NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 A 4.3520 8.1233 123.5853 52.3018 21.0322 178.7821 10 N 4.1034 8.3061 113.2716 56.4480 38.4374 175.6130 11 S 4.1283 8.9094 117.2480 62.0842 63.3196 176.6349 12 T 3.8869 7.7399 117.8110 66.5402 68.2609 176.8671 13 V 3.4130 8.0694 120.5325 65.8966 31.5684 178.1368 14 L 3.8420 8.1764 119.1942 57.5951 41.3698 179.3932 15 S 4.0869 8.2891 113.2884 61.3964 62.1668 175.9068 16 F 4.4439 8.0007 121.8920 61.7777 39.4205 176.6049 17 C 3.8216 8.2461 116.0024 62.4355 27.7040 175.6664 18 A 3.7495 8.0695 121.7932 54.6987 17.9004 178.7386 19 F 4.6258 7.2387 111.1241 56.5450 38.6666 176.2845 20 A 4.1934 7.1891 122.9809 51.7512 18.7892 179.4008 21 V 3.6962 8.1823 113.2582 63.4888 32.0965 177.0773 22 D 4.6083 7.5044 118.6595 50.6535 42.0765 173.2231 23 P 4.2343 0.0000 0.0000 65.2714 31.4832 177.9144 24 A 4.0212 8.0650 119.0146 54.9953 18.3068 179.4716 25 K 3.9158 8.4588 118.0772 59.3621 32.1803 178.9418 26 A 4.0789 8.0611 121.2091 55.3894 18.2594 179.0066 27 Y 4.3836 8.2301 118.0849 60.7000 38.8018 178.0086 28 K 3.7701 8.4466 120.8188 59.6590 32.3469 178.3342 29 D 4.3676 8.8132 119.7314 57.5989 40.7723 178.1257 30 Y 4.1183 8.5448 120.2279 60.8757 38.8151 178.3730 31 L 3.5060 7.9891 119.5274 57.5637 41.4491 179.2605 32 A 4.0601 7.8369 119.7910 55.1743 18.3506 179.1100 33 S 4.3325 7.6523 110.3804 59.0282 62.8537 175.2133 34 G 3.8009 8.1420 110.9534 44.8773 0.0000 174.4715 35 G 2.6622 6.9947 108.1460 44.6679 0.0000 173.5804 36 Q 4.1670 8.3158 122.0438 54.5149 29.8714 174.3451 37 P 4.7049 0.0000 0.0000 62.4199 32.0931 176.2787 38 I 4.0543 8.7083 122.8849 61.7242 37.6215 176.2614 39 T 4.6694 8.8180 116.1933 61.2983 71.0135 173.9212 40 N 4.3021 8.7199 117.5796 55.0758 35.7822 174.0458 41 C 4.4777 8.0697 114.6869 59.3402 29.4000 173.6188 42 V 4.2069 9.0834 117.4803 60.7448 32.6533 175.3311 43 K 4.5378 8.6101 124.5239 55.3765 33.6019 175.8139 44 M 4.3703 8.4226 124.5007 53.8548 33.4608 176.1163 45 L 4.0587 8.4382 125.4628 54.7130 41.6828 175.7628 46 C 4.5394 8.0617 127.1137 57.6257 31.4554 173.2103 47 T 4.0483 7.9568 121.8919 65.0897 68.8290 175.1834 48 H 4.6444 7.1371 115.7718 54.3518 29.9151 174.9948 49 T 3.9036 8.4228 118.4803 63.6928 68.5307 175.0006 50 G 4.0623 8.2640 116.6438 43.9720 0.0000 173.5891 51 T 3.8875 9.0094 109.4895 62.7027 68.7607 176.0251 52 G 3.9743 8.4709 110.0739 45.5572 0.0000 173.8268 53 Q 4.1563 7.6077 118.2866 55.5152 29.5237 176.2155 54 A 4.1578 8.9794 124.6832 54.7611 19.0497 177.4232 55 I 5.1458 7.4897 114.4852 59.8232 40.2676 174.7881 56 T 4.8479 9.0552 116.4531 60.0231 72.3882 175.2817 57 V 4.1939 8.6470 114.3008 63.2277 32.0652 176.4837 58 T 4.6792 7.5548 107.9339 58.7337 71.6884 171.7027 59 P 4.3638 0.0000 0.0000 63.6418 31.7165 176.3018 60 E 4.6995 9.4918 121.8095 55.7417 31.2354 175.3299 61 A 4.4294 7.8248 122.8049 52.4889 18.9856 178.4951 62 N 5.0339 8.9713 121.8205 51.5053 39.8393 175.4603 63 M 4.1410 8.5992 114.3310 58.0337 31.4560 176.4765 64 D 4.8434 9.1884 119.3324 54.0218 41.1596 175.0727 65 Q 5.3031 7.7639 117.5878 54.3569 33.3504 174.1275 66 E 4.6817 8.9245 118.2181 54.8988 33.8680 175.2430 67 S 5.3520 8.3347 118.7269 57.0972 65.5867 173.1658 68 F 5.3182 9.2873 121.8123 55.2805 43.1137 174.4792 69 G 3.9554 9.3213 109.3035 46.2514 0.0000 174.6119 70 G 3.8614 9.0601 112.7187 48.0867 0.0000 175.6988 71 A 4.0350 8.0321 123.3759 54.7859 18.0910 179.2791 72 S 4.0516 7.5896 109.5074 61.2812 62.7992 175.3204 73 C 4.4779 8.0329 116.8661 58.4645 28.4004 172.3633 74 C 4.6407 7.5554 123.2599 57.8683 32.2670 173.8987 75 L 3.5945 8.2400 128.7585 58.4384 41.6576 178.5875 76 Y 3.9665 6.8855 116.0539 61.0431 37.9659 177.9392 77 C 4.1046 7.8811 117.2746 62.8843 28.1393 176.2188 78 R 3.8322 7.8187 118.4599 58.6308 29.6867 177.9349 79 C 4.2151 7.6792 114.2286 59.0156 28.6246 173.1980 80 H 3.9996 7.5587 116.4710 56.7847 26.3254 174.2720 81 I 4.4711 7.1462 110.8793 58.3761 40.1342 174.7563 82 D 4.3790 8.2324 120.2146 54.7238 41.0884 176.4427 83 H 4.0338 8.3203 119.3287 54.5932 29.9276 173.2322 84 P 4.4658 0.0000 0.0000 64.9669 32.2131 177.6230 85 N 3.3199 6.2425 110.7517 54.6221 40.7816 177.5343 *89 F 4.4569 7.2886 123.2832 58.3449 40.2185 175.3788 90 C 4.8016 9.3293 118.9997 57.2476 33.5257 173.3278 91 D 4.6913 8.8994 125.2360 54.1764 39.9195 