NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.4590 0.0000 0.0000 62.8123 32.7933 175.0610 3 S 4.6113 8.1920 116.0987 56.4730 65.0221 170.8117 4 Y 5.3947 9.2655 123.2617 56.5122 41.4674 174.5731 5 R 4.9812 8.9887 120.9542 54.6584 35.4104 174.2357 6 V 4.9241 8.3268 119.4355 59.9393 34.4238 174.9616 7 K 4.4809 8.7824 122.8101 54.5090 35.7333 175.3594 8 R 5.0254 8.5266 125.1412 54.3558 30.5696 175.0278 *10 D 4.3847 8.4164 125.9744 53.6993 42.2552 175.9020 11 I 2.9613 8.5329 126.7789 63.7082 38.0534 177.2169 12 A 4.1933 8.3726 122.0200 54.0223 18.1879 177.9981 13 K 4.5268 7.8759 115.0991 55.8033 32.5093 176.3714 14 N 4.8283 7.7122 115.7133 52.8730 37.4893 173.9647 15 D 4.9378 8.7893 117.4496 54.2412 41.6152 175.4941 16 E 4.7968 8.6579 116.9204 54.0044 32.0310 175.8770 17 E 4.5014 8.7021 118.6602 58.3795 30.0439 176.4697 18 C 3.7665 7.4493 112.3380 56.8408 33.6858 173.0758 19 V 4.7692 7.7435 117.8534 59.8307 34.5082 174.5347 20 V 4.5098 8.5866 123.4639 61.4197 32.8639 174.5808 21 N 4.6884 8.8628 127.3430 52.8800 40.5003 174.2035 22 A 4.2221 8.7017 127.8629 51.3302 17.7287 176.5057 23 A 4.7221 8.9871 124.0485 51.0407 21.6635 175.5215 24 N 5.3270 8.4011 115.6791 50.4586 40.1865 174.4011 25 P 5.1328 0.0000 0.0000 64.8680 31.7086 177.8041 26 R 4.3186 8.1872 116.5374 55.6388 30.3437 176.8450 27 G 3.9591 8.1474 105.9829 46.1396 0.0000 174.0018 28 L 4.2399 8.0186 118.5185 53.0750 42.4359 175.3708 29 P 4.0384 0.0000 0.0000 62.6368 31.8827 176.3303 30 G 4.0603 7.8943 109.1953 44.5414 0.0000 170.4992 31 D 4.6719 8.5373 119.4686 54.3231 44.1005 178.1301 32 G 3.6291 8.5078 108.6044 46.9774 0.0000 176.0344 33 V 3.6242 8.4433 117.8350 66.3157 31.4688 177.6626 34 C 4.7298 8.1083 119.1739 61.6718 31.3433 175.3227 35 K 3.9438 8.0387 120.8132 59.5439 31.8510 178.6768 36 A 3.9805 7.9849 120.5179 55.1140 18.3972 179.5988 37 V 4.0096 8.3617 117.1635 66.4709 31.4640 177.6692 38 Y 4.0062 8.2662 118.5019 60.4604 38.6449 177.5419 39 K 3.8636 7.8335 119.6641 59.0975 32.3591 178.3624 40 K 3.6547 7.5999 118.6271 57.5818 33.6477 177.1652 41 W 5.0489 8.3483 117.4808 54.5176 29.5282 174.7293 42 P 4.2025 0.0000 0.0000 66.0228 30.9781 178.2536 43 E 4.1665 8.3815 117.9779 58.9569 29.1769 178.4649 44 S 4.4962 8.3247 112.2387 59.6730 63.2563 175.0972 45 F 4.7228 8.1591 122.1062 55.5154 39.1211 175.2672 46 K 3.9791 7.6977 121.1915 57.2785 31.8637 176.3073 47 N 4.2097 8.7262 126.5342 54.3781 36.0663 175.3113 48 S 4.2101 7.8552 110.3451 58.8031 64.1525 173.7247 49 A 4.2633 7.6808 123.6128 53.1502 18.7397 176.7050 50 T 4.5327 8.2482 114.5701 60.3633 71.4156 171.3492 51 P 4.7824 0.0000 0.0000 61.7244 33.0296 176.0044 52 V 3.5183 8.3373 121.0084 64.8985 31.6860 176.2970 53 G 3.8900 9.2780 113.8434 46.4902 0.0000 172.4953 54 T 4.8501 7.6054 109.0743 59.4931 72.7423 172.3799 55 A 5.2429 8.3718 121.8508 50.0913 22.4433 175.4822 56 K 4.4842 9.1295 121.8382 55.0306 35.7206 175.0653 57 T 4.7141 8.5578 124.1798 62.7740 69.5989 174.2629 58 V 4.3230 8.2671 127.9991 61.8871 35.6585 174.4527 *60 C 4.5622 8.7212 119.4932 59.9332 32.8153 176.0149 61 G 3.9498 8.5713 120.1014 47.2542 0.0000 173.2335 62 T 4.3503 8.9912 112.7444 60.9824 69.1065 173.1445 63 Y 4.2506 8.0435 124.5610 55.9711 39.1763 173.1150 64 P 4.2356 0.0000 0.0000 62.2389 32.9388 175.4478 65 V 4.1247 8.3792 124.5855 61.1187 33.8048 174.5748 66 I 4.2994 8.6878 130.5962 