NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 C 4.7578 8.4549 115.4737 54.7361 43.1322 172.9183 2 D 4.3960 8.4591 119.3103 53.7369 40.9502 175.4116 3 I 2.7901 7.8708 123.9351 60.3550 38.4505 174.3472 4 P 4.4009 0.0000 0.0000 62.2212 32.3324 176.1994 5 Q 4.2674 8.5674 118.1432 59.4715 29.3609 176.0493 6 S 5.1833 7.6757 110.9802 57.5703 66.1757 173.5890 7 T 4.7837 8.9263 114.1448 60.6709 71.3392 172.0821 8 N 4.9518 9.2904 127.1936 52.5189 40.7072 173.0137 9 C 4.6367 9.5351 126.8266 56.2630 39.1249 174.2114 10 G 4.0713 9.6223 114.8367 46.6094 0.0000 172.2200 11 G 3.9495 8.9154 109.6307 44.7496 0.0000 174.3447 12 N 4.6202 8.2799 117.8363 52.2173 39.3772 174.3873 13 V 4.5416 8.1439 124.5732 61.9278 32.8479 174.6701 14 Y 5.1648 9.0008 125.4205 56.2545 41.7524 175.4193 15 S 5.0769 9.2610 117.4510 57.0734 65.3871 174.8408 16 N 4.2147 8.6327 117.7180 56.3421 36.5713 177.0581 17 D 4.3212 8.0232 120.5339 57.2058 40.9785 178.2046 18 D 4.3819 8.2843 119.3946 57.3824 40.8063 179.0258 19 I 3.5982 7.7098 120.2214 64.3470 37.0711 177.8911 20 N 4.2150 8.3582 118.2231 57.1343 38.6748 176.8936 21 T 3.8143 8.2122 117.0477 66.4543 68.4342 176.4591 22 A 4.0969 7.9672 122.6261 55.2797 18.4369 179.7877 23 I 3.1444 7.5782 118.2890 64.3760 37.0951 178.3885 24 Q 3.8811 8.2634 120.8823 59.0118 28.7186 178.6624 25 G 3.4321 8.1182 106.5529 47.6104 0.0000 175.2957 26 A 3.1951 6.9550 123.5996 54.5616 18.2761 179.7321 27 L 3.8473 7.5832 117.2780 58.0511 41.5911 179.5694 28 D 4.3273 8.1310 118.8878 57.4654 40.6834 178.6552 29 D 4.4017 8.4021 119.8077 57.2121 40.8253 178.9551 30 V 3.6078 8.0438 118.6495 66.0557 31.3606 177.9301 31 A 4.0433 7.9062 119.1773 55.1716 18.3286 178.7186 32 N 4.5908 8.5089 112.9112 53.1866 38.8860 175.5631 33 G 4.0152 8.0169 108.3756 46.5119 0.0000 174.3123 34 D 4.6424 8.1950 118.8914 52.1307 41.5459 172.7601 35 R 4.4517 8.1271 120.8313 53.6191 30.5674 174.3626 36 P 4.4858 0.0000 0.0000 63.8454 31.6882 175.9956 37 D 4.5718 9.6835 122.3656 55.2150 39.7332 172.7629 38 N 4.3336 8.2712 109.7262 54.0506 36.7242 174.0314 39 Y 4.5910 8.0091 115.4622 56.1221 39.2776 173.9897 40 P 5.2003 0.0000 0.0000 63.5268 32.8353 174.8722 41 H 5.1280 9.0166 117.4315 53.9415 32.0384 174.0853 42 Q 4.4460 8.6157 118.9296 56.2022 29.3490 175.0467 43 Y 4.6633 8.3318 124.5819 56.0130 40.5233 174.4788 44 Y 4.7286 7.5931 123.3643 55.5802 40.7879 175.0428 45 D 4.3043 8.9137 123.1664 54.5431 41.9383 176.0629 46 E 4.4909 8.4612 124.6835 54.2305 31.2568 175.6831 47 A 4.1593 8.4692 127.9331 54.5087 18.8508 179.8454 48 S 4.2240 8.1154 109.7052 61.2041 62.9311 175.3344 49 E 4.1422 8.5206 119.5668 56.7187 29.6034 176.0090 50 D 4.3503 7.7784 117.6763 55.4608 38.7385 174.0135 51 I 4.5188 7.8186 119.6090 59.7889 38.4142 175.7928 52 T 4.3070 8.6551 116.6970 60.4424 69.9720 174.2628 53 L 4.5942 8.0372 123.8873 53.2226 43.8110 175.2541 54 C 4.8213 8.5095 115.2463 55.1300 42.0272 171.8493 55 C 4.3442 7.6088 114.2818 52.2722 43.0739 177.9123 56 G 3.8293 8.1194 111.6789 43.5227 0.0000 172.8942 57 S 4.3303 8.4847 116.7832 58.2520 63.4691 174.3734 58 G 2.3670 7.4988 112.5731 43.6631 0.0000 171.2124 59 P 3.9894 0.0000 0.0000 62.3605 32.6334 175.4726 60 W 5.2948 8.2157 119.9746 55.1829 32.8662 174.6208 61 S 5.2861 8.7273 118.3471 56.5822 66.7570 172.7619 62 E 5.6926 9.2548 118.5930 53.8121 32.9759 174.3731 63 F 5.2221 8.5551 122.3747 55.8437 43.4906 171.6319 64 P 4.2205 0.0000 0.0000 62.4951 31.7808 175.3332 65 L 4.3944 7.9977 126.3956 53.4089 43.0047 176.0107 66 V 4.4267 7.7941 118.1445 59.5350 35.8380 174.7796 67 Y 4.4612 8.3196 119.0045 58.9816 38.5566 175.1101 68 N 4.2112 8.8802 116.7192 54.4427 36.2870 174.5186 69 G 4.0524 7.8792 106.9518 43.8286 0.0000 171.8312 70 P 4.6261 0.0000 0.0000 61.7588 32.3031 175.3069 71 Y 4.1713 8.6456 120.1746 58.6555 38.9627 175.1899 72 Y 4.3709 7.4474 125.8439 56.1723 42.0767 173.5715 73 S 4.2988 6.3731 118.4056 57.0034 65.6225 172.7515 74 S 4.5391 8.4663 118.4538 56.4505 66.1488 174.9333 75 R 3.9159 8.7379 120.7298 59.7070 29.5915 177.0310 76 D 4.6269 7.5353 114.5769 55.5350 41.3943 176.8320 77 N 4.8581 7.8816 118.0099 