176.5819 92 L 4.4800 7.7609 119.9197 55.8204 43.4495 176.7576 93 K 3.9242 8.0488 119.0161 58.0643 32.2419 176.8326 94 G 3.8564 8.9215 113.5507 45.3751 0.0000 172.2702 95 K 4.5439 7.8393 119.2113 54.5736 36.0469 174.1283 96 Y 5.0436 8.9812 117.6212 56.5386 41.4189 175.2749 97 V 4.9717 8.8946 123.1827 61.4254 34.1358 174.1254 98 Q 5.2437 9.3547 127.5869 54.5651 30.3349 175.0976 99 I 4.2933 8.8030 125.0573 58.3084 40.8044 173.4589 100 P 4.5715 0.0000 0.0000 63.1951 31.4710 177.5416 101 T 4.0160 8.9464 121.1153 66.9882 68.5750 176.2558 102 T 4.1548 7.8126 109.1864 63.4806 69.2016 174.3925 103 C 4.6262 8.2997 118.4853 59.1519 29.7276 174.9662 104 A 4.1032 7.5265 120.9550 53.1843 17.8083 178.3761 105 N 4.5619 7.8252 113.0534 54.2140 38.3879 174.9949 106 D 4.7865 7.6451 118.0300 51.3051 41.0291 173.6863 107 P 3.9981 0.0000 0.0000 65.1789 31.2928 178.4003 108 V 4.1885 7.1218 118.0676 65.6688 31.5392 178.3091 109 G 3.6764 8.5199 106.1794 46.9540 0.0000 175.0414 110 F 3.7997 8.4841 123.6447 61.5294 39.1369 177.4534 111 T 3.7083 7.3391 106.3549 64.4205 68.6279 176.2891 112 L 4.1560 7.1889 121.2266 57.6285 41.7765 179.0253 113 R 4.1415 7.8736 116.3704 56.6974 30.3736 175.7968 114 N 4.9959 7.2251 114.8048 51.4349 41.6171 173.4589 115 T 4.9305 8.2662 114.3088 61.9770 72.5363 173.5351 116 V 4.1023 8.3243 125.1526 61.8428 32.7809 176.2408 117 C 4.5318 9.5161 127.0469 57.2333 40.3703 175.2561 118 T 3.8185 8.6949 114.5865 64.4971 68.6871 175.9625 119 V 3.6911 7.5771 121.3239 65.8159 32.1210 176.4564 120 C 4.0852 8.0323 119.0743 62.5993 31.6832 175.0925 121 G 3.8742 8.8303 107.3017 45.2523 0.0000 172.5120 122 M 4.7304 7.3338 118.4659 52.5591 35.0078 174.9895 123 W 4.7478 8.4543 120.1537 56.3484 29.7416 176.1208 124 K 4.1965 9.4401 126.0918 58.0323 31.8720 177.0883 125 G 3.8966 9.7985 114.8908 45.6768 0.0000 173.1934 126 Y 4.7469 8.2202 116.1895 54.0621 38.6612 173.6951 127 G 4.2579 8.6101 110.1017 45.8636 0.0000 172.9641 128 C 4.3393 8.1734 119.0746 57.7489 44.3297 173.2898 129 S 4.0685 8.7917 121.3397 59.2167 62.6913 171.9655 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 9 A 8.12 4.35 1.37 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 10 N 8.31 4.10 0.00 2.82 2.87 0.00 0.00 7.13 6.68 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 11 S 8.91 4.13 0.00 3.87 3.94 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 12 T 7.74 3.89 4.38 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 1.21 0.00 0.00 13 V 8.07 3.41 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 0.62 0.00 0.00 0.61 0.00 0.00 14 L 8.18 3.84 0.00 1.64 1.58 0.89 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 15 S 8.29 4.09 0.00 4.07 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 16 F 8.00 4.44 0.00 2.99 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 17 C 8.25 3.82 0.00 2.83 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 18 A 8.07 3.75 0.74 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 0.00 0.00 19 F 7.24 4.63 0.00 3.03 3.01 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 0.00 0.00 0.00 20 A 7.19 4.19 1.03 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 21 V 8.18 3.70 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 0.71 0.00 0.00 0.93 0.00 0.00 22 D 7.50 4.61 0.00 2.79 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 0.00 0.00 0.00 0.00 23 P 0.00 4.23 0.00 2.22 2.07 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 2.19 2.34 0.00 24 A 8.06 4.02 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 25 K 8.46 3.92 0.00 2.02 1.96 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.62 1.48 7.81 26 A 8.06 4.08 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.23 4.38 0.00 2.96 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 28 K 8.45 3.77 0.00 1.92 2.05 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.45 7.81 29 D 8.81 4.37 0.00 3.04 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 30 Y 8.54 4.12 0.00 3.24 3.41 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 31 L 7.99 3.51 0.00 1.63 1.46 0.45 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 32 A 7.84 4.06 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 33 S 7.65 4.33 0.00 3.85 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 34 G 8.14 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 