NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4784 8.3349 117.0943 57.9697 63.6154 172.7785 3 V 4.5707 7.9773 118.1960 57.9970 35.7856 173.6025 4 L 4.4617 9.0315 122.9405 54.5958 44.6612 175.6143 5 T 4.8338 8.5740 118.3004 62.3995 70.1466 174.0673 6 Q 5.1648 8.2702 124.3029 53.0916 32.8156 173.7481 7 P 4.2582 0.0000 0.0000 63.1762 32.4207 176.0134 *9 S 4.7209 8.5780 114.5625 58.1537 64.7104 173.4463 10 S 5.3520 7.9067 111.2835 56.7081 65.9616 173.8886 11 V 4.6325 9.0838 121.1745 60.1855 34.8852 174.3010 12 S 5.1257 8.4633 115.7246 57.0580 65.5157 172.5637 13 A 4.6614 8.6048 126.0592 50.8662 23.2940 175.2558 14 A 4.4897 8.4480 120.7931 50.4921 20.2285 175.5269 15 P 4.3534 0.0000 0.0000 64.5944 31.8200 177.1942 16 G 3.9567 8.8848 110.9403 45.3308 0.0000 173.8362 17 Q 4.2879 7.6013 118.4014 55.3388 30.4182 174.8380 18 K 4.8514 8.3741 122.8912 55.5422 33.3073 176.1200 19 V 4.5918 8.9132 126.2682 60.2074 35.2418 174.4602 20 T 4.9018 8.3034 117.2891 61.8704 72.1330 173.2373 21 I 4.5410 8.4248 126.9105 59.5276 39.6128 175.3706 22 S 5.2127 8.7837 121.9399 57.8210 65.3439 174.5800 23 C 4.9988 9.2523 121.0942 55.8263 47.7039 172.6379 24 S 5.3239 9.4534 123.3419 56.4550 65.3294 172.7684 25 G 4.0573 8.9476 114.0699 45.3044 0.0000 171.7596 26 S 4.7429 8.5715 119.1562 56.9139 65.8606 175.1225 27 T 3.7802 8.5507 110.0586 64.6962 68.4799 176.0679 *29 S 4.6729 8.2058 114.8681 57.1051 66.0473 174.5214 30 N 5.1678 8.3676 114.9456 51.8898 37.4920 176.2412 31 I 3.7644 8.7787 113.0074 62.2407 38.7257 174.7021 32 G 4.4208 8.9235 116.6260 46.1574 0.0000 174.3095 33 N 4.5146 8.0312 117.6499 54.2596 40.1945 173.8768 *39 N 5.1678 7.5911 112.7666 53.4418 40.1420 173.3800 40 Y 4.9076 8.3999 116.6624 57.5837 39.1395 175.5544 41 V 4.7389 8.4862 122.2406 61.2808 34.2637 174.5836 42 S 5.0884 8.8605 121.4208 56.4076 66.7528 172.7665 43 W 5.6359 8.9127 119.7328 55.2853 33.1545 174.1053 44 Y 5.3483 9.6063 120.7254 56.3869 41.6190 174.0368 45 Q 4.5762 9.1850 125.0558 54.4857 31.7738 174.2064 46 Q 4.5771 8.5667 126.4291 54.5593 32.1953 173.8842 47 H 4.7727 8.6675 124.0946 54.7059 30.3514 173.5931 48 P 4.4123 0.0000 0.0000 64.5669 31.6273 175.5602 49 G 4.1421 9.1560 111.2268 45.0909 0.0000 173.7778 50 K 4.3487 7.5800 117.0961 55.1062 34.1079 176.4048 51 A 4.1546 8.1786 122.5948 51.2627 18.9702 175.8955 52 P 4.7573 0.0000 0.0000 63.0285 32.5131 175.8050 53 K 4.6592 9.0754 122.4811 54.3534 35.5991 175.1501 54 L 4.2184 8.9776 129.9001 56.0464 41.9384 175.8012 55 M 4.5039 9.0891 126.1619 56.3619 34.3097 176.7869 56 I 5.0810 7.5637 118.0956 59.7884 41.9261 174.0724 57 Y 5.1326 8.6229 123.8750 54.8741 42.0067 174.4507 58 D 4.4675 8.7834 116.1594 55.6497 39.0141 175.5920 *67 V 4.4209 7.9375 111.9410 61.0600 33.5616 177.5658 68 S 4.7632 7.5364 108.6780 57.2630 64.3495 173.7951 69 K 4.0675 7.8067 122.0897 55.6077 32.6865 175.7440 70 R 4.9841 8.0259 121.4976 53.6230 32.2736 174.7449 71 P 4.6430 0.0000 0.0000 62.1030 32.1323 175.8205 72 S 4.2389 8.5611 115.8283 60.8131 63.0627 175.2118 73 G 4.0423 8.9605 112.8453 45.4478 0.0000 173.8950 74 V 3.7378 7.3159 119.8423 61.5638 32.2057 174.0840 75 P 4.5112 0.0000 0.0000 62.7864 31.6852 176.7831 76 D 4.6560 8.6284 119.3051 54.9536 39.9323 177.4077 77 R 3.9886 7.9722 117.3187 58.9828 30.5533 176.5969 78 F 4.8844 8.0726 118.9110 56.9519 39.7137 175.4766 79 S 4.7074 9.1293 117.0963 56.9259 66.7753 173.0358 80 G 4.7623 8.6770 106.8830 43.7322 0.0000 171.5369 81 S 4.8435 8.7094 115.3936 57.3375 67.1172 172.5377 82 K 5.1277 8.3314 119.7290 55.3948 35.4434 175.2766 83 S 4.3721 9.5012 121.3510 56.6883 65.7365 174.3260 84 G 3.6379 8.9594 117.9450 47.3867 0.0000 173.7070 *87 N 4.9260 8.6712 121.9293 52.2596 41.0203 171.9014 88 S 5.2654 8.2265 114.0842 56.4656 65.6625 172.7441 89 A 5.3714 9.3735 127.0381 50.4738 23.2694 174.9779 90 S 5.2274 9.1188 114.3854 56.8316 67.6503 172.9900 91 L 4.1865 8.0743 126.7737 53.4750 43.2179 174.6085 92 D 5.1783 8.5985 126.6905 52.6370 43.6640 175.5736 