NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 L 4.3189 8.1849 122.5221 54.8727 44.1680 177.3597 4 L 3.6613 7.6630 118.3584 54.4106 42.1898 176.5225 5 D 4.3677 8.5806 123.0719 57.5819 41.8260 178.7697 6 S 4.3461 7.6928 111.6295 60.5033 63.1320 174.8518 7 F 4.8486 7.7562 118.7445 58.7756 38.9559 176.2466 8 K 4.4550 8.0356 119.3564 56.1200 32.3807 176.5805 9 V 4.4759 7.4786 118.8503 59.4530 33.6709 175.1180 10 D 4.5651 9.3007 123.5594 54.0768 40.3019 176.5384 11 H 4.3017 8.9065 125.2841 58.6183 28.9301 177.1803 12 T 4.1381 8.3668 108.4988 63.0455 68.9705 175.4840 13 K 4.2577 7.4845 122.8650 54.6825 30.8672 175.1653 *15 N 4.5340 7.9052 118.3720 53.2025 40.0499 173.7061 16 A 4.7447 7.8851 118.7542 50.3353 22.1994 174.6672 17 P 4.7289 0.0000 0.0000 62.9708 32.7833 175.3162 18 A 4.9025 9.2440 123.2467 51.2906 23.4392 175.0717 19 V 5.0602 8.5666 119.9605 61.4339 34.1160 174.8315 20 R 5.2429 8.9173 126.7324 53.5715 33.7436 173.9478 21 I 4.0708 8.6127 126.9466 60.9156 36.8444 175.6501 22 A 4.3211 8.9461 131.1065 54.4734 18.7902 177.3145 23 K 4.4059 7.3322 111.6159 56.7862 35.5289 174.1867 24 T 5.1704 8.0978 109.8318 58.4744 71.9215 172.9450 *26 L 4.2389 8.1659 120.3271 54.6879 42.7012 177.5055 27 T 4.2531 8.6881 113.7984 60.2695 69.9024 173.7238 28 P 4.1985 0.0000 0.0000 65.9484 31.1747 178.2232 29 K 4.0693 7.8962 113.9504 57.2828 32.2038 177.6848 30 G 4.1091 8.1624 107.7615 45.0804 0.0000 173.5535 31 D 4.7313 8.3014 119.6987 53.7847 42.6839 174.9656 32 N 5.1920 8.5886 117.9060 51.9564 40.9461 174.0066 33 I 4.9961 8.2844 123.1165 59.7963 40.8935 174.4787 34 T 4.7310 8.8997 122.5816 61.6074 72.3417 172.9567 35 V 4.6434 8.5590 125.4205 61.1442 34.2282 174.0988 36 F 5.2275 9.0069 125.9850 55.8470 42.1618 174.1517 37 D 4.4742 9.5877 123.5846 53.1642 42.3463 175.2039 38 L 4.9598 9.0165 128.7761 53.3292 41.8889 174.7087 39 R 4.5222 9.1312 123.9848 55.9091 30.2751 176.5038 40 F 4.5098 9.5069 126.3692 60.0360 39.7043 176.0124 41 C 5.1549 8.3893 114.4102 57.5939 31.1704 174.3687 42 I 3.9035 9.1370 123.2086 60.3664 36.9337 174.3172 43 P 4.3982 0.0000 0.0000 64.5050 31.5291 175.8408 44 N 4.3480 9.0759 117.6789 53.9125 36.1834 174.8902 45 K 4.5574 8.2142 117.5403 56.5446 34.7487 176.3233 46 E 4.8255 7.8640 115.2488 54.8388 33.5198 174.1128 47 I 4.5970 7.8538 119.3074 59.9362 41.0051 173.9599 48 L 4.6040 8.6383 128.8044 53.9106 42.7910 177.0444 49 S 4.3135 8.5021 116.5662 57.6565 64.1882 173.3694 50 P 4.2112 0.0000 0.0000 65.8575 31.1170 179.2600 51 K 4.2425 8.0168 116.9502 59.2026 32.0320 179.5907 52 G 3.5873 8.2598 106.2099 47.8597 0.0000 175.7086 53 I 3.7682 8.1949 121.5191 63.6271 37.7656 177.5658 54 H 4.3306 7.9070 119.7243 59.5026 29.7197 177.4051 55 T 3.9014 8.0659 117.6386 66.5287 68.2498 176.5276 56 L 4.0360 8.3960 122.7399 57.9826 42.0629 178.5738 57 E 4.1114 8.5460 119.3702 59.6656 29.6793 178.4961 58 H 4.1620 8.1637 115.9407 58.9522 28.7909 177.8683 59 L 3.6396 7.7492 120.1114 57.6543 41.2886 179.3431 60 F 4.4378 8.6802 119.3755 61.4284 39.3912 176.7752 61 A 3.9813 7.9940 119.2913 54.5688 18.4399 179.6596 62 G 3.5465 7.4033 103.6951 47.5769 0.0000 178.0524 63 F 5.1936 7.7877 122.7003 56.7136 38.9750 177.7694 *65 R 