3455 0.0000 0.0000 63.6911 32.2528 175.4097 56 Y 5.1574 7.2031 118.2067 57.7796 39.6888 174.7069 57 H 5.0097 9.2012 121.4463 55.0576 33.7713 171.9082 58 I 4.9243 8.9684 126.6876 59.7596 39.4592 174.5139 59 A 5.0860 8.8459 127.7456 50.0520 22.1353 174.7996 60 V 4.7097 9.1575 122.8690 61.0247 34.6767 174.1078 61 S 5.0191 8.8330 123.0960 56.7689 63.8607 174.7563 62 I 3.7014 8.8177 129.3757 64.5658 37.2635 178.8209 63 G 3.5236 8.0957 107.3201 48.7568 0.0000 174.5548 64 A 4.0777 7.6005 120.9880 51.9252 18.9530 177.1895 65 K 3.8860 7.7843 115.0164 57.7698 30.4612 174.5906 66 T 5.1643 7.7177 106.3283 59.7558 72.7540 173.0995 67 L 5.0748 8.9024 125.3482 53.8172 44.8808 175.0140 68 T 4.9552 8.9764 123.6035 61.8796 70.9691 173.2658 69 L 5.1509 8.6512 127.9344 53.4719 43.9795 175.6672 70 S 5.1359 9.1400 121.7045 56.6158 67.0683 172.6906 71 L 4.6848 8.7659 124.2733 53.8604 44.8101 176.4041 72 N 4.2595 9.5453 125.1046 54.7005 36.7283 173.8017 73 N 4.3061 8.2683 107.6443 54.4220 36.6418 174.5827 74 R 4.5877 7.7106 116.5406 54.0300 32.5722 176.4318 75 V 4.3408 8.0373 121.3468 61.9949 32.5464 174.6175 *77 K 3.9373 8.1817 122.5590 56.4133 33.4192 174.1962 78 T 4.8428 7.9954 122.1057 61.8863 71.4521 172.8616 79 Y 5.0479 8.8027 123.3992 55.3649 41.9401 173.2789 80 P 5.1051 0.0000 0.0000 62.7354 32.8596 175.3320 81 I 4.9286 8.4684 114.2364 59.2283 41.7136 174.1159 82 A 4.8510 8.5564 124.9178 51.5624 20.7968 176.7156 83 V 4.8696 8.5546 112.4876 59.1244 36.6675 175.2399 84 G 4.3285 8.6132 108.6790 45.7741 0.0000 174.0466 85 K 4.5406 8.8811 122.5559 56.0000 32.9891 178.3388 86 I 3.7884 8.4309 114.5215 63.4572 37.6481 176.9618 87 L 4.4605 7.8426 118.8872 55.4077 42.8831 176.5136 88 T 4.7528 7.5505 108.4495 60.0930 67.7855 173.3321 89 Q 4.7153 8.0039 124.1978 56.0939 30.8665 176.6550 90 T 4.4961 8.5971 118.6142 62.1991 68.8727 173.1759 91 P 4.3652 0.0000 0.0000 62.8229 32.1460 175.7414 92 T 4.6870 8.6999 109.8176 60.6273 71.3197 173.7681 93 G 3.5654 7.7805 107.5295 44.4082 0.0000 171.6153 94 E 4.5351 8.0568 120.5067 54.9675 30.9567 175.6008 95 F 4.7821 8.8006 122.5811 55.7741 43.7544 173.2194 96 Y 5.3436 8.6931 115.3655 56.5255 42.7125 175.1927 97 I 4.3034 8.7120 123.4659 61.8960 37.6839 176.6113 98 I 4.2236 8.9143 129.0992 63.1975 38.4012 175.2299 99 N 4.9875 7.8811 116.8669 52.9505 40.2469 172.8952 100 R 5.3291 8.3649 113.5866 55.8073 32.4537 174.5373 101 Q 4.5526 9.4603 119.0395 54.2437 32.8614 174.6168 102 R 2.5100 8.6537 125.1266 56.0655 30.8289 175.7435 103 N 4.2180 8.0986 124.1809 53.9448 37.7882 172.6185 104 P 4.1483 0.0000 0.0000 63.9742 32.1412 177.9199 105 G 3.8324 8.3921 107.0161 45.0766 0.0000 173.4140 106 G 3.7551 8.3294 105.8124 45.6987 0.0000 173.8296 107 P 4.7871 0.0000 0.0000 63.7112 31.4958 177.8054 108 F 4.7280 7.4873 117.1850 57.0088 40.8494 177.9564 109 G 3.7374 7.5872 109.5750 46.9243 0.0000 176.8956 110 A 4.2468 9.4318 124.7072 54.4228 19.6816 176.6487 111 Y 4.9191 7.8744 111.2469 56.6233 42.8586 173.5380 112 W 4.9905 9.4549 133.0788 55.5467 33.7625 174.0542 113 L 5.0402 8.1745 127.4032 52.7348 43.7799 176.1350 114 S 4.5311 9.0688 121.7107 58.6839 64.2091 174.3565 115 L 5.3096 8.9023 124.3503 52.0999 44.1972 176.3910 116 S 5.1957 8.8177 112.5759 58.4279 63.3682 173.8793 117 A 4.7804 8.0394 122.2937 50.7566 21.5083 176.4269 118 A 4.1902 8.5860 126.0011 54.2895 18.6922 177.5805 119 H 4.2674 9.1875 121.4117 56.1488 29.2809 173.7429 120 Y 4.7191 8.0867 116.3447 57.5969 40.3487 174.9227 121 G 3.6413 8.1004 107.9435 45.5993 0.0000 171.2079 122 I 4.7862 7.9348 120.9232 59.6097 39.7258 175.2805 123 H 5.1989 8.6912 121.2152 54.2137 32.5734 173.1669 124 G 4.3055 8.4886 107.2635 