NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4128 8.3049 120.3271 55.1732 33.4008 174.4250 2 I 4.0396 8.1009 123.7075 58.5181 38.3098 172.0307 3 E 4.0264 9.5069 128.3451 55.3443 30.6178 174.3413 4 P 4.2714 0.0000 0.0000 63.4357 31.9766 175.9023 5 S 3.5422 8.4460 114.8871 59.0947 60.9051 171.1499 6 K 4.1279 8.4026 126.9589 57.4238 33.1150 175.9102 7 I 4.3061 7.6593 119.2292 59.4087 38.7007 174.2780 8 T 4.8355 7.9679 117.8656 58.9992 73.0464 174.5910 9 V 3.6687 8.4030 119.8082 66.2992 31.3912 177.7876 10 E 4.1588 8.6948 117.5285 59.1731 29.5353 178.8555 11 Q 3.9753 7.8672 121.0801 58.8445 29.0836 178.0128 12 W 4.2945 8.2913 129.1763 60.2717 30.7364 177.8868 13 L 3.8326 8.5345 119.6944 57.9741 41.1711 179.3848 14 N 4.3936 8.3852 116.8870 55.8819 37.2344 177.2082 15 R 3.8843 7.6158 120.0564 58.7908 30.1784 178.1467 16 W 3.9855 8.4258 128.5677 60.2965 30.5423 177.8979 17 L 3.6928 8.2556 119.2773 58.1855 40.8769 179.5853 18 T 3.8540 7.5888 114.2238 66.3770 68.4386 175.9339 19 D 4.4952 7.8701 119.9708 56.9481 41.1871 177.6884 20 Y 4.0786 8.0702 113.7138 58.0186 38.0518 176.5068 21 A 4.4381 7.5783 121.2374 51.2282 19.7969 178.0433 22 K 4.0437 7.0865 118.0379 54.8878 32.7320 175.1581 23 P 4.2751 0.0000 0.0000 63.9909 31.4235 175.2055 24 H 4.8055 9.0159 119.2063 53.7700 32.5659 172.5975 25 L 4.3163 7.8945 123.5023 53.4598 41.1469 175.1227 26 R 4.0596 8.4129 118.5393 55.9618 31.1557 170.1896 27 Q 3.4416 8.8413 132.2788 55.2573 27.4961 175.0451 28 S 4.1048 8.2856 119.9508 58.1672 61.0440 174.0165 29 T 3.9647 7.4518 120.5848 61.1833 70.3511 174.9104 30 W 4.7727 7.7242 123.4961 56.4991 30.4995 176.6835 31 E 4.5809 8.8798 115.7937 57.2048 29.2618 177.8170 32 S 4.2336 8.4364 118.1522 62.3215 62.9056 175.9354 33 Y 4.4898 8.5644 119.9681 59.8978 37.6896 177.9533 34 E 3.6232 7.1326 120.5881 59.2201 29.9364 178.2667 35 T 3.8499 7.8876 115.8045 67.0779 68.4691 176.9172 36 V 3.7984 7.8658 113.8970 64.6400 31.5675 178.0603 37 L 4.0966 7.7465 120.0052 58.0245 41.5012 179.0657 38 R 4.0100 8.5920 116.1278 59.3421 29.2175 178.5579 39 L 3.9284 7.9152 120.0802 57.6092 42.0778 177.9572 40 H 4.6300 8.0594 115.5285 57.8934 29.4963 177.6943 41 V 4.2860 8.1700 122.1024 63.3099 31.4967 178.5178 42 I 3.7146 7.4337 119.9608 63.9171 36.9005 176.2088 43 P 4.5183 0.0000 0.0000 63.9110 31.4143 176.4351 44 T 4.3733 7.0247 107.1848 62.0649 70.7608 175.8342 45 L 4.6446 8.5175 121.6458 53.4471 43.5478 179.0910 46 G 3.6678 7.9517 108.6456 48.4692 0.0000 175.1678 47 S 4.7225 8.0147 113.9116 58.3427 63.0236 173.4545 48 I 4.5537 7.4946 122.3736 58.3250 39.5581 173.6319 49 P 4.6846 0.0000 0.0000 62.5558 31.8304 177.5048 50 L 3.9143 8.4418 120.4965 57.8366 41.6990 178.9747 51 K 4.2732 7.8914 115.2059 57.1385 32.2537 176.9444 52 K 4.3603 7.7063 118.6143 55.7327 33.7610 175.6176 53 L 4.0185 7.2772 119.7868 55.4419 42.4147 176.1941 54 Q 4.4278 8.0072 125.7791 54.3806 30.0627 175.4313 55 P 4.3366 0.0000 0.0000 65.5588 31.2170 178.9689 56 A 3.9957 7.9260 119.4542 55.1722 18.2579 179.2345 57 D 4.2809 7.9273 117.3298 57.4486 40.9324 179.0656 58 I 3.4078 7.5327 119.9025 64.1775 37.1810 178.0604 59 Q 4.0031 8.0832 120.4358 59.2587 28.9253 178.2934 60 R 3.8945 8.3141 120.1449 59.1227 30.1606 178.1864 61 L 3.8556 7.8195 120.3069 58.3704 41.9830 178.5921 62 Y 4.3583 7.3631 115.8359 61.0656 37.8162 178.6363 63 A 4.0104 8.1621 121.5419 55.4992 18.7367 179.9964 64 S 4.1314 8.6765 114.0213 61.5736 63.0040 176.9619 65 K 4.3171 8.0795 121.9565 57.9957 31.8193 179.1992 66 L 3.9961 7.6938 