NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 F 4.6764 8.1827 119.4122 58.4118 40.9906 177.0802 11 H 3.7294 7.2457 120.5702 57.1134 30.2837 170.3815 12 E 4.6587 12.0000 118.5471 56.6680 32.1610 174.7965 13 M 4.4199 7.6653 117.1781 55.7811 32.4236 178.9654 14 R 3.6317 8.7586 112.8970 58.7722 31.2129 176.1524 15 E 3.8846 8.0487 118.4100 55.7154 29.4595 175.2426 16 P 4.3568 0.0000 0.0000 63.3559 31.5470 176.7397 17 R 4.1368 8.4625 109.8796 57.0891 29.6410 173.7542 18 I 2.6011 7.5072 124.7033 61.6937 38.3329 173.2378 19 E 5.6265 9.1159 135.0000 56.9512 30.6248 177.4986 20 K 3.6481 8.1950 125.9238 56.5055 31.9363 173.6444 21 V 4.0196 7.7572 122.8981 62.9123 32.5884 170.4419 22 V 3.9199 7.5356 122.8744 61.0193 32.8439 175.7902 23 V 4.9145 6.6255 117.2301 62.4335 34.5701 168.9233 24 H 4.6471 8.6783 128.8941 55.4561 31.2174 172.6341 25 M 4.4133 7.3065 125.7075 55.9057 36.9603 174.8229 26 G 4.3328 7.5782 103.2553 46.9285 0.0000 172.9507 27 I 4.6915 7.8778 126.4436 58.1880 41.1192 176.5292 28 G 3.8545 9.2325 117.1301 50.9307 0.0000 172.7488 29 H 3.3433 12.0000 111.3581 54.1689 31.8442 174.3748 *35 A 4.0020 7.9933 124.8637 54.9816 18.2759 174.5336 36 N 4.6582 9.5739 120.4913 55.2653 35.9057 177.7543 37 A 3.9553 8.0291 120.1854 55.3015 18.9458 178.9635 38 E 4.1713 8.1701 114.3508 58.5385 29.7137 178.4618 39 D 4.3609 12.0000 118.5070 56.7859 41.0682 177.7699 40 I 4.0161 7.3437 118.8760 63.2622 37.0883 177.8713 41 L 4.2848 7.8045 120.3455 57.5138 41.5969 179.0389 42 G 3.7202 8.3921 106.0464 48.0793 0.0000 175.5354 43 E 4.1290 7.7042 118.2968 58.6133 29.5826 178.7032 44 I 4.2642 7.4749 118.2219 61.5418 37.8240 175.1960 45 T 5.0707 7.8508 112.8162 60.7074 73.8559 176.6259 46 G 5.1823 8.5404 115.7018 45.0353 0.0000 172.8060 47 Q 4.6544 7.5030 116.0199 54.7845 31.5658 174.9765 48 M 4.0084 7.9362 116.6890 55.4260 33.2382 176.0168 49 P 4.6988 0.0000 0.0000 60.8065 33.0345 175.4745 50 V 4.3583 8.4422 124.1870 60.7659 32.2508 174.1805 51 R 4.8445 8.8846 124.6413 54.1133 35.1105 174.3807 52 T 4.3664 8.3020 111.5191 59.9622 69.1428 174.7986 53 K 4.2372 8.5699 130.0919 58.1836 33.8537 174.8863 54 A 4.5637 8.4309 118.7669 54.4070 23.0591 173.3792 55 K 3.9154 8.6707 110.2984 56.9936 31.5673 175.6925 56 R 5.7826 7.8287 112.9607 57.1291 32.6498 175.2359 57 T 4.3694 7.5510 119.9358 62.9175 71.4851 174.6592 58 V 4.2956 8.0651 120.8159 63.4114 31.8900 176.9969 59 G 4.0281 8.2712 104.8722 45.0139 0.0000 174.0007 60 E 5.2556 7.7680 122.4845 56.1537 33.7792 176.8247 61 F 3.8969 8.6040 116.6029 58.3848 35.6073 174.1997 62 D 4.9506 7.9095 116.0920 53.9622 41.7803 176.3911 63 I 3.6892 8.2806 119.9187 64.1438 37.8357 174.7595 64 R 3.9786 7.4155 121.1703 56.1865 29.0464 176.5436 65 E 5.0545 8.2466 129.1700 52.1508 28.4627 176.5170 66 G 5.1667 6.4728 121.8197 47.1183 0.0000 170.0452 67 D 4.9722 7.1839 115.0028 51.6617 44.0675 175.7658 68 P 4.6824 0.0000 0.0000 61.3147 30.3769 174.6141 69 I 4.3815 7.7551 126.3138 61.7289 40.2846 175.7392 70 G 3.6793 7.8802 107.4089 46.3539 0.0000 172.4687 71 A 5.7190 8.5423 128.0282 49.5057 21.5424 175.8761 72 K 4.1400 8.3934 121.5907 55.9035 35.3898 175.0277 73 V 4.4897 7.7996 129.0343 60.5594 29.5249 174.9422 74 T 3.8559 7.7610 113.2132 62.0361 69.5623 174.6646 75 L 4.5363 8.1073 117.4599 54.7728 43.9239 174.0415 76 R 4.1837 7.8190 123.8025 55.1319 33.5241 174.7688 77 D 3.5412 9.3313 116.7770 54.6532 41.0136 177.0397 78 E 3.5371 8.1223 119.8731 58.1713 30.3136 177.4000 79 M 4.3715 7.9888 119.9615 58.0207 32.0108 178.5756 80 A 4.1226 8.0791 119.3236 55.5512 18.7121 179.3964 81 E 3.9936 7.9186 116.8724 59.9697 29.5089 179.3938 82 E 4.5681 8.1465 