0.00 0.00 0.00 35 G 6.99 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 0.00 0.00 0.00 36 Q 8.32 4.17 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.95 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 37 P 0.00 4.70 0.00 2.22 2.24 0.00 3.76 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 38 I 8.71 4.05 1.77 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.49 0.86 0.00 0.00 39 T 8.82 4.67 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 1.29 0.00 0.00 40 N 8.72 4.30 0.00 2.91 2.99 0.00 0.00 6.80 7.66 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 41 C 8.07 4.48 0.00 3.01 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 42 V 9.08 4.21 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 0.79 0.00 0.00 1.05 0.00 0.00 43 K 8.61 4.54 0.00 1.53 1.48 0.00 1.63 0.00 0.00 1.42 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.48 1.42 7.81 44 M 8.42 4.37 0.00 1.75 1.88 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.81 0.00 45 L 8.44 4.06 0.00 1.54 1.56 0.88 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 46 C 8.06 4.54 0.00 2.80 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 47 T 7.96 4.05 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 1.19 0.00 0.00 48 H 7.14 4.64 0.00 3.26 3.29 0.00 5.53 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 T 8.42 3.90 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 1.22 0.00 0.00 50 G 8.26 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 51 T 9.01 3.89 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 1.28 0.00 0.00 52 G 8.47 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 53 Q 7.61 4.16 0.00 2.01 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.87 0.00 0.00 0.00 0.00 0.00 2.40 2.45 0.00 54 A 8.98 4.16 0.21 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 55 I 7.49 5.15 1.81 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 1.51 0.53 0.94 0.00 0.00 56 T 9.06 4.85 4.36 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 1.29 0.00 0.00 57 V 8.65 4.19 2.15 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 0.78 0.00 0.00 0.98 0.00 0.00 58 T 7.55 4.68 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 1.23 0.00 0.00 59 P 0.00 4.36 0.00 1.88 1.87 0.00 3.21 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.07 0.00 60 E 9.49 4.70 0.00 1.97 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 2.49 2.40 0.00 61 A 7.82 4.43 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 62 N 8.97 5.03 0.00 2.98 3.15 0.00 0.00 6.35 7.23 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 63 M 8.60 4.14 0.00 2.15 2.25 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.57 0.00 64 D 9.19 4.84 0.00 2.81 2.73 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 65 Q 7.76 5.30 0.00 1.87 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.67 6.61 0.00 0.00 0.00 0.00 0.00 2.36 2.47 0.00 66 E 8.92 4.68 0.00 1.98 1.45 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 2.21 2.42 0.00 67 S 8.33 5.35 0.00 3.67 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 68 F 9.29 5.32 0.00 3.06 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 69 G 9.32 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 70 G 9.06 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 0.00 0.00 0.00 71 A 8.03 4.03 1.34 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 0.00 0.00 0.00 72 S 7.59 4.05 0.00 3.98 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 73 C 8.03 4.48 0.00 3.11 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 74 C 7.56 4.64 0.00 2.99 2.92 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 75 L 8.24 3.59 0.00 1.35 0.84 0.43 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 6.89 3.97 0.00 2.69 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 77 C 7.88 4.10 0.00 3.06 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 78 R 7.82 3.83 0.00 1.79 1.82 0.00 3.22 0.00 0.00 3.15 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.76 0.00 79 C 7.68 4.22 0.00 2.84 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 80 H 7.56 4.00 0.00 3.27 3.32 0.00 5.60 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 7.15 4.47 1.79 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 1.24 0.68 0.77 0.00 0.00 82 D 8.23 4.38 