NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.7501 0.0000 0.0000 62.4437 33.7630 174.7019 2 K 4.7174 8.9151 121.6620 54.3066 34.4202 170.5719 3 V 4.8140 9.6964 125.1791 61.2756 34.8706 173.5211 4 N 5.0629 9.4610 126.2427 52.0646 40.2898 174.0155 5 L 4.8484 8.1822 123.8092 53.2002 43.6938 175.5752 6 Y 4.6505 8.2472 119.9475 55.2687 42.1040 178.5855 7 A 3.6563 9.1318 124.6248 52.9949 18.8023 179.0970 8 T 3.8454 8.7562 114.5484 69.6806 67.9512 175.3648 9 F 4.5156 7.5031 118.8044 60.3758 38.7920 177.8987 10 R 4.0627 7.9498 119.8626 58.9758 29.7290 178.3037 11 D 4.3153 7.9252 116.9043 57.1186 40.9535 178.1009 12 L 4.1001 7.6341 119.9283 58.5509 42.3134 179.0209 13 T 3.8374 7.4407 108.0089 62.4331 68.7649 175.6069 14 G 3.9162 8.0421 108.4061 45.3766 0.0000 173.0883 15 K 4.6125 7.8892 118.9528 54.5030 35.0008 177.1226 16 S 4.2933 8.4454 117.8745 60.3586 64.3720 173.7702 17 Q 4.9660 7.6827 118.3790 54.6793 32.0701 173.7577 18 L 4.8911 9.0281 124.2063 52.9396 46.4889 175.0287 19 E 5.0194 8.8056 122.7234 54.7709 30.6979 174.9723 20 L 5.0443 8.7260 127.0434 52.1234 45.4376 175.2172 21 P 4.4764 0.0000 0.0000 61.8811 32.3370 174.7639 22 G 4.0220 7.9323 110.8496 44.8980 0.0000 172.7023 23 A 4.6824 8.5887 126.8903 52.3789 20.0191 176.4959 24 T 5.1167 7.2666 105.7976 58.7345 73.3238 174.6785 25 V 3.6654 8.4351 121.8094 66.2362 31.4021 178.5297 26 G 3.8162 8.2764 105.3230 48.0718 0.0000 175.3284 27 E 4.0017 8.0480 120.9082 59.1265 29.4072 179.7505 28 V 3.7993 7.8235 118.1406 66.0576 31.5706 178.1240 29 L 3.9921 8.2196 118.8125 57.6287 41.3378 179.3209 30 E 4.1098 8.6765 119.0384 59.7216 29.3773 179.2437 31 N 4.3703 8.3509 116.4235 55.9213 38.4528 177.3035 32 L 4.0043 8.1975 122.2377 58.3223 41.7057 179.4266 33 V 3.7147 8.3496 112.7483 64.5704 31.2522 178.7206 34 R 3.9310 8.0144 116.7561 59.2025 29.9549 178.6900 35 A 4.1543 8.1101 119.9424 53.8547 19.5805 177.2863 36 Y 4.5673 8.3377 116.3835 54.2356 39.0332 173.8047 37 P 4.4598 0.0000 0.0000 64.6481 31.4072 177.1068 38 A 4.2465 8.1039 116.9812 53.6736 18.4927 178.0464 39 L 4.6713 7.9065 116.8570 54.1031 42.2336 177.9725 40 K 3.9961 8.0378 121.5051 60.0284 31.9470 178.3192 41 E 4.2780 8.1781 115.9575 58.5502 29.6503 177.8661 42 E 4.4844 7.6768 116.6212 56.7249 30.1176 176.7736 43 L 4.4986 7.7127 117.4736 54.5432 44.8039 176.2779 44 F 5.4426 8.4352 115.5824 55.7929 41.7510 175.2199 45 E 4.7575 9.4684 122.6253 54.0973 30.5446 176.8203 46 G 4.0470 8.0925 115.7653 45.7979 0.0000 172.8510 47 E 4.2109 9.0895 123.9275 55.8116 30.1260 175.4049 48 G 4.1422 7.4945 108.0321 43.2483 0.0000 172.7499 49 L 4.3321 8.2044 120.9080 54.0239 42.6344 176.2795 50 A 4.2550 8.5319 128.9349 52.5060 18.8615 176.9682 51 E 4.4946 8.4989 115.4606 56.6881 31.1089 177.3587 52 R 4.2594 7.8957 117.2976 57.2548 30.9459 176.8845 53 V 4.3684 7.5308 116.6530 61.3318 33.0805 175.7660 54 S 4.7056 9.0081 117.2410 56.7439 66.6719 173.2640 55 V 4.9190 8.0940 123.2838 61.1095 34.4872 173.8783 56 F 5.3237 9.5030 126.1941 55.5712 42.6584 173.9028 57 L 4.8706 9.2843 125.8123 53.3311 43.6234 176.2218 58 E 3.9893 9.7367 128.8186 57.5218 27.5877 176.2685 59 G 4.2248 8.6836 104.7410 45.4686 0.0000 173.5863 60 R 4.6092 7.9533 119.6719 53.7762 32.2774 174.9728 61 D 4.0621 8.7224 122.5917 54.1140 41.5675 177.3108 62 V 3.7355 8.2536 120.7635 63.8917 31.2259 178.6575 63 R 3.7378 8.0677 117.7952 58.6300 29.8544 177.4456 64 Y 4.5186 7.3786 113.9347 56.2728 38.5749 175.5872 65 L 4.5457 8.2312 118.5635 55.1090 40.6398 177.3646 66 Q 4.6137 7.0974 126.4314 55.8079 30.9347 176.1589 67 G 3.6973 7.8823 109.0676 46.6798 0.0000 178.0181 68 L 