119.5108 58.6429 29.3894 179.6528 83 F 4.1930 8.0001 117.0759 60.4264 39.2399 177.6444 84 L 3.9878 9.1085 117.8602 58.4251 41.7740 178.9149 85 Q 4.0444 8.6653 117.9381 58.4626 28.0808 177.2872 86 T 4.0488 7.1974 119.9497 64.0870 69.2755 174.1192 87 A 4.6786 7.9499 122.1773 51.6030 20.4187 176.7094 88 L 4.2592 7.9362 116.9528 55.2295 42.5714 175.8408 89 P 4.4262 0.0000 0.0000 65.8101 31.8024 177.6023 90 L 4.0806 7.8680 115.4930 55.0345 41.9677 176.0526 91 A 4.4458 7.2705 123.0852 50.5079 19.8194 176.6067 92 E 4.6150 8.3886 123.3756 54.9110 31.7720 174.6208 93 L 4.2075 8.9154 130.5945 54.4139 47.3038 175.2699 94 A 3.5692 9.1136 116.0461 50.0986 15.5209 177.6717 95 T 3.2282 8.4187 120.3672 62.6399 71.2945 176.1465 96 S 3.4044 7.6127 113.7557 59.1480 65.4864 174.0018 97 Q 3.4834 7.9604 119.0149 56.5421 27.8772 177.1542 98 F 6.1157 12.0000 118.6320 56.3981 38.8056 175.2962 99 D 4.8925 8.3067 125.7647 52.3667 43.2275 178.2442 100 D 4.1695 9.4584 116.4988 58.5944 40.3136 178.7925 101 T 3.5275 9.2388 116.3022 67.9252 68.8500 178.0930 102 G 3.7131 9.0295 105.7048 44.8764 0.0000 172.6098 103 N 4.3606 5.7700 127.1988 53.7847 44.0350 172.9946 104 F 4.7778 7.8491 116.2251 57.3260 44.2880 173.7029 105 S 5.0209 7.9654 118.0963 57.3533 66.1355 173.7135 106 F 4.9105 8.8610 125.7688 57.6099 40.6125 174.3747 107 G 3.5685 8.6498 110.2351 47.8119 0.0000 174.9265 *128 L 4.1058 8.2743 126.7832 53.5983 43.3043 174.2422 129 D 4.2104 8.4352 117.1386 53.7219 43.0957 175.1461 130 V 4.7045 7.8341 117.9308 60.6919 35.6701 172.3178 131 T 5.3933 8.2770 113.2283 60.5653 73.0440 172.9013 132 V 4.6368 8.8425 120.7119 60.6895 34.9900 172.8933 133 N 5.3685 8.6215 120.8472 51.5647 40.8456 174.9796 134 L 4.2092 12.0000 122.3121 54.7601 42.9216 177.7776 135 V 4.0647 7.4140 116.7592 61.4863 29.8379 173.6430 136 R 4.0879 7.9499 117.8490 55.2864 30.6090 176.0487 137 P 4.4724 0.0000 0.0000 65.1845 31.4246 177.1290 138 G 4.1068 7.4355 106.8566 45.8238 0.0000 174.9785 139 Y 3.9615 8.0396 118.0403 59.7996 38.1703 177.5579 140 R 3.6404 8.0366 117.1449 59.7463 31.0432 179.7710 141 V 3.1876 7.0359 115.7496 65.6272 33.4148 177.7493 142 A 4.2809 7.8226 119.0138 53.2182 17.8870 177.6633 143 K 4.4041 8.2569 116.2097 57.0524 33.5253 177.6004 144 R 4.0919 7.7602 118.3280 56.1725 30.3718 176.8511 145 D 4.4113 8.6823 121.3962 56.2290 41.1789 176.2311 146 K 4.2312 7.7116 117.0741 55.3241 35.0096 177.0536 147 A 3.6965 7.6401 121.0993 54.1106 15.4472 179.8878 148 S 4.3462 7.4940 118.7739 57.1562 61.1503 172.3594 149 R 3.8555 8.0391 124.5786 57.2137 30.1686 178.3724 150 S 4.1935 8.6905 124.0553 59.8171 62.3930 176.0984 151 I 2.9564 12.0000 115.8361 62.4511 34.1752 172.7540 152 P 4.3698 0.0000 0.0000 63.3201 31.4845 177.1001 153 T 4.3060 8.3211 107.9688 61.6724 69.0679 175.2841 154 K 4.3872 7.8727 120.8089 57.3959 33.4886 176.9595 155 H 4.5164 8.2261 114.9970 57.4424 29.5953 175.0525 156 R 4.2811 7.3692 123.3344 56.4744 29.8011 175.6295 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 10 F 8.18 4.68 0.00 3.21 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 11 H 7.25 3.73 0.00 3.20 3.36 0.00 5.91 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 E 12.00 4.66 0.00 2.01 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 2.31 2.43 0.00 13 M 7.67 4.42 0.00 2.12 1.46 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.55 0.00 14 R 8.76 3.63 0.00 1.85 1.93 0.00 3.36 0.00 0.00 3.27 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.82 0.00 15 E 8.05 3.88 0.00 1.94 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 2.19 2.24 0.00 16 P 0.00 4.36 0.00 2.15 2.07 0.00 3.79 