NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 A 4.3931 8.1233 123.5866 51.6735 19.9815 179.1122 10 N 4.1873 9.2632 121.0933 57.8505 38.3258 174.4888 11 S 4.1637 8.8197 117.5237 61.8432 63.2518 176.4112 12 T 3.9689 7.7661 118.3552 66.3582 68.2138 177.0855 13 V 3.5411 7.6930 120.9239 64.7154 31.6978 178.5740 14 L 3.8437 8.2186 120.2229 57.1819 41.1945 179.5091 15 S 4.2104 8.1769 113.3437 61.2517 62.1689 175.7514 16 F 4.4797 7.7892 122.2417 61.9025 39.3025 176.6726 17 C 3.8438 8.2996 116.0472 62.3983 27.6500 175.6754 18 A 3.7177 8.1674 121.8880 54.9476 17.9753 178.9643 19 F 4.3175 7.5422 111.5537 57.1088 38.5571 176.5537 20 A 4.1334 7.0776 122.9284 51.8238 18.7455 179.1010 21 V 3.8991 8.3601 114.4015 63.7677 32.0631 176.2287 22 D 4.7491 7.3782 118.3108 50.1644 41.2672 173.3556 23 P 4.1493 0.0000 0.0000 65.3266 31.5407 177.5404 24 A 3.9572 7.9503 118.8264 54.9260 18.4047 179.4642 25 K 3.9326 8.5860 118.0936 59.2977 32.2219 178.9194 26 A 4.0127 8.0688 121.1860 55.4652 18.3107 178.8999 27 Y 4.2874 7.9460 117.9646 60.7118 38.8159 178.2737 28 K 3.8083 8.1049 120.3789 59.8057 32.1759 178.6652 29 D 4.4277 8.1318 117.5082 57.0816 40.9426 177.8952 30 Y 4.2549 8.1891 120.4644 60.7991 38.7873 178.0807 31 L 3.5957 7.9029 119.4960 57.6747 41.5492 179.3596 32 A 3.6510 7.7399 119.0579 54.5433 18.3174 178.7643 33 S 4.4558 7.6380 111.6774 58.3404 63.3661 174.9737 34 G 3.8233 8.3001 111.1293 45.1214 0.0000 174.1024 35 G 2.6050 6.9920 107.4855 44.2817 0.0000 173.9983 36 Q 4.1031 8.3869 123.6663 54.9620 29.7874 174.4023 37 P 4.7495 0.0000 0.0000 62.1126 32.1524 176.3951 38 I 3.9670 8.3354 122.7252 62.0690 37.6949 176.0472 39 T 4.8143 8.6523 116.1376 61.4261 70.8909 173.3739 40 N 4.2646 7.8679 114.9325 55.1410 36.4333 174.0591 41 C 4.4119 8.1335 115.1856 58.9142 29.4776 173.9474 42 V 3.9865 8.4517 124.6966 61.3765 32.0008 175.6516 43 K 4.3552 8.7435 125.6811 56.2345 32.9206 176.3294 44 M 4.3834 9.1142 125.1634 53.8276 33.5312 176.3655 45 L 4.1384 8.5257 125.9050 54.2237 41.2038 174.7945 46 C 4.8374 7.8734 120.0960 55.8441 32.4230 174.0607 47 T 3.8824 8.2001 112.5721 63.4325 67.0228 174.6730 48 H 4.3930 8.1766 116.0874 56.9815 26.1008 174.7490 49 T 4.5654 7.4320 106.3445 61.0262 69.2036 173.8985 50 G 3.8797 7.8316 112.0551 45.8338 0.0000 174.1658 51 T 3.8384 9.1651 109.4352 62.9839 68.6030 175.8913 52 G 3.9839 8.3660 109.7683 45.0627 0.0000 173.7040 53 Q 4.0428 7.5414 117.8686 55.5531 29.0668 175.7906 54 A 3.8207 8.0890 121.8882 54.0988 18.3458 176.7543 55 I 5.0858 7.2190 114.3445 59.5423 39.7595 174.7251 56 T 4.8109 8.9453 115.9107 60.2996 72.2708 175.2881 57 V 4.0670 8.6310 114.9606 63.5204 31.9997 176.4518 58 T 4.4376 7.5268 108.0155 58.8582 71.4682 171.6440 59 P 4.1834 0.0000 0.0000 63.7764 31.6750 176.1009 60 E 4.6023 10.0429 120.7090 55.6037 31.2876 175.4233 61 A 4.3973 7.6532 122.9346 52.7188 19.2625 178.1099 62 N 5.2715 9.1477 119.8836 51.5269 39.9729 175.3865 63 M 4.0947 8.6004 116.3483 58.8155 32.3138 176.9254 64 D 4.7387 9.1426 117.6103 54.4050 40.9585 175.1127 65 Q 5.2254 7.8733 117.5072 54.3460 33.2321 173.9862 66 E 4.7742 9.0898 117.9679 54.8562 33.7452 175.3740 67 S 5.2688 8.1994 117.7044 56.8850 65.8409 173.1810 68 F 5.0457 9.1289 122.3722 55.1350 43.4942 174.7511 69 G 3.7668 9.0741 109.2120 46.4124 0.0000 174.4788 70 G 3.9129 9.1348 112.9799 48.0122 0.0000 175.4664 71 A 4.0121 8.0863 123.6375 54.8580 18.1131 179.3619 72 S 4.2740 7.5808 108.7739 60.3600 63.3313 174.5002 73 C 4.4342 8.5764 119.6427 59.6462 29.8945 172.5137 74 C 4.4825 7.9823 120.8579 55.3386 44.4312 172.9966 75 L 3.5238 8.3684 130.7766 58.8074 41.4956 178.4966 76 Y 3.8156 7.3957 115.5936 61.0558 37.2450 178.9567 77 C 4.3045 7.9130 117.0956 59.7538 40.2066 176.0284 78 R 3.7227 7.7577 119.0157 58.6208 29.7851 177.7815 79 C 4.1738 7.8738 114.0493 58.9292 29.4036 172.8720 80 H 4.0378 7.3656 116.3312 56.5811 26.1498 173.6609 81 I 4.6050 7.4426 110.0551 58.7056 41.0460 174.7583 82 D 4.3621 8.4589 121.1589 54.9638 41.2157 175.1677 83 H 4.2065 8.2269 116.6292 53.5015 31.3767 172.5157 84 P 4.5411 0.0000 0.0000 63.4224 32.0880 175.5217 85 N 3.7752 7.3340 114.3167 57.1138 38.7735 176.6526 *89 F 4.1570 7.5304 119.7779 58.2254 40.9724 175.0407 90 C 3.7241 7.0935 117.9953 59.6896 24.9555 174.1891 91 D 4.8032 