93 I 4.5924 8.3401 123.2849 59.4270 40.2888 175.0467 94 S 4.5734 8.4373 122.2372 56.5845 65.1291 173.8439 95 G 3.8059 8.2455 106.5623 45.7456 0.0000 174.1366 96 L 3.8160 7.4219 119.2769 55.6467 43.0011 175.8905 97 Q 4.9897 8.9936 124.0971 53.7836 31.8955 176.7079 98 S 4.2012 8.7588 116.3538 61.8820 62.9638 176.9548 99 E 4.1724 8.1311 116.3080 58.7623 29.5090 177.6493 100 D 4.7057 8.0402 118.9845 56.3864 41.1717 176.0434 101 E 4.2421 7.9581 120.0353 57.3353 30.0765 176.0467 102 A 4.3320 8.2386 126.1157 51.9646 23.8563 173.9997 103 D 5.1867 8.1213 118.5838 53.7264 42.9231 175.9073 104 Y 5.1763 9.0340 120.4383 56.5106 41.1662 174.0674 105 Y 5.2413 9.4373 122.5637 56.3547 40.9429 173.4195 106 C 4.4770 8.6815 118.2215 54.8512 44.4108 171.8703 107 A 4.7044 7.9401 118.3033 51.3778 22.5903 175.2078 108 A 4.7384 7.6650 119.1289 50.4722 23.4874 175.8671 109 W 4.3915 8.9119 130.5269 57.5399 32.6104 174.1473 110 D 5.0925 7.8799 126.8661 52.5651 41.9039 176.9075 111 D 4.5893 9.3081 127.5410 57.2834 40.9648 178.1641 112 S 4.1384 8.1881 113.9397 60.9413 63.2801 176.0900 *134 L 4.1397 7.5856 117.8520 53.0033 43.7272 176.4774 135 S 3.6335 7.3692 113.5440 58.6444 60.8434 171.5933 136 E 4.1451 5.9000 117.2131 54.6147 34.5674 175.9176 137 F 4.5886 8.5068 125.5596 57.8093 40.3872 174.4537 138 L 4.5714 7.8605 125.9108 52.8643 44.5744 175.5915 139 F 4.9274 8.4330 121.0145 55.4759 41.6968 175.6597 140 G 4.6125 8.9946 109.8024 46.2027 0.0000 174.0492 141 T 4.1775 8.5887 109.7273 62.6171 69.2937 175.5924 142 G 3.3802 8.4597 109.2135 45.8679 0.0000 172.5496 143 T 4.8731 8.2795 118.2577 61.3526 71.9493 173.3082 144 K 5.0279 8.8487 126.5351 55.1961 33.1854 175.6012 145 L 5.1401 9.2393 128.9541 53.8819 44.0745 175.0167 146 T 4.8004 8.7843 116.9269 59.8500 71.3570 173.3279 147 V 4.2478 8.3496 126.9010 61.4286 32.0631 175.7331 148 L 4.2750 8.8059 127.9912 55.0832 41.0531 177.3557 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 S 8.33 4.48 0.00 3.65 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 3 V 7.98 4.57 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 0.90 0.00 0.00 0.94 0.00 0.00 4 L 9.03 4.46 0.00 1.69 1.51 0.81 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 5 T 8.57 4.83 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 1.23 0.00 0.00 6 Q 8.27 5.16 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.89 0.00 0.00 0.00 0.00 0.00 2.56 2.31 0.00 7 P 0.00 4.26 0.00 2.20 2.08 0.00 3.99 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.99 0.00 *9 S 8.58 4.72 0.00 3.97 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 10 S 7.91 5.35 0.00 3.87 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 11 V 9.08 4.63 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 0.65 0.00 0.00 0.90 0.00 0.00 12 S 8.46 5.13 0.00 3.84 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 13 A 8.60 4.66 1.19 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 0.00 0.00 0.00 0.00 0.00 14 A 8.45 4.49 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 15 P 0.00 4.35 0.00 2.04 2.03 0.00 3.68 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 2.04 2.12 0.00 16 G 8.88 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 17 Q 7.60 4.29 0.00 2.09 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.84 0.00 0.00 0.00 0.00 0.00 2.32 2.54 0.00 18 K 8.37 4.85 0.00 1.69 1.63 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.28 1.34 7.81 19 V 8.91 4.59 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 0.46 0.00 0.00 0.85 0.00 0.00 20 T 8.30 4.90 4.18 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 1.21 0.00 0.00 21 I 8.42 4.54 1.56 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.67 1.16 0.00 0.00 22 S 8.78 5.21 0.00 3.95 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 23 C 9.25 5.00 0.00 3.03 3.17 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 24 S 9.45 5.32 0.00 3.74 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 25 G 8.95 