121.0472 58.2292 41.8328 178.8354 67 E 4.0817 8.1668 117.2225 59.1317 29.5445 178.7879 68 S 4.4609 7.8698 113.7149 58.9529 62.7436 175.3203 69 G 4.1853 7.7804 110.9882 45.4238 0.0000 173.6543 70 L 4.4015 7.4748 118.6625 53.5448 42.7098 177.7828 71 S 4.3472 8.4359 118.9071 57.5621 64.6204 173.7467 72 P 4.2278 0.0000 0.0000 66.7188 30.8015 178.9993 73 T 3.8488 7.8008 114.7809 66.2713 68.4657 176.5728 74 R 4.0157 7.8225 120.2491 59.1353 30.1486 178.5019 75 V 3.6566 8.2047 118.7155 65.8284 31.5107 177.9602 76 R 3.7468 8.1812 118.8529 59.4138 29.8640 177.9624 77 Y 4.0741 8.1339 119.3988 60.7746 38.8736 177.8093 78 I 3.8135 8.0694 120.7983 64.5367 37.2063 177.6501 79 H 4.7320 8.2875 120.6192 59.0189 29.5659 177.6920 80 V 3.5238 7.2457 112.6507 63.9359 31.4575 179.0359 81 V 3.5343 7.5462 119.1055 64.5892 31.1906 178.2857 82 L 3.9770 8.1166 121.0554 58.0986 41.9670 178.1372 83 H 4.1131 8.1086 118.3360 59.4675 29.7467 176.9446 84 E 3.9930 8.5091 118.5701 58.3976 29.7401 178.7804 85 A 3.9275 7.9339 122.6390 55.4075 18.5471 179.2660 86 M 3.8027 8.1512 116.6288 58.5275 32.2133 178.5299 87 S 4.2718 7.8934 116.5547 60.6768 62.6367 176.4827 88 Q 3.9408 7.4793 119.6239 58.4900 28.7423 177.9646 89 A 3.4774 7.2066 122.0969 54.2986 18.2971 179.5593 90 R 3.9427 7.3259 118.1827 59.0773 30.0811 177.9367 91 E 4.2593 7.9714 114.7669 57.3735 29.5261 177.8116 92 S 4.5346 7.8175 113.0517 57.8934 62.5182 175.0713 93 G 3.8130 7.6793 108.6891 46.2323 0.0000 174.0440 94 L 4.3650 7.0975 119.0948 55.1590 41.2663 176.2034 95 L 4.6058 7.3043 122.1413 52.9091 44.4393 176.7436 96 L 4.0754 8.5302 126.2377 58.2829 41.0962 177.1363 97 Q 4.4716 7.3684 115.0700 54.0348 32.5471 173.8036 98 N 4.5045 8.5811 118.9299 52.2642 38.6763 174.6269 99 P 4.3478 0.0000 0.0000 64.9743 31.0733 178.6257 100 T 3.9705 7.8694 108.7226 64.5566 68.5301 175.9191 101 E 4.1232 8.2467 120.0202 57.7346 29.7100 177.0790 102 A 4.4232 7.4826 119.6282 51.7044 19.7205 176.4926 103 A 4.4917 7.2968 119.2905 51.2313 20.1228 178.4312 104 K 4.4493 8.2582 119.3322 54.0805 31.4430 174.3534 105 P 4.7731 0.0000 0.0000 59.6466 33.7583 174.5045 106 P 4.1442 0.0000 0.0000 62.5900 31.6529 176.4140 107 R 4.0656 8.3719 122.6440 56.3896 30.1987 175.4156 108 H 4.4465 8.2835 121.9387 54.5925 32.6226 171.6278 109 P 4.3841 0.0000 0.0000 62.3340 31.9858 175.3942 110 L 4.2173 7.9188 119.3006 53.8335 42.2164 177.3026 111 E 4.0272 8.6072 120.7406 57.0141 30.1802 177.1288 112 H 4.3762 7.8632 115.2290 55.5462 27.3445 174.4958 113 H 4.5042 8.3143 115.9793 56.1237 26.8531 174.9644 114 H 4.5920 8.3575 121.9445 54.6328 29.7548 174.7297 115 H 4.0202 8.9346 128.8095 56.0930 27.6652 177.1188 116 H 4.5040 8.5113 114.6051 56.0490 32.4441 172.7747 117 H 5.3162 7.3202 117.9088 55.5953 28.6548 175.6338 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 M 8.30 4.41 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.57 0.00 2 I 8.10 4.04 1.87 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 1.30 0.41 0.92 0.00 0.00 3 E 9.51 4.03 0.00 1.91 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 0.00 2.30 2.40 0.00 4 P 0.00 4.27 0.00 2.08 1.97 0.00 3.88 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 2.03 2.07 0.00 5 S 8.45 3.54 0.00 4.10 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 6 K 8.40 4.13 0.00 1.74 1.87 0.00 1.74 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.37 1.42 7.81 7 I 7.66 4.31 1.90 0.00 0.00 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 1.49 1.11 0.92 0.00 0.00 8 T 7.97 4.84 4.52 0.00 0.00 0.00 