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 1.99 1.97 0.00 17 R 8.46 4.14 0.00 1.86 1.92 0.00 3.04 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.55 0.00 18 I 7.51 2.60 1.85 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.45 0.90 0.00 0.00 19 E 9.12 5.63 0.00 1.99 1.79 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 2.09 2.01 0.00 20 K 8.19 3.65 0.00 1.95 1.81 0.00 1.85 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.36 7.81 21 V 7.76 4.02 2.08 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 0.77 0.00 0.00 0.97 0.00 0.00 22 V 7.54 3.92 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 0.81 0.00 0.00 1.08 0.00 0.00 23 V 6.63 4.91 1.93 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 0.66 0.00 0.00 0.63 0.00 0.00 24 H 8.68 4.65 0.00 3.21 3.12 0.00 5.99 0.00 0.00 0.00 0.00 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 M 7.31 4.41 0.00 2.05 2.03 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.24 0.00 26 G 7.58 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 0.00 0.00 0.00 27 I 7.88 4.69 1.89 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 1.29 0.98 0.92 0.00 0.00 28 G 9.23 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 0.00 0.00 0.00 29 H 12.00 3.34 0.00 3.38 3.67 0.00 5.59 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *35 A 7.99 4.00 1.32 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 0.00 0.00 36 N 9.57 4.66 0.00 2.83 3.24 0.00 0.00 6.88 7.54 0.00 0.00 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 A 8.03 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 38 E 8.17 4.17 0.00 2.03 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 0.00 2.40 2.37 0.00 39 D 12.00 4.36 0.00 2.86 2.65 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 0.00 0.00 0.00 0.00 40 I 7.34 4.02 2.00 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 1.53 0.71 0.93 0.00 0.00 41 L 7.80 4.28 0.00 1.93 1.69 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 42 G 8.39 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.70 4.13 0.00 2.06 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 0.00 2.36 2.56 0.00 44 I 7.47 4.26 2.04 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 1.66 0.74 1.26 0.00 0.00 45 T 7.85 5.07 4.57 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 -4.69 0.00 0.00 46 G 8.54 5.18 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 0.00 47 Q 7.50 4.65 0.00 2.11 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.86 6.71 0.00 0.00 0.00 0.00 0.00 2.22 2.34 0.00 48 M 7.94 4.01 0.00 1.90 2.05 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.54 0.00 49 P 0.00 4.70 0.00 2.04 3.44 0.00 3.31 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.83 0.00 50 V 8.44 4.36 2.08 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 0.83 0.00 0.00 0.93 0.00 0.00 51 R 8.88 4.84 0.00 1.77 1.72 0.00 3.11 0.00 0.00 3.20 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 52 T 8.30 4.37 4.46 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 1.20 0.00 0.00 53 K 8.57 4.24 0.00 1.81 1.78 0.00 1.85 0.00 0.00 1.93 0.00 0.00 2.92 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.52 1.44 7.81 54 A 8.43 4.56 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 55 K 8.67 3.92 0.00 1.89 2.17 0.00 1.71 0.00 0.00 1.81 0.00 0.00 3.12 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.33 7.81 56 R 7.83 5.78 0.00 1.75 1.81 0.00 3.25 0.00 0.00 3.88 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.59 0.00 57 T 7.55 4.37 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 58 V 8.07 4.30 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 0.53 0.00 0.00 0.75 