NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 31 L 4.3280 8.0427 120.6284 54.4609 44.9338 178.3916 32 E 3.8418 8.3343 118.1497 57.2430 28.7608 174.0629 33 E 4.0343 9.3385 124.1088 58.2558 31.6226 176.7696 34 Q 4.2723 7.4467 117.4089 57.4408 29.6207 176.3040 35 L 4.5653 8.2585 116.7407 55.3742 42.0791 176.3277 36 N 4.7034 7.8661 116.0618 54.7137 39.9641 175.7556 37 K 3.7443 8.1871 121.8579 59.8988 32.3994 177.6936 38 S 4.4028 8.1358 113.3516 59.8705 62.3547 174.8821 39 L 3.9258 7.9483 122.4563 58.0552 41.9899 179.8489 40 K 3.9234 8.7814 120.2995 59.7363 32.1062 178.9015 41 T 4.1472 7.2578 107.3867 63.8239 69.0048 176.3482 42 I 3.9042 7.9931 123.7376 64.4013 37.3285 177.9721 43 A 4.0105 8.1567 121.6797 55.0898 17.9095 179.2772 44 S 3.9819 8.4983 112.1822 61.5140 62.2711 176.0417 45 Q 4.2452 7.9878 119.5477 57.4855 29.0587 177.0027 46 K 3.8778 8.2153 121.1729 59.5714 32.0845 178.4565 47 A 3.9878 7.9540 120.3729 54.9932 18.0565 179.1593 48 A 3.9564 7.4812 119.5219 55.2867 18.3911 179.5990 49 I 3.7757 7.6290 117.5706 63.7509 37.7042 177.7943 50 E 4.0025 8.5237 120.5392 59.5453 28.7555 178.8721 51 N 4.3922 8.6431 116.9396 56.9113 38.5471 175.8905 52 Y 4.0889 7.7124 120.5449 60.3586 38.4967 177.5615 53 N 4.2272 8.8611 116.5033 56.9635 37.6456 177.1910 54 Q 3.9140 8.0379 118.9280 59.1317 28.7640 179.2255 55 L 4.5233 7.3842 120.8434 56.6112 42.3514 178.5263 56 K 3.8673 7.9562 119.9062 59.5759 32.2113 178.6250 57 E 4.0000 9.2271 119.8730 59.3155 28.8024 178.8855 58 D 4.4623 7.5117 116.9462 56.7620 40.9457 178.2117 59 Y 4.1734 8.3538 120.7366 60.8083 38.7843 177.5488 60 N 4.1144 8.4642 117.3784 56.6728 38.4721 177.1534 61 T 3.8090 7.5185 115.5638 67.2395 68.9376 175.9991 62 L 4.0811 8.1539 120.3618 57.6932 41.4120 179.6087 63 K 3.8387 8.1052 119.6293 59.1055 31.7914 178.9893 64 R 4.0320 8.1989 119.0581 58.7044 30.0673 177.7081 65 E 4.3097 7.9941 116.5050 57.5502 29.6379 177.9026 66 L 4.1103 7.4828 120.9100 57.4910 41.9462 178.4539 67 S 4.0713 7.8306 116.6576 61.7149 63.2033 175.7770 68 D 4.4429 7.7881 120.6317 57.6987 40.5249 178.0806 69 R 4.3267 7.9450 116.1377 56.8382 30.1966 177.1062 70 D 4.4627 7.9454 117.6112 54.9717 41.6515 176.3268 71 D 4.8110 7.7012 118.4551 56.1729 42.2841 177.7771 72 E 4.1312 7.5899 118.5817 58.0377 29.3620 179.1557 73 V 3.5733 7.5231 118.7455 65.5985 31.7714 177.8846 74 K 3.9563 7.8263 116.3304 59.4221 32.5122 178.6597 75 R 4.0159 8.4756 119.3649 59.6613 29.3963 178.1820 76 L 4.9681 7.3904 119.2606 56.0396 41.6124 178.4147 77 R 4.3684 7.6830 116.0245 56.8069 30.1308 177.0680 78 E 4.5878 7.7831 118.5099 57.0534 31.6642 177.4846 79 D 4.5231 7.7094 117.0163 56.1090 40.7767 178.5996 80 I 3.8832 7.5980 120.6749 64.1564 36.0123 177.7603 81 A 4.1222 7.6627 121.1646 54.3652 18.0475 179.9345 82 K 3.9262 7.7619 117.1136 59.6598 32.5372 178.8533 83 E 4.2427 7.8616 115.9394 57.8363 29.2762 177.7203 84 N 4.7695 7.8214 115.4382 53.1655 39.0952 175.1921 85 E 4.5621 7.5110 119.8178 55.8827 31.7343 176.7143 86 L 4.5188 7.7903 118.2107 55.7479 42.5958 177.5317 87 R 4.6846 7.6553 116.0499 56.6746 30.2728 177.1947 88 T 4.5807 7.7679 113.5281 62.7824 70.9755 174.8162 89 K 4.1838 7.8987 121.6278 57.9564 33.0375 177.4415 90 A 4.4183 8.0594 119.0033 53.4692 18.3322 177.3711 91 E 4.7190 8.1030 114.0823 55.8966 30.4464 175.9645 92 E 4.5173 7.9436 118.3741 57.4412 32.6245 177.9524 93 E 4.0193 8.4781 116.9747 58.9825 29.4231 178.7756 94 A 4.1354 7.8725 121.3982 54.5203 18.6358 178.4688 95 D 4.3992 8.0140 115.6226 56.0384 41.0943 177.7626 96 K 4.2530 7.7213 118.7721 59.1963 33.3003 178.1426 97 L 3.9699 7.4810 120.2030 58.0459 41.9553 178.5916 98 N 4.4724 8.2446 115.9628 56.2817 38.4640 