4.2370 8.0487 119.4590 56.4521 31.7933 177.9646 66 D 4.3440 8.0021 117.3879 57.5804 40.8538 178.0549 67 H 4.5706 8.1576 114.0574 56.6759 29.2590 175.7417 68 L 4.5126 7.7147 119.5225 55.8130 43.8075 176.5882 69 N 4.6088 8.1001 115.9453 53.5253 39.3392 174.7325 70 G 4.0776 8.6852 109.6893 45.5059 0.0000 173.0371 71 D 4.3857 9.0189 118.2787 57.0502 40.7708 177.7536 72 S 4.7500 7.9913 111.0991 58.0519 63.8577 173.5195 73 I 4.9087 7.7083 121.5082 59.6001 41.4459 174.0149 74 E 4.8596 9.1016 127.0451 54.2823 32.4850 174.4746 75 I 4.0437 9.1439 129.5721 62.0817 37.2198 176.4041 76 I 4.0989 8.7505 128.8681 63.4697 37.4760 175.6687 77 D 4.7291 7.4496 118.0841 53.2261 44.6465 174.4071 78 I 4.9106 8.3090 123.9713 59.9379 40.3298 174.7940 79 S 5.0023 9.2817 122.6632 55.7420 67.2425 173.1281 80 P 3.8414 0.0000 0.0000 62.4186 30.5967 177.7187 *82 G 3.9620 8.6838 101.9845 45.6102 0.0000 173.5975 83 C 4.0613 7.9753 112.7467 58.4315 30.1801 173.8152 84 R 3.5754 7.4155 119.2062 57.8531 27.8582 177.1418 85 T 4.5402 7.3881 102.1177 60.4877 69.5664 174.2742 86 G 4.1241 6.5546 107.9995 46.3164 0.0000 171.8263 87 F 4.9238 8.2150 116.6859 56.2065 43.7356 174.6660 88 Y 5.4155 9.0547 119.6219 55.7447 41.2391 174.4975 *90 S 4.9669 8.3521 113.2090 59.0435 64.7705 172.8060 91 L 5.0373 8.7534 120.9159 55.0146 44.5337 173.9043 92 I 4.4812 9.5200 121.7037 60.1591 38.5272 175.9191 93 G 4.1834 7.5598 113.6886 44.0051 0.0000 172.6307 94 T 4.7720 7.8309 112.3659 60.4200 67.3767 172.1845 95 P 4.4695 0.0000 0.0000 62.6521 32.7092 176.3717 96 N 4.9381 8.3841 118.3092 51.7913 40.5422 175.7267 97 E 4.0936 8.7680 118.9701 59.6754 29.4189 179.3276 98 Q 3.9222 8.1479 118.9241 59.1766 29.0928 178.0668 99 K 3.8976 8.6177 120.8514 59.5495 32.1680 178.9046 100 V 3.4740 7.6609 118.4245 65.9216 31.3629 178.2323 101 S 4.3206 8.6236 114.4930 61.5388 62.8729 176.3159 102 E 3.9339 8.4357 121.9604 58.8873 29.1987 179.0242 103 A 4.0322 7.8938 121.2592 54.4895 18.1946 179.5155 104 W 4.3830 8.2250 126.3042 60.7286 30.9632 177.4989 105 L 3.9367 7.9223 118.7457 58.3169 41.7758 178.6115 106 A 4.1127 7.9531 120.2894 54.7906 18.2877 179.8796 107 S 4.4361 8.0978 114.2057 58.9384 62.6965 176.6285 *109 Q 4.2602 8.1133 122.2160 56.1754 30.9586 177.5817 110 D 4.0722 7.9244 117.6262 57.1552 40.5566 179.0092 111 V 3.9272 7.8427 118.6367 66.2418 31.3698 178.1345 112 L 4.0749 7.5289 116.2835 57.5312 41.4844 179.3436 113 G 3.9542 7.7170 104.1922 45.7016 0.0000 174.4887 114 V 4.0399 7.4984 120.4105 62.1820 31.5322 175.2868 115 Q 4.2784 8.5658 126.3864 57.9318 29.3144 176.7512 116 D 4.8857 7.6997 115.4631 51.0847 42.6827 175.9780 117 Q 3.8600 8.8222 122.0324 59.2320 29.2414 178.3144 118 A 4.0268 7.9291 119.2772 54.5783 18.5041 178.0226 119 S 4.1871 8.1135 109.5578 59.7622 62.6429 174.0770 120 I 4.1743 7.6290 121.3593 59.7480 35.9877 173.5749 121 P 4.4002 0.0000 0.0000 65.6850 31.2301 178.4522 122 E 4.8507 7.9979 110.6549 56.5275 29.8168 177.6958 123 L 4.4780 7.3046 121.3743 53.3959 40.1443 174.6898 124 N 4.7173 7.4508 118.2992 50.6600 40.9778 176.3879 125 I 3.5382 7.2511 111.4200 63.4395 37.7468 177.0112 126 Y 4.2614 7.7366 118.3106 60.1650 38.2192 176.0838 127 Q 4.5849 8.8103 116.5342 55.6596 