60.1469 38.1086 175.0276 67 H 4.6082 9.1022 126.4531 55.2710 29.6360 174.4892 68 A 4.9419 8.8278 126.6794 50.0813 21.3503 175.3663 69 V 4.5997 8.5332 124.0255 61.1336 32.5340 175.8881 70 G 4.1469 8.8134 116.5641 43.4713 0.0000 170.2574 71 P 3.9488 0.0000 0.0000 61.9669 32.0010 175.9194 72 N 4.2378 8.0578 119.2238 52.6500 38.3501 175.7025 73 F 4.3455 8.9863 125.9143 59.5016 39.2141 177.2171 74 S 4.3530 8.7158 117.4107 61.0248 62.8363 175.0504 75 N 4.5151 8.1531 116.6962 54.4228 39.1521 175.0546 76 Y 4.4245 7.5633 114.3693 56.1176 39.7386 176.0694 77 S 4.4785 8.3957 117.8902 58.1687 65.2040 175.2248 78 E 4.2211 8.8566 122.1114 59.8287 29.0877 179.5862 79 S 4.1361 8.1027 112.3452 61.7181 62.6544 175.9934 80 E 4.1570 8.5497 121.3941 59.2133 29.1591 179.6229 81 G 3.0549 8.6084 106.3660 47.5249 0.0000 175.1303 82 D 4.5367 8.5045 120.6005 57.2266 41.2360 178.4531 83 R 3.8691 7.7974 119.0302 59.5818 29.7833 178.4258 84 E 3.8572 8.0866 118.3765 58.9431 29.4248 179.1397 85 L 3.8696 8.0175 120.4155 58.0088 42.2588 178.6111 86 A 3.9650 7.7932 120.5156 55.3221 18.1952 179.4884 87 A 3.9248 8.0154 118.7693 55.1392 18.4411 179.5921 88 A 3.8526 8.1804 119.5652 55.7092 18.4398 179.5387 89 Y 4.1188 7.8203 114.8234 61.2964 37.9181 179.0171 90 R 4.0169 8.2705 119.0723 59.3440 30.1427 179.0009 91 E 4.0072 8.5320 118.6667 59.0438 29.3733 179.4089 92 V 3.5242 7.9995 118.2651 66.0594 31.5696 177.8363 93 A 4.0525 8.1930 120.3871 55.2256 18.1404 179.7326 94 K 3.9098 8.0515 116.8115 59.6357 32.0414 179.4884 95 E 3.9096 8.1965 118.8187 59.3433 28.9928 179.3058 96 V 3.5251 8.1286 118.7051 66.4716 31.4118 178.2765 97 T 3.7226 8.0933 115.2499 66.6892 68.1242 176.5986 98 R 3.8878 8.0728 119.6411 59.6109 30.1060 178.2298 99 L 4.1610 8.1199 117.9371 55.3255 41.6025 177.9931 100 G 3.8802 7.5599 105.4440 46.1658 0.0000 174.2655 101 V 3.9270 7.0124 111.8746 61.2125 32.1189 176.2375 102 N 4.7988 9.4684 119.9829 55.0686 38.3574 174.9561 103 S 5.2505 7.7757 112.0632 57.4875 66.8811 173.6291 104 V 4.7989 8.5946 119.2552 60.6161 35.0099 172.7421 105 A 5.2909 9.0899 127.3039 50.7676 20.7473 175.7609 106 I 5.0039 9.0293 122.6596 58.8675 41.8906 173.0357 107 P 5.3906 0.0000 0.0000 61.4668 34.3135 174.9769 108 L 4.5975 8.4347 119.4651 53.1850 40.8324 176.4713 109 L 4.1125 8.5185 124.3413 56.1276 41.9184 177.8551 110 S 4.1628 8.9448 116.4647 59.8905 60.1673 172.4861 111 T 4.9039 7.8295 107.3374 61.4591 71.0615 174.6365 112 G 3.9478 7.9433 109.8709 45.9525 0.0000 176.8902 113 V 3.7688 9.0686 119.2500 63.8836 32.0698 176.1469 114 Y 5.0939 8.0161 116.5652 58.0670 38.0721 176.9528 115 S 4.6141 7.9343 115.7188 58.3045 63.4847 175.1590 116 G 4.1936 9.2702 108.5586 46.6496 0.0000 174.1454 117 G 3.9113 8.2015 104.6573 45.2496 0.0000 173.9013 118 K 4.4939 7.5079 119.2052 53.6918 34.1837 175.4244 119 D 4.6388 8.7312 124.6639 55.0317 41.1034 175.6389 120 R 4.5274 8.6760 124.8527 55.7059 31.3232 177.3465 121 L 3.4602 7.9220 121.5908 58.7927 41.5446 179.3536 122 T 3.6602 7.4543 114.5058 66.4573 68.5416 176.1564 123 Q 3.8435 7.8898 120.8811 59.3936 29.0898 178.3474 124 S 4.2584 8.3007 114.2817 61.2741 62.3815 175.7929 125 L 3.4666 7.9038 123.1484 58.0090 41.8981 178.6247 126 N 4.2920 8.1164 116.5744 56.7556 38.4617 177.1485 127 H 4.2341 7.8911 117.3740 58.4258 28.5077 177.5847 128 L 2.8094 6.8284 121.3344 57.7128 41.8829 178.7012 129 F 4.5374 