0.00 0.00 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 9 V 8.40 3.67 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 1.13 0.00 0.00 1.05 0.00 0.00 10 E 8.69 4.16 0.00 2.22 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 0.00 2.52 2.35 0.00 11 Q 7.87 3.98 0.00 2.19 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.89 0.00 0.00 0.00 0.00 0.00 2.57 2.50 0.00 12 W 8.29 4.29 0.00 3.46 3.38 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 13 L 8.53 3.83 0.00 1.91 1.77 1.01 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 14 N 8.39 4.39 0.00 2.99 3.16 0.00 0.00 7.06 7.74 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 15 R 7.62 3.88 0.00 2.03 2.09 0.00 3.20 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 16 W 8.43 3.99 0.00 1.95 2.61 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 17 L 8.26 3.69 0.00 1.96 1.64 1.12 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 18 T 7.59 3.85 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 1.19 0.00 0.00 19 D 7.87 4.50 0.00 2.93 2.61 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 20 Y 8.07 4.08 0.00 1.68 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 0.00 0.00 0.00 0.00 21 A 7.58 4.44 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 22 K 7.09 4.04 0.00 1.73 1.69 0.00 1.66 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.43 1.44 7.81 23 P 0.00 4.28 0.00 2.10 2.07 0.00 3.66 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 1.93 1.98 0.00 24 H 9.02 4.81 0.00 3.26 3.21 0.00 5.78 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 L 7.89 4.32 0.00 1.55 1.58 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 26 R 8.41 4.06 0.00 1.76 1.81 0.00 3.42 0.00 0.00 3.21 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.53 0.00 27 Q 8.84 3.44 0.00 2.20 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 7.13 0.00 0.00 0.00 0.00 0.00 2.22 2.33 0.00 28 S 8.29 4.10 0.00 3.73 3.65 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 0.00 0.00 0.00 0.00 29 T 7.45 3.96 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 1.05 0.00 0.00 30 W 7.72 4.77 0.00 3.58 3.07 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 31 E 8.88 4.58 0.00 2.22 2.18 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 2.35 2.56 0.00 32 S 8.44 4.23 0.00 4.21 4.09 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 0.00 0.00 0.00 33 Y 8.56 4.49 0.00 3.38 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 34 E 7.13 3.62 0.00 1.26 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 2.26 2.24 0.00 35 T 7.89 3.85 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 1.22 0.00 0.00 36 V 7.87 3.80 2.26 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 1.25 0.00 0.00 1.30 0.00 0.00 37 L 7.75 4.10 0.00 2.17 1.85 1.01 0.98 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 38 R 8.59 4.01 0.00 2.07 2.19 0.00 2.82 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.64 0.00 39 L 7.92 3.93 0.00 1.72 1.79 0.88 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 40 H 8.06 4.63 0.00 3.42 3.36 0.00 5.85 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.17 4.29 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 1.47 0.00 0.00 0.93 0.00 0.00 42 I 7.43 3.71 2.09 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.35 0.93 0.00 0.00 43 P 0.00 4.52 0.00 2.04 2.10 0.00 3.76 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 2.18 2.07 0.00 44 T 7.02 4.37 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 1.24 0.00 0.00 45 L 8.52 4.64 0.00 1.65 1.67 0.89 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 46 G 7.95 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 47 S 8.01 4.72 0.00 3.88 3.90 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 0.00 0.00 0.00 48 I 7.49 4.55 2.