52.7013 40.1616 171.4621 78 Y 4.4785 8.2340 123.9150 56.6325 39.8749 174.9680 79 V 4.2398 7.4454 126.1405 60.4965 34.2936 175.1903 80 S 4.1460 8.4809 121.8296 57.5030 62.8050 172.3427 81 P 3.1595 0.0000 0.0000 62.9438 31.3634 177.6630 82 G 3.8653 7.6992 108.9801 44.3097 0.0000 171.0008 83 P 4.6591 0.0000 0.0000 63.8150 32.8212 175.3691 84 D 5.3674 7.8349 120.3873 52.8958 43.8931 175.4398 85 R 4.9388 8.6156 119.4166 54.6030 35.1951 174.4226 86 V 4.5931 8.5268 121.6184 60.4725 34.0604 174.6369 87 I 4.9121 8.3897 124.3629 59.7306 39.5190 174.3203 88 Y 5.2085 8.2829 123.6752 55.0806 42.3890 173.9366 89 Q 4.6875 9.2592 122.3841 56.2334 29.4305 176.3896 90 T 4.0053 8.7705 124.8612 67.1105 68.4448 175.8114 91 N 4.5907 8.3820 116.8430 55.1325 38.9775 175.7997 92 T 4.4255 8.0755 105.7238 60.4293 70.7345 175.1613 93 G 3.9714 8.8096 109.9887 44.8311 0.0000 173.4492 94 E 4.2574 8.1774 120.2702 55.9949 30.6366 176.3741 95 F 4.4399 8.9864 126.2142 59.0972 39.8878 174.6254 96 C 4.4700 7.8435 121.9106 57.6408 40.8579 173.5186 97 A 4.3735 5.8000 117.3039 51.4614 22.1822 174.7598 98 T 4.9188 7.9631 108.5395 60.1719 71.9383 173.5896 99 V 4.8913 8.3083 116.3322 60.3399 36.8219 173.8741 100 T 5.0308 8.6184 114.7645 61.3672 70.7492 174.4577 101 H 4.7878 9.5487 123.7567 57.9288 29.1740 176.1123 102 T 4.1266 7.9816 117.4317 64.7071 68.4014 174.5386 103 G 3.8724 9.0479 113.5185 45.8491 0.0000 173.3635 104 A 4.2477 7.6522 121.3087 51.4527 18.9358 178.5615 105 A 4.2155 8.4968 122.7614 54.3520 18.9780 178.1190 106 S 4.7530 7.5920 108.6678 56.1017 66.3217 172.6676 107 Y 4.1875 8.5737 122.3308 59.3597 38.7578 175.9497 108 D 3.8038 7.9735 124.4913 54.4606 38.7741 174.1579 109 G 3.7538 7.8415 109.1745 45.3342 0.0000 172.7998 110 F 5.4533 8.8781 118.7030 56.0045 41.6402 175.1856 111 T 4.8109 8.9432 115.0949 60.0787 71.2898 172.6936 112 Q 4.3545 8.6151 126.9745 56.0905 29.7298 176.4970 113 C 4.7599 8.8357 124.0361 56.8900 40.9140 174.0598 114 S 4.3702 8.9080 115.7627 58.5095 62.8252 174.0029 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 1 C 8.45 4.76 0.00 3.16 3.43 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 2 D 8.46 4.40 0.00 2.75 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 3 I 7.87 2.79 1.65 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 1.01 0.30 0.58 0.00 0.00 4 P 0.00 4.40 0.00 2.29 1.99 0.00 2.70 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.88 0.00 5 Q 8.57 4.27 0.00 2.12 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.71 0.00 0.00 0.00 0.00 0.00 2.39 2.35 0.00 6 S 7.68 5.18 0.00 3.95 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 T 8.93 4.78 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 1.32 0.00 0.00 8 N 9.29 4.95 0.00 2.78 2.69 0.00 0.00 7.11 7.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 C 9.54 4.64 0.00 3.32 3.26 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 0.00 10 G 9.62 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 11 G 8.92 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 12 N 8.28 4.62 0.00 2.79 2.32 0.00 0.00 6.41 7.10 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 13 V 8.14 4.54 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 0.83 0.00 0.00 0.90 0.00 0.00 14 Y 9.00 5.16 0.00 2.87 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.26 5.08 0.00 3.91 4.06 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 16 N 8.63 4.21 0.00 2.87 3.26 0.00 0.00 7.43 7.36 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 17 D 8.02 4.32 0.00 2.81 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 18 D 8.28 4.38 0.00 2.93 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 19 I 7.71 3.60 1.86 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.62 0.86 0.00 0.00 20 N 8.36 4.22 0.00 2.74 2.90 0.00 0.00 7.29 6.90 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 21 T 8.21 3.81 4.46 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 1.25 0.00 0.00 22 A 7.97 4.10 1.50 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 0.00 0.00 23 I 7.58 3.14 1.71 0.00 0.00 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 