NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6280 8.2227 120.4783 54.1434 43.0485 173.7047 2 V 4.1183 7.9197 120.5555 62.0856 32.5639 173.7572 3 Q 4.6926 9.8758 126.5036 54.2077 33.6658 173.5545 4 L 5.2531 8.4828 121.4317 53.2236 46.1150 175.3649 5 Q 4.5602 8.4451 122.4023 55.0785 32.6691 173.5683 6 E 5.1080 8.9276 126.1678 56.2892 31.0216 175.7392 7 S 4.5979 8.9324 115.6297 57.2688 66.9547 173.7464 8 G 4.5065 8.7005 107.8284 42.2668 0.0000 171.0800 9 P 4.3464 0.0000 0.0000 62.9879 31.7368 176.3807 10 S 4.7314 8.5145 113.7625 58.5527 64.8834 172.9966 11 L 5.2259 7.7053 122.2564 53.5432 44.6720 175.6240 12 V 4.6196 8.8018 118.1621 59.6772 36.7713 174.5362 13 K 5.0120 9.0798 121.6339 54.2438 34.1722 175.0347 14 P 4.4742 0.0000 0.0000 64.3132 31.7304 177.0638 15 S 4.1267 9.5618 115.7712 58.1722 62.7407 169.0893 16 Q 4.4212 7.5662 117.5623 56.1280 31.2218 174.2150 17 T 4.8356 8.1503 115.6428 62.1057 69.9479 174.4592 18 L 4.3354 8.7586 129.7488 54.1831 43.5774 175.4117 19 S 5.1203 8.4333 121.4315 56.7282 66.2057 173.2961 20 L 4.9811 8.7108 123.3641 53.1679 46.0629 175.5082 21 T 5.2894 8.9990 117.2915 61.9957 72.5119 172.3686 22 C 5.1818 8.7464 125.0212 54.9199 40.5569 172.6279 23 S 4.8497 8.7697 123.4115 57.2546 64.2975 173.3542 24 V 4.7323 8.0722 125.3128 61.2211 32.9652 174.9357 25 T 4.5396 8.9073 117.7218 61.0776 71.3569 174.4234 26 G 3.9859 9.4249 111.3094 46.9484 0.0000 172.7148 27 D 4.4577 7.3153 116.0324 53.3826 44.1766 174.3109 28 S 4.4838 8.3021 116.7640 57.3797 63.0433 174.9717 29 I 4.1572 8.2986 120.1368 63.6186 37.4706 176.8234 30 T 4.3340 7.9505 110.0483 62.9191 68.7937 175.0231 31 S 4.7167 7.9678 117.7737 58.1147 63.0781 172.5898 32 D 4.2561 7.7370 118.9521 54.0177 43.7691 173.3687 33 Y 4.8618 7.5194 117.4959 55.9993 40.4738 175.1537 34 W 4.9426 8.9116 122.4480 54.9638 32.7131 174.8636 35 S 5.6699 9.2832 119.3131 56.6109 67.1782 172.8404 36 W 5.5619 9.1739 119.8939 55.2923 32.7805 174.9453 37 I 5.2773 9.3277 124.7610 59.5153 41.1214 174.5781 38 R 4.9975 8.9264 120.5644 54.2601 33.3054 173.7086 39 K 4.7946 8.7130 122.3505 54.7193 34.5087 175.9017 40 F 4.8552 9.0610 126.7740 56.0655 39.8610 174.8150 41 P 4.2702 0.0000 0.0000 65.3146 30.6579 177.2757 42 G 4.1386 8.0432 106.9517 45.4163 0.0000 173.3054 43 N 4.0855 7.8136 113.2394 53.8999 36.9057 174.2037 44 R 4.6312 7.5057 115.8541 54.9006 31.7788 174.7292 45 L 5.1174 8.6026 126.4173 53.4514 43.8019 175.6655 46 E 4.7522 9.0334 123.2928 54.6052 33.0975 173.6437 47 Y 4.4968 8.9228 128.5603 57.4909 38.9714 174.7888 48 M 4.4367 9.3840 128.1172 56.7294 33.5388 177.0285 49 G 4.8036 7.9454 104.2085 47.2304 0.0000 170.2658 50 Y 5.9060 8.2848 116.8980 55.8670 42.0361 174.1048 51 V 4.9460 9.2262 120.5649 60.0846 34.2325 175.8295 52 S 4.3507 8.5687 119.9958 55.9292 64.9111 174.3252 53 Y 4.1579 8.0823 118.3436 60.1068 37.2666 177.8914 54 S 3.6065 6.9331 112.7540 58.6766 63.5091 174.8339 55 G 3.9620 7.8387 109.6253 45.0048 0.0000 174.3300 56 S 4.0525 7.5863 115.5897 58.3582 63.5553 173.2557 57 T 4.7720 7.6260 111.9758 59.9992 71.9183 172.7268 58 Y 4.1964 7.9310 119.3489 56.4026 41.4598 174.0297 59 Y 5.6070 8.3696 121.4898 55.8508 41.3299 175.1325 60 N 4.6227 9.4648 123.0048 53.1347 39.6419 174.2355 61 P 4.3552 0.0000 0.0000 65.3274 31.7512 178.5362 62 S 4.1941 8.6225 112.6358 60.9385 62.9895 175.1923 63 L 4.2857 8.4875 119.9180 54.4065 41.7600 176.7404 64 K 4.1265 8.6902 117.4605 57.7555 30.1576 174.7582 65 S 3.7415 8.1153 107.6722 60.1414 60.5695 173.2955 66 R 4.4521 7.7482 116.8634 56.0931 31.2708 176.0101 67 I 4.7393 7.3069 119.4265 59.2921 40.2132 174.5875 68 S 4.5092 8.6630 121.8187 56.6397 66.0098 172.4484 69 I 5.7268 9.3567 127.6017 59.0261 39.6347 174.8850 70 T 5.0318 8.9480 115.8418 60.0653 72.7924 172.5943 71 R 5.1459 8.6872 119.2421 54.6295 34.6994 175.2611 72 D 4.6336 9.1024 120.3917 52.9881 43.3923 176.1049 73 T 3.9290 8.7866 124.0031 66.5563 68.8214 177.2239 74 S 4.1644 8.2548 114.3652 60.6945 62.9524 174.9697 75 K 4.2356 8.2554 117.8039 55.2667 33.1044 175.3638 76 N 4.0987 7.9248 117.6794 54.5904 37.7974 172.5531 77 Q 4.9323 7.8901 115.0592 54.3972 34.2295 175.1325 78 Y 4.8933 8.0165 