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.70 0.89 0.00 0.00 49 P 0.00 4.68 0.00 2.19 2.35 0.00 3.69 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 2.05 1.98 0.00 50 L 8.44 3.91 0.00 1.58 1.60 0.47 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 51 K 7.89 4.27 0.00 1.71 1.81 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.87 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.38 1.35 7.81 52 K 7.71 4.36 0.00 1.66 1.87 0.00 1.79 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.32 1.31 7.81 53 L 7.28 4.02 0.00 1.80 1.67 0.86 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 54 Q 8.01 4.43 0.00 2.36 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.17 6.53 0.00 0.00 0.00 0.00 0.00 2.32 2.45 0.00 55 P 0.00 4.34 0.00 2.14 2.33 0.00 3.58 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.14 0.00 56 A 7.93 4.00 1.30 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 0.00 0.00 57 D 7.93 4.28 0.00 2.87 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 58 I 7.53 3.41 1.92 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 1.40 0.97 0.65 0.00 0.00 59 Q 8.08 4.00 0.00 2.23 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.84 0.00 0.00 0.00 0.00 0.00 2.62 2.54 0.00 60 R 8.31 3.89 0.00 1.99 2.03 0.00 3.14 0.00 0.00 3.08 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 61 L 7.82 3.86 0.00 1.70 1.45 0.89 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 62 Y 7.36 4.36 0.00 3.20 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 63 A 8.16 4.01 1.39 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 0.00 0.00 64 S 8.68 4.13 0.00 3.85 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 65 K 8.08 4.32 0.00 2.05 1.90 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.50 1.53 7.81 66 L 7.69 4.00 0.00 1.91 1.92 1.01 1.39 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 67 E 8.17 4.08 0.00 2.20 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 2.65 2.51 0.00 68 S 7.87 4.46 0.00 4.12 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 69 G 7.78 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 0.00 0.00 0.00 0.00 70 L 7.47 4.40 0.00 1.83 1.62 0.93 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 71 S 8.44 4.35 0.00 3.87 3.78 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 72 P 0.00 4.23 0.00 2.24 2.32 0.00 3.70 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 2.07 2.07 0.00 73 T 7.80 3.85 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 1.21 0.00 0.00 74 R 7.82 4.02 0.00 1.88 1.93 0.00 3.17 0.00 0.00 3.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.68 0.00 75 V 8.20 3.66 2.20 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 1.09 0.00 0.00 1.04 0.00 0.00 76 R 8.18 3.75 0.00 1.99 2.03 0.00 3.03 0.00 0.00 2.94 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.56 0.00 77 Y 8.13 4.07 0.00 3.13 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 78 I 8.07 3.81 2.15 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 1.53 1.12 1.06 0.00 0.00 79 H 8.29 4.73 0.00 2.46 3.26 0.00 5.82 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 V 7.25 3.52 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 0.82 0.00 0.00 0.87 0.00 0.00 81 V 7.55 3.53 1.72 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 