0.00 0.00 59 G 8.27 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 60 E 7.77 5.26 0.00 2.06 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 0.00 2.14 2.13 0.00 61 F 8.60 3.90 0.00 3.04 3.47 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.91 4.95 0.00 2.63 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 63 I 8.28 3.69 2.12 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 1.41 1.23 0.92 0.00 0.00 64 R 7.42 3.98 0.00 2.07 2.10 0.00 3.29 0.00 0.00 3.22 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 65 E 8.25 5.05 0.00 2.10 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 2.33 2.19 0.00 66 G 6.47 5.17 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 0.00 0.00 0.00 67 D 7.18 4.97 0.00 2.66 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.68 0.00 2.11 2.04 0.00 3.47 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.90 0.00 69 I 7.76 4.38 1.90 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.33 1.22 0.00 0.00 70 G 7.88 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.54 5.72 1.32 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 0.00 0.00 72 K 8.39 4.14 0.00 1.64 1.69 0.00 1.36 0.00 0.00 1.73 0.00 0.00 2.80 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.39 1.27 7.81 73 V 7.80 4.49 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 0.60 0.00 0.00 0.89 0.00 0.00 74 T 7.76 3.86 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 75 L 8.11 4.54 0.00 1.37 1.57 0.42 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 76 R 7.82 4.18 0.00 1.76 1.94 0.00 3.14 0.00 0.00 3.34 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 77 D 9.33 3.54 0.00 2.79 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 78 E 8.12 3.54 0.00 2.08 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.26 0.00 79 M 7.99 4.37 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.63 0.00 80 A 8.08 4.12 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 81 E 7.92 3.99 0.00 2.21 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 2.35 2.48 0.00 82 E 8.15 4.57 0.00 1.99 1.74 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 2.23 2.20 0.00 83 F 8.00 4.19 0.00 3.30 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 84 L 9.11 3.99 0.00 1.78 1.79 0.93 0.97 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 85 Q 8.67 4.04 0.00 2.24 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.88 0.00 0.00 0.00 0.00 0.00 2.91 2.27 0.00 86 T 7.20 4.05 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 1.16 0.00 0.00 87 A 7.95 4.68 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 88 L 7.94 4.26 0.00 1.93 1.62 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.43 0.00 2.25 2.26 0.00 3.77 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 2.05 1.97 0.00 90 L 7.87 4.08 0.00 1.66 1.75 0.93 0.74 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 91 A 7.27 4.45 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 92 E 8.39 4.62 0.00 1.91 1.89 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 2.19 2.29 0.00 93 L 8.92 4.21 0.00 1.89 1.50 0.57 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 94 A 9.11 3.57 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 95 T 8.42 3.23 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 1.07 0.00 0.00 96 S 7.61 3.40 0.00 4.11 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 97 Q 7.96 3.48 0.00 2.85 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.20 6.80 0.00 0.00 0.00 0.00 0.00 2.21 2.49 0.00 98 F 12.00 6.12 0.00 3.15 3.45 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 0.00 0.00 0.00 0.00 99 D 8.31 4.89 0.00 2.53 2.39 