NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 A 4.7492 8.1648 122.9717 51.5278 20.0611 176.3415 -1 N 4.1347 8.1734 116.7529 53.0131 39.2805 172.8800 -1 A 3.7147 8.0134 121.8530 52.4131 19.4805 175.4800 2 T 4.6595 8.4907 116.7089 61.5989 72.0278 172.0735 3 V 4.5583 8.5496 126.1192 60.9385 34.5737 174.5061 4 K 4.7255 9.3234 128.0852 56.3551 33.8523 175.9688 5 M 4.3897 9.3083 125.3207 56.4087 33.2469 175.4568 6 G 4.2183 8.9781 113.9932 46.9861 0.0000 172.7748 7 S 4.4360 8.4547 119.5855 57.6540 63.9823 175.1996 8 D 4.3357 8.5764 121.4188 57.4875 40.6314 177.9147 9 S 4.2776 8.0300 110.7358 58.3991 63.3598 173.5747 10 G 3.6701 8.0833 108.4426 47.2954 0.0000 173.5971 11 A 4.7750 7.9364 120.8323 49.8702 22.0778 177.1407 12 L 4.8207 8.0885 121.4782 53.8517 39.9709 176.4015 13 V 4.4763 7.0483 114.1635 59.6467 37.2014 173.8143 14 F 5.0311 8.6450 120.8703 56.4168 40.3985 175.1164 15 E 4.7745 9.2998 124.9874 53.6189 32.0714 173.1006 16 P 4.8830 0.0000 0.0000 62.4472 32.1716 176.7381 17 S 4.5163 8.9950 116.8185 61.0952 64.2554 173.9683 18 T 5.2249 7.8990 115.8225 61.5997 71.1777 174.1037 19 V 4.6026 8.6277 118.2505 59.7767 36.1189 174.6488 20 T 5.1266 8.4734 119.2852 61.8452 71.2771 173.1816 21 I 4.6769 8.7150 119.1108 59.0441 41.9467 174.0647 22 K 4.9364 9.0066 121.0276 54.3866 34.1037 176.7521 23 A 4.2915 8.6260 127.1060 54.2665 18.7160 177.7628 24 G 4.0305 9.4234 111.3148 45.2611 0.0000 173.8060 25 E 4.5640 8.2084 119.5016 55.6445 31.3823 175.1259 26 E 5.3248 8.6604 117.8607 54.6806 33.3183 175.2625 27 V 4.6998 8.6199 119.4877 60.8595 34.8015 173.8765 28 K 4.9662 8.2025 128.1879 54.4384 34.9106 174.2267 29 W 5.2029 9.4010 127.9949 55.2949 31.2397 175.2512 30 V 4.8718 8.7539 125.0260 60.6690 33.8522 174.0922 31 N 4.3541 9.4703 127.8353 54.3780 39.2156 172.5970 32 N 4.9421 9.2237 124.1379 54.1040 40.5604 174.3337 33 K 4.6346 7.2366 115.3184 55.1715 36.9652 175.6737 34 L 3.8372 8.5310 116.9673 56.0942 38.7132 174.8802 35 S 4.2296 7.8279 113.0639 58.0752 64.0784 173.5512 36 P 4.8933 0.0000 0.0000 61.6656 32.9729 174.3636 37 H 5.1705 8.1220 115.7937 54.6411 33.6872 171.8441 38 N 5.4529 8.5671 116.1483 52.1953 41.4074 172.8696 39 I 4.3036 8.3357 119.3202 59.3246 40.2088 175.1660 40 V 4.3708 8.0597 127.1428 60.8205 34.0716 174.3479 41 F 4.9178 8.8590 127.7351 56.8479 39.7010 175.6265 42 D 4.8234 8.9119 123.0058 52.6971 40.6699 175.8844 43 A 4.5848 8.5182 122.0538 52.0334 19.0759 176.5237 44 D 4.5892 7.5524 119.4197 54.7758 40.2284 177.0454 45 G 3.9824 9.5985 112.9170 45.0295 0.0000 173.0532 46 V 4.4351 6.9661 110.4360 58.3520 35.8423 173.3907 47 P 4.2760 0.0000 0.0000 62.5538 32.1026 177.3729 48 A 3.8756 8.8618 125.9836 55.4420 18.6556 179.1490 *50 D 4.6352 7.9724 114.0709 54.8011 43.2379 178.2154 51 T 3.7936 7.9203 115.2235 66.4855 68.2647 176.2526 52 A 3.9298 7.7754 121.2494 55.1948 18.5300 179.2641 53 A 4.0459 7.9193 118.9655 55.3313 18.2785 180.1118 54 K 3.8543 7.8718 115.6878 59.1940 32.1059 179.0862 55 L 3.8537 7.4176 118.1636 55.7115 41.8513 177.7255 56 S 4.4168 6.7639 114.3352 58.7359 63.5078 174.1628 57 H 4.2933 8.6149 119.7224 53.6520 29.2254 174.5050 58 K 3.8409 8.1045 124.6277 58.4594 32.5157 177.6976 *61 G 3.9110 7.7545 106.2902 44.7368 0.0000 172.2276 62 L 4.4546 8.5074 122.8030 53.9560 42.9543 176.2342 63 L 4.7446 8.5517 123.0915 53.3561 43.3897 176.5670 64 F 4.3759 9.1458 121.2307 58.9862 40.7151 176.5658 65 A 4.2092 8.0227 122.9610 51.3860 18.9675 176.4937 66 A 4.2229 8.3540 124.9370 53.5060 18.9825 177.9854 67 G 4.0668 8.9977 111.8474 45.1582 