NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 K 4.2337 8.3149 121.7861 55.9477 33.7034 174.7080 4 I 4.3035 7.5429 117.4336 58.7568 38.9037 174.0719 5 I 3.8504 9.3552 129.4040 61.5480 38.4533 174.6715 6 H 4.9005 8.7174 125.6027 54.6218 29.1618 175.4552 7 L 4.6428 8.6693 124.7188 54.2954 43.0265 176.2058 8 T 4.9232 8.0736 107.8524 59.4474 71.5949 174.4210 9 D 4.6213 9.2569 124.1048 57.2865 40.5442 179.1018 10 D 4.5457 8.1571 117.7313 56.3242 41.1749 177.6594 11 S 4.6244 7.9793 113.1547 58.3368 63.4233 175.7205 12 F 3.8327 7.9080 124.6263 61.4990 39.2262 175.9329 13 D 4.4432 8.4213 117.0729 58.0359 40.7105 178.5632 14 T 3.8734 7.7321 111.1547 65.2446 67.5855 175.6790 15 D 4.3705 8.1755 120.1589 56.4918 40.8347 177.4854 16 V 3.7572 7.2961 116.6426 64.4712 32.5331 176.9518 17 L 3.9716 7.4816 120.0464 57.6372 42.3194 179.0919 18 K 4.5232 7.8026 119.6157 53.4837 31.1948 177.2034 19 A 4.7846 7.3991 125.0900 51.1270 22.8597 176.1932 20 D 4.6572 8.5297 118.2740 53.0539 41.2198 178.7148 21 G 4.0060 8.6816 107.2274 44.5252 0.0000 172.4559 22 A 4.6296 8.1354 120.0165 51.4823 20.2187 176.6179 23 I 4.9009 8.7484 122.3528 59.3978 41.0300 174.1754 24 L 5.0456 8.9904 130.1096 53.7158 43.7295 175.0238 25 V 4.8039 9.4238 127.7435 61.3110 34.0313 173.8438 26 D 5.3892 9.1937 127.8967 52.6989 43.2862 174.8931 27 F 5.0466 9.4422 127.1276 56.4983 40.4483 175.2973 28 W 5.5886 8.7381 120.5580 55.2517 32.2429 173.4738 29 A 4.1025 8.2116 118.7145 50.2761 21.2681 177.2604 30 E 4.1967 8.4738 121.4705 58.9150 29.9662 178.4643 31 W 4.4569 7.3085 114.4916 58.6119 29.0102 176.8586 32 C 4.4067 7.0113 118.5824 59.2437 32.5479 174.1747 33 G 3.6080 8.6021 114.5364 47.5567 0.0000 174.3991 34 P 4.2704 0.0000 0.0000 65.0632 31.3805 178.5194 35 C 4.1787 8.1435 117.5764 63.5047 28.0382 176.7178 36 K 3.9660 7.4025 123.0466 59.5757 31.1767 180.8178 37 M 4.3661 7.3298 116.8866 58.9296 32.5085 178.1075 38 I 3.8966 7.8205 116.6627 61.9777 37.9620 177.2573 39 A 3.7332 7.4446 120.6795 55.5517 18.5080 177.3782 40 P 4.5961 0.0000 0.0000 65.1123 31.3937 178.6615 41 I 3.8306 7.7673 118.0394 64.6805 37.0309 178.1599 42 L 3.9429 7.8101 119.4213 57.7983 41.2501 179.2633 43 D 4.3299 7.8662 118.4525 57.3685 40.7631 178.7754 44 E 3.9914 8.0407 118.3167 59.5849 29.6745 179.0490 45 I 3.7987 7.9156 119.6068 64.6944 36.9752 178.3638 46 A 4.0450 8.3603 120.5260 55.0399 18.2096 178.8257 47 D 4.4442 7.7267 115.4611 57.2525 41.6437 178.1633 48 E 4.1456 8.8568 119.4656 59.6400 29.1504 178.6828 49 Y 4.0921 8.2959 114.5582 58.2836 37.8656 177.2958 50 Q 4.1757 7.8970 122.4176 58.0695 29.4521 177.5332 51 G 4.0303 8.1858 105.0800 46.5320 0.0000 174.4858 52 K 4.6153 7.4723 118.0813 55.6204 33.1545 175.3591 53 L 4.7051 7.2003 118.1449 56.1388 44.7934 172.7973 54 T 4.6709 8.0029 121.0161 61.7235 71.8536 172.9587 55 V 4.7704 8.3472 125.2118 61.1982 34.0378 174.1102 56 A 5.1334 9.1104 129.1031 50.1233 22.4004 174.6795 57 K 4.9883 8.9015 121.4213 54.5926 35.3797 175.5291 58 L 4.7742 9.0331 125.5980 53.1018 45.1419 175.0642 59 N 3.6317 8.6165 126.9161 52.6965 39.1897 175.3466 60 I 4.1505 7.9431 120.7659 62.4250 37.4240 176.9961 61 D 4.5764 8.3019 122.8702 56.5155 41.1807 177.5761 62 Q 4.2723 8.0174 116.4158 57.1287 29.7687 175.6525 63 N 5.1195 7.8482 115.4249 50.7794 38.5438 173.0452 64 P 4.6428 0.0000 0.0000 63.9111 32.3623 178.5005 65 G 3.7950 8.5055 108.1743 47.7953 0.0000 175.7829 66 T 3.8726 8.2807 116.8386 66.5223 69.0641 176.5594 67 A 3.8794 8.3915 122.7350 55.1788 18.1748 177.7110 68 P 4.1981 0.0000 0.0000 65.5716 31.2028 178.6098 69 K 4.0236 7.8807 115.7594 58.0929 30.5101 177.1385 70 Y 4.4936 7.5744 116.1188 56.9633 38.5939 176.4393 71 G 3.9707 7.8953 107.0881 46.1686 0.0000 174.1854 72 I 3.4997 6.9496 120.4078 62.7024 37.2955 176.7000 73 R 4.6613 8.3032 120.2523 55.2887 31.6351 172.1851 74 G 4.2698 7.4758 103.3020 