177.4222 99 K 3.9847 7.3506 117.9228 58.0989 32.0367 177.5258 100 E 4.4934 7.9662 118.9446 56.2421 30.3814 176.9711 101 V 3.9694 8.7372 118.3986 64.9255 32.0154 177.3823 102 E 3.9277 8.0478 119.1747 58.9940 29.6781 177.7991 103 D 4.3956 8.1787 118.9563 57.2911 39.1167 177.7088 104 L 3.8774 7.8820 119.8511 58.1592 41.6222 178.4587 105 T 3.9201 7.4571 109.5775 64.9475 69.1122 176.4030 106 A 3.9810 8.6153 123.7907 55.1923 18.2535 179.3709 107 S 4.2779 7.8900 109.6013 60.5551 62.2816 175.6757 108 L 4.1382 7.9189 123.5575 57.8218 41.8030 178.6595 109 F 4.2740 8.5792 120.9823 61.3424 39.2647 176.7080 110 D 4.4155 7.9712 113.8146 55.4256 40.5604 176.8485 111 E 4.4921 7.8836 118.5993 55.8947 30.6027 176.7408 112 A 4.2300 8.2258 119.9544 53.6079 18.6940 178.1478 113 N 4.4539 7.6368 113.7085 54.2299 38.8992 176.3231 114 N 4.5717 7.8522 116.9054 54.5586 39.1650 176.4469 115 L 4.1893 7.5924 121.5854 56.9106 42.2462 178.8751 116 V 3.5606 7.2271 118.8786 65.8976 31.3212 177.8042 117 A 4.2519 7.4279 118.0808 54.8894 18.1494 179.0208 118 D 4.3583 7.4582 114.6923 57.5220 41.6551 177.8857 119 A 4.1474 7.9283 121.2002 55.1594 16.9015 179.8050 120 R 3.8994 8.2649 114.5615 57.8661 30.6532 177.8066 *122 E 4.5776 8.1678 118.2395 55.9008 31.7362 178.3249 123 K 3.9825 8.2699 118.6731 59.5492 31.9028 178.8474 124 Y 4.0275 7.6136 114.6279 60.3790 37.5544 178.4381 125 A 4.0066 7.8198 121.9944 55.2793 18.4287 179.5664 126 I 3.6340 7.6476 115.1984 64.3155 37.8542 177.0863 127 E 4.1149 8.4005 120.5892 59.0691 29.2850 179.0414 128 I 3.8123 8.5388 119.7496 64.5853 37.2391 178.8103 129 L 4.0570 8.3613 119.8600 57.1447 41.5455 178.2986 130 N 4.7743 7.7853 113.8356 53.6298 38.7765 176.9370 131 K 3.9965 8.0212 122.5571 59.3038 30.8491 178.6445 132 R 4.7324 7.8517 119.8455 58.6988 30.1010 177.7516 133 L 4.1199 7.6574 118.3008 57.3961 41.7970 178.5360 134 T 4.1555 7.6521 115.3135 65.8578 68.6579 175.8308 135 E 4.3769 8.4519 118.7081 56.9084 28.9902 177.4806 136 Q 4.2959 7.3545 116.9223 57.3677 30.4536 177.0192 137 L 4.2796 7.8145 117.6848 56.1513 42.4040 177.5074 138 R 4.4557 7.6048 115.4914 57.1487 31.3559 176.9377 139 E 4.4956 8.0991 115.5666 56.1734 29.9347 176.4986 140 K 4.4376 7.6642 118.3249 56.6441 32.9419 176.0886 141 D 4.8023 7.6578 118.4019 55.1513 41.4296 177.5864 *143 L 4.3042 7.8243 120.4025 54.2303 43.2812 177.9466 144 L 4.3530 7.2321 119.5866 55.7308 42.2508 176.8229 145 D 4.4665 7.8673 116.6427 55.4340 41.5480 177.3173 146 T 4.4629 7.5651 115.4826 64.2774 69.1233 175.6492 147 L 4.2841 8.0705 119.7277 56.1050 41.6194 177.7420 148 T 4.4485 7.2955 111.1503 61.6781 68.0575 174.1826 149 L 4.5354 7.7885 119.7318 55.8521 43.1573 176.1318 150 Q 4.5567 7.9946 115.3455 56.2505 30.9128 176.6098 151 L 4.3541 7.2370 113.5004 54.8940 42.5625 177.4557 152 K 4.2544 7.8949 117.6364 57.0390 32.5587 176.3350 153 N 4.7530 7.8162 114.7956 54.9528 40.3818 173.5819 154 L 4.1251 7.3664 125.5934 55.1762 42.1712 176.1435 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 31 L 8.04 4.33 0.00 1.72 1.79 0.92 0.50 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 32 E 8.33 3.84 0.00 2.08 1.70 0.00 0.00 0.00 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 2.36 0.00 33 E 9.34 4.03 0.00 2.08 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 2.38 2.38 0.00 34 Q 7.45 4.27 0.00 1.85 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.55 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 35 L 8.26 4.57 0.00 1.73 1.65 0.94 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 36 N 7.87 4.70 0.00 2.73 2.76 0.00 0.00 6.77 6.75 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 37 K 8.19 3.74 0.00 2.21 1.95 0.00 