NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 N 4.9219 8.4244 118.1382 52.9027 40.6926 173.9493 3 V 4.0783 7.3151 116.7513 58.8020 32.0864 170.9118 4 P 4.0215 0.0000 0.0000 62.2306 32.8808 176.6615 5 A 4.0826 8.8155 126.2468 55.2231 18.2529 178.2168 6 E 4.2591 7.8842 110.1760 57.0673 30.4267 176.3546 7 L 4.3263 7.0875 118.9093 54.4274 42.9085 176.1683 8 K 4.7921 8.3746 119.4646 55.2723 35.1596 175.2538 9 Y 5.0966 8.9800 118.8445 56.4149 42.6880 174.4423 10 S 5.2344 9.0469 116.1914 56.0994 65.4080 175.3027 11 K 4.1380 8.8151 122.8369 59.6637 32.5559 177.5898 12 E 4.2769 8.1058 117.6954 56.4991 29.9894 175.8341 13 H 4.2489 8.1838 114.4305 57.3266 26.1319 173.7925 14 E 5.2673 7.7443 117.8821 54.2799 34.3534 176.6806 15 W 5.0801 8.1748 118.3043 54.8500 31.8881 174.5933 16 L 5.2451 8.9444 120.0279 53.1171 45.3862 175.4521 17 R 4.8845 9.2767 124.7926 54.1212 32.3345 174.7957 18 K 3.7042 8.7774 128.6171 56.3801 33.0319 176.4897 19 E 4.3258 9.2002 127.9219 54.5677 31.2433 177.0961 20 A 3.9333 8.3443 122.6183 55.4817 18.3705 178.2951 21 D 4.5179 7.9141 112.2331 53.5813 39.4822 177.2934 22 G 3.8244 7.9518 109.7303 45.6735 0.0000 174.1398 23 T 4.3159 7.4114 110.4019 61.5416 71.0036 172.9945 24 Y 5.0829 8.7378 118.9933 56.4441 41.0851 175.4725 25 T 4.4199 8.8861 121.7137 63.0154 70.2523 173.9865 26 V 4.1706 8.0542 125.5683 60.1009 35.1231 174.8449 27 G 3.6202 5.7494 111.7299 45.1822 0.0000 170.9424 28 I 5.0565 8.2240 112.7235 59.2906 40.2353 175.7194 29 T 4.5055 8.4701 113.8804 60.5431 70.4178 175.2717 30 E 3.8544 8.8064 121.9729 59.8967 29.4756 178.3740 31 H 4.1699 8.4601 117.3437 59.2440 30.0526 176.9954 32 A 4.0664 7.9482 122.9659 55.1679 18.1778 179.6441 33 Q 3.9794 8.5505 116.6814 59.0895 28.4706 178.1777 34 E 3.8819 7.9611 120.6374 59.3668 29.7614 178.6876 35 L 4.0976 7.4948 117.0303 57.4932 41.6829 178.9364 36 L 4.1064 7.6869 120.0488 56.6579 42.3936 177.7637 37 G 3.8101 8.2283 106.1638 44.2250 0.0000 172.0413 38 D 4.5296 8.2942 118.1025 54.4993 41.2192 175.5155 39 M 4.4288 9.1787 124.7631 55.1477 33.0223 175.9357 40 V 4.1082 8.6724 118.2407 61.7138 34.2858 175.8933 41 F 5.1883 7.7735 117.2032 55.7448 43.6803 173.9266 42 V 4.9501 8.4647 119.6630 60.1313 34.5389 174.3842 43 D 4.8913 9.1581 123.7092 52.8150 42.6838 175.5093 44 L 4.9399 8.3731 123.7564 52.3721 43.7243 174.7269 45 P 4.4830 0.0000 0.0000 62.4557 32.6960 175.5806 46 E 4.1588 8.4745 119.5379 55.5071 30.1751 176.9349 47 V 3.8332 8.1631 123.2059 64.4449 32.0412 175.8256 48 G 3.9730 9.4203 115.9630 44.9927 0.0000 173.7553 49 A 4.0349 7.7606 122.0553 52.8666 19.4424 176.7053 50 T 4.7460 8.4380 118.9710 62.7444 69.5999 174.7613 51 V 4.6484 8.9863 119.7922 59.6525 35.5024 175.2025 52 S 4.7914 9.3852 119.1765 56.4725 64.4247 173.8959 53 A 4.2099 8.3485 126.4029 54.4545 18.3414 178.3389 54 G 4.0196 9.3764 112.0251 45.0131 0.0000 173.7536 55 D 4.6282 8.2584 120.9312 54.5896 42.0656 175.6986 56 D 4.7886 8.9278 123.1848 53.3326 39.6521 175.4738 57 C 4.8099 8.6462 117.4268 57.6206 30.8501 173.2221 58 A 4.7450 7.4366 120.2221 51.1683 22.8304 175.2492 59 V 4.7160 8.7406 118.3003 61.0950 35.1004 173.9971 60 A 4.9604 9.1264 129.9676 50.2554 21.4107 174.9261 61 E 5.0321 9.3613 124.5283 54.5152 32.1440 175.8548 62 S 5.0500 8.9074 122.5358 55.4119 65.7015 175.3143 63 V 3.5052 8.1465 114.2241 64.0180 30.7995 174.9984 *65 A 4.2618 7.7888 118.8778 51.3038 20.1674 176.1140 66 A 4.7708 8.4620 121.2981 51.2543 20.3576 177.0726 67 S 4.5531 9.3917 116.5484 56.2439 65.5269 173.0840 68 D 4.7471 8.9248 127.3354 54.5882 41.6364 175.7267 69 I 4.3860 8.6765 123.2876 59.7126 39.8483 174.2130 