29.8484 174.5916 128 C 5.0920 7.8468 117.7424 57.2972 34.7092 174.2230 129 G 3.8270 8.8319 114.2022 48.3278 0.0000 174.5869 130 S 4.7651 7.7637 115.5171 56.9117 64.1384 173.9960 131 Y 4.3263 8.3662 120.3434 59.5560 38.1652 178.4183 132 T 3.8895 7.1223 108.3116 61.9716 70.1194 174.6074 133 E 4.2720 7.7774 125.6393 55.5516 28.3419 175.0157 134 H 5.0042 7.3452 115.6087 53.9191 33.5366 175.2309 135 S 4.4505 9.0366 116.4115 56.5206 64.0050 174.6558 136 L 3.9487 8.9943 132.0040 57.7943 41.9238 178.3992 137 E 4.0000 8.0811 118.2777 59.4778 29.3764 178.8782 138 D 4.3684 8.0385 118.2202 57.2368 40.8442 178.6186 139 A 4.0363 8.0138 121.3291 55.5187 18.3213 179.3872 140 H 4.2593 8.6771 115.1275 59.0761 28.7875 177.6307 141 E 3.9681 8.3849 121.0692 59.2999 29.4278 178.9840 142 I 3.7726 8.2365 119.9429 64.2725 37.1362 178.1452 143 A 4.1005 8.2732 121.6591 55.3513 18.1815 179.8093 144 K 3.8795 8.2926 117.0371 59.6472 32.0600 179.1383 145 N 4.2847 8.2387 117.3931 56.5975 38.8595 177.2029 146 V 3.4445 8.0099 119.8005 65.9136 31.3638 178.1304 147 I 3.5716 7.7585 118.6689 64.2906 37.0021 178.0146 148 A 4.0890 8.0191 120.8771 55.0014 18.2951 179.4526 149 R 4.0507 8.0414 115.5669 55.9732 30.5624 178.2452 150 G 3.9490 7.5342 102.3789 45.5805 0.0000 172.6037 151 I 4.1794 7.7843 120.0189 59.2235 39.4309 175.7388 152 G 4.2704 8.5532 116.2198 45.3428 0.0000 172.0585 153 V 5.2178 8.2519 119.6437 61.4425 35.0578 175.4961 154 N 5.1684 9.1641 123.6095 51.3827 42.0844 173.6368 155 K 4.7006 8.4811 121.8658 54.2850 35.0440 176.7996 156 N 4.3353 8.9730 120.5554 56.6586 38.7774 177.0443 157 E 3.9659 8.2778 116.2578 59.4092 29.5849 177.3886 158 D 4.7642 8.0442 115.7054 54.4669 41.1310 176.5714 159 L 4.8024 7.8309 119.4516 54.3233 42.4936 176.5367 160 S 4.4920 8.2070 114.5208 58.7331 63.3314 173.6590 161 L 4.7695 8.3064 123.3469 53.1625 43.8435 176.3974 162 D 4.5425 8.5975 120.8977 54.5327 41.0084 176.4332 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 3 L 8.18 4.32 0.00 1.65 1.81 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 4 L 7.66 3.66 0.00 0.58 0.71 0.81 0.50 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 5 D 8.58 4.37 0.00 2.63 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 6 S 7.69 4.35 0.00 4.14 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 7 F 7.76 4.85 0.00 3.19 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 8 K 8.04 4.45 0.00 1.88 1.88 0.00 1.67 0.00 0.00 1.77 0.00 0.00 3.06 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.57 7.81 9 V 7.48 4.48 2.12 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 0.81 0.00 0.00 0.94 0.00 0.00 10 D 9.30 4.57 0.00 2.73 2.70 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 0.00 0.00 0.00 11 H 8.91 4.30 0.00 3.17 3.42 0.00 5.95 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 T 8.37 4.14 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 13 K 7.48 4.26 0.00 1.94 1.82 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.41 1.53 7.81 *15 N 7.91 4.53 0.00 2.75 2.79 0.00 0.00 6.98 7.35 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 16 A 7.89 4.74 1.24 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 0.00 0.00 0.00 17 P 0.00 4.73 0.00 