45.7517 0.0000 172.9103 75 I 4.8160 8.0144 113.9292 57.7059 40.9486 173.2808 76 P 4.7801 0.0000 0.0000 63.2949 32.8708 174.8476 77 T 4.8696 8.7300 119.0072 61.8983 71.3360 173.0857 78 L 5.1763 8.8685 126.9587 53.2460 43.8225 175.3629 79 L 4.9298 9.3858 124.7399 52.7496 44.7267 175.2158 80 L 4.9262 8.8938 126.9198 53.7507 43.6843 174.8880 81 F 5.8347 9.4131 125.7879 55.3097 41.6307 175.4675 82 K 4.6369 8.1792 120.9496 54.6735 35.6414 176.2645 83 N 3.9128 9.6842 125.0479 54.5113 35.8226 175.3589 84 G 4.0630 8.5579 101.2676 46.1004 0.0000 173.0948 85 E 4.8341 7.9099 116.5937 54.0328 33.3272 175.5479 86 V 3.5432 8.2172 120.6105 62.0211 30.9201 175.9036 87 A 4.2147 9.0832 130.5395 54.2905 18.2782 176.9628 88 A 4.8630 7.6742 115.4306 50.5302 23.2353 174.2087 89 T 5.1824 8.6721 115.7382 61.2552 70.7132 173.9247 90 K 4.5523 8.7587 130.7859 53.5993 36.1693 172.9241 91 V 4.5497 8.5235 123.9560 61.3352 33.7944 176.0737 92 G 3.9335 8.7141 111.7367 45.5776 0.0000 174.9037 93 A 4.2648 7.9981 124.3648 51.5103 15.7007 176.9924 94 L 4.2740 7.6611 122.5729 54.3016 42.9445 177.3359 95 S 4.7130 8.9218 115.3706 56.7663 65.6917 174.7843 96 K 3.8558 8.6494 123.0077 59.9456 31.6490 178.5881 97 G 3.7582 7.9945 104.7060 47.1283 0.0000 175.8052 98 Q 4.1038 8.0103 120.3628 58.6046 28.5779 178.7636 99 L 4.0891 8.4496 123.0208 58.3994 41.6568 179.9466 100 K 4.0186 7.6258 124.2816 59.2351 31.5207 180.5898 101 E 4.1725 8.3055 119.5666 59.3183 29.4494 178.9641 102 F 4.2456 8.3644 120.6079 62.0047 39.2681 176.7558 103 L 3.7456 8.7930 119.0498 57.3769 41.1384 178.7811 104 D 4.2303 8.5552 119.7581 57.9269 41.0957 179.0509 105 A 4.1394 8.4068 120.1614 54.1445 18.4861 178.3966 106 N 4.5538 7.3189 113.1896 54.2185 39.9025 175.0262 107 L 4.0882 8.4105 125.1278 55.2070 41.7958 176.8368 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 K 8.31 4.23 0.00 1.73 1.85 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.27 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.46 7.81 4 I 7.54 4.30 1.71 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.77 0.78 0.00 0.00 5 I 9.36 3.85 1.79 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.54 0.85 0.00 0.00 6 H 8.72 4.90 0.00 3.08 3.32 0.00 5.69 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 L 8.67 4.64 0.00 1.67 1.71 0.84 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 8 T 8.07 4.92 4.32 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 1.24 0.00 0.00 9 D 9.26 4.62 0.00 2.71 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 10 D 8.16 4.55 0.00 2.67 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 11 S 7.98 4.62 0.00 4.17 4.11 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 12 F 7.91 3.83 0.00 3.38 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 D 8.42 4.44 0.00 2.86 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 14 T 7.73 3.87 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 1.25 0.00 0.00 15 D 8.18 4.37 0.00 2.63 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 16 V 7.30 3.76 0.87 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 -0.27 0.00 0.00 0.04 0.00 0.00 17 L 7.48 3.97 0.00 1.84 1.75 1.15 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 18 K 7.80 4.52 0.00 1.76 1.62 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.30 1.22 7.81 19 A 7.40 4.78 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 20 D 8.53 4.66 0.00 2.71 2.45 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 21 G 8.68 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 22 A 8.14 4.63 1.24 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 0.00 0.00 23 I 8.75 4.90 1.88 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 1.08 0.81 0.86 0.00 0.00 24 L 8.99 5.05 0.00 1.76 1.53 1.14 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 25 V 9.42 4.80 2.41 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 