7.4272 116.2976 61.0600 38.9518 177.4085 130 T 4.1110 7.6003 113.1018 66.6175 68.5932 176.3937 131 A 4.1956 7.8139 118.7470 53.3817 17.8118 178.6024 *133 D 4.7138 8.0042 120.1884 55.1693 42.7684 176.8320 134 S 4.3172 7.9760 112.0411 59.4701 63.4795 174.1774 135 T 4.4655 7.5989 111.4631 60.5868 70.4514 173.7065 136 D 4.8237 8.3490 117.3661 52.8908 40.0566 175.7182 137 A 4.4720 7.4368 120.8903 51.9684 20.4476 177.3437 138 D 4.3567 8.8983 120.9128 54.1914 42.2402 175.6246 139 V 4.6419 8.9434 124.9117 61.1887 33.8035 174.4959 140 V 4.6859 8.7988 128.0230 61.2470 34.0294 174.1449 141 I 4.9650 8.9472 130.0870 60.8126 38.8562 174.4385 142 Y 5.1905 9.2046 125.0668 56.5117 40.4013 174.6851 143 C 5.4180 9.0639 117.4265 57.1408 33.7413 174.3663 144 R 4.5900 8.7543 114.8195 55.2412 31.9444 175.7328 145 D 4.8459 7.7144 117.8745 52.0468 43.6024 176.3074 146 K 3.9694 8.5877 127.3939 59.9315 32.3934 178.8661 147 E 4.0924 8.3742 118.2676 59.1214 29.3657 179.2115 148 W 4.1315 9.1961 119.6588 59.5187 29.0809 177.9852 149 E 3.9786 8.5287 119.4610 59.2645 29.0590 178.9578 150 K 4.0361 7.7871 120.7748 58.8830 32.2832 178.8955 151 K 4.0400 7.9657 118.6895 59.6715 31.9051 179.3844 152 I 3.6788 8.0100 120.2226 64.4361 36.4584 178.6747 153 S 4.1419 8.1485 116.0021 61.6007 62.4350 176.5330 154 E 3.9589 8.4268 120.2371 59.5069 29.3189 179.0478 155 A 4.1318 7.9610 119.4629 55.0592 18.4758 179.4397 156 I 3.7280 7.8666 117.7612 64.3689 37.4543 180.4810 157 Q 4.1834 7.8819 119.0257 55.3114 28.5427 176.6997 *159 R 3.9747 8.0690 121.7223 56.4266 29.8046 174.9736 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 P 0.00 4.46 0.00 1.69 2.09 0.00 3.31 0.00 0.00 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.92 0.00 3 S 8.19 4.61 0.00 3.94 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 4 Y 9.27 5.39 0.00 2.91 2.93 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 5 R 8.99 4.98 0.00 1.75 1.75 0.00 3.07 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 6 V 8.33 4.92 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 0.83 0.00 0.00 0.97 0.00 0.00 7 K 8.78 4.48 0.00 0.84 1.52 0.00 1.61 0.00 0.00 1.53 0.00 0.00 2.82 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.09 1.11 7.81 8 R 8.53 5.03 0.00 1.95 1.90 0.00 3.12 0.00 0.00 2.57 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.50 0.00 *10 D 8.42 4.38 0.00 2.76 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.53 2.96 1.90 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 1.21 0.60 0.99 0.00 0.00 12 A 8.37 4.19 1.21 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 0.00 0.00 13 K 7.88 4.53 0.00 1.86 1.81 0.00 1.70 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.31 1.27 7.81 14 N 7.71 4.83 0.00 2.89 2.38 0.00 0.00 6.73 7.67 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 15 D 8.79 4.94 0.00 2.73 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 16 E 8.66 4.80 0.00 2.17 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 0.00 2.54 2.38 0.00 17 E 8.70 4.50 0.00 1.98 1.95 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 2.37 2.28 0.00 18 C 7.45 3.77 0.00 2.65 2.59 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 19 V 7.74 4.77 1.87 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 -0.02 0.00 0.00 0.89 0.00 0.00 20 V 8.59 4.51 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 0.70 0.00 0.00 