NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 Q 4.1547 8.3444 121.7008 55.7764 30.2072 174.5251 4 N 4.4444 8.4720 123.5178 51.9541 40.1844 172.7152 5 I 4.0151 8.5303 124.1367 63.0968 40.1562 174.7096 6 L 5.2525 7.9189 123.5327 53.7339 45.1637 175.1578 7 S 5.3216 9.0753 122.1926 56.8722 66.7580 173.7214 8 V 5.1150 8.9437 115.1415 58.9909 36.0704 174.1531 9 H 5.4581 8.4967 116.7444 54.4993 32.8266 171.8250 10 I 4.8044 8.8587 119.3685 59.3284 40.8611 174.2628 11 L 4.8823 8.7885 128.8690 53.0840 44.8796 174.7702 12 N 5.0615 8.9305 125.7677 53.2306 39.0477 175.2936 13 Q 4.2986 9.1612 126.1424 57.7203 28.5385 177.6770 14 Q 4.3289 8.8302 118.4873 57.2295 29.3739 176.6697 15 T 4.3529 8.1662 105.6639 60.5048 70.2322 174.8875 16 G 4.0120 8.2985 109.6030 46.3075 0.0000 173.1409 17 K 4.8176 7.6172 117.4365 53.2334 36.6376 174.2853 18 P 4.8532 0.0000 0.0000 62.7495 32.6143 176.1044 19 A 4.3917 8.4318 124.6142 50.9773 19.6210 176.2765 20 A 4.8146 8.5918 123.9245 51.1643 21.4916 175.5215 21 D 4.3270 8.4184 117.2776 55.3220 40.4735 173.6952 22 V 4.2481 7.5144 117.6982 61.0702 33.2066 175.0849 23 T 4.4383 8.5312 125.1531 63.7873 69.8493 173.3841 24 V 4.7131 9.2292 126.1252 61.3016 34.7324 174.5651 25 T 4.9233 8.3562 117.9765 60.1170 71.8277 173.1398 26 L 5.2005 8.7123 124.4442 53.4277 45.2305 175.0881 27 E 5.2433 9.2275 124.2624 54.5631 34.3907 174.1924 28 K 4.6538 8.7522 123.1062 54.5411 35.0897 175.6675 29 K 3.3981 8.1446 128.7716 55.4496 30.6963 176.3402 30 A 4.2435 8.0752 129.3143 50.2885 20.0042 178.4286 31 D 4.2468 8.5282 119.1393 57.7582 40.7894 177.9346 32 N 4.5502 7.8714 113.1276 52.9995 38.7601 173.2350 33 G 3.6251 7.2818 104.8419 43.5006 0.0000 173.3517 34 W 4.5083 8.5580 119.1836 56.3767 29.8044 175.5535 35 L 4.7449 8.7964 124.6964 53.0005 44.1965 175.2192 36 Q 4.4765 8.8603 128.2291 56.5026 29.1727 175.0244 37 L 4.4919 8.7721 126.2227 56.1810 43.7212 176.1400 38 N 4.8458 7.4804 114.4020 52.8389 42.3926 173.0430 39 T 5.1083 8.0504 116.1398 60.7496 71.0456 172.1613 40 A 4.5091 8.3811 126.9838 51.4828 23.5806 174.9496 41 K 5.1040 8.3819 117.9549 54.4178 35.4807 177.0118 42 T 4.2219 8.4515 115.3735 62.1061 70.0998 174.8970 43 D 4.8599 8.5412 124.7458 52.5216 41.0402 176.4879 44 K 3.9301 8.6755 117.0481 60.2856 32.3490 176.9820 45 D 4.6192 8.4335 117.8089 53.5907 40.7824 176.5219 46 G 4.2685 8.1371 107.0158 46.5761 0.0000 173.6071 47 R 4.9789 8.0197 117.2798 53.9577 33.0679 175.2500 48 I 4.3465 8.6795 122.8043 59.4975 38.0340 176.5462 49 K 3.9420 8.5903 125.4465 57.9027 32.3333 177.3383 50 A 4.6337 7.7391 119.7893 50.4323 19.9788 174.8765 51 L 4.3729 8.8461 123.8792 56.0394 42.9754 177.1071 52 W 4.0264 8.1018 128.3319 56.6306 31.3648 174.6180 53 P 4.5900 0.0000 0.0000 62.7015 32.1532 175.7042 54 E 4.6173 8.6354 118.6241 57.0826 29.6689 175.9923 55 Q 4.7911 7.9347 115.6340 54.0134 31.3201 175.2042 56 T 3.8717 8.6602 116.3581 64.2311 69.0344 173.6428 57 A 4.6451 8.3560 128.5501 51.7482 19.5408 176.7840 58 T 4.7149 8.3701 111.6025 59.3718 71.4416 174.2000 59 T 4.1772 8.4090 112.8571 61.9181 69.3021 173.5988 60 G 3.9919 7.4166 108.1186 43.8633 0.0000 171.5368 61 D 5.1664 7.7274 119.2567 53.1667 43.0459 175.7601 62 Y 5.4202 8.4502 118.8695 56.5750 43.1603 174.2971 63 R 5.0618 9.1393 116.5463 55.1918 33.2484 174.3719 64 V 4.5560 8.6934 115.9880 59.8786 34.2878 175.2282 65 V 4.6016 8.0318 123.8363 61.0374 34.2065 174.4813 66 F 4.4403 8.8284 128.4435 56.3039 40.0398 176.9631 67 K 4.6420 8.6881 128.3142 55.8426 28.5286 177.8628 68 T 4.2729 7.7464 112.4626 63.8226 69.7095 177.2977 69 G 3.9436 8.0936 109.9917 47.4547 0.0000 175.0072 70 D 4.4403 8.2186 121.3033 57.1896 39.2517 178.2364 71 Y 4.0537 7.5369 118.6791 60.9394 38.8216 178.3387 72 F 4.4293 8.2792 118.6256 60.2485 39.0135 177.6904 73 K 4.0311 8.2610 119.4523 59.3375 31.7313 179.0422 74 K 4.1090 7.8528 117.8572 58.6444 31.9018 178.1782 75 Q 4.3946 7.0732 115.5715 54.4264 29.0065 175.0315 76 N 4.2352 7.7433 115.3383 54.3343 36.9619 173.9695 77 L 4.7642 7.7892 116.0840 52.8466 44.0790 176.9117 78 E 4.3111 8.5005 122.1420 56.1728 30.4216 176.0713 79 S 4.0014 7.8976 114.1806 56.0210 65.6402 173.8946 80 F 4.2604 7.3171 128.4383 60.2370 