1.28 0.67 0.47 0.00 0.00 24 Q 8.26 3.88 0.00 2.09 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 25 G 8.12 3.43 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 0.00 26 A 6.95 3.20 0.74 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 0.00 0.00 27 L 7.58 3.85 0.00 1.68 1.63 0.79 0.89 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 28 D 8.13 4.33 0.00 2.80 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 29 D 8.40 4.40 0.00 2.90 3.06 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 30 V 8.04 3.61 2.24 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 1.06 0.00 0.00 1.04 0.00 0.00 31 A 7.91 4.04 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 32 N 8.51 4.59 0.00 2.90 2.91 0.00 0.00 7.02 7.77 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 33 G 8.02 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 34 D 8.19 4.64 0.00 2.65 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 35 R 8.13 4.45 0.00 2.02 2.21 0.00 3.25 0.00 0.00 3.48 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.71 0.00 36 P 0.00 4.49 0.00 1.91 1.79 0.00 4.44 0.00 0.00 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.46 0.00 37 D 9.68 4.57 0.00 2.93 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 38 N 8.27 4.33 0.00 2.88 2.87 0.00 0.00 6.81 7.08 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 39 Y 8.01 4.59 0.00 3.11 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 5.20 0.00 2.31 2.52 0.00 3.97 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.25 0.00 41 H 9.02 5.13 0.00 3.37 3.26 0.00 5.63 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 42 Q 8.62 4.45 0.00 1.85 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.70 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 43 Y 8.33 4.66 0.00 2.89 2.82 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 44 Y 7.59 4.73 0.00 2.93 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 45 D 8.91 4.30 0.00 2.87 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 46 E 8.46 4.49 0.00 2.19 1.81 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 2.28 2.42 0.00 47 A 8.47 4.16 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 48 S 8.12 4.22 0.00 4.00 4.04 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 49 E 8.52 4.14 0.00 2.14 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 0.00 2.46 2.40 0.00 50 D 7.78 4.35 0.00 2.86 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 I 7.82 4.52 1.94 0.00 0.00 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 1.46 0.79 0.76 0.00 0.00 52 T 8.66 4.31 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 1.19 0.00 0.00 53 L 8.04 4.59 0.00 1.28 1.15 -0.81 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 54 C 8.51 4.82 0.00 3.06 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 55 C 7.61 4.34 0.00 3.16 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 56 G 8.12 3.83 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 0.00 0.00 0.00 57 S 8.48 4.33 0.00 3.85 3.74 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 58 G 7.50 2.37 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 0.00 59 P 0.00 3.99 0.00 1.97 2.02 0.00 3.49 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.90 0.00 60 W 8.22 5.29 0.00 3.66 2.86 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 61 S 8.73 5.29 0.00 2.72 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 62 E 9.25 5.69 0.00 1.89 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 2.44 2.44 0.00 63 F 8.56 5.22 0.00 3.36 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 64 P 0.00 4.22 0.00 0.81 1.14 0.00 2.20 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 65 L 8.00 4.39 0.00 1.28 0.96 0.52 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 66 V 7.79 4.43 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 0.71 0.00 0.00 1.02 0.00 0.00 67 Y 8.32 4.46 0.00 3.10 2.92 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 68 N 8.88 4.21 0.00 2.94 2.93 0.00 0.00 6.91 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 69 G 7.88 4.05 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 