0.0000 174.1208 68 E 4.3209 7.7716 119.7603 56.6560 30.6657 176.1136 69 S 5.6368 7.9896 115.3378 57.0824 66.7601 172.8221 70 F 5.2965 8.7375 117.0456 56.2518 43.1991 174.0924 71 T 5.3851 8.7909 117.5446 62.1083 72.2165 173.5464 72 S 4.7517 9.0670 120.0364 57.2001 67.3813 172.9356 73 T 4.8859 8.4082 120.4631 62.1690 70.1526 174.3045 74 F 4.4637 9.2727 126.2576 56.2246 39.6768 176.4049 75 T 4.1749 8.5122 114.0016 61.7796 69.6763 174.5003 76 E 4.6902 7.9003 123.1397 53.3336 31.5453 173.5623 77 P 4.5870 0.0000 0.0000 61.9242 32.2242 176.3144 78 G 3.9127 7.6208 109.5752 45.7612 0.0000 170.7329 79 T 5.0287 7.7762 116.1964 62.1371 70.3606 174.1879 80 Y 4.8946 9.6172 126.5028 56.6122 40.0645 175.1971 81 T 5.1552 8.7384 115.5293 60.9389 71.4703 173.3718 82 Y 5.0752 8.2650 121.1994 56.4661 42.2748 172.5312 83 Y 5.2437 8.2710 116.2437 56.4112 42.2856 173.3067 84 C 5.2568 9.0870 120.7635 57.5235 32.4079 173.6674 85 E 4.2143 9.4926 127.4866 59.4062 29.2799 178.2963 86 P 4.3821 0.0000 0.0000 65.0165 31.7796 176.4373 87 H 5.0001 8.0543 116.2751 55.5116 29.6964 175.7076 88 R 3.9062 8.1844 123.1323 59.4317 30.0406 179.0949 89 G 3.5353 8.1410 105.1808 48.5319 0.0000 174.0241 90 A 4.0827 7.9131 120.0369 52.5781 18.5911 177.5414 91 G 3.7960 8.2336 104.2583 46.2887 0.0000 174.6678 92 M 4.4452 7.8210 121.7030 54.3005 31.1209 175.1655 93 V 5.0176 8.1197 115.8365 59.2733 36.4157 174.1576 94 G 3.5896 7.9581 108.3505 45.3494 0.0000 171.0916 95 K 5.3286 8.7832 119.0336 55.2532 36.3267 174.7761 96 V 4.8121 9.4289 127.1418 61.1554 34.4652 174.0303 97 V 4.8016 8.8493 128.6941 61.3506 33.4685 174.2611 98 V 4.7250 9.1320 128.8977 61.1984 33.8012 175.3653 99 E 4.4137 9.0391 126.7380 56.4957 30.0112 175.9212 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 A 8.16 4.75 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 -1 N 8.17 4.13 0.00 2.81 2.70 0.00 0.00 6.63 6.14 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 -1 A 8.01 3.71 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 2 T 8.49 4.66 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 1.18 0.00 0.00 3 V 8.55 4.56 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 1.53 0.00 0.00 0.69 0.00 0.00 4 K 9.32 4.73 0.00 1.77 1.75 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.47 1.57 7.81 5 M 9.31 4.39 0.00 1.73 2.05 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 3.07 0.00 6 G 8.98 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 7 S 8.45 4.44 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 8 D 8.58 4.34 0.00 2.69 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 9 S 8.03 4.28 0.00 3.97 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 10 G 8.08 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 0.00 0.00 0.00 11 A 7.94 4.77 1.20 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 12 L 8.09 4.82 0.00 1.56 1.52 0.78 0.54 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 13 V 7.05 4.48 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 0.74 0.00 0.00 0.96 0.00 0.00 14 F 8.65 5.03 0.00 3.02 3.15 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 0.00 0.00 0.00 15 E 9.30 4.77 0.00 2.08 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 2.21 2.29 0.00 16 P 0.00 4.88 0.00 2.30 2.05 0.00 3.96 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 2.00 1.96 0.00 17 S 8.99 4.52 0.00 3.96 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 0.00 18 T 7.90 5.22 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 19 V 8.63 4.60 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 