47.4414 0.0000 172.9305 125 T 4.7723 8.7777 112.0251 62.4921 70.2477 173.6758 126 N 4.7876 8.5085 123.5805 52.7162 38.4223 174.0722 127 N 5.0279 8.1003 118.2914 51.0160 38.8903 172.7235 128 P 4.2470 0.0000 0.0000 65.1226 32.2360 178.9184 129 A 4.0636 8.0429 120.3437 54.9430 18.5823 178.6843 130 S 4.2166 8.1558 110.6572 61.0141 63.1273 174.8123 131 I 3.8338 7.2686 122.2811 62.4759 37.0905 176.3197 132 G 3.9740 8.8530 113.1363 44.9905 0.0000 172.8701 133 K 4.6438 7.7123 117.8076 54.2660 36.2119 175.6141 134 A 4.8656 8.4548 124.8122 51.1185 16.6601 177.2616 135 V 4.5131 7.9340 109.6660 60.1462 34.5581 175.6111 136 S 4.6926 8.3433 116.6336 56.8267 65.0302 175.4158 137 K 4.1379 8.6457 118.6227 57.6778 32.0178 177.4265 138 G 4.0364 7.7111 116.0937 46.2127 0.0000 173.3442 139 C 4.4181 7.5804 117.8361 59.6878 29.5410 173.1798 140 I 4.2940 7.9844 121.8138 60.8537 38.3301 176.3004 141 R 5.2709 8.0784 126.2139 54.0858 33.3864 174.9791 *143 H 4.8231 8.4012 115.0641 55.8716 30.1201 174.4464 144 N 4.3703 8.8574 120.5812 56.4868 38.5386 177.8344 145 K 3.9981 8.0769 119.6015 60.1464 32.5284 178.8027 146 D 4.2106 7.9693 119.7751 56.9369 40.8027 178.9231 147 V 3.4840 7.7189 119.7546 64.5573 31.4323 178.3823 148 I 3.7393 7.8760 120.5389 64.2290 36.9291 177.9775 149 E 3.8619 7.9308 119.3928 59.0693 29.5191 178.2691 150 L 3.9009 8.0026 120.5892 58.3432 41.8561 178.8994 151 A 3.7208 7.7397 119.5233 54.9631 18.2389 179.5059 152 S 4.1013 7.8175 111.6478 60.7161 62.9520 176.0087 153 I 3.9920 6.7975 120.7230 61.8735 38.2657 176.2411 154 V 3.8121 6.7973 112.0525 59.2535 32.6529 174.4668 155 P 4.6727 0.0000 0.0000 61.2566 32.7836 175.0087 156 N 4.3963 8.4132 116.5395 55.0932 38.7552 175.7908 157 G 4.1272 9.3830 111.2644 45.2661 0.0000 174.0744 158 T 4.1788 7.7957 118.0757 63.3089 69.6081 174.0132 159 R 4.4272 9.0046 126.9085 56.7170 31.6477 175.2240 160 V 4.7116 8.8048 125.8494 61.6433 34.3986 173.9777 161 T 4.9089 9.0694 126.2978 62.2421 70.4801 173.9834 162 I 4.9195 8.8475 127.7301 59.6984 39.6934 174.6420 163 N 5.3418 9.0538 124.3230 50.8720 42.4648 175.3401 164 R 4.0797 8.4578 118.3173 56.7616 30.1724 176.9064 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 2 L 8.03 4.32 0.00 1.86 1.45 0.41 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 3 T 8.42 4.85 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 1.19 0.00 0.00 4 Y 8.62 4.78 0.00 2.86 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 5 Q 8.17 4.51 0.00 1.95 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.70 0.00 0.00 0.00 0.00 0.00 2.16 2.23 0.00 6 V 8.34 3.82 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 0.93 0.00 0.00 1.01 0.00 0.00 7 K 9.24 4.67 0.00 1.96 1.71 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.80 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.33 1.45 7.81 8 Q 8.52 4.14 0.00 2.05 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.56 0.00 0.00 0.00 0.00 0.00 2.36 2.31 0.00 9 G 9.00 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 10 D 7.73 4.50 0.00 2.92 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 T 8.42 4.74 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 1.24 0.00 0.00 12 L 8.31 4.00 0.00 1.73 1.78 0.94 0.63 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 13 N 8.16 4.42 0.00 2.76 2.89 0.00 0.00 6.85 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 14 S 8.14 4.14 0.00 4.12 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 15 I 8.05 3.71 1.92 0.00 0.00 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 1.57 1.35 0.82 0.00 0.00 16 A 8.46 4.07 1.49 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 0.00 0.00 17 A 8.39 4.