0.00 0.00 0.00 70 P 0.00 4.63 0.00 2.39 2.31 0.00 3.82 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.96 0.00 71 Y 8.65 4.17 0.00 2.74 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 72 Y 7.45 4.37 0.00 2.81 2.66 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 0.00 0.00 0.00 0.00 73 S 6.37 4.30 0.00 3.20 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 74 S 8.47 4.54 0.00 4.03 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 0.00 75 R 8.74 3.92 0.00 1.82 2.05 0.00 3.25 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 76 D 7.54 4.63 0.00 2.59 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.88 4.86 0.00 2.81 2.68 0.00 0.00 6.71 7.70 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 78 Y 8.23 4.48 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 79 V 7.45 4.24 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 0.82 0.00 0.00 0.89 0.00 0.00 80 S 8.48 4.15 0.00 3.97 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 81 P 0.00 3.16 0.00 1.36 0.79 0.00 3.93 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 1.82 1.85 0.00 82 G 7.70 3.87 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 0.00 0.00 0.00 83 P 0.00 4.66 0.00 2.19 2.36 0.00 3.68 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.04 0.00 84 D 7.83 5.37 0.00 2.61 2.46 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 85 R 8.62 4.94 0.00 1.16 1.46 0.00 3.27 0.00 0.00 2.91 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.37 0.00 86 V 8.53 4.59 2.19 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 0.91 0.00 0.00 1.16 0.00 0.00 87 I 8.39 4.91 1.24 0.00 0.00 -0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.16 0.27 0.00 0.00 88 Y 8.28 5.21 0.00 3.23 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 89 Q 9.26 4.69 0.00 2.31 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.79 0.00 0.00 0.00 0.00 0.00 2.41 2.59 0.00 90 T 8.77 4.01 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 1.23 0.00 0.00 91 N 8.38 4.59 0.00 2.72 2.89 0.00 0.00 6.66 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 92 T 8.08 4.43 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 1.29 0.00 0.00 93 G 8.81 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 94 E 8.18 4.26 0.00 2.01 1.97 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 2.39 2.46 0.00 95 F 8.99 4.44 0.00 3.03 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 C 7.84 4.47 0.00 2.43 2.51 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 0.00 0.00 0.00 0.00 97 A 5.80 4.37 0.83 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 0.00 0.00 98 T 7.96 4.92 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 1.33 0.00 0.00 99 V 8.31 4.89 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 0.38 0.00 0.00 -0.12 0.00 0.00 100 T 8.62 5.03 4.29 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 1.32 0.00 0.00 101 H 9.55 4.79 0.00 3.27 3.30 0.00 5.68 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 T 7.98 4.13 4.29 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 1.30 0.00 0.00 103 G 9.05 3.87 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 0.00 0.00 0.00 104 A 7.65 4.25 1.35 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 0.00 0.00 105 A 8.50 4.22 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 0.00 106 S 7.59 4.75 0.00 3.98 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 0.00 107 Y 8.57 4.19 0.00 2.91 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 0.00 108 D 7.97 3.80 0.00 2.39 2.39 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.84 3.75 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 0.00 0.00 0.00 110 F 8.88 5.45 0.00 2.99 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 0.00 111 T 8.94 4.81 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 0.00 112 Q 8.62 4.35 0.00 2.09 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.78 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 113 C 8.84 4.76 0.00 2.98 3.06 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 0.00 114 S 8.91 4.37 0.00 3.96 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