4.0971 8.4287 122.6140 57.2186 41.6230 178.4306 69 S 4.3907 7.8467 113.0061 59.3849 63.3880 174.3071 70 T 4.1985 7.6926 119.2866 63.2135 68.9205 172.1590 71 P 4.9458 0.0000 0.0000 62.9452 32.2816 175.7534 72 L 4.9841 9.0048 121.3793 53.1222 45.4574 176.6393 73 S 4.6762 8.5161 116.8801 56.1566 64.6712 173.2567 74 P 4.2087 0.0000 0.0000 65.6323 31.1088 178.2848 75 G 3.9746 7.4983 104.3524 45.4162 0.0000 173.5326 76 A 4.4980 7.9533 122.6482 52.1124 19.9627 177.2155 77 T 5.0693 9.5495 117.2077 61.7462 72.0987 173.0864 78 L 5.3046 9.1807 126.4154 53.0601 45.0400 175.0359 79 D 5.5039 9.3285 122.9769 52.6446 43.5208 175.0511 80 L 5.3894 8.8730 123.6665 52.9895 44.6923 175.4803 81 F 5.1139 9.5365 122.5455 55.0249 42.3658 173.7170 82 P 4.6187 0.0000 0.0000 60.1043 32.9209 175.3981 83 P 4.4383 0.0000 0.0000 62.2585 29.7109 176.5996 *88 G 3.5040 7.7460 103.7461 47.0644 0.0000 173.0469 89 F 5.2902 8.4937 121.3541 55.6687 43.4459 173.5704 90 E 5.9710 8.6449 117.8816 55.7306 32.6904 174.0633 91 R 4.7058 8.7694 119.2058 55.6775 33.9162 173.4612 92 T 4.9930 8.2817 121.5744 62.1284 70.1439 173.9320 93 F 4.6121 9.6971 126.9958 56.3158 40.9298 175.2937 94 G 4.1837 8.9158 110.7591 45.3411 0.0000 173.4656 95 A 3.8045 8.8601 130.0005 53.6615 16.4969 178.0613 96 F 4.9050 8.0753 123.6186 56.1261 39.8492 172.7738 97 P 4.1887 0.0000 0.0000 62.1448 32.4362 174.9484 98 P 3.7140 0.0000 0.0000 65.3293 31.3717 178.8007 99 W 4.4002 8.0356 114.9090 59.3256 27.9657 178.0978 100 L 2.7604 5.9219 120.5158 57.3167 41.4453 178.3222 101 L 3.5173 6.6392 120.1577 58.0416 41.7933 178.7801 102 E 3.3212 7.8898 118.7713 59.1960 29.3624 179.3449 103 R 3.8979 7.5937 118.6715 59.4096 30.0595 178.2957 104 Y 3.3068 7.4209 116.4684 60.7271 37.7683 178.2213 105 L 3.7716 7.4691 120.1538 57.8465 41.5665 179.5999 106 E 4.0648 8.0405 118.4624 59.2968 29.2019 178.9521 107 E 3.9756 7.8082 118.4280 58.5613 29.6585 177.8677 108 W 5.1107 7.7104 117.0559 56.4604 29.2405 176.9556 109 G 3.9934 8.2732 107.2065 45.4229 0.0000 174.4132 110 G 3.9295 8.3459 106.6769 46.3084 0.0000 173.6830 111 T 4.7611 8.5021 117.9983 61.2042 71.7487 173.4577 112 R 3.0625 8.4511 127.0431 55.9158 29.7771 175.8335 113 E 4.1618 8.5227 127.1894 57.5080 30.5175 176.8103 114 G 3.7875 6.7503 103.7638 45.7029 0.0000 171.3627 115 E 3.9019 8.2520 122.0863 56.7509 29.9784 178.0291 116 G 2.8451 8.7728 113.5482 45.2681 0.0000 172.2705 117 V 4.7581 7.1025 118.2467 61.2390 34.5599 173.6967 118 Y 5.0914 9.3197 125.6801 56.1248 42.0728 174.5619 119 R 5.0000 8.8488 122.5789 54.6609 32.7649 174.7680 120 L 4.8147 9.0831 125.3815 51.8869 46.0215 174.1951 121 P 4.4448 0.0000 0.0000 64.7321 29.6811 176.3095 122 G 4.2080 9.3392 109.0832 44.5147 0.0000 170.4203 123 A 4.9962 8.0982 120.3877 51.1798 23.6368 175.8208 124 V 4.7279 8.8951 119.1862 59.9103 34.3573 174.6964 125 V 4.9155 9.2302 125.4059 61.2714 33.6008 174.3431 126 R 5.2454 9.4447 127.4751 54.3522 33.1204 174.8720 127 F 6.0372 8.3556 117.6386 55.0967 41.8453 173.3909 128 R 4.8886 8.4879 118.8937 55.3119 33.4989 173.5033 129 E 4.6801 8.9183 124.2639 56.7049 30.3859 176.3883 130 V 4.6437 8.4757 117.3452 58.9058 35.5056 174.4719 131 E 4.0707 8.9232 121.9626 56.8793 29.4545 175.5783 132 P 4.7030 0.0000 0.0000 62.7852 32.8023 175.8859 133 L 4.5539 8.6927 121.5731 54.0183 43.9081 175.6021 134 K 4.9924 8.3868 120.6309 54.8582 35.0735 175.5027 135 V 4.2747 8.6992 127.1524 61.6007 34.1828 175.0001 136 G 3.7319 8.3308 118.2927 47.4790 0.0000 174.3032 137 S 4.4501 8.7703 120.3101 58.2931 63.3017 173.1903 138 L 4.4228 8.0560 124.5948 53.6466 42.8355 174.7034 139 S 4.9445 8.5803 