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.17 4.36 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 19 F 7.80 4.61 0.00 3.06 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 20 R 7.54 3.87 0.00 2.01 2.03 0.00 3.30 0.00 0.00 3.55 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.78 0.00 21 I 7.71 4.68 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 1.46 0.72 1.01 0.00 0.00 22 S 8.20 4.59 0.00 4.03 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 23 T 8.41 3.95 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 1.26 0.00 0.00 24 A 7.92 3.96 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 25 A 7.44 4.98 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 26 L 8.34 4.37 0.00 1.73 1.69 0.92 0.55 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 27 L 7.28 3.89 0.00 1.80 1.88 0.86 0.75 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 28 Q 7.78 4.11 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.77 0.00 0.00 0.00 0.00 0.00 2.40 2.38 0.00 29 A 8.22 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 30 N 7.67 4.72 0.00 2.71 2.82 0.00 0.00 7.24 8.64 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 31 P 0.00 4.45 0.00 2.19 2.01 0.00 4.02 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.19 0.00 32 S 8.47 4.21 0.00 3.86 3.92 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 33 L 7.84 4.24 0.00 1.82 1.91 0.95 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 7.55 4.63 0.00 2.09 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.53 0.00 0.00 0.00 0.00 0.00 2.44 2.49 0.00 35 A 7.75 4.32 1.26 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 36 G 7.65 3.69 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 0.00 0.00 0.00 37 L 8.39 4.66 0.00 1.95 1.72 0.97 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 38 T 8.14 4.51 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 1.22 0.00 0.00 39 A 8.61 4.19 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 40 G 8.84 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.74 4.33 0.00 2.10 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.74 0.00 0.00 0.00 0.00 0.00 2.34 2.30 0.00 42 S 8.45 5.36 0.00 3.86 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 43 I 8.51 4.74 1.88 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.71 0.95 0.00 0.00 44 V 8.25 4.65 2.02 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 0.69 0.00 0.00 0.92 0.00 0.00 45 I 8.10 4.20 1.49 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 -0.36 0.52 0.00 0.00 46 P 0.00 4.28 0.00 2.16 2.02 0.00 3.68 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 1.96 1.97 0.00 47 G 10.03 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.20 4.65 0.00 1.54 1.49 1.02 1.16 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 49 P 0.00 4.54 0.00 2.18 2.07 0.00 3.79 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 2.00 1.97 0.00 50 D 8.49 4.35 0.00 2.79 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 51 P 0.00 4.33 0.00 2.50 2.62 0.00 3.74 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 2.20 2.02 0.00 52 Y 8.17 4.23 0.00 2.98 3.26 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 53 T 7.85 3.92 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 1.23 0.00 0.00 54 I 7.38 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.84 0.91 0.00 0.00 63 G 8.10 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.60 4.08 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 65 K 7.78 3.89 0.00 1.95 2.08 0.00 1.62 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.56 1.50 7.81 66 T 7.72 5.16 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 1.30 0.00 0.00 67 L 8.90 5.07 