0.93 0.00 0.00 1.15 0.00 0.00 82 L 8.12 3.98 0.00 1.96 2.07 0.95 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 83 H 8.11 4.11 0.00 3.30 3.42 0.00 5.63 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 E 8.51 3.99 0.00 2.03 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 2.47 2.26 0.00 85 A 7.93 3.93 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 M 8.15 3.80 0.00 2.12 2.04 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 87 S 7.89 4.27 0.00 3.99 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 88 Q 7.48 3.94 0.00 2.04 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.04 0.00 0.00 0.00 0.00 0.00 2.58 2.37 0.00 89 A 7.21 3.48 0.03 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 90 R 7.33 3.94 0.00 1.78 1.95 0.00 3.17 0.00 0.00 3.24 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.57 0.00 91 E 7.97 4.26 0.00 1.97 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 0.00 2.50 2.45 0.00 92 S 7.82 4.53 0.00 4.16 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 93 G 7.68 3.81 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 0.00 0.00 0.00 94 L 7.10 4.37 0.00 1.79 1.73 0.44 0.56 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 95 L 7.30 4.61 0.00 1.40 1.38 0.81 0.40 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 96 L 8.53 4.08 0.00 1.75 1.73 0.89 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 97 Q 7.37 4.47 0.00 1.97 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.04 0.00 0.00 0.00 0.00 0.00 2.23 2.34 0.00 98 N 8.58 4.50 0.00 2.72 2.73 0.00 0.00 6.96 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 99 P 0.00 4.35 0.00 2.11 2.06 0.00 3.53 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.08 0.00 100 T 7.87 3.97 4.39 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 1.28 0.00 0.00 101 E 8.25 4.12 0.00 1.99 2.06 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 2.55 2.48 0.00 102 A 7.48 4.42 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 0.00 103 A 7.30 4.49 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 0.00 0.00 104 K 8.26 4.45 0.00 1.75 1.76 0.00 1.74 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.34 1.39 7.81 105 P 0.00 4.77 0.00 1.50 2.07 0.00 3.75 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.00 0.00 106 P 0.00 4.14 0.00 1.90 1.93 0.00 2.99 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.93 0.00 107 R 8.37 4.07 0.00 1.75 1.84 0.00 3.26 0.00 0.00 3.14 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 108 H 8.28 4.45 0.00 3.04 3.12 0.00 5.98 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 P 0.00 4.38 0.00 2.12 1.98 0.00 3.66 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 1.83 1.92 0.00 110 L 7.92 4.22 0.00 1.21 1.52 0.75 0.81 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 0.00 111 E 8.61 4.03 0.00 2.20 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 0.00 2.29 2.43 0.00 112 H 7.86 4.38 0.00 3.28 3.40 0.00 5.95 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 H 8.31 4.50 0.00 3.12 3.28 0.00 5.94 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 0.00 114 H 8.36 4.59 0.00 3.10 3.17 0.00 5.69 0.00 0.00 0.00 0.00 6.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 H 8.93 4.02 0.00 3.00 2.72 0.00 5.89 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 H 8.51 4.50 0.00 3.24 3.03 0.00 5.78 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 0.00 117 H 7.32 5.32 0.00 3.09 3.07 0.00 6.00 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00