120.9614 57.2209 63.7453 172.9873 140 I 4.4105 8.7076 128.9994 58.9053 38.6067 173.5441 141 P 4.6157 0.0000 0.0000 63.0496 32.8688 175.6631 142 Q 4.9878 8.7308 120.9845 54.2406 32.1571 174.0110 143 L 5.0651 9.2909 127.9729 53.3653 44.2124 175.1113 144 R 4.7708 9.0340 128.4211 55.6543 31.5481 174.9808 145 V 5.2239 9.2750 127.1653 61.2739 34.4172 173.8926 146 E 5.4248 10.1024 127.9550 54.6225 32.8674 175.1203 147 V 5.0994 9.1654 123.5719 61.3408 35.0224 174.1092 148 E 4.8938 9.8082 125.9407 54.9036 34.2211 174.9694 149 G 4.3712 8.8048 107.2619 43.1209 0.0000 173.6508 150 E 4.1780 8.6197 119.1788 58.5959 29.6782 177.8813 151 E 4.7501 8.8834 119.0069 55.5873 30.7661 178.3260 152 A 4.2093 8.4701 122.4842 55.3617 18.5522 179.1148 153 E 3.2495 8.3948 117.2959 59.3698 29.5775 178.8507 154 R 3.5758 7.7003 117.8275 59.2609 30.1681 178.3865 155 W 4.1522 8.0084 118.6951 59.5305 29.0438 178.2857 156 F 4.3138 9.0376 121.0642 61.5881 38.7403 177.1360 157 E 3.6761 8.0776 118.0985 59.1324 29.0183 179.3049 158 R 3.7587 7.7398 118.8388 59.1693 29.9128 178.6948 159 I 3.9030 7.9403 119.7642 64.1250 37.1984 178.1524 160 A 3.8754 7.6887 121.7726 54.8971 17.9404 179.4110 161 F 4.0470 8.1725 118.1987 61.4475 39.5779 176.8371 162 A 3.5843 7.9606 118.8517 54.9387 18.0903 179.1350 163 A 2.7982 7.0795 118.5751 54.5099 18.2844 178.2193 164 S 4.1946 7.3070 115.9347 58.7570 63.3732 174.0157 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 1 P 0.00 4.75 0.00 2.10 2.13 0.00 4.07 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 2.15 2.18 0.00 2 K 8.92 4.72 0.00 1.68 1.70 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.60 7.81 3 V 9.70 4.81 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 1.01 0.00 0.00 0.92 0.00 0.00 4 N 9.46 5.06 0.00 2.93 2.48 0.00 0.00 6.44 6.60 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 5 L 8.18 4.85 0.00 1.46 1.54 0.76 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 6 Y 8.25 4.65 0.00 2.29 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 A 9.13 3.66 1.16 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 8 T 8.76 3.85 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 1.15 0.00 0.00 9 F 7.50 4.52 0.00 3.07 2.85 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 10 R 7.95 4.06 0.00 1.95 2.02 0.00 3.10 0.00 0.00 3.20 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.51 0.00 11 D 7.93 4.32 0.00 2.68 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 12 L 7.63 4.10 0.00 1.76 1.78 0.99 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 13 T 7.44 3.84 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 0.52 0.00 0.00 14 G 8.04 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 0.00 0.00 0.00 15 K 7.89 4.61 0.00 1.64 1.62 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.53 1.57 7.81 16 S 8.45 4.29 0.00 3.69 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 17 Q 7.68 4.97 0.00 2.02 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.76 0.00 0.00 0.00 0.00 0.00 2.21 2.55 0.00 18 L 9.03 4.89 0.00 1.56 1.51 0.95 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 19 E 8.81 5.02 0.00 1.94 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 2.20 2.38 0.00 20 L 8.73 5.04 0.00 1.51 1.51 0.97 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 21 P 0.00 4.48 0.00 2.18 2.05 0.00 3.85 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 1.99 1.96 0.00 22 G 7.93 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 23 A 8.59 4.68 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 24 T 7.27 5.12 4.41 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 1.22 0.00 0.00 