1.78 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.47 7.81 38 S 8.14 4.40 0.00 3.99 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 39 L 7.95 3.93 0.00 1.97 1.72 0.92 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 40 K 8.78 3.92 0.00 1.86 1.85 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.44 7.81 41 T 7.26 4.15 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 1.27 0.00 0.00 42 I 7.99 3.90 2.02 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 1.45 0.94 0.91 0.00 0.00 43 A 8.16 4.01 1.35 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 0.00 0.00 44 S 8.50 3.98 0.00 4.03 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 45 Q 7.99 4.25 0.00 2.21 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.56 0.00 0.00 0.00 0.00 0.00 2.27 2.57 0.00 46 K 8.22 3.88 0.00 1.86 1.82 0.00 1.54 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.44 1.51 7.81 47 A 7.95 3.99 1.33 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 48 A 7.48 3.96 1.33 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 49 I 7.63 3.78 1.89 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.09 0.95 0.00 0.00 50 E 8.52 4.00 0.00 2.12 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 0.00 2.33 2.39 0.00 51 N 8.64 4.39 0.00 3.01 2.88 0.00 0.00 6.55 7.12 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 52 Y 7.71 4.09 0.00 3.00 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 53 N 8.86 4.23 0.00 2.88 2.93 0.00 0.00 7.16 7.25 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 54 Q 8.04 3.91 0.00 2.37 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.74 0.00 0.00 0.00 0.00 0.00 2.40 2.52 0.00 55 L 7.38 4.52 0.00 1.72 1.63 0.90 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 56 K 7.96 3.87 0.00 1.43 1.83 0.00 1.76 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.38 7.81 57 E 9.23 4.00 0.00 1.91 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 2.34 2.57 0.00 58 D 7.51 4.46 0.00 2.85 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 59 Y 8.35 4.17 0.00 2.86 3.09 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 60 N 8.46 4.11 0.00 2.80 2.81 0.00 0.00 7.04 6.62 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 61 T 7.52 3.81 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 1.19 0.00 0.00 62 L 8.15 4.08 0.00 1.63 1.67 0.93 0.54 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 63 K 8.11 3.84 0.00 1.27 1.58 0.00 0.80 0.00 0.00 1.30 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.23 1.24 7.81 64 R 8.20 4.03 0.00 2.06 1.91 0.00 3.14 0.00 0.00 3.14 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.74 0.00 65 E 7.99 4.31 0.00 2.09 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 2.28 2.54 0.00 66 L 7.48 4.11 0.00 1.74 1.66 0.90 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 67 S 7.83 4.07 0.00 3.84 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 68 D 7.79 4.44 0.00 2.93 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 69 R 7.95 4.33 0.00 1.98 1.92 0.00 3.15 0.00 0.00 3.08 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 70 D 7.95 4.46 0.00 2.84 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 71 D 7.70 4.81 0.00 2.79 2.64 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 72 E 7.59 4.13 0.00 2.12 1.98 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 2.48 2.45 0.00 73 V 7.52 3.57 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 1.07 0.00 0.00 1.00 0.00 0.00 74 K 7.83 3.96 0.00 1.76 1.85 0.00 1.82 0.00 0.00 1.63 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.60 7.81 75 R 8.48 4.02 0.00 1.87 2.00 0.00 3.08 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 76 L 