0.73 0.00 0.00 0.84 0.00 0.00 20 T 8.47 5.13 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 1.26 0.00 0.00 21 I 8.71 4.68 1.92 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.60 0.86 0.00 0.00 22 K 9.01 4.94 0.00 1.83 1.75 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.37 7.81 23 A 8.63 4.29 1.34 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 0.00 0.00 0.00 24 G 9.42 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 25 E 8.21 4.56 0.00 2.02 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 2.30 2.35 0.00 26 E 8.66 5.32 0.00 2.07 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 2.31 2.24 0.00 27 V 8.62 4.70 1.51 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 -0.29 0.00 0.00 0.52 0.00 0.00 28 K 8.20 4.97 0.00 1.79 1.53 0.00 1.77 0.00 0.00 1.82 0.00 0.00 2.84 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.41 1.65 7.81 29 W 9.40 5.20 0.00 3.52 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 30 V 8.75 4.87 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 1.11 0.00 0.00 0.95 0.00 0.00 31 N 9.47 4.35 0.00 2.84 2.84 0.00 0.00 6.37 6.97 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 32 N 9.22 4.94 0.00 2.76 3.03 0.00 0.00 7.29 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 33 K 7.24 4.63 0.00 1.79 1.62 0.00 2.04 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.42 1.44 7.81 34 L 8.53 3.84 0.00 1.77 1.66 0.87 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 35 S 7.83 4.23 0.00 3.75 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.89 0.00 1.33 0.59 0.00 3.21 0.00 0.00 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.57 0.00 37 H 8.12 5.17 0.00 3.05 3.15 0.00 5.62 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 N 8.57 5.45 0.00 2.92 2.91 0.00 0.00 5.93 7.89 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 39 I 8.34 4.30 1.21 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 -0.30 -0.06 -0.58 0.00 0.00 40 V 8.06 4.37 1.03 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 0.79 0.00 0.00 0.79 0.00 0.00 41 F 8.86 4.92 0.00 3.13 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 42 D 8.91 4.82 0.00 2.82 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 43 A 8.52 4.58 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 44 D 7.55 4.59 0.00 2.98 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 45 G 9.60 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 0.00 0.00 0.00 46 V 6.97 4.44 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 0.13 0.00 0.00 0.91 0.00 0.00 47 P 0.00 4.28 0.00 2.17 1.97 0.00 3.60 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 2.11 2.07 0.00 48 A 8.86 3.88 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 *50 D 7.97 4.64 0.00 2.81 2.74 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 0.00 0.00 0.00 0.00 51 T 7.92 3.79 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 1.23 0.00 0.00 52 A 7.78 3.93 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 53 A 7.92 4.05 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 54 K 7.87 3.85 0.00 1.77 1.74 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.57 7.81 55 L 7.42 3.85 0.00 1.05 0.79 -0.03 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 56 S 6.76 4.42 0.00 3.82 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 57 H 8.61 4.29 0.00 2.25 1.31 0.00 5.62 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 K 8.10 3.84 0.00 1.75 1.82 0.00 1.65 0.00 0.00 1.80 0.00 0.00 2.88 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.45 