0.91 0.00 0.00 21 N 8.86 4.69 0.00 2.79 2.50 0.00 0.00 6.65 9.28 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 22 A 8.70 4.22 1.22 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 0.00 0.00 0.00 23 A 8.99 4.72 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 24 N 8.40 5.33 0.00 3.01 2.97 0.00 0.00 5.68 7.76 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 25 P 0.00 5.13 0.00 2.27 2.40 0.00 4.03 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.01 0.00 26 R 8.19 4.32 0.00 1.87 2.02 0.00 3.26 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 27 G 8.15 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 28 L 8.02 4.24 0.00 1.75 1.56 0.93 1.06 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 29 P 0.00 4.04 0.00 1.47 0.70 0.00 3.36 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.78 0.00 30 G 7.89 4.06 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 0.00 0.00 0.00 31 D 8.54 4.67 0.00 2.65 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 32 G 8.51 3.63 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 0.00 0.00 0.00 33 V 8.44 3.62 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 1.23 0.00 0.00 0.99 0.00 0.00 34 C 8.11 4.73 0.00 3.27 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 35 K 8.04 3.94 0.00 2.08 2.00 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.47 7.81 36 A 7.98 3.98 1.40 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 0.00 0.00 37 V 8.36 4.01 2.48 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 1.28 0.00 0.00 1.25 0.00 0.00 38 Y 8.27 4.01 0.00 2.51 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 39 K 7.83 3.86 0.00 1.88 1.90 0.00 1.77 0.00 0.00 1.53 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.31 1.35 7.81 40 K 7.60 3.65 0.00 1.08 0.74 0.00 1.06 0.00 0.00 1.10 0.00 0.00 2.69 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.30 0.21 7.81 41 W 8.35 5.05 0.00 3.54 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 P 0.00 4.20 0.00 2.03 1.69 0.00 3.73 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 1.98 1.84 0.00 43 E 8.38 4.17 0.00 2.18 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 0.00 2.45 2.48 0.00 44 S 8.32 4.50 0.00 4.03 4.09 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 45 F 8.16 4.72 0.00 3.43 3.30 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 46 K 7.70 3.98 0.00 1.83 1.80 0.00 1.99 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.49 1.46 7.81 47 N 8.73 4.21 0.00 2.87 2.84 0.00 0.00 7.19 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 48 S 7.86 4.21 0.00 3.31 3.91 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 49 A 7.68 4.26 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 50 T 8.25 4.53 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 1.20 0.00 0.00 51 P 0.00 4.78 0.00 2.11 1.96 0.00 3.66 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 2.11 2.08 0.00 52 V 8.34 3.52 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 0.56 0.00 0.00 1.00 0.00 0.00 53 G 9.28 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 0.00 0.00 0.00 54 T 7.61 4.85 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 1.20 0.00 0.00 55 A 8.37 5.24 1.15 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 56 K 9.13 4.48 0.00 1.73 1.57 0.00 1.60 0.00 0.00 1.69 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.29 1.37 