7.39 4.97 0.00 1.88 1.69 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 77 R 7.68 4.37 0.00 1.97 1.96 0.00 3.10 0.00 0.00 3.22 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.91 0.00 78 E 7.78 4.59 0.00 2.11 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 0.00 2.49 2.44 0.00 79 D 7.71 4.52 0.00 2.79 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 80 I 7.60 3.88 1.87 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 1.57 0.89 0.91 0.00 0.00 81 A 7.66 4.12 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 82 K 7.76 3.93 0.00 1.97 1.85 0.00 1.68 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.79 1.46 7.81 83 E 7.86 4.24 0.00 2.06 1.98 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 2.32 2.34 0.00 84 N 7.82 4.77 0.00 2.80 2.83 0.00 0.00 6.68 7.72 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 85 E 7.51 4.56 0.00 2.10 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 2.20 2.29 0.00 86 L 7.79 4.52 0.00 1.73 1.67 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 87 R 7.66 4.68 0.00 2.06 1.93 0.00 3.10 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.58 0.00 88 T 7.77 4.58 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 1.21 0.00 0.00 89 K 7.90 4.18 0.00 1.89 1.93 0.00 1.71 0.00 0.00 1.82 0.00 0.00 3.08 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.58 1.41 7.81 90 A 8.06 4.42 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 91 E 8.10 4.72 0.00 1.93 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 0.00 2.20 2.34 0.00 92 E 7.94 4.52 0.00 2.10 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 2.28 2.42 0.00 93 E 8.48 4.02 0.00 2.18 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 0.00 2.56 2.32 0.00 94 A 7.87 4.14 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 D 8.01 4.40 0.00 2.87 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 96 K 7.72 4.25 0.00 1.98 2.03 0.00 1.38 0.00 0.00 1.57 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.37 7.81 97 L 7.48 3.97 0.00 1.82 1.91 0.92 0.83 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 98 N 8.24 4.47 0.00 2.96 2.83 0.00 0.00 7.11 7.30 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 99 K 7.35 3.98 0.00 1.99 1.87 0.00 1.88 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.48 1.45 7.81 100 E 7.97 4.49 0.00 2.16 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 2.21 2.27 0.00 101 V 8.74 3.97 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 0.95 0.00 0.00 0.95 0.00 0.00 102 E 8.05 3.93 0.00 2.06 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 0.00 2.36 2.34 0.00 103 D 8.18 4.40 0.00 2.91 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 0.00 104 L 7.88 3.88 0.00 1.83 1.77 0.93 0.76 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 0.00 105 T 7.46 3.92 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 0.00 106 A 8.62 3.98 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 0.00 107 S 7.89 4.28 0.00 3.94 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 0.00 108 L 7.92 4.14 0.00 1.94 1.80 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 109 F 8.58 4.27 0.00 3.20 3.29 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 0.00 110 D 7.97 4.42 0.00 2.75 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 0.00 111 E 7.88 4.49 0.00 2.14 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 2.16 2.41 0.00 112 A 8.23 4.23 1.21 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 0.00 113 N 7.64 4.45 0.00 2.46 2.68 0.00 0.00 7.12 6.92 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 0.00 114 N 7.85 4.57 0.00 2.71 2.82 0.00 0.00 6.79 6.74 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 0.00 