117.9343 55.5758 42.3124 173.4843 79 Y 5.5981 9.5221 116.9352 56.3195 43.1497 174.1510 80 L 4.9453 8.6453 121.8071 53.3769 45.1480 174.7234 81 D 5.2316 9.0125 125.9640 52.2895 44.4115 174.7441 82 L 5.0102 8.8678 124.9399 53.3336 44.7577 175.5254 83 N 4.7240 9.3668 124.4765 52.3890 39.7091 175.4581 84 S 3.7683 8.1803 114.1476 58.6712 60.5678 172.9121 85 V 4.0734 7.7178 114.6081 61.6481 32.5922 176.1170 86 T 4.8541 8.9213 111.9065 59.7268 72.1322 174.8707 87 T 4.0127 8.3816 110.2018 64.4440 68.6230 175.6953 88 E 4.1800 7.9990 120.4335 58.1362 29.5229 176.9769 89 D 4.9712 8.2065 118.2224 54.3462 41.3727 176.7649 90 T 4.1920 7.9108 117.2556 63.6995 68.8871 173.4489 91 A 4.3654 8.3275 126.5623 52.1713 23.8445 174.6263 92 T 4.6829 8.0760 116.2441 62.7087 70.0998 174.1047 93 Y 4.9267 9.1321 125.1606 56.7840 40.0963 174.4967 94 Y 5.6154 9.7044 121.2778 56.4018 42.2751 172.0714 95 C 4.9290 9.4077 117.2170 53.9090 43.5800 172.4857 96 A 4.9091 8.0085 120.2744 50.8795 22.7138 175.5894 97 N 4.6183 8.5971 117.4518 51.9882 38.5443 175.8912 98 W 4.0912 8.4078 130.4956 60.8949 30.5689 177.3059 99 D 4.1325 8.1358 118.1787 55.5369 40.4210 177.4188 100 G 3.9350 7.8033 106.1974 45.4871 0.0000 174.0453 101 D 4.3597 7.5781 119.7131 55.8046 41.4112 176.2207 102 Y 5.1056 7.4893 116.6307 55.9061 40.4000 174.5860 103 W 5.3166 8.9371 123.5750 54.6785 32.9041 175.3372 104 G 4.2245 8.9500 111.2256 44.3765 0.0000 174.0849 105 Q 4.1401 8.6203 116.5968 57.1867 29.0230 177.2941 106 G 3.8371 9.5594 105.4611 46.0056 0.0000 172.6243 107 T 4.5880 8.4500 115.7914 59.9213 70.9523 172.4877 108 L 4.7042 8.6391 131.1596 54.8399 43.3880 175.7978 109 V 4.5875 9.0046 125.8936 61.4980 34.4912 173.9562 110 T 4.8717 9.0762 125.2053 61.8348 70.9970 173.5913 111 V 4.8249 8.5411 127.1618 61.5097 32.2783 175.0251 112 S 4.7856 8.8550 121.6949 56.8759 66.0496 175.4931 113 A 3.7420 8.8197 124.2393 54.6360 18.6049 177.5802 114 A 4.1772 7.3346 123.0358 52.4962 18.4227 177.1703 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 D 8.22 4.63 0.00 2.68 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 2 V 7.92 4.12 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 0.00 0.00 0.52 0.00 0.00 0.72 0.00 0.00 3 Q 9.88 4.69 0.00 1.94 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.51 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 4 L 8.48 5.25 0.00 1.69 1.52 1.10 0.90 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 5 Q 8.45 4.56 0.00 2.08 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.91 0.00 0.00 0.00 0.00 0.00 2.27 2.37 0.00 6 E 8.93 5.11 0.00 1.96 2.02 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 2.58 2.47 0.00 7 S 8.93 4.60 0.00 3.86 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 8 G 8.70 4.51 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 0.00 0.00 0.00 9 P 0.00 4.35 0.00 2.13 2.02 0.00 3.84 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.88 0.00 10 S 8.51 4.73 0.00 3.99 4.12 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 11 L 7.71 5.23 0.00 1.59 1.52 0.97 0.87 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 12 V 8.80 4.62 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 0.71 0.00 0.00 0.96 0.00 0.00 13 K 9.08 5.01 0.00 1.64 1.69 0.00 1.68 0.00 0.00 1.88 0.00 0.00 3.08 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.54 7.81 14 P 0.00 4.47 0.00 2.03 1.99 0.00 3.72 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 15 S 9.56 4.13 0.00 3.99 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 16 Q 7.57 4.42 0.00 2.16 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.58 0.00 0.00 0.00 0.00 0.00 2.54 2.28 0.00 17 T 8.15 4.84 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 1.21 0.00 0.00 18 L 8.76 4.34 0.00 1.58 1.36 0.58 0.07 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 19 S 8.43 5.12 0.00 3.63 3.60 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 20 L 8.71 4.98 0.00 0.86 1.37 0.48 0.63 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 21 T 9.00 5.29 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 1.29 0.00 0.00 22 C 8.75 5.18 0.00 2.07 1.52 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 