1.34 7.81 *61 G 7.75 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 0.00 0.00 0.00 62 L 8.51 4.45 0.00 1.67 1.14 0.89 0.88 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 63 L 8.55 4.74 0.00 1.63 1.58 0.54 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 64 F 9.15 4.38 0.00 2.97 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 65 A 8.02 4.21 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 66 A 8.35 4.22 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 67 G 9.00 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 0.00 0.00 0.00 68 E 7.77 4.32 0.00 1.89 1.71 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 2.29 2.35 0.00 69 S 7.99 5.64 0.00 3.96 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 F 8.74 5.30 0.00 3.03 2.50 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 0.00 0.00 0.00 71 T 8.79 5.39 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 1.35 0.00 0.00 72 S 9.07 4.75 0.00 4.19 3.32 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 73 T 8.41 4.89 4.17 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 1.23 0.00 0.00 74 F 9.27 4.46 0.00 2.82 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 75 T 8.51 4.17 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 1.19 0.00 0.00 76 E 7.90 4.69 0.00 1.96 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 2.25 2.43 0.00 77 P 0.00 4.59 0.00 2.13 2.02 0.00 3.93 0.00 0.00 3.87 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 78 G 7.62 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 0.00 0.00 0.00 79 T 7.78 5.03 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 1.27 0.00 0.00 80 Y 9.62 4.89 0.00 3.28 3.41 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 81 T 8.74 5.16 4.30 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 1.28 0.00 0.00 82 Y 8.27 5.08 0.00 2.09 1.53 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 83 Y 8.27 5.24 0.00 3.19 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 84 C 9.09 5.26 0.00 3.20 2.97 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 85 E 9.49 4.21 0.00 2.14 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 0.00 2.69 2.35 0.00 86 P 0.00 4.38 0.00 1.91 2.09 0.00 3.74 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 1.74 1.84 0.00 87 H 8.05 5.00 0.00 3.21 3.24 0.00 5.64 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 R 8.18 3.91 0.00 1.87 1.85 0.00 2.44 0.00 0.00 2.89 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.29 0.00 89 G 8.14 3.54 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 0.00 90 A 7.91 4.08 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 91 G 8.23 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 M 7.82 4.45 0.00 2.17 1.99 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.74 0.00 93 V 8.12 5.02 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 0.81 0.00 0.00 0.99 0.00 0.00 94 G 7.96 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 95 K 8.78 5.33 0.00 1.82 1.63 0.00 1.61 0.00 0.00 1.60 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.48 7.81 96 V 9.43 4.81 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 0.14 0.00 0.00 1.14 0.00 0.00 97 V 8.85 4.80 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 0.99 0.00 0.00 0.98 0.00 0.00 98 V 9.13 4.72 2.29 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 1.05 0.00 0.00 0.79 0.00 0.00 99 E 9.04 4.41 0.00 1.92 1.78 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 2.23 2.23 0.00 * Residues marked with a * may have inaccurate shift predictions.