7.81 57 T 8.56 4.71 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 1.10 0.00 0.00 58 V 8.27 4.32 2.21 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 0.97 0.00 0.00 0.91 0.00 0.00 *60 C 8.72 4.56 0.00 3.21 3.08 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 61 G 8.57 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 62 T 8.99 4.35 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 1.24 0.00 0.00 63 Y 8.04 4.25 0.00 2.95 3.04 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 64 P 0.00 4.24 0.00 1.77 1.75 0.00 2.92 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.89 0.00 65 V 8.38 4.12 1.95 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 0.62 0.00 0.00 0.53 0.00 0.00 66 I 8.69 4.30 1.75 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 1.10 0.39 0.84 0.00 0.00 67 H 9.10 4.61 0.00 3.05 3.15 0.00 5.58 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 135 T 7.60 4.47 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 1.23 0.00 0.00 136 D 8.35 4.82 0.00 2.71 2.71 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 0.00 0.00 0.00 0.00 137 A 7.44 4.47 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 0.00 138 D 8.90 4.36 0.00 2.59 2.59 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 0.00 139 V 8.94 4.64 1.87 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 1.12 0.00 0.00 0.77 0.00 0.00 140 V 8.80 4.69 2.41 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 0.70 0.00 0.00 1.05 0.00 0.00 141 I 8.95 4.96 1.91 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 1.31 0.65 0.98 0.00 0.00 142 Y 9.20 5.19 0.00 2.96 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 0.00 143 C 9.06 5.42 0.00 3.11 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 0.00 144 R 8.75 4.59 0.00 1.74 1.94 0.00 3.36 0.00 0.00 3.20 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.52 0.00 145 D 7.71 4.85 0.00 2.52 2.29 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 0.00 146 K 8.59 3.97 0.00 1.89 1.83 0.00 1.79 0.00 0.00 1.83 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.54 1.57 7.81 147 E 8.37 4.09 0.00 2.36 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 0.00 2.47 2.42 0.00 148 W 9.20 4.13 0.00 3.47 3.32 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 0.00 149 E 8.53 3.98 0.00 2.11 2.21 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 2.34 2.35 0.00 150 K 7.79 4.04 0.00 1.87 1.93 0.00 1.75 0.00 0.00 1.76 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.35 7.81 151 K 7.97 4.04 0.00 1.86 1.67 0.00 1.44 0.00 0.00 1.49 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.63 7.81 152 I 8.01 3.68 1.89 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.63 0.92 0.00 0.00 153 S 8.15 4.14 0.00 3.89 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 0.00 154 E 8.43 3.96 0.00 2.06 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 2.34 2.55 0.00 155 A 7.96 4.13 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 0.00 156 I 7.87 3.73 2.06 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 1.71 0.89 1.02 0.00 0.00 157 Q 7.88 4.18 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.55 0.00 0.00 0.00 0.00 0.00 2.68 2.51 0.00 *159 R 8.07 3.97 0.00 1.69 1.68 0.00 2.21 0.00 0.00 2.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.21 0.00 * Residues marked with a * may have inaccurate shift predictions.