NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 L 4.3375 8.0433 120.6325 54.4603 43.4979 177.2784 8 E 4.1596 8.2581 117.0829 56.3466 29.5507 175.6705 9 A 4.7278 8.5178 123.8838 53.1358 21.3414 178.8418 10 Q 3.9842 7.9962 115.9969 59.1627 28.7128 178.2647 11 A 4.0193 8.0080 121.5241 55.1901 18.2443 179.2682 12 W 4.2132 8.4052 124.9863 60.5597 30.8448 177.8656 13 A 4.3930 8.2087 121.8467 54.7871 17.6588 179.5430 14 L 3.9379 8.0487 117.4712 58.0291 41.6316 179.8885 15 L 4.0523 7.6866 118.8931 57.3895 41.7678 178.6640 16 E 4.1224 7.8384 117.0690 57.8012 29.1023 177.8954 17 A 4.7598 7.3464 118.7106 51.2533 19.9199 176.8027 18 V 3.9966 7.8134 119.5687 62.3871 32.5168 174.5353 19 Y 4.8927 8.6603 125.3945 56.2513 40.7832 174.6794 20 D 4.6830 9.2152 124.2651 52.2897 42.0118 175.4240 21 P 4.2967 0.0000 0.0000 65.9384 31.6909 177.4035 22 E 4.0759 8.5166 117.3451 58.7253 28.3707 177.7189 23 L 4.4409 7.8955 115.5194 53.5277 42.6420 176.8938 24 G 3.9695 8.1316 106.5694 46.4252 0.0000 173.3419 25 L 4.4260 7.0013 115.0681 51.2825 45.8897 175.7398 26 D 4.1756 6.9493 119.4714 52.8051 41.5113 177.7444 27 V 3.4204 8.2598 115.8807 64.4394 31.4408 179.4098 28 V 3.2508 7.3684 117.5102 66.0518 31.5312 177.7931 29 N 4.4046 8.5577 116.2515 55.9217 38.1135 176.9388 30 L 4.3828 7.8539 119.0205 55.1170 41.7960 177.5756 31 G 4.2161 7.9036 106.2363 47.0654 0.0000 174.7813 32 L 3.8941 8.0234 120.5165 55.5494 41.9702 177.1548 33 I 4.1146 7.4895 119.7162 60.2690 37.3924 174.8629 34 Y 4.8029 8.6897 124.5739 60.0364 38.6422 175.7052 35 D 4.9861 7.7703 117.1589 52.8404 45.2633 174.1341 36 L 5.0588 8.5211 125.6059 53.7792 45.0319 175.3327 37 V 4.6518 9.8024 127.0319 61.3882 34.9565 173.8387 38 V 5.0619 8.7299 127.7580 61.3897 33.8305 175.8575 39 E 4.6353 10.0292 128.1156 53.9751 31.4632 171.8009 40 P 4.4181 0.0000 0.0000 61.6709 32.3470 174.1304 41 P 4.9984 0.0000 0.0000 62.7030 32.4931 175.0623 42 R 5.2077 8.3009 119.3682 55.0210 32.5922 175.1446 43 A 4.9794 9.0902 124.2183 50.4589 22.1272 174.1670 44 Y 5.1017 9.9863 125.1275 56.0144 42.0801 174.8725 45 V 4.5751 7.9793 124.9001 59.8971 35.1825 174.0018 46 R 5.0385 8.4326 123.8056 53.9515 33.0388 174.9188 *48 T 4.2633 8.1214 117.5384 62.0368 68.2019 171.9060 49 L 4.6043 8.0085 122.0577 52.7047 44.5465 176.9148 50 T 3.4265 7.9748 109.1613 62.9217 69.2510 174.8949 51 T 4.5921 7.4686 111.5380 58.7112 71.0772 172.0715 52 P 3.7185 0.0000 0.0000 64.0178 31.4525 174.7627 53 G 3.9463 6.7202 108.6881 43.2229 0.0000 172.2505 54 C 4.5790 8.4418 120.5904 58.1660 29.1281 172.1897 55 P 4.6512 0.0000 0.0000 61.7403 32.3171 176.0593 56 L 4.0398 8.6897 119.9066 57.6820 41.6033 177.4338 57 H 4.6861 7.9910 115.2041 53.7375 30.8259 174.0798 58 D 4.6234 8.3074 125.8136 52.6108 38.7278 176.2253 59 S 4.0902 8.0528 120.4401 61.1925 63.3841 175.4865 60 L 4.1150 8.0284 121.1211 57.8569 41.3503 179.7421 61 G 4.0193 8.1231 106.0705 47.2498 0.0000 174.8357 62 E 3.8784 8.2989 122.5056 58.9790 29.7295 178.7769 63 A 4.1344 9.0337 121.3606 55.2931 18.3500 179.8009 64 V 3.4959 8.1600 117.1537 65.9863 31.5478 178.3029 65 R 3.8745 8.0675 118.5876 59.3701 29.6829 178.5689 66 Q 4.0215 8.0916 118.0695 58.4909 28.8572 178.4643 67 A 4.1118 7.7605 120.0112 54.4806 18.1443 178.8524 68 L 4.3618 7.6741 116.4741 55.9672 41.5453 178.0901 69 S 4.7260 7.7360 113.8967 58.5153 62.7421 174.8627 70 R 4.5738 7.3057 118.3361 56.1864 31.0631 175.5663 71 L 4.2900 7.8208 119.1229 52.8416 42.7641 174.5654 72 P 4.1933 0.0000 0.0000 