70 Y 5.2549 8.3029 124.2497 55.7931 40.4171 175.6320 71 A 4.3581 8.9376 125.6619 51.9044 18.7622 177.1024 72 P 4.5484 0.0000 0.0000 64.9296 32.0322 176.6300 73 V 4.5504 7.3197 109.6776 59.2550 35.8442 174.8654 74 S 4.6309 9.7662 117.9371 57.4258 64.0055 175.5988 75 G 4.1998 7.3005 109.1967 46.0085 0.0000 169.8625 76 E 5.1173 7.8669 120.7524 54.1025 32.6312 176.8109 77 I 4.2925 8.7924 128.4659 61.9409 37.5166 176.7948 78 V 4.5415 8.9093 120.1970 61.6039 33.5167 175.7715 79 A 4.7691 7.7141 120.0110 51.1358 22.2899 175.4726 80 V 4.9763 8.4737 112.1374 59.7258 36.2689 175.7624 81 N 3.8919 8.2726 121.9159 52.3455 37.9009 175.3140 82 D 4.4122 8.4842 125.3805 56.0074 41.1221 177.7241 83 A 4.0485 7.8414 121.8491 54.7898 17.0129 179.3191 84 L 4.0287 7.7640 117.2141 57.3500 41.3627 179.5588 85 S 4.3775 7.8861 114.8095 60.7343 62.7677 175.1547 86 D 4.8136 7.4025 117.4932 54.4471 43.3947 176.9563 87 S 5.0054 8.5291 113.9045 54.6958 63.4573 173.2751 88 P 4.2512 0.0000 0.0000 65.3849 31.4109 177.9376 89 E 4.2536 8.0802 116.6892 58.4074 29.4133 178.5602 90 L 4.0406 8.1236 122.3050 57.1934 41.3509 179.2781 91 V 3.5909 7.5431 117.7092 65.8441 31.4143 177.5535 92 N 4.9361 8.0893 116.5013 55.4782 38.5908 177.0262 93 S 4.4315 8.1836 115.1429 59.6577 64.5469 173.9467 94 E 4.8696 8.3957 121.6646 54.3987 29.8078 175.1179 95 P 4.3512 0.0000 0.0000 65.2734 31.8587 177.1706 96 Y 3.7937 7.5897 113.8235 57.3605 40.6781 175.3804 97 A 4.5376 8.4275 121.2917 52.1110 18.9884 179.1549 98 G 3.8820 7.0263 114.4086 47.8957 0.0000 174.8252 99 G 3.9470 8.0943 107.7270 44.6723 0.0000 173.8421 100 W 4.4953 7.9353 116.6330 57.4577 28.6941 175.2966 101 I 4.2250 8.9579 121.2700 62.5474 38.6313 175.4786 102 F 5.6296 7.3866 114.2130 55.9100 41.8472 172.2579 103 K 5.1995 9.9281 118.3044 54.6386 35.3571 175.4572 104 I 5.0892 9.0491 123.8215 59.1820 41.7822 174.2763 105 K 4.7381 9.5081 131.3632 54.9085 32.5498 175.3897 106 A 4.7223 8.8212 130.0680 52.3200 18.7557 176.9568 107 S 4.6296 8.9045 115.6640 58.1665 64.4132 173.9987 108 D 4.5493 7.8151 120.2604 51.8388 42.7241 175.2380 109 E 4.0697 8.8040 127.9231 59.1194 29.2271 179.2592 110 S 4.2433 8.2958 113.7625 61.0211 63.4589 176.0982 111 E 4.1088 8.1115 122.8087 59.2224 29.1272 179.0565 112 L 3.9155 7.7830 118.5897 57.8238 41.5613 179.1748 113 E 4.1524 8.0467 116.9754 58.4807 29.4374 178.3635 114 S 4.6063 7.3963 113.1069 57.6196 63.4342 173.9186 115 L 4.5093 6.9202 121.9938 53.9362 42.7613 176.7623 116 L 4.4562 8.6993 122.2067 54.8191 43.1183 176.8451 117 D 5.0684 8.7186 122.3363 52.3577 41.7652 176.9993 118 A 4.1251 9.0423 119.8670 56.0629 18.1484 179.7020 119 T 3.8262 8.0840 113.1348 66.9744 68.3252 176.3435 120 A 4.1528 8.1325 121.0103 54.4780 18.7749 178.9092 121 Y 4.1406 8.2159 118.7556 60.8271 38.8253 177.1225 122 E 3.7192 8.4739 119.7912 59.7146 29.4380 179.5351 123 A 3.9882 7.7246 118.6186 54.7208 18.3891 179.0101 124 L 3.9969 7.8824 118.7529 58.0573 42.4599 178.5354 125 L 3.8921 7.8504 118.9860 57.7478 41.4902 180.1439 126 E 3.6748 8.2237 118.7806 58.6232 29.5727 177.5303 127 D 4.5745 7.7088 121.5589 54.5640 41.4379 175.5694 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 N 8.42 4.92 0.00 2.76 3.04 0.00 0.00 6.62 6.79 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 3 V 7.32 4.08 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 0.71 0.00 0.00 1.00 0.00 0.00 4 P 0.00 4.02 0.00 1.79 1.71 0.00 2.77 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 1.50 0.00 5 A 8.82 4.08 1.27 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 0.00 0.00 6 E 7.88 4.26 0.00 2.06 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 