25 V 8.44 3.67 2.22 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 0.97 0.00 0.00 0.93 0.00 0.00 26 G 8.28 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 0.00 0.00 0.00 27 E 8.05 4.00 0.00 2.24 2.03 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 2.34 2.34 0.00 28 V 7.82 3.80 2.23 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 1.13 0.00 0.00 0.99 0.00 0.00 29 L 8.22 3.99 0.00 2.06 1.48 0.68 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 30 E 8.68 4.11 0.00 2.23 1.97 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 2.08 2.65 0.00 31 N 8.35 4.37 0.00 2.90 2.88 0.00 0.00 6.71 6.02 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 32 L 8.20 4.00 0.00 1.80 1.87 0.91 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 33 V 8.35 3.71 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 1.29 0.00 0.00 1.07 0.00 0.00 34 R 8.01 3.93 0.00 1.97 1.97 0.00 3.15 0.00 0.00 3.39 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.89 0.00 35 A 8.11 4.15 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 36 Y 8.34 4.57 0.00 2.97 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 37 P 0.00 4.46 0.00 2.17 2.14 0.00 3.88 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.13 0.00 38 A 8.10 4.25 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 39 L 7.91 4.67 0.00 1.75 1.56 0.69 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 40 K 8.04 4.00 0.00 1.93 1.94 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.62 7.81 41 E 8.18 4.28 0.00 2.03 2.04 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 2.36 2.44 0.00 42 E 7.68 4.48 0.00 2.02 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 0.00 2.40 2.42 0.00 43 L 7.71 4.50 0.00 1.35 1.09 0.66 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 44 F 8.44 5.44 0.00 3.17 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 45 E 9.47 4.76 0.00 1.95 1.88 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 2.32 2.37 0.00 46 G 8.09 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 47 E 9.09 4.21 0.00 1.94 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 2.19 2.18 0.00 48 G 7.49 4.14 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 0.00 0.00 0.00 49 L 8.20 4.33 0.00 1.57 1.54 0.72 0.89 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 50 A 8.53 4.25 1.20 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 0.00 0.00 51 E 8.50 4.49 0.00 2.04 2.04 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 2.18 2.29 0.00 52 R 7.90 4.26 0.00 1.84 2.04 0.00 3.36 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.56 0.00 53 V 7.53 4.37 2.36 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 0.66 0.00 0.00 1.16 0.00 0.00 54 S 9.01 4.71 0.00 4.02 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 55 V 8.09 4.92 1.97 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 1.01 0.00 0.00 0.88 0.00 0.00 56 F 9.50 5.32 0.00 3.18 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 57 L 9.28 4.87 0.00 1.74 1.59 1.01 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 58 E 9.74 3.99 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 2.40 0.00 59 G 8.68 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 0.00 0.00 0.00 0.00 60 R 7.95 4.61 0.00 2.05 1.86 0.00 3.10 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.75 0.00 61 D 8.72 4.06 0.00 2.43 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 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0.00 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 71 P 0.00 4.95 0.00 2.08 2.06 0.00 3.87 0.00 0.00 3.78 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 