0.00 1.74 1.65 0.89 0.98 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 68 T 8.98 4.96 4.22 0.00 0.00 0.00 0.00 0.00 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 69 L 8.65 5.15 0.00 1.67 1.57 0.92 1.12 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 70 S 9.14 5.14 0.00 3.94 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 130 S 8.16 4.22 0.00 4.01 4.33 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 0.00 131 I 7.27 3.83 1.78 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.43 0.80 0.00 0.00 132 G 8.85 3.97 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 0.00 0.00 0.00 133 K 7.71 4.64 0.00 1.79 1.66 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.33 1.34 7.81 134 A 8.45 4.87 1.28 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 0.00 135 V 7.93 4.51 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 0.77 0.00 0.00 1.00 0.00 0.00 136 S 8.34 4.69 0.00 3.91 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 K 8.65 4.14 0.00 1.76 1.85 0.00 1.78 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.43 1.43 7.81 138 G 7.71 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 0.00 139 C 7.58 4.42 0.00 2.99 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 0.00 140 I 7.98 4.29 1.74 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 1.17 0.69 0.83 0.00 0.00 141 R 8.08 5.27 0.00 1.72 1.78 0.00 3.13 0.00 0.00 3.25 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.35 0.00 *143 H 8.40 4.82 0.00 3.44 3.26 0.00 5.82 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 N 8.86 4.37 0.00 2.76 2.91 0.00 0.00 6.79 7.59 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 0.00 145 K 8.08 4.00 0.00 2.00 2.09 0.00 1.51 0.00 0.00 1.81 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.56 7.81 146 D 7.97 4.21 0.00 2.70 2.02 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 0.00 147 V 7.72 3.48 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 1.11 0.00 0.00 0.90 0.00 0.00 148 I 7.88 3.74 2.06 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 1.61 1.07 0.97 0.00 0.00 149 E 7.93 3.86 0.00 2.16 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 0.00 2.38 2.34 0.00 150 L 8.00 3.90 0.00 1.51 1.57 0.91 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 151 A 7.74 3.72 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 S 7.82 4.10 0.00 4.02 4.12 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 0.00 153 I 6.80 3.99 1.62 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.62 0.36 0.00 0.00 154 V 6.80 3.81 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 0.36 0.00 0.00 0.88 0.00 0.00 155 P 0.00 4.67 0.00 2.26 2.23 0.00 3.82 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.11 0.00 156 N 8.41 4.40 0.00 2.78 2.97 0.00 0.00 7.20 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 0.00 157 G 9.38 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 0.00 158 T 7.80 4.18 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 1.37 0.00 0.00 159 R 9.00 4.43 0.00 2.05 1.90 0.00 2.95 0.00 0.00 3.38 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.48 0.00 160 V 8.80 4.71 2.14 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 1.02 0.00 0.00 1.00 0.00 0.00 161 T 9.07 4.91 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 1.33 0.00 0.00 162 I 8.85 4.92 2.04 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.82 0.96 0.00 0.00 163 N 9.05 5.34 0.00 2.58 2.68 0.00 0.00 6.59 7.20 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 0.00 164 R 8.46 4.08 0.00 1.80 1.85 0.00 3.24 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 * Residues marked with a * may have inaccurate shift predictions.