39.1930 175.3148 81 F 4.8061 7.0145 119.5394 54.5828 40.4099 173.9750 82 P 4.4064 0.0000 0.0000 65.7196 31.3730 175.4342 83 E 4.7997 7.5487 113.6418 55.5568 32.6493 175.3094 84 I 4.3517 8.5420 120.6129 58.6625 39.5711 173.2182 85 P 4.9455 0.0000 0.0000 62.2701 32.7464 175.9340 86 V 4.4935 9.0550 122.2089 61.3752 34.4174 173.8306 87 E 5.2916 8.9770 127.5065 55.1726 31.3362 175.2046 88 F 5.0630 8.6124 117.0921 56.2700 41.8790 172.5650 89 H 5.1581 9.0403 116.9212 55.0126 30.5066 175.1694 90 I 4.1265 8.9209 124.3247 59.8768 37.8606 175.8748 91 N 4.6046 9.1016 125.0352 53.2569 38.4084 175.4000 92 K 4.5518 8.2634 118.1705 54.4166 34.4105 177.4290 93 V 3.6863 8.5527 118.6031 63.8167 31.7157 176.7617 94 N 4.7357 8.0937 115.9118 52.7270 37.4740 174.3446 95 E 4.4885 7.8576 118.4317 55.4977 31.9307 173.8703 96 H 4.9212 8.1971 119.7502 54.7891 31.6979 172.8918 97 Y 4.4912 8.9266 123.7629 56.3461 40.6305 174.2471 98 H 5.1178 8.5529 122.9050 54.5861 33.5718 171.9369 99 V 4.5149 8.5874 126.1775 59.1062 32.0553 172.8380 100 P 4.4728 0.0000 0.0000 61.6902 33.1500 174.6138 101 L 4.5765 8.3711 123.7421 53.2518 45.0974 175.0513 102 L 4.9846 8.9654 127.3063 53.3325 43.3967 175.1971 103 L 5.1237 8.9957 126.9482 53.3763 44.6829 175.4182 104 S 5.3025 9.3827 121.0593 56.6652 67.4389 175.2197 105 Q 3.3486 9.5072 120.4499 58.6295 28.4216 178.1905 106 Y 4.3695 7.1810 110.0709 56.8298 39.0319 175.3336 107 G 4.3838 8.3685 106.0233 45.4078 0.0000 172.3916 108 Y 5.4025 7.9032 118.3372 55.9830 40.9391 173.8128 109 S 4.9181 9.1895 115.6261 57.3903 67.1734 173.1052 110 T 5.1638 8.6015 115.5659 61.3118 70.3700 171.5199 111 Y 4.7210 7.6693 121.6519 56.3331 41.3789 172.8968 112 R 4.3201 8.8261 120.8230 55.7054 30.4608 176.0096 113 G 4.1847 8.5415 116.4223 45.2895 0.0000 173.2465 114 S 4.5291 8.5047 113.9282 58.3679 63.3360 173.8634 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 Q 8.34 4.15 0.00 1.90 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.95 0.00 0.00 0.00 0.00 0.00 1.95 1.90 0.00 4 N 8.47 4.44 0.00 2.80 2.80 0.00 0.00 7.03 7.06 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 5 I 8.53 4.02 1.52 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 1.14 0.24 0.00 0.00 6 L 7.92 5.25 0.00 2.08 1.79 0.94 1.18 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 7 S 9.08 5.32 0.00 3.40 3.58 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.94 5.12 2.43 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 0.70 0.00 0.00 0.95 0.00 0.00 9 H 8.50 5.46 0.00 3.29 3.38 0.00 5.40 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 10 I 8.86 4.80 1.69 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 1.06 0.59 0.00 0.00 11 L 8.79 4.88 0.00 1.74 1.51 0.91 0.34 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 12 N 8.93 5.06 0.00 2.90 2.97 0.00 0.00 6.82 6.32 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 13 Q 9.16 4.30 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.69 0.00 0.00 0.00 0.00 0.00 2.45 2.60 0.00 14 Q 8.83 4.33 0.00 2.30 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.77 0.00 0.00 0.00 0.00 0.00 2.46 2.57 0.00 15 T 8.17 4.35 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 1.35 0.00 0.00 16 G 8.30 4.01 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 0.00 17 K 7.62 4.82 0.00 1.63 1.68 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.53 1.56 7.81 18 P 0.00 4.85 0.00 2.10 2.13 0.00 3.68 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 19 A 8.43 4.39 0.53 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 0.00 0.00 20 A 8.59 4.81 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 0.00 0.00 0.00 0.00 0.00 21 D 8.42 4.33 0.00 2.84 2.80 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 22 V 7.51 4.25 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 0.83 0.00 0.00 0.54 0.00 0.00 23 T 8.53 4.44 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 1.17 0.00 0.00 24 V 9.23 4.71 1.91 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 0.40 0.00 0.00 0.95 0.00 0.00 25 T 8.36 4.92 4.13 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 1.12 0.00 0.00 26 L 8.71 5.20 0.00 1.58 1.31 0.97 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 