2.17 2.21 0.00 7 L 7.09 4.33 0.00 1.06 1.23 0.19 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 8 K 8.37 4.79 0.00 1.64 1.66 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.86 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.59 7.81 9 Y 8.98 5.10 0.00 2.81 2.37 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 10 S 9.05 5.23 0.00 3.82 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 11 K 8.82 4.14 0.00 1.93 1.97 0.00 1.60 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.46 7.81 12 E 8.11 4.28 0.00 2.06 2.17 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 2.51 2.39 0.00 13 H 8.18 4.25 0.00 3.59 3.65 0.00 5.55 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 E 7.74 5.27 0.00 1.84 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.47 0.00 15 W 8.17 5.08 0.00 3.15 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 16 L 8.94 5.25 0.00 1.55 1.61 0.81 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 17 R 9.28 4.88 0.00 2.09 2.00 0.00 3.05 0.00 0.00 3.03 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.54 0.00 18 K 8.78 3.70 0.00 1.62 1.57 0.00 1.75 0.00 0.00 1.61 0.00 0.00 2.83 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.09 0.67 7.81 19 E 9.20 4.33 0.00 2.00 1.75 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 2.13 2.24 0.00 20 A 8.34 3.93 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 21 D 7.91 4.52 0.00 2.76 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 22 G 7.95 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 23 T 7.41 4.32 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 1.24 0.00 0.00 24 Y 8.74 5.08 0.00 2.98 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 25 T 8.89 4.42 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 1.05 0.00 0.00 26 V 8.05 4.17 0.68 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 0.56 0.00 0.00 0.64 0.00 0.00 27 G 5.75 3.62 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 0.00 0.00 0.00 28 I 8.22 5.06 1.93 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 1.41 0.77 0.89 0.00 0.00 29 T 8.47 4.51 4.65 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 1.53 0.00 0.00 30 E 8.81 3.85 0.00 2.22 2.18 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 2.34 2.71 0.00 31 H 8.46 4.17 0.00 3.40 3.49 0.00 5.92 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 A 7.95 4.07 1.47 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 0.00 0.00 33 Q 8.55 3.98 0.00 2.31 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.73 0.00 0.00 0.00 0.00 0.00 2.41 2.61 0.00 34 E 7.96 3.88 0.00 1.97 2.27 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 2.29 2.36 0.00 35 L 7.49 4.10 0.00 1.84 1.69 0.88 0.74 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 36 L 7.69 4.11 0.00 1.65 1.87 0.92 1.14 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 37 G 8.23 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 38 D 8.29 4.53 0.00 2.68 2.56 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 39 M 9.18 4.43 0.00 2.02 1.92 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 2.57 2.63 0.00 40 V 8.67 4.11 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.80 0.00 0.00 41 F 7.77 5.19 0.00 2.94 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 42 V 8.46 4.95 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 0.72 0.00 0.00 0.98 0.00 0.00 43 D 9.16 4.89 0.00 2.54 2.57 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 44 L 8.37 4.94 0.00 1.49 1.56 0.88 1.13 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 45 P 0.00 4.48 0.00 1.90 2.01 0.00 3.72 