1.75 1.57 0.00 3.66 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.01 0.00 18 A 9.24 4.90 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 19 V 8.57 5.06 2.25 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 1.17 0.00 0.00 1.27 0.00 0.00 20 R 8.92 5.24 0.00 1.96 1.77 0.00 3.22 0.00 0.00 3.30 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.67 0.00 21 I 8.61 4.07 1.83 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.76 0.68 0.00 0.00 22 A 8.95 4.32 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 0.00 0.00 0.00 0.00 0.00 23 K 7.33 4.41 0.00 1.73 1.81 0.00 1.36 0.00 0.00 1.78 0.00 0.00 2.81 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.24 1.28 7.81 24 T 8.10 5.17 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 1.13 0.00 0.00 *26 L 8.17 4.24 0.00 1.67 1.69 0.92 0.87 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 27 T 8.69 4.25 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 1.26 0.00 0.00 28 P 0.00 4.20 0.00 2.05 2.18 0.00 3.67 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 2.13 0.00 29 K 7.90 4.07 0.00 1.74 1.86 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.43 7.81 30 G 8.16 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 31 D 8.30 4.73 0.00 2.66 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 32 N 8.59 5.19 0.00 2.65 2.72 0.00 0.00 6.66 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 33 I 8.28 5.00 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.84 0.90 0.00 0.00 34 T 8.90 4.73 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 0.54 0.00 0.00 35 V 8.56 4.64 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 1.13 0.00 0.00 0.89 0.00 0.00 36 F 9.01 5.23 0.00 3.06 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 37 D 9.59 4.47 0.00 2.70 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 38 L 9.02 4.96 0.00 1.66 0.72 0.87 0.61 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 39 R 9.13 4.52 0.00 2.24 2.10 0.00 3.27 0.00 0.00 3.42 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.91 0.00 40 F 9.51 4.51 0.00 3.12 3.27 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 41 C 8.39 5.15 0.00 2.89 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 42 I 9.14 3.90 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.84 0.94 0.00 0.00 43 P 0.00 4.40 0.00 2.11 2.13 0.00 3.87 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.21 0.00 44 N 9.08 4.35 0.00 2.89 2.93 0.00 0.00 6.84 7.61 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 45 K 8.21 4.56 0.00 1.84 1.81 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.57 1.53 7.81 46 E 7.86 4.83 0.00 1.93 1.82 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 2.23 2.30 0.00 47 I 7.85 4.60 1.88 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.79 0.91 0.00 0.00 48 L 8.64 4.60 0.00 1.68 1.51 0.98 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.50 4.31 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 50 P 0.00 4.21 0.00 2.14 2.10 0.00 3.57 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 51 K 8.02 4.24 0.00 1.78 1.71 0.00 1.64 0.00 0.00 1.86 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.62 1.47 7.81 52 G 8.26 3.59 