27 E 9.23 5.24 0.00 1.86 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 0.00 2.23 2.16 0.00 28 K 8.75 4.65 0.00 1.92 1.58 0.00 1.83 0.00 0.00 1.58 0.00 0.00 2.71 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.01 0.55 7.81 29 K 8.14 3.40 0.00 0.79 1.01 0.00 1.20 0.00 0.00 1.30 0.00 0.00 2.70 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.78 0.21 7.81 30 A 8.08 4.24 1.19 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 0.00 0.00 31 D 8.53 4.25 0.00 2.60 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 32 N 7.87 4.55 0.00 2.66 2.80 0.00 0.00 7.04 7.65 0.00 0.00 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 G 7.28 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.56 4.51 0.00 3.23 3.19 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 35 L 8.80 4.74 0.00 1.70 1.58 0.91 0.42 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 36 Q 8.86 4.48 0.00 2.08 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.63 0.00 0.00 0.00 0.00 0.00 2.35 2.33 0.00 37 L 8.77 4.49 0.00 1.35 1.32 0.47 0.82 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 38 N 7.48 4.85 0.00 2.62 2.50 0.00 0.00 6.56 7.22 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 39 T 8.05 5.11 4.18 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 0.00 0.00 1.17 0.00 0.00 40 A 8.38 4.51 1.18 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 0.00 0.00 0.00 0.00 0.00 41 K 8.38 5.10 0.00 1.59 1.68 0.00 1.86 0.00 0.00 1.76 0.00 0.00 2.77 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.31 1.37 7.81 42 T 8.45 4.22 4.18 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 0.00 0.00 1.27 0.00 0.00 43 D 8.54 4.86 0.00 2.95 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 44 K 8.68 3.93 0.00 1.89 2.01 0.00 1.57 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.41 1.48 7.81 45 D 8.43 4.62 0.00 2.82 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 46 G 8.14 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 47 R 8.02 4.98 0.00 2.01 1.81 0.00 3.06 0.00 0.00 3.34 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.80 0.00 48 I 8.68 4.35 1.87 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.95 0.90 0.00 0.00 49 K 8.59 3.94 0.00 1.75 1.86 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.44 7.81 50 A 7.74 4.63 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 0.00 0.00 0.00 0.00 0.00 51 L 8.85 4.37 0.00 1.57 1.87 0.85 0.83 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 52 W 8.10 4.03 0.00 3.42 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 53 P 0.00 4.59 0.00 2.16 2.09 0.00 2.39 0.00 0.00 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 54 E 8.64 4.62 0.00 2.01 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 2.30 2.25 0.00 55 Q 7.93 4.79 0.00 2.21 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.84 6.86 0.00 0.00 0.00 0.00 0.00 2.23 2.41 0.00 56 T 8.66 3.87 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 1.23 0.00 0.00 57 A 8.36 4.65 0.60 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 58 T 8.37 4.71 4.31 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 1.30 0.00 0.00 59 T 8.41 4.18 4.37 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 1.30 0.00 0.00 60 G 7.42 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 0.00 0.00 0.00 61 D 7.73 5.17 0.00 2.35 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 62 Y 8.45 5.42 0.00 1.76 2.47 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 63 R 9.14 5.06 0.00 1.67 1.40 0.00 2.21 0.00 0.00 2.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 1.20 0.00 64 V 8.69 4.56 1.54 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 0.67 0.00 0.00 0.86 0.00 0.00 65 V 8.03 4.60 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 0.95 0.00 0.00 0.77 0.00 0.00 66 F 8.83 4.44 0.00 2.81 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 67 K 8.69 4.64 0.00 1.82 1.77 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.55 7.81 68 T 7.75 4.27 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 1.08 0.00 0.00 69 G 8.09 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 0.00 0.00 0.00 0.00 70 D 8.22 4.44 0.00 3.01 