0.00 23 S 8.77 4.85 0.00 3.75 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 24 V 8.07 4.73 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 0.61 0.00 0.00 0.18 0.00 0.00 25 T 8.91 4.54 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 26 G 9.42 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 27 D 7.32 4.46 0.00 2.59 2.58 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 28 S 8.30 4.48 0.00 3.94 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 29 I 8.30 4.16 1.71 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 1.45 0.76 0.38 0.00 0.00 30 T 7.95 4.33 4.34 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 1.29 0.00 0.00 31 S 7.97 4.72 0.00 4.24 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 32 D 7.74 4.26 0.00 2.34 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 0.00 0.00 0.00 0.00 33 Y 7.52 4.86 0.00 2.59 2.63 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 34 W 8.91 4.94 0.00 2.46 1.74 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 35 S 9.28 5.67 0.00 3.66 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 36 W 9.17 5.56 0.00 3.46 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 37 I 9.33 5.28 2.04 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 -0.25 1.09 0.00 0.00 38 R 8.93 5.00 0.00 0.96 1.26 0.00 2.21 0.00 0.00 2.69 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.74 0.00 39 K 8.71 4.79 0.00 1.97 1.81 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.36 1.41 7.81 40 F 9.06 4.86 0.00 3.14 2.91 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 41 P 0.00 4.27 0.00 2.10 2.21 0.00 3.86 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 2.13 2.21 0.00 42 G 8.04 4.14 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 0.00 0.00 0.00 43 N 7.81 4.09 0.00 2.88 2.94 0.00 0.00 6.65 7.56 0.00 0.00 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 R 7.51 4.63 0.00 2.02 2.06 0.00 3.13 0.00 0.00 3.22 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.72 0.00 45 L 8.60 5.12 0.00 1.61 1.62 0.86 0.83 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 46 E 9.03 4.75 0.00 2.28 1.75 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 2.36 2.42 0.00 47 Y 8.92 4.50 0.00 3.17 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 48 M 9.38 4.44 0.00 2.25 2.54 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.62 0.00 49 G 7.95 4.80 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 50 Y 8.28 5.91 0.00 3.42 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 51 V 9.23 4.95 2.22 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 0.95 0.00 0.00 0.96 0.00 0.00 52 S 8.57 4.35 0.00 2.77 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 53 Y 8.08 4.16 0.00 3.18 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 54 S 6.93 3.61 0.00 3.59 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 55 G 7.84 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 S 7.59 4.05 0.00 3.64 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 57 T 7.63 4.77 3.28 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 1.16 0.00 0.00 58 Y 7.93 4.20 0.00 1.99 2.65 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 59 Y 8.37 5.61 0.00 2.90 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 60 N 9.46 4.62 0.00 3.25 2.88 0.00 0.00 7.10 7.41 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 61 P 0.00 4.36 0.00 2.29 2.16 0.00 3.76 0.00 0.00 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.18 0.00 62 S 8.62 4.19 0.00 4.05 4.14 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 63 L 8.49 4.29 0.00 1.86 1.77 1.09 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.69 4.13 0.00 1.87 1.87 0.00 1.90 0.00 0.00 1.90 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.59 1.55 7.81 65 S 8.12 3.74 0.00 4.02 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 66 R 7.75 4.45 0.00 1.76 2.02 0.00 3.31 0.00 0.00 3.10 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.82 0.00 67 I 7.31 4.74 1.74 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.80 0.40 0.00 0.00 68 S 8.66 4.51 0.00 3.82 3.57 0.00 0.00 0.00 0.00 0.00 0.00 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 