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 0.00 100 D 9.46 4.17 0.00 2.72 2.44 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 0.00 101 T 9.24 3.53 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 1.14 0.00 0.00 102 G 9.03 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 0.00 0.00 0.00 103 N 5.77 4.36 0.00 2.46 2.88 0.00 0.00 6.81 8.01 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 0.00 104 F 7.85 4.78 0.00 2.93 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 0.00 105 S 7.97 5.02 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 0.00 106 F 8.86 4.91 0.00 2.99 2.94 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 0.00 0.00 0.00 107 G 8.65 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 0.00 0.00 0.00 *128 L 8.27 4.11 0.00 1.69 1.76 0.94 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 129 D 8.44 4.21 0.00 2.87 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 0.00 130 V 7.83 4.70 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 0.65 0.00 0.00 1.03 0.00 0.00 131 T 8.28 5.39 4.34 0.00 0.00 0.00 0.00 0.00 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 0.00 132 V 8.84 4.64 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 0.76 0.00 0.00 0.95 0.00 0.00 133 N 8.62 5.37 0.00 2.60 2.92 0.00 0.00 7.04 7.85 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 0.00 134 L 12.00 4.21 0.00 1.75 1.58 1.10 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 135 V 7.41 4.06 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 0.75 0.00 0.00 0.70 0.00 0.00 136 R 7.95 4.09 0.00 2.29 2.11 0.00 3.29 0.00 0.00 3.62 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.80 0.00 137 P 0.00 4.47 0.00 2.21 2.21 0.00 3.84 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.12 0.00 138 G 7.44 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 0.00 139 Y 8.04 3.96 0.00 3.19 3.13 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 0.00 140 R 8.04 3.64 0.00 1.88 1.88 0.00 3.21 0.00 0.00 3.27 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.69 0.00 141 V 7.04 3.19 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 0.95 0.00 0.00 0.91 0.00 0.00 142 A 7.82 4.28 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 0.00 143 K 8.26 4.40 0.00 1.70 1.87 0.00 1.73 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.58 7.81 144 R 7.76 4.09 0.00 1.90 2.04 0.00 3.21 0.00 0.00 3.29 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 145 D 8.68 4.41 0.00 2.66 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 7.71 4.23 0.00 1.71 1.74 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.34 1.39 7.81 147 A 7.64 3.70 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 0.00 148 S 7.49 4.35 0.00 3.97 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 0.00 149 R 8.04 3.86 0.00 1.81 1.93 0.00 3.28 0.00 0.00 3.36 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.55 0.00 150 S 8.69 4.19 0.00 3.93 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 0.00 151 I 12.00 2.96 1.74 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.45 0.66 0.00 0.00 152 P 0.00 4.37 0.00 2.32 2.21 0.00 3.59 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.86 0.00 153 T 8.32 4.31 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 1.18 0.00 0.00 154 K 7.87 4.39 0.00 1.73 1.81 0.00 1.72 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.35 1.43 7.81 155 H 8.23 4.52 0.00 3.09 3.39 0.00 5.89 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 R 7.37 4.28 0.00 1.54 1.67 0.00 3.03 0.00 0.00 3.04 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 * Residues marked with a * may have inaccurate shift predictions.