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 71 Y 7.54 4.05 0.00 3.00 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 F 8.28 4.43 0.00 3.17 3.18 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 0.00 0.00 0.00 73 K 8.26 4.03 0.00 2.07 1.97 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.50 7.81 74 K 7.85 4.11 0.00 1.90 1.80 0.00 1.88 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.47 7.81 75 Q 7.07 4.39 0.00 2.16 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.71 0.00 0.00 0.00 0.00 0.00 2.21 2.11 0.00 76 N 7.74 4.24 0.00 2.84 2.87 0.00 0.00 6.72 8.33 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 77 L 7.79 4.76 0.00 1.88 1.49 1.10 0.77 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 78 E 8.50 4.31 0.00 2.03 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 2.33 2.33 0.00 79 S 7.90 4.00 0.00 3.60 3.69 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 80 F 7.32 4.26 0.00 2.32 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 81 F 7.01 4.81 0.00 3.04 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 82 P 0.00 4.41 0.00 2.22 2.31 0.00 3.74 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 2.08 1.93 0.00 83 E 7.55 4.80 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 2.15 2.28 0.00 84 I 8.54 4.35 1.57 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 0.73 0.02 0.00 0.00 85 P 0.00 4.95 0.00 1.94 1.89 0.00 3.66 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.89 0.00 86 V 9.06 4.49 2.28 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 1.12 0.00 0.00 1.10 0.00 0.00 87 E 8.98 5.29 0.00 1.94 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 2.43 2.13 0.00 88 F 8.61 5.06 0.00 3.24 3.18 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 0.00 0.00 0.00 89 H 9.04 5.16 0.00 3.17 3.32 0.00 5.66 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 90 I 8.92 4.13 1.98 0.00 0.00 0.31 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 1.12 0.74 0.00 0.00 91 N 9.10 4.60 0.00 2.88 3.01 0.00 0.00 6.06 7.13 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 92 K 8.26 4.55 0.00 1.87 1.77 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.42 1.73 7.81 93 V 8.55 3.69 2.00 0.00 0.00 0.00 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 94 N 8.09 4.74 0.00 2.80 2.87 0.00 0.00 5.92 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 95 E 7.86 4.49 0.00 2.12 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 2.11 2.15 0.00 96 H 8.20 4.92 0.00 3.01 3.08 0.00 5.88 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 8.93 4.49 0.00 2.97 2.67 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 98 H 8.55 5.12 0.00 2.99 2.98 0.00 5.62 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 V 8.59 4.51 2.00 0.00 0.00 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 0.44 0.00 0.00 100 P 0.00 4.47 0.00 1.30 1.40 0.00 2.87 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.64 0.00 101 L 8.37 4.58 0.00 0.51 0.69 0.51 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 102 L 8.97 4.98 0.00 1.69 1.64 1.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 103 L 9.00 5.12 0.00 1.61 1.61 1.09 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 104 S 9.38 5.30 0.00 4.07 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 0.00 105 Q 9.51 3.35 0.00 2.04 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 6.82 0.00 0.00 0.00 0.00 0.00 1.16 1.67 0.00 106 Y 7.18 4.37 0.00 2.94 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 0.00 107 G 8.37 4.38 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 0.00 108 Y 7.90 5.40 0.00 2.91 2.77 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 0.00 109 S 9.19 4.92 0.00 3.84 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 0.00 110 T 8.60 5.16 4.31 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 1.34 0.00 0.00 111 Y 7.67 4.72 0.00 3.11 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 0.00 112 R 8.83 4.32 0.00 1.90 1.97 0.00 3.32 0.00 0.00 3.26 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 113 G 8.54 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 114 S 8.50 4.53 0.00 4.00 3.86 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 0.00 0.00 0.00