64.1593 29.8538 175.8103 73 G 3.7861 8.5847 114.0508 46.5775 0.0000 171.3634 74 V 4.3719 7.8997 119.4998 61.2811 32.1451 174.8010 75 E 4.5791 8.7897 125.8170 56.0664 32.0747 175.4772 76 E 4.5058 8.6487 120.5003 54.3752 31.9371 174.2773 77 V 4.7949 8.3678 126.8460 61.0136 33.7152 174.1553 78 E 4.6549 10.0976 129.3295 54.3502 32.1664 174.5304 79 V 4.5040 8.4256 126.5648 61.2414 33.5450 174.3095 80 E 4.3478 8.8734 129.5743 55.1426 30.8852 175.8941 81 V 4.0941 8.2548 125.9019 61.6428 31.8558 174.6767 82 T 4.3581 8.0220 121.7760 60.2919 70.0548 173.6162 83 F 5.0173 8.4094 120.1527 57.0436 39.7682 175.2749 84 E 4.7229 8.3934 120.4359 53.8792 32.0809 174.2757 85 P 4.6059 0.0000 0.0000 61.2245 32.3826 174.2889 86 P 4.6560 0.0000 0.0000 62.4007 31.7689 176.2796 87 W 4.4720 8.9851 132.8308 57.7130 31.5976 174.6911 88 T 4.1795 6.7537 111.8763 59.5878 71.3429 174.6512 89 L 3.4730 7.7089 121.1673 57.2223 41.6536 179.4543 90 A 3.9561 7.0859 120.6016 54.3629 18.0392 178.2202 91 R 4.3364 7.6151 114.1723 56.2426 30.5123 176.6930 92 L 4.4274 7.6447 119.0631 54.4579 42.4362 177.0730 93 S 4.5997 8.6803 116.6503 57.4955 64.3788 175.1841 94 E 4.0324 8.7651 119.9237 59.3135 28.7683 179.6355 95 K 3.9199 7.9969 118.2058 59.5555 32.7433 178.0315 96 A 4.1131 7.8011 120.8516 55.3747 18.1137 179.8996 97 R 4.0124 7.9551 116.0504 59.3767 30.0208 179.4855 98 R 4.4590 7.8074 110.7284 56.9315 29.1472 176.6181 99 L 4.5110 7.8953 119.6840 56.5400 43.9720 177.4296 100 L 4.0959 7.8257 115.8813 53.6302 41.2872 176.5835 101 G 4.0280 7.7765 105.4327 46.5812 0.0000 174.1161 102 W 4.7007 8.2325 123.6760 56.5308 29.4502 176.2125 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 7 L 8.04 4.34 0.00 1.75 1.78 0.94 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 8 E 8.26 4.16 0.00 2.02 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 2.34 2.39 0.00 9 A 8.52 4.73 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 10 Q 8.00 3.98 0.00 2.33 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.83 0.00 0.00 0.00 0.00 0.00 2.48 2.46 0.00 11 A 8.01 4.02 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 12 W 8.41 4.21 0.00 3.49 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 13 A 8.21 4.39 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 14 L 8.05 3.94 0.00 1.70 1.82 0.97 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.69 4.05 0.00 1.34 1.46 0.82 1.00 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 16 E 7.84 4.12 0.00 2.04 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 1.96 2.27 0.00 17 A 7.35 4.76 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 18 V 7.81 4.00 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 0.97 0.00 0.00 0.94 0.00 0.00 19 Y 8.66 4.89 0.00 2.75 2.83 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 20 D 9.22 4.68 0.00 2.50 2.49 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 0.00 0.00 0.00 0.00 21 P 0.00 4.30 0.00 2.21 2.17 0.00 3.80 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.98 0.00 22 E 8.52 4.08 0.00 1.96 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 0.00 2.30 2.50 0.00 23 L 7.90 4.44 0.00 1.64 1.62 1.10 1.41 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 24 G 8.13 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 25 L 7.00 4.43 0.00 1.46 1.24 0.83 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 26 D 6.95 4.18 0.00 2.70 2.32 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 27 V 8.26 3.42 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 