0.40 0.00 0.00 0.93 0.00 0.00 26 D 9.19 5.39 0.00 2.77 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 27 F 9.44 5.05 0.00 3.13 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 28 W 8.74 5.59 0.00 3.42 3.40 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 0.00 29 A 8.21 4.10 -0.04 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 0.00 0.00 30 E 8.47 4.20 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 2.40 2.50 0.00 31 W 7.31 4.46 0.00 3.62 3.22 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 32 C 7.01 4.41 0.00 2.53 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 33 G 8.60 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.27 0.00 2.17 2.12 0.00 3.63 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 2.13 2.20 0.00 35 C 8.14 4.18 0.00 2.99 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 36 K 7.40 3.97 0.00 1.98 1.75 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.39 1.36 7.81 37 M 7.33 4.37 0.00 1.93 2.16 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.53 0.00 38 I 7.82 3.90 1.83 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 1.40 1.31 0.92 0.00 0.00 39 A 7.44 3.73 1.16 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 0.00 0.00 40 P 0.00 4.60 0.00 2.13 2.08 0.00 4.09 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.98 0.00 41 I 7.77 3.83 2.02 0.00 0.00 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 1.62 0.44 0.89 0.00 0.00 42 L 7.81 3.94 0.00 1.82 1.63 0.81 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 43 D 7.87 4.33 0.00 2.76 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 44 E 8.04 3.99 0.00 2.17 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 2.40 2.53 0.00 45 I 7.92 3.80 1.96 0.00 0.00 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 1.69 1.13 0.73 0.00 0.00 46 A 8.36 4.05 1.33 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 0.00 0.00 47 D 7.73 4.44 0.00 2.85 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 48 E 8.86 4.15 0.00 2.20 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 0.00 2.34 2.56 0.00 49 Y 8.30 4.09 0.00 3.15 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 50 Q 7.90 4.18 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.34 0.00 51 G 8.19 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 52 K 7.47 4.62 0.00 1.88 1.88 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.83 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.29 1.51 7.81 53 L 7.20 4.71 0.00 1.68 1.64 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.00 4.67 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 1.17 0.00 0.00 55 V 8.35 4.77 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 1.01 0.00 0.00 0.89 0.00 0.00 56 A 9.11 5.13 1.10 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 0.00 0.00 0.00 0.00 0.00 57 K 8.90 4.99 0.00 1.87 1.93 0.00 1.51 0.00 0.00 1.31 0.00 0.00 2.39 0.00 0.00 2.30 0.00 0.00 0.00 0.00 1.27 1.23 7.81 58 L 9.03 4.77 0.00 1.48 0.99 1.03 0.43 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 59 N 8.62 3.63 0.00 2.26 2.51 0.00 0.00 6.89 7.93 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 60 I 7.94 4.15 1.91 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.12 1.11 0.00 0.00 61 D 8.30 4.58 0.00 2.82 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 62 Q 8.02 4.27 0.00 1.99 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 7.29 0.00 0.00 0.00 0.00 0.00 2.28 2.47 0.00 63 N 7.85 5.12 0.00 2.81 2.92 0.00 0.00 6.61 8.19 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 64 P 0.00 4.64 0.00 2.18 2.17 0.00 3.93 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 65 G 8.51 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 66 T 8.28 3.87 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 0.29 0.00 0.00 67 A 8.39 3.88 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 