8.6498 122.9135 53.6452 39.3023 176.8581 92 L 4.5142 7.7533 121.1140 55.8352 43.7247 177.0068 93 K 3.8711 7.8910 118.7321 58.2144 32.2280 176.4076 94 G 3.9196 8.9435 114.3283 44.9676 0.0000 172.5742 95 K 4.6097 7.9327 119.1222 54.8960 35.5543 174.4888 96 Y 5.0977 9.1689 117.2993 56.6189 41.9321 175.3009 97 V 4.9173 8.9640 123.2395 61.3669 33.9214 174.3985 98 Q 5.0176 9.3408 128.5852 55.5727 29.6652 175.6713 99 I 4.2401 8.8961 124.6675 58.2916 41.1688 173.3100 100 P 4.4774 0.0000 0.0000 63.2967 31.5937 177.2505 101 T 3.7762 9.1346 122.4729 67.1854 68.5767 175.8336 102 T 4.2374 7.8273 107.9552 63.0172 69.1047 174.2282 103 C 4.6835 8.5718 118.8329 59.1142 29.9883 175.2853 104 A 4.0790 7.4980 123.1218 53.8836 18.0829 178.2123 105 N 4.5583 7.9209 112.4277 54.7552 38.5639 175.2509 106 D 4.7121 8.1526 118.5910 50.8088 41.5661 172.8401 107 P 3.8831 0.0000 0.0000 65.4212 31.2603 177.9054 108 V 4.3319 7.1117 117.4336 65.7560 31.3899 178.4008 109 G 4.4169 8.3960 105.8345 47.3462 0.0000 174.9505 110 F 3.8409 8.4186 123.8253 61.3355 39.0985 177.4319 111 T 3.7345 7.6563 107.6992 64.4656 68.6094 176.4463 112 L 4.1433 7.3142 120.0139 57.7134 41.7991 179.2640 113 R 3.9986 7.6778 116.4523 58.3586 30.2595 177.2295 114 N 4.6874 7.0532 114.1840 52.5805 39.9318 174.2397 115 T 4.9774 8.2586 114.5790 62.0145 72.8004 173.2344 116 V 4.3929 8.3177 124.3128 61.2066 33.1852 175.7392 117 C 4.3227 9.4455 129.2848 57.4104 43.7839 174.6662 118 T 3.9065 8.7486 116.9878 63.9518 69.0808 175.8287 119 V 3.8809 7.8771 121.3890 64.7853 31.8800 175.3147 120 C 4.5368 8.1045 112.1031 54.4686 43.9719 174.8293 121 G 3.9307 8.5641 109.3215 46.2327 0.0000 173.0361 122 M 4.6909 7.0586 118.9377 52.4563 34.5205 175.4971 123 W 4.8817 8.4989 120.5528 56.6626 29.4495 176.3286 124 K 4.2984 8.9633 124.7597 58.0318 31.8775 177.4275 125 G 3.9478 10.1673 111.8783 45.7874 0.0000 173.3373 126 Y 4.9374 8.5390 117.5487 55.6890 39.2309 174.6812 127 G 4.2023 8.6564 118.2279 46.4254 0.0000 172.7921 128 C 3.8425 7.6707 120.6101 60.6340 31.9769 173.6358 129 S 4.3529 8.6986 119.9459 59.0555 61.9599 169.5043 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 9 A 8.12 4.39 1.06 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 0.00 0.00 0.00 0.00 0.00 0.00 10 N 9.26 4.19 0.00 2.82 2.86 0.00 0.00 6.84 6.68 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 11 S 8.82 4.16 0.00 3.88 3.93 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 12 T 7.77 3.97 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 1.22 0.00 0.00 13 V 7.69 3.54 1.64 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 0.72 0.00 0.00 0.16 0.00 0.00 14 L 8.22 3.84 0.00 1.71 1.67 0.84 0.43 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 15 S 8.18 4.21 0.00 4.22 3.93 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 16 F 7.79 4.48 0.00 2.99 3.23 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 17 C 8.30 3.84 0.00 2.81 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 18 A 8.17 3.72 0.99 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 0.00 0.00 19 F 7.54 4.32 0.00 3.07 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 20 A 7.08 4.13 1.01 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 0.00 0.00 21 V 8.36 3.90 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 0.71 0.00 0.00 0.93 0.00 0.00 22 D 7.38 4.75 0.00 2.66 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.15 0.00 2.01 1.93 0.00 3.70 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 2.12 2.33 0.00 24 A 7.95 3.96 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 25 K 8.59 3.93 0.00 2.00 1.95 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.62 1.48 7.81 26 A 8.07 4.01 0.91 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 27 Y 7.95 4.29 0.00 2.95 2.98 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 28 K 8.10 3.81 0.00 2.00 2.02 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.46 7.81 29 D 8.13 4.43 0.00 2.85 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 30 Y 8.19 4.25 0.00 3.33 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 31 L 7.90 3.60 0.00 1.65 1.51 0.46 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 32 A 7.74 3.65 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 33 S 7.64 4.46 0.00 3.78 