0.00 2.60 2.55 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 83 H 8.32 4.03 0.00 2.93 3.00 0.00 5.84 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 P 0.00 4.47 0.00 1.96 1.78 0.00 3.04 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.26 0.00 85 N 6.24 3.32 0.00 2.74 2.79 0.00 0.00 6.79 7.45 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 *89 F 7.29 4.46 0.00 2.94 2.68 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 90 C 9.33 4.80 0.00 2.38 2.84 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 91 D 8.90 4.69 0.00 2.86 2.80 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 92 L 7.76 4.48 0.00 1.77 1.80 1.01 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 93 K 8.05 3.92 0.00 1.80 1.90 0.00 1.93 0.00 0.00 1.90 0.00 0.00 3.45 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.57 1.53 7.81 94 G 8.92 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 0.00 0.00 0.00 95 K 7.84 4.54 0.00 1.79 1.87 0.00 1.61 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.36 7.81 96 Y 8.98 5.04 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 97 V 8.89 4.97 2.33 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 1.46 0.00 0.00 1.09 0.00 0.00 98 Q 9.35 5.24 0.00 2.23 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.35 0.00 0.00 0.00 0.00 0.00 2.47 2.44 0.00 99 I 8.80 4.29 1.79 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.86 -0.30 0.00 0.00 100 P 0.00 4.57 0.00 1.74 2.01 0.00 2.27 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 2.18 0.00 101 T 8.95 4.02 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 1.21 0.00 0.00 102 T 7.81 4.15 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 1.25 0.00 0.00 103 C 8.30 4.63 0.00 2.08 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 0.00 104 A 7.53 4.10 1.39 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 0.00 0.00 105 N 7.83 4.56 0.00 2.84 2.94 0.00 0.00 5.80 8.06 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 0.00 106 D 7.65 4.79 0.00 2.70 2.52 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 0.00 107 P 0.00 4.00 0.00 1.75 1.23 0.00 3.46 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 1.33 1.46 0.00 108 V 7.12 4.19 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 1.01 0.00 0.00 0.76 0.00 0.00 109 G 8.52 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 0.00 110 F 8.48 3.80 0.00 3.03 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 0.00 111 T 7.34 3.71 4.45 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 1.41 0.00 0.00 112 L 7.19 4.16 0.00 1.69 1.79 0.96 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 113 R 7.87 4.14 0.00 1.55 1.85 0.00 3.05 0.00 0.00 3.17 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.74 0.00 114 N 7.23 5.00 0.00 1.59 2.56 0.00 0.00 6.76 7.68 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 0.00 115 T 8.27 4.93 4.36 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 1.27 0.00 0.00 116 V 8.32 4.10 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 0.53 0.00 0.00 -0.04 0.00 0.00 117 C 9.52 4.53 0.00 2.99 3.01 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 0.00 0.00 0.00 118 T 8.69 3.82 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 1.20 0.00 0.00 119 V 7.58 3.69 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 0.78 0.00 0.00 0.93 0.00 0.00 120 C 8.03 4.09 0.00 2.97 3.01 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 0.00 0.00 0.00 121 G 8.83 3.87 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 0.00 0.00 0.00 122 M 7.33 4.73 0.00 2.16 2.02 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.73 0.00 123 W 8.45 4.75 0.00 3.76 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 0.00 124 K 9.44 4.20 0.00 1.97 1.84 0.00 1.85 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.50 1.45 7.81 125 G 9.80 3.90 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 0.00 0.00 0.00 126 Y 8.22 4.75 0.00 3.22 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 0.00 127 G 8.61 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 0.00 0.00 0.00 0.00 128 C 8.17 4.34 0.00 3.13 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 0.00 129 S 8.79 4.07 0.00 4.00 3.78 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 * Residues marked with a * may have inaccurate shift predictions.