I 9.36 5.73 2.33 0.00 0.00 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 1.38 2.30 1.45 0.00 0.00 70 T 8.95 5.03 4.43 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 1.33 0.00 0.00 71 R 8.69 5.15 0.00 1.75 1.88 0.00 3.26 0.00 0.00 3.28 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.72 0.00 72 D 9.10 4.63 0.00 3.01 2.70 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 0.00 0.00 0.00 0.00 73 T 8.79 3.93 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 74 S 8.25 4.16 0.00 3.99 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 75 K 8.26 4.24 0.00 1.85 1.93 0.00 2.07 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.53 7.81 76 N 7.92 4.10 0.00 2.87 2.71 0.00 0.00 6.83 6.88 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 77 Q 7.89 4.93 0.00 1.82 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.44 0.00 0.00 0.00 0.00 0.00 2.15 2.48 0.00 78 Y 8.02 4.89 0.00 3.11 2.68 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 0.00 0.00 0.00 0.00 79 Y 9.52 5.60 0.00 2.92 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 80 L 8.65 4.95 0.00 0.27 0.13 0.67 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 81 D 9.01 5.23 0.00 2.51 2.42 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 82 L 8.87 5.01 0.00 1.57 1.38 0.92 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 83 N 9.37 4.72 0.00 2.55 2.69 0.00 0.00 7.33 7.49 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 84 S 8.18 3.77 0.00 3.92 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 85 V 7.72 4.07 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 0.81 0.00 0.00 0.94 0.00 0.00 86 T 8.92 4.85 4.25 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 1.27 0.00 0.00 87 T 8.38 4.01 4.26 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 1.29 0.00 0.00 88 E 8.00 4.18 0.00 2.03 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 0.00 2.33 2.39 0.00 89 D 8.21 4.97 0.00 2.87 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 90 T 7.91 4.19 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 1.28 0.00 0.00 91 A 8.33 4.37 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 T 8.08 4.68 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 0.75 0.00 0.00 93 Y 9.13 4.93 0.00 2.87 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 94 Y 9.70 5.62 0.00 3.15 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 95 C 9.41 4.93 0.00 2.05 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 96 A 8.01 4.91 -0.19 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 97 N 8.60 4.62 0.00 2.30 2.81 0.00 0.00 6.92 8.70 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 98 W 8.41 4.09 0.00 3.22 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 99 D 8.14 4.13 0.00 2.68 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 0.00 100 G 7.80 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 0.00 101 D 7.58 4.36 0.00 1.72 2.03 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 0.00 102 Y 7.49 5.11 0.00 3.10 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 0.00 103 W 8.94 5.32 0.00 3.22 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 0.00 104 G 8.95 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 0.00 0.00 0.00 0.00 105 Q 8.62 4.14 0.00 2.25 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.44 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 106 G 9.56 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 0.00 0.00 0.00 107 T 8.45 4.59 4.26 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 1.31 0.00 0.00 108 L 8.64 4.70 0.00 1.68 1.56 0.95 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 109 V 9.00 4.59 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 0.81 0.00 0.00 0.74 0.00 0.00 110 T 9.08 4.87 4.26 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 1.24 0.00 0.00 111 V 8.54 4.82 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 0.79 0.00 0.00 0.97 0.00 0.00 112 S 8.85 4.79 0.00 3.91 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 0.00 113 A 8.82 3.74 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 0.00 114 A 7.33 4.18 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