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 1.81 1.50 0.00 46 E 8.47 4.16 0.00 1.99 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 2.36 2.21 0.00 47 V 8.16 3.83 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 0.82 0.00 0.00 0.97 0.00 0.00 48 G 9.42 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 49 A 7.76 4.03 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 50 T 8.44 4.75 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 1.21 0.00 0.00 51 V 8.99 4.65 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 0.62 0.00 0.00 0.89 0.00 0.00 52 S 9.39 4.79 0.00 3.99 3.76 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 53 A 8.35 4.21 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 54 G 9.38 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 55 D 8.26 4.63 0.00 2.68 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 56 D 8.93 4.79 0.00 2.49 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 57 C 8.65 4.81 0.00 2.75 2.90 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 58 A 7.44 4.74 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 59 V 8.74 4.72 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 1.00 0.00 0.00 0.87 0.00 0.00 60 A 9.13 4.96 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 61 E 9.36 5.03 0.00 2.08 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 0.00 2.38 2.29 0.00 62 S 8.91 5.05 0.00 3.91 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 63 V 8.15 3.51 2.06 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 0.79 0.00 0.00 0.89 0.00 0.00 *65 A 7.79 4.26 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 66 A 8.46 4.77 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 67 S 9.39 4.55 0.00 3.83 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 D 8.92 4.75 0.00 2.45 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 0.00 0.00 0.00 69 I 8.68 4.39 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 1.21 0.99 1.01 0.00 0.00 70 Y 8.30 5.25 0.00 2.90 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 71 A 8.94 4.36 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 72 P 0.00 4.55 0.00 2.15 2.33 0.00 3.96 0.00 0.00 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.89 0.00 73 V 7.32 4.55 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 0.64 0.00 0.00 0.85 0.00 0.00 74 S 9.77 4.63 0.00 3.91 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 75 G 7.30 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 0.00 0.00 0.00 76 E 7.87 5.12 0.00 2.04 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 2.20 2.39 0.00 77 I 8.79 4.29 1.94 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.56 0.94 0.00 0.00 78 V 8.91 4.54 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 0.74 0.00 0.00 1.00 0.00 0.00 79 A 7.71 4.77 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 80 V 8.47 4.98 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 0.95 0.00 0.00 81 N 8.27 3.89 0.00 1.44 1.87 0.00 0.00 7.56 7.94 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 82 D 8.48 4.41 0.00 2.73 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 A 7.84 4.05 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 84 L 7.76 4.03 0.00 1.66 1.65 0.78 0.58 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 85 S 7.89 4.38 0.00 3.98 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 86 D 7.40 4.81 0.00 2.59 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 S 8.53 5.01 0.00 3.86 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 88 P 0.00 4.25 0.00 2.18 2.34 0.00 3.72 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 1.96 2.03 0.00 