115 L 7.59 4.19 0.00 1.80 1.63 0.91 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 116 V 7.23 3.56 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 0.82 0.00 0.00 0.93 0.00 0.00 117 A 7.43 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 0.00 118 D 7.46 4.36 0.00 2.72 2.82 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 0.00 119 A 7.93 4.15 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 0.00 120 R 8.26 3.90 0.00 1.90 1.98 0.00 3.10 0.00 0.00 3.15 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.96 0.00 *122 E 8.17 4.58 0.00 2.25 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 2.59 0.00 123 K 8.27 3.98 0.00 1.89 1.83 0.00 1.56 0.00 0.00 1.51 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.42 7.81 124 Y 7.61 4.03 0.00 3.04 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 0.00 125 A 7.82 4.01 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 0.00 126 I 7.65 3.63 1.86 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 1.77 1.12 0.95 0.00 0.00 127 E 8.40 4.11 0.00 2.14 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 2.25 2.41 0.00 128 I 8.54 3.81 2.01 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.81 0.94 0.00 0.00 129 L 8.36 4.06 0.00 1.80 1.73 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 130 N 7.79 4.77 0.00 3.09 2.83 0.00 0.00 6.50 6.78 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 0.00 131 K 8.02 4.00 0.00 1.96 2.03 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.44 7.81 132 R 7.85 4.73 0.00 1.92 2.07 0.00 3.27 0.00 0.00 3.23 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.55 0.00 133 L 7.66 4.12 0.00 1.85 1.74 0.92 0.77 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 0.00 134 T 7.65 4.16 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 1.21 0.00 0.00 135 E 8.45 4.38 0.00 2.00 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 2.33 2.67 0.00 136 Q 7.35 4.30 0.00 2.16 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.83 0.00 0.00 0.00 0.00 0.00 2.27 2.55 0.00 137 L 7.81 4.28 0.00 1.80 1.67 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 138 R 7.60 4.46 0.00 2.01 1.95 0.00 3.19 0.00 0.00 3.22 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 139 E 8.10 4.50 0.00 2.05 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 2.23 2.28 0.00 140 K 7.66 4.44 0.00 1.95 1.80 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.35 1.45 7.81 141 D 7.66 4.80 0.00 2.80 2.64 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 *143 L 7.82 4.30 0.00 1.73 1.75 0.94 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 144 L 7.23 4.35 0.00 2.12 1.81 0.92 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 145 D 7.87 4.47 0.00 2.71 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 0.00 146 T 7.57 4.46 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 0.00 147 L 8.07 4.28 0.00 1.75 1.70 0.93 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 148 T 7.30 4.45 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 1.22 0.00 0.00 149 L 7.79 4.54 0.00 1.91 1.70 0.92 0.70 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 0.00 150 Q 7.99 4.56 0.00 2.12 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.50 0.00 0.00 0.00 0.00 0.00 2.33 2.56 0.00 151 L 7.24 4.35 0.00 1.67 1.70 0.96 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 152 K 7.89 4.25 0.00 1.85 1.85 0.00 1.74 0.00 0.00 1.63 0.00 0.00 3.03 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.38 1.48 7.81 153 N 7.82 4.75 0.00 2.71 2.79 0.00 0.00 6.99 7.78 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 0.00 154 L 7.37 4.13 0.00 1.92 1.53 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.