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 26 S 8.57 4.74 0.00 3.96 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 27 T 8.55 3.78 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 1.22 0.00 0.00 *29 S 8.21 4.67 0.00 4.03 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 0.00 30 N 8.37 5.17 0.00 2.81 2.78 0.00 0.00 7.15 7.21 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 31 I 8.78 3.76 1.88 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 1.33 0.50 1.00 0.00 0.00 32 G 8.92 4.42 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 N 8.03 4.51 0.00 3.05 2.85 0.00 0.00 7.28 6.59 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 *39 N 7.59 5.17 0.00 2.88 2.88 0.00 0.00 7.27 7.46 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 40 Y 8.40 4.91 0.00 2.87 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 41 V 8.49 4.74 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 0.75 0.00 0.00 0.94 0.00 0.00 42 S 8.86 5.09 0.00 3.84 4.07 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 0.00 0.00 0.00 43 W 8.91 5.64 0.00 3.23 3.19 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 0.00 0.00 0.00 44 Y 9.61 5.35 0.00 3.18 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 45 Q 9.19 4.58 0.00 2.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.75 0.00 0.00 0.00 0.00 0.00 1.91 1.63 0.00 46 Q 8.57 4.58 0.00 2.19 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.75 0.00 0.00 0.00 0.00 0.00 2.26 2.43 0.00 47 H 8.67 4.77 0.00 3.13 3.19 0.00 5.69 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 P 0.00 4.41 0.00 2.06 2.03 0.00 3.73 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.13 0.00 49 G 9.16 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 50 K 7.58 4.35 0.00 1.91 1.85 0.00 1.66 0.00 0.00 1.84 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.64 1.39 7.81 51 A 8.18 4.15 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 52 P 0.00 4.76 0.00 1.94 2.03 0.00 3.57 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.97 0.00 53 K 9.08 4.66 0.00 1.80 1.74 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.76 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.39 7.81 54 L 8.98 4.22 0.00 1.84 1.63 0.98 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 55 M 9.09 4.50 0.00 1.66 2.20 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.81 0.00 56 I 7.56 5.08 2.11 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.75 1.05 0.00 0.00 57 Y 8.62 5.13 0.00 3.09 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 58 D 8.78 4.47 0.00 2.64 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.94 4.42 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 0.89 0.00 0.00 0.87 0.00 0.00 68 S 7.54 4.76 0.00 3.84 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 69 K 7.81 4.07 0.00 0.79 0.88 0.00 1.48 0.00 0.00 1.53 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.10 1.14 7.81 70 R 8.03 4.98 0.00 1.79 1.87 0.00 3.39 0.00 0.00 3.61 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.61 0.00 71 P 0.00 4.64 0.00 2.24 2.03 0.00 3.81 0.00 0.00 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.33 0.00 72 S 8.56 4.24 0.00 3.88 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 73 G 8.96 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 74 V 7.32 3.74 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 0.77 0.00 0.00 0.93 0.00 0.00 75 P 0.00 4.51 0.00 2.41 2.27 0.00 3.81 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.16 0.00 76 D 8.63 4.66 0.00 2.81 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 77 R 7.97 3.99 0.00 1.86 2.16 0.00 2.66 0.00 0.00 3.35 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.01 0.00 78 F 8.07 4.88 0.00 3.08 2.96 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 79 S 9.13 4.71 0.00 3.77 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 80 G 8.68 4.76 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 0.00 0.00 0.00 81 S 8.71 4.84 0.00 3.90 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 