0.56 0.00 0.00 0.76 0.00 0.00 28 V 7.37 3.25 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 0.39 0.00 0.00 0.17 0.00 0.00 29 N 8.56 4.40 0.00 2.80 2.83 0.00 0.00 7.15 6.98 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 30 L 7.85 4.38 0.00 1.75 1.68 0.81 0.90 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 31 G 7.90 4.22 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 0.00 32 L 8.02 3.89 0.00 1.56 1.57 0.58 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 33 I 7.49 4.11 1.82 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.53 0.95 0.00 0.00 34 Y 8.69 4.80 0.00 3.12 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 35 D 7.77 4.99 0.00 2.93 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 36 L 8.52 5.06 0.00 1.79 1.67 0.98 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 37 V 9.80 4.65 2.36 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 0.95 0.00 0.00 1.03 0.00 0.00 38 V 8.73 5.06 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 0.88 0.00 0.00 0.99 0.00 0.00 39 E 10.03 4.64 0.00 2.00 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 2.25 2.31 0.00 40 P 0.00 4.42 0.00 2.05 2.22 0.00 3.69 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.16 0.00 41 P 0.00 5.00 0.00 2.12 2.26 0.00 3.83 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 2.07 1.84 0.00 42 R 8.30 5.21 0.00 1.94 1.89 0.00 3.07 0.00 0.00 3.18 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 43 A 9.09 4.98 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 44 Y 9.99 5.10 0.00 2.86 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 45 V 7.98 4.58 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 0.68 0.00 0.00 0.84 0.00 0.00 46 R 8.43 5.04 0.00 1.91 1.86 0.00 3.30 0.00 0.00 3.40 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.41 0.00 *48 T 8.12 4.26 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 0.89 0.00 0.00 49 L 8.01 4.60 0.00 1.97 1.52 1.01 0.72 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 50 T 7.97 3.43 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 0.27 0.00 0.00 51 T 7.47 4.59 4.22 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 1.22 0.00 0.00 52 P 0.00 3.72 0.00 1.99 1.99 0.00 3.71 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 1.88 1.90 0.00 53 G 6.72 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 54 C 8.44 4.58 0.00 3.05 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 55 P 0.00 4.65 0.00 2.19 2.06 0.00 3.84 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 56 L 8.69 4.04 0.00 1.70 1.90 0.94 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 57 H 7.99 4.69 0.00 3.04 3.22 0.00 5.89 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 D 8.31 4.62 0.00 2.76 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.05 4.09 0.00 3.88 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 60 L 8.03 4.12 0.00 1.64 1.63 0.86 0.73 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 61 G 8.12 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 62 E 8.30 3.88 0.00 2.06 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 0.00 2.30 2.52 0.00 63 A 9.03 4.13 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 64 V 8.16 3.50 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 0.89 0.00 0.00 0.89 0.00 0.00 65 R 8.07 3.87 0.00 1.89 2.05 0.00 3.14 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 66 Q 8.09 4.02 0.00 2.20 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.78 