68 P 0.00 4.20 0.00 2.12 2.08 0.00 3.66 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.17 0.00 69 K 7.88 4.02 0.00 1.30 1.40 0.00 1.49 0.00 0.00 1.55 0.00 0.00 2.96 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.33 1.48 7.81 70 Y 7.57 4.49 0.00 2.91 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 71 G 7.90 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 72 I 6.95 3.50 1.79 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.45 0.88 0.00 0.00 73 R 8.30 4.66 0.00 1.77 1.75 0.00 3.30 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.15 0.00 74 G 7.48 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 75 I 8.01 4.82 1.86 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.68 0.93 0.00 0.00 76 P 0.00 4.78 0.00 2.26 2.26 0.00 3.65 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.99 0.00 77 T 8.73 4.87 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 1.18 0.00 0.00 78 L 8.87 5.18 0.00 1.59 1.62 0.81 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 79 L 9.39 4.93 0.00 1.92 1.60 0.87 -0.05 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 80 L 8.89 4.93 0.00 1.89 1.45 0.60 0.70 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 81 F 9.41 5.83 0.00 2.96 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 82 K 8.18 4.64 0.00 1.75 1.69 0.00 1.93 0.00 0.00 1.82 0.00 0.00 2.76 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.41 1.01 7.81 83 N 9.68 3.91 0.00 2.87 2.91 0.00 0.00 7.20 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 84 G 8.56 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 0.00 0.00 0.00 85 E 7.91 4.83 0.00 2.06 1.85 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 2.32 2.42 0.00 86 V 8.22 3.54 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 0.58 0.00 0.00 0.31 0.00 0.00 87 A 9.08 4.21 1.22 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 88 A 7.67 4.86 1.12 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 0.00 0.00 0.00 0.00 0.00 0.00 89 T 8.67 5.18 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 1.21 0.00 0.00 90 K 8.76 4.55 0.00 1.45 1.58 0.00 1.83 0.00 0.00 1.57 0.00 0.00 2.72 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.26 1.25 7.81 91 V 8.52 4.55 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 1.02 0.00 0.00 0.90 0.00 0.00 92 G 8.71 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 93 A 8.00 4.26 1.27 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 94 L 7.66 4.27 0.00 1.59 1.60 0.69 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 95 S 8.92 4.71 0.00 3.99 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 96 K 8.65 3.86 0.00 1.88 1.89 0.00 1.62 0.00 0.00 1.98 0.00 0.00 3.16 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.53 1.63 7.81 97 G 7.99 3.76 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 0.00 0.00 0.00 98 Q 8.01 4.10 0.00 2.32 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.77 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 99 L 8.45 4.09 0.00 1.81 1.69 0.89 0.93 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 0.00 100 K 7.63 4.02 0.00 1.78 1.84 0.00 1.80 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.38 1.24 7.81 101 E 8.31 4.17 0.00 2.29 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 0.00 2.37 2.51 0.00 102 F 8.36 4.25 0.00 3.12 3.25 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 0.00 103 L 8.79 3.75 0.00 1.66 1.33 0.07 1.02 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 0.00 104 D 8.56 4.23 0.00 2.73 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 0.00 105 A 8.41 4.14 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 0.00 106 N 7.32 4.55 0.00 2.26 2.55 0.00 0.00 7.00 9.01 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 0.00 107 L 8.41 4.09 0.00 1.59 1.62 1.09 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00