82 K 8.33 5.13 0.00 1.82 1.70 0.00 1.84 0.00 0.00 1.69 0.00 0.00 2.78 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.37 1.50 7.81 83 S 9.50 4.37 0.00 3.87 3.67 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 84 G 8.96 3.64 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *87 N 8.67 4.93 0.00 2.74 2.94 0.00 0.00 6.24 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 88 S 8.23 5.27 0.00 3.92 3.83 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 0.00 0.00 0.00 89 A 9.37 5.37 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 90 S 9.12 5.23 0.00 3.74 3.65 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 91 L 8.07 4.19 0.00 0.27 0.16 0.56 0.85 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 92 D 8.60 5.18 0.00 2.47 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 93 I 8.34 4.59 1.52 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.28 0.13 0.00 0.00 94 S 8.44 4.57 0.00 3.79 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 95 G 8.25 3.81 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 0.00 0.00 0.00 96 L 7.42 3.82 0.00 1.91 1.55 0.83 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 97 Q 8.99 4.99 0.00 2.25 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.52 0.00 0.00 0.00 0.00 0.00 2.27 2.38 0.00 98 S 8.76 4.20 0.00 3.90 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 99 E 8.13 4.17 0.00 2.13 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 2.50 2.46 0.00 100 D 8.04 4.71 0.00 2.96 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 0.00 101 E 7.96 4.24 0.00 2.12 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 2.39 2.63 0.00 102 A 8.24 4.33 0.96 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 0.00 103 D 8.12 5.19 0.00 2.79 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 0.00 104 Y 9.03 5.18 0.00 2.93 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 0.00 105 Y 9.44 5.24 0.00 3.12 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 0.00 106 C 8.68 4.48 0.00 1.93 1.18 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 0.00 107 A 7.94 4.70 0.79 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 0.00 0.00 108 A 7.67 4.74 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 0.00 109 W 8.91 4.39 0.00 3.65 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 0.00 110 D 7.88 5.09 0.00 2.56 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 0.00 0.00 0.00 0.00 111 D 9.31 4.59 0.00 2.70 2.79 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 0.00 112 S 8.19 4.14 0.00 4.01 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 *134 L 7.59 4.14 0.00 1.56 1.61 0.85 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 135 S 7.37 3.63 0.00 4.02 4.07 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 0.00 0.00 0.00 136 E 5.90 4.15 0.00 1.56 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.16 0.00 137 F 8.51 4.59 0.00 3.15 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 0.00 138 L 7.86 4.57 0.00 1.50 1.25 0.77 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 139 F 8.43 4.93 0.00 2.97 2.89 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 0.00 140 G 8.99 4.61 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 0.00 0.00 0.00 0.00 0.00 0.00 141 T 8.59 4.18 4.28 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 1.25 0.00 0.00 142 G 8.46 3.38 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 0.00 143 T 8.28 4.87 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 0.00 144 K 8.85 5.03 0.00 1.75 1.77 0.00 1.67 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 1.64 1.42 7.81 145 L 9.24 5.14 0.00 1.86 1.99 0.90 0.37 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 0.00 146 T 8.78 4.80 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 0.00 147 V 8.35 4.25 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 0.77 0.00 0.00 1.01 0.00 0.00 148 L 8.81 4.28 0.00 1.56 1.57 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.