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 67 A 7.76 4.11 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 68 L 7.67 4.36 0.00 1.85 1.71 0.88 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 69 S 7.74 4.73 0.00 4.07 4.19 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 70 R 7.31 4.57 0.00 1.78 1.91 0.00 3.20 0.00 0.00 3.33 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 71 L 7.82 4.29 0.00 1.63 1.65 0.98 1.11 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 72 P 0.00 4.19 0.00 2.19 2.14 0.00 3.90 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 73 G 8.58 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 0.00 0.00 0.00 74 V 7.90 4.37 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 0.92 0.00 0.00 0.95 0.00 0.00 75 E 8.79 4.58 0.00 1.87 1.96 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 2.21 2.27 0.00 76 E 8.65 4.51 0.00 2.01 1.96 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 2.21 2.22 0.00 77 V 8.37 4.79 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 0.87 0.00 0.00 0.97 0.00 0.00 78 E 10.10 4.65 0.00 2.16 1.96 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 2.30 2.28 0.00 79 V 8.43 4.50 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 0.76 0.00 0.00 0.85 0.00 0.00 80 E 8.87 4.35 0.00 1.85 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 2.49 2.65 0.00 81 V 8.25 4.09 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 0.42 0.00 0.00 0.86 0.00 0.00 82 T 8.02 4.36 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 1.33 0.00 0.00 83 F 8.41 5.02 0.00 3.14 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 84 E 8.39 4.72 0.00 2.01 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 2.35 2.35 0.00 85 P 0.00 4.61 0.00 2.18 2.01 0.00 3.26 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 86 P 0.00 4.66 0.00 2.30 2.23 0.00 3.83 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.01 0.00 87 W 8.99 4.47 0.00 3.39 3.24 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 88 T 6.75 4.18 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 1.10 0.00 0.00 89 L 7.71 3.47 0.00 1.40 1.58 0.19 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 90 A 7.09 3.96 1.13 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 0.00 0.00 0.00 0.00 0.00 91 R 7.62 4.34 0.00 1.78 2.13 0.00 3.10 0.00 0.00 3.57 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.48 0.00 92 L 7.64 4.43 0.00 1.77 1.74 1.38 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 93 S 8.68 4.60 0.00 4.08 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 94 E 8.77 4.03 0.00 2.12 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 2.43 2.47 0.00 95 K 8.00 3.92 0.00 1.78 1.87 0.00 1.83 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.52 7.81 96 A 7.80 4.11 1.42 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 97 R 7.96 4.01 0.00 2.17 2.09 0.00 3.32 0.00 0.00 3.28 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.85 0.00 98 R 7.81 4.46 0.00 1.99 2.05 0.00 3.02 0.00 0.00 3.24 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.68 0.00 99 L 7.90 4.51 0.00 1.83 1.63 0.94 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 100 L 7.83 4.10 0.00 0.74 0.37 0.33 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 101 G 7.78 4.03 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 0.00 102 W 8.23 4.70 0.00 3.40 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 * Residues marked with a * may have inaccurate shift predictions.