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 34 G 8.30 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 35 G 6.99 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.39 4.10 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.94 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 37 P 0.00 4.75 0.00 2.16 2.26 0.00 3.79 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 38 I 8.34 3.97 1.77 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.52 0.81 0.00 0.00 39 T 8.65 4.81 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 1.29 0.00 0.00 40 N 7.87 4.26 0.00 2.96 2.98 0.00 0.00 6.96 7.54 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 41 C 8.13 4.41 0.00 3.04 2.87 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 42 V 8.45 3.99 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 0.86 0.00 0.00 0.99 0.00 0.00 43 K 8.74 4.36 0.00 1.63 1.66 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.70 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.80 1.20 7.81 44 M 9.11 4.38 0.00 1.65 1.96 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.78 0.00 45 L 8.53 4.14 0.00 1.55 1.58 0.90 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 46 C 7.87 4.84 0.00 2.91 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 47 T 8.20 3.88 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 1.20 0.00 0.00 48 H 8.18 4.39 0.00 3.34 3.36 0.00 5.69 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 T 7.43 4.57 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 1.24 0.00 0.00 50 G 7.83 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 51 T 9.17 3.84 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 1.25 0.00 0.00 52 G 8.37 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 53 Q 7.54 4.04 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.91 0.00 0.00 0.00 0.00 0.00 2.38 2.30 0.00 54 A 8.09 3.82 -0.11 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 55 I 7.22 5.09 1.78 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 1.46 0.51 0.92 0.00 0.00 56 T 8.95 4.81 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 1.22 0.00 0.00 57 V 8.63 4.07 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 0.78 0.00 0.00 0.97 0.00 0.00 58 T 7.53 4.44 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 1.22 0.00 0.00 59 P 0.00 4.18 0.00 1.80 1.83 0.00 3.18 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.10 0.00 60 E 10.04 4.60 0.00 1.91 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.36 0.00 61 A 7.65 4.40 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 62 N 9.15 5.27 0.00 2.93 3.02 0.00 0.00 6.87 7.50 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 63 M 8.60 4.09 0.00 2.03 2.19 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.52 0.00 64 D 9.14 4.74 0.00 2.80 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 65 Q 7.87 5.23 0.00 1.95 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.87 6.65 0.00 0.00 0.00 0.00 0.00 2.33 2.59 0.00 66 E 9.09 4.77 0.00 1.84 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 2.22 2.44 0.00 67 S 8.20 5.27 0.00 3.60 3.72 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 68 F 9.13 5.05 0.00 3.01 3.03 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 69 G 9.07 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 0.00 0.00 0.00 70 G 9.13 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 71 A 8.09 4.01 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 72 S 7.58 4.27 0.00 4.14 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 73 C 8.58 4.43 0.00 3.04 2.89 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 74 C 7.98 4.48 0.00 3.05 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 75 L 8.37 3.52 0.00 1.35 1.03 0.35 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 7.40 3.82 0.00 2.70 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 77 C 7.91 4.30 0.00 3.21 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 78 R 7.76 3.72 0.00 1.70 1.83 0.00 3.23 0.00 0.00 3.14 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.65 0.00 79 C 7.87 4.17 0.00 2.78 2.75 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 0.00 0.00 0.00 80 H 7.37 4.04 0.00 3.27 3.30 0.00 5.60 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 7.44 4.60 1.77 