89 E 8.08 4.25 0.00 2.15 2.20 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 2.33 2.32 0.00 90 L 8.12 4.04 0.00 1.74 1.84 0.91 1.19 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 91 V 7.54 3.59 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 0.82 0.00 0.00 0.95 0.00 0.00 92 N 8.09 4.94 0.00 2.80 2.90 0.00 0.00 7.29 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 93 S 8.18 4.43 0.00 4.06 4.10 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 0.00 0.00 0.00 0.00 94 E 8.40 4.87 0.00 2.11 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 2.24 2.23 0.00 95 P 0.00 4.35 0.00 1.86 2.20 0.00 3.67 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 1.39 1.77 0.00 96 Y 7.59 3.79 0.00 2.76 2.35 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.43 4.54 1.17 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 98 G 7.03 3.88 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 0.00 0.00 0.00 99 G 8.09 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 0.00 100 W 7.94 4.50 0.00 3.56 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 0.00 101 I 8.96 4.23 1.65 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 1.19 0.94 1.04 0.00 0.00 102 F 7.39 5.63 0.00 3.28 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 0.00 103 K 9.93 5.20 0.00 1.73 1.71 0.00 1.43 0.00 0.00 1.36 0.00 0.00 2.13 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.01 1.08 7.81 104 I 9.05 5.09 2.21 0.00 0.00 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 1.22 1.68 1.14 0.00 0.00 105 K 9.51 4.74 0.00 1.88 1.74 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.43 1.42 7.81 106 A 8.82 4.72 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 0.00 107 S 8.90 4.63 0.00 3.89 3.98 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 0.00 108 D 7.82 4.55 0.00 2.63 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 0.00 109 E 8.80 4.07 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 2.44 2.34 0.00 110 S 8.30 4.24 0.00 4.03 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.11 4.11 0.00 2.13 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 2.34 0.00 112 L 7.78 3.92 0.00 1.83 1.69 1.07 0.52 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 0.00 113 E 8.05 4.15 0.00 1.98 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 2.36 2.49 0.00 114 S 7.40 4.61 0.00 3.98 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 0.00 115 L 6.92 4.51 0.00 1.48 1.75 0.74 1.42 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 0.00 116 L 8.70 4.46 0.00 1.85 1.73 1.10 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 117 D 8.72 5.07 0.00 2.88 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 0.00 118 A 9.04 4.13 1.54 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 0.00 0.00 119 T 8.08 3.83 4.40 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 1.21 0.00 0.00 120 A 8.13 4.15 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 0.00 121 Y 8.22 4.14 0.00 2.86 2.57 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 0.00 122 E 8.47 3.72 0.00 2.07 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 2.28 2.29 0.00 123 A 7.72 3.99 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 0.00 124 L 7.88 4.00 0.00 1.50 1.60 0.90 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 125 L 7.85 3.89 0.00 1.66 1.47 0.80 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 126 E 8.22 3.67 0.00 1.93 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 2.30 2.41 0.00 127 D 7.71 4.57 0.00 2.90 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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.