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 0.00 0.00 0.00 53 I 8.19 3.77 1.86 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.08 0.92 0.00 0.00 54 H 7.91 4.33 0.00 3.24 3.42 0.00 5.66 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 T 8.07 3.90 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 1.21 0.00 0.00 56 L 8.40 4.04 0.00 1.89 1.94 0.96 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 57 E 8.55 4.11 0.00 2.62 2.41 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 2.50 2.68 0.00 58 H 8.16 4.16 0.00 3.33 3.41 0.00 5.69 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 L 7.75 3.64 0.00 1.78 1.75 1.04 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 60 F 8.68 4.44 0.00 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0.00 0.00 0.00 0.00 0.00 139 A 8.01 4.04 1.40 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 0.00 0.00 0.00 140 H 8.68 4.26 0.00 3.35 3.36 0.00 5.65 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 E 8.38 3.97 0.00 2.18 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 2.34 2.38 0.00 142 I 8.24 3.77 2.12 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 1.54 0.68 1.21 0.00 0.00 143 A 8.27 4.10 1.46 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 0.00 0.00 0.00 144 K 8.29 3.88 0.00 1.83 1.88 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.69 7.81 145 N 8.24 4.28 0.00 2.86 3.08 0.00 0.00 6.84 7.83 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 0.00 146 V 8.01 3.44 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 0.36 0.00 0.00 0.89 0.00 0.00 147 I 7.76 3.57 1.96 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 1.38 0.69 0.86 0.00 0.00 148 A 8.02 4.09 1.29 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 0.00 0.00 149 R 8.04 4.05 0.00 1.77 1.93 0.00 3.21 0.00 0.00 3.35 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.69 0.00 150 G 7.53 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 0.00 151 I 7.78 4.18 1.49 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.06 0.03 0.42 0.00 0.00 152 G 8.55 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 0.00 0.00 0.00 0.00 153 V 8.25 5.22 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 0.89 0.00 0.00 0.96 0.00 0.00 154 N 9.16 5.17 0.00 2.71 2.69 0.00 0.00 6.75 6.95 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 0.00 155 K 8.48 4.70 0.00 1.97 2.05 0.00 1.83 0.00 0.00 1.84 0.00 0.00 2.94 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.45 1.44 7.81 156 N 8.97 4.34 0.00 2.79 2.91 0.00 0.00 7.14 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 0.00 157 E 8.28 3.97 0.00 1.95 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 2.33 2.41 0.00 158 D 8.04 4.76 0.00 2.70 2.70 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 0.00 0.00 0.00 159 L 7.83 4.80 0.00 1.69 1.63 0.94 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 160 S 8.21 4.49 0.00 3.87 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 0.00 161 L 8.31 4.77 0.00 1.64 1.59 0.98 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 162 D 8.60 4.54 0.00 2.65 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 * Residues marked with a * may have inaccurate shift predictions.