72 L 9.00 4.98 0.00 1.37 1.56 0.98 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 73 S 8.52 4.68 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 74 P 0.00 4.21 0.00 2.20 2.15 0.00 3.59 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.10 0.00 75 G 7.50 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 76 A 7.95 4.50 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 77 T 9.55 5.07 4.41 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 1.25 0.00 0.00 78 L 9.18 5.30 0.00 1.56 1.59 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 133 L 8.69 4.55 0.00 1.64 1.65 0.94 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 134 K 8.39 4.99 0.00 1.70 1.65 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.32 1.48 7.81 135 V 8.70 4.27 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 1.01 0.00 0.00 0.94 0.00 0.00 136 G 8.33 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 0.00 0.00 0.00 137 S 8.77 4.45 0.00 3.88 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 0.00 138 L 8.06 4.42 0.00 1.72 1.72 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 139 S 8.58 4.94 0.00 3.94 3.77 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 0.00 140 I 8.71 4.41 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.54 0.95 0.00 0.00 141 P 0.00 4.62 0.00 2.13 2.03 0.00 3.58 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.18 0.00 142 Q 8.73 4.99 0.00 2.06 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.87 0.00 0.00 0.00 0.00 0.00 2.56 2.44 0.00 143 L 9.29 5.07 0.00 1.81 1.78 1.10 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 144 R 9.03 4.77 0.00 2.03 2.01 0.00 3.15 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.67 0.00 145 V 9.27 5.22 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 1.33 0.00 0.00 146 E 10.10 5.42 0.00 1.98 1.88 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 2.30 2.34 0.00 147 V 9.17 5.10 2.42 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 1.31 0.00 0.00 1.34 0.00 0.00 148 E 9.81 4.89 0.00 1.93 1.73 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 2.15 2.24 0.00 149 G 8.80 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 E 8.62 4.18 0.00 2.03 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 2.35 2.31 0.00 151 E 8.88 4.75 0.00 2.34 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 2.30 2.48 0.00 152 A 8.47 4.21 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.39 3.25 0.00 1.73 1.73 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 1.47 1.47 0.00 154 R 7.70 3.58 0.00 1.69 1.76 0.00 2.86 0.00 0.00 2.96 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 1.10 0.00 155 W 8.01 4.15 0.00 3.56 3.27 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 0.00 156 F 9.04 4.31 0.00 3.19 3.18 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 0.00 157 E 8.08 3.68 0.00 1.55 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.47 0.00 158 R 7.74 3.76 0.00 1.45 1.42 0.00 2.21 0.00 0.00 2.25 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.07 0.00 159 I 7.94 3.90 2.05 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.94 0.79 0.00 0.00 160 A 7.69 3.88 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 0.00 161 F 8.17 4.05 0.00 2.94 3.21 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 0.00 162 A 7.96 3.58 0.63 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 0.00 163 A 7.08 2.80 0.03 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 0.00 164 S 7.31 4.19 0.00 3.93 3.71 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 * Residues marked with a * may have inaccurate shift predictions.