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.63 0.80 0.00 0.00 82 D 8.46 4.36 0.00 2.69 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 83 H 8.23 4.21 0.00 2.87 2.78 0.00 5.86 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 P 0.00 4.54 0.00 2.03 1.94 0.00 2.77 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.43 0.00 85 N 7.33 3.78 0.00 2.68 2.78 0.00 0.00 6.90 7.45 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 *89 F 7.53 4.16 0.00 2.84 2.75 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 0.00 0.00 0.00 90 C 7.09 3.72 0.00 3.05 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.65 4.80 0.00 2.80 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 92 L 7.75 4.51 0.00 1.76 1.74 1.00 0.82 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 93 K 7.89 3.87 0.00 1.73 1.89 0.00 1.86 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.46 7.81 94 G 8.94 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 0.00 0.00 0.00 95 K 7.93 4.61 0.00 1.76 1.96 0.00 1.61 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.36 1.38 7.81 96 Y 9.17 5.10 0.00 2.94 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 97 V 8.96 4.92 2.30 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 1.35 0.00 0.00 1.09 0.00 0.00 98 Q 9.34 5.02 0.00 2.25 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.36 0.00 0.00 0.00 0.00 0.00 2.51 2.46 0.00 99 I 8.90 4.24 2.03 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.90 0.24 0.00 0.00 100 P 0.00 4.48 0.00 1.64 1.89 0.00 2.20 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.91 0.00 101 T 9.13 3.78 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 0.00 102 T 7.83 4.24 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 1.24 0.00 0.00 103 C 8.57 4.68 0.00 2.53 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 0.00 104 A 7.50 4.08 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 N 7.92 4.56 0.00 2.84 2.98 0.00 0.00 5.78 8.06 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 0.00 106 D 8.15 4.71 0.00 2.75 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 P 0.00 3.88 0.00 1.75 1.12 0.00 3.51 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.42 0.00 108 V 7.11 4.33 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 0.52 0.00 0.00 0.80 0.00 0.00 109 G 8.40 4.42 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 0.00 110 F 8.42 3.84 0.00 3.04 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 0.00 111 T 7.66 3.73 4.42 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 1.39 0.00 0.00 112 L 7.31 4.14 0.00 1.89 1.79 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 113 R 7.68 4.00 0.00 1.79 1.78 0.00 3.07 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 114 N 7.05 4.69 0.00 1.53 2.50 0.00 0.00 6.89 8.01 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 0.00 115 T 8.26 4.98 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 1.28 0.00 0.00 116 V 8.32 4.39 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 0.46 0.00 0.00 0.34 0.00 0.00 117 C 9.45 4.32 0.00 3.30 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 0.00 118 T 8.75 3.91 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 1.26 0.00 0.00 119 V 7.88 3.88 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 0.85 0.00 0.00 0.93 0.00 0.00 120 C 8.10 4.54 0.00 3.14 3.30 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 0.00 121 G 8.56 3.93 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 0.00 0.00 0.00 122 M 7.06 4.69 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.47 0.00 123 W 8.50 4.88 0.00 3.71 3.35 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 0.00 124 K 8.96 4.30 0.00 1.87 1.84 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.01 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.55 1.66 7.81 125 G 10.17 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 0.00 126 Y 8.54 4.94 0.00 3.09 3.03 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 0.00 127 G 8.66 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 0.00 128 C 7.67 3.84 0.00 3.02 2.95 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 0.00 129 S 8.70 4.35 0.00 4.12 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 * Residues marked with a * may have inaccurate shift predictions.