NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3707 8.4045 120.3486 55.0934 33.4862 175.3778 2 E 4.0915 8.6635 124.9685 56.1163 31.0070 171.4606 3 L 4.9979 8.6253 124.6573 53.1531 45.0642 174.2296 4 T 4.7688 8.8038 113.5428 61.5801 70.9445 171.9353 5 T 5.2953 8.4677 110.0705 60.2378 72.2156 173.1553 6 R 4.7236 8.8843 121.3562 55.2500 34.2353 173.5532 7 T 4.9249 8.3773 121.2248 61.8430 70.3504 174.2040 8 L 4.3571 9.4657 129.0774 53.4700 42.7024 175.6094 9 P 4.6100 0.0000 0.0000 62.1781 32.1961 176.3228 10 A 4.1355 8.4027 121.4729 54.5309 18.3374 178.2055 11 R 4.2218 7.5871 115.8360 54.8112 29.3848 176.1292 12 K 4.2684 8.3897 122.6822 56.4968 33.9051 176.3152 13 H 5.2134 9.6287 121.7913 54.9727 29.8444 173.8968 14 I 4.9721 9.2550 125.5179 59.5955 39.4063 174.8228 15 A 5.1139 9.1457 129.6284 50.6120 20.8385 175.6308 16 L 5.0724 9.1353 123.3487 52.9595 44.3259 175.9358 17 V 4.6103 8.9409 123.8094 61.0698 35.0537 174.0336 18 A 5.3616 8.4133 127.5667 50.9518 22.3721 175.7462 19 H 4.7691 9.3016 118.8592 55.5255 30.2258 176.3545 20 D 4.4929 9.2496 120.7823 58.4811 40.5185 179.3841 21 H 4.3972 8.4322 113.1493 57.6777 29.1725 176.2483 22 C 4.6672 8.2185 117.8963 59.5368 28.5740 175.5484 23 K 4.1226 7.9630 123.9424 60.2997 31.6725 179.6531 24 Q 4.0978 8.1392 120.3786 60.4226 28.1960 180.2122 25 M 4.3757 8.1217 120.1229 58.4386 32.0305 178.5446 26 L 4.1950 8.3371 120.4307 58.1531 42.1316 178.7065 27 M 4.1155 8.5237 119.1721 58.7143 31.9078 178.8392 28 S 4.1592 8.3027 115.0565 61.3954 63.1367 176.6075 29 W 4.1499 8.3193 130.6067 60.5575 30.2669 178.2267 30 V 3.4735 8.2653 117.4370 65.9917 31.1706 177.5673 31 E 4.0602 8.4762 118.6592 59.3995 29.0806 179.3092 32 R 3.8386 8.0312 117.9826 58.7360 30.2365 177.3356 33 H 4.6461 7.2956 113.4669 55.2807 29.0023 175.8483 34 Q 3.8792 7.4525 124.6107 59.2793 28.5122 177.1380 35 P 4.5819 0.0000 0.0000 64.7252 31.5843 177.8163 36 L 4.2391 7.7156 118.2979 57.7935 42.2991 178.6130 37 L 4.1942 8.1277 118.9779 57.7064 41.3699 179.1775 38 E 4.0161 8.6187 118.7935 58.8726 29.1256 178.3979 39 Q 4.3230 7.8707 116.0897 56.3963 29.3322 174.2964 40 H 4.9743 7.9952 116.5741 53.7630 32.8384 172.9718 41 V 4.1628 8.5035 119.2667 61.9080 32.7667 174.5858 42 L 5.2233 8.3456 127.9383 53.6888 43.8500 175.2244 43 Y 5.2393 9.1818 120.0969 56.6689 42.6037 174.0787 44 A 5.1560 8.7579 121.4735 52.2360 23.6186 175.9429 45 T 4.0284 8.4620 109.6146 61.2760 70.4958 175.1922 46 G 3.8284 8.9736 106.7576 49.0513 0.0000 176.1690 47 T 3.8874 7.7257 116.4116 66.0133 68.9388 176.8185 48 T 3.9844 8.0300 117.2457 66.7794 68.5952 176.3808 49 G 3.7752 8.5121 107.7154 48.2425 0.0000 175.3680 50 N 4.4212 8.1639 118.6957 55.8968 38.6336 177.6404 51 L 4.0531 8.1107 120.5208 57.6337 41.6111 179.6324 52 I 3.7274 7.9025 120.0146 64.5172 37.0861 178.7095 53 S 4.4277 8.0813 118.7739 61.6602 62.5678 177.2958 54 R 3.9233 8.0625 123.0988 60.4642 29.1667 180.4396 55 A 4.6314 7.6765 118.1096 53.6287 19.7296 178.4133 56 T 4.3778 8.2725 106.4291 60.8661 70.0542 176.0473 57 G 3.9190 8.1705 109.2012 45.8151 0.0000 173.8766 58 M 4.1872 7.7756 119.7919 54.9068 32.6091 174.9617 59 N 4.6449 8.4617 119.9524 52.6916 39.5156 174.3557 60 V 4.4134 8.0937 125.4150 61.1174 34.3361 174.9810 61 N 4.6131 9.0167 126.1537 52.5290 38.5616 173.4350 62 A 4.7826 8.3283 125.6953 51.7154 19.6351 176.7547 63 M 4.6275 8.8318 123.8501 54.1944 35.5134 175.8248 64 L 4.2600 9.0122 119.7301 55.0667 43.4251 176.9613 65 S 4.2878 8.6966 115.3486 58.7013 63.3659 175.0951 66 G 3.7370 9.0669 112.1250 47.9221 0.0000 174.2882 67 P 4.1502 0.0000 0.0000 64.5673 31.3736 177.5896 68 M 4.4339 7.7631 114.8694 54.7593 32.5995 175.8941 69 G 3.8446 8.0869 107.8417 45.3981 0.0000 176.5752 70 G 3.6509 8.8940 108.5913 48.0657 0.0000 175.6561 71 D 4.3054 8.0032 120.5625 57.2055 40.8574 178.6420 72 Q 4.0026 8.0001 118.0385 58.5401 28.8171 178.4811 73 Q 3.9280 7.8763 119.3887 58.8622 28.7017 178.7715 74 V 3.5867 7.7804 119.4056 65.8931 31.5818 178.1784 75 G 3.5954 8.3289 105.5346 47.8394 0.0000 175.4350 76 A 3.9585 8.3367 123.6009 54.8204 18.2789 179.7556 77 L 3.7857 7.8750 117.4635 57.7630 41.5848 179.7370 78 I 3.5228 7.7948 120.1456 64.4211 36.9046 178.7379 79 S 2.7900 7.6679 113.1124 60.2961 62.7853 175.2449 80 E 4.0452 7.2632 119.6361 55.3966 29.4361 176.5697 81 G 3.6453 7.3087 107.0642 46.3455 0.0000 174.7986 82 K 4.1609 7.9386 118.0609 55.7867 32.8251 176.6520 83 I 4.3736 7.2893 119.5823 59.4848 39.7340 174.6798 84 D 4.8529 8.9966 124.4373 54.8008 42.8415 177.0769 85 V 4.6935 7.6234 117.5942 60.9861 35.5556 173.4909 86 L 5.0954 8.9866 129.2743 53.4524 44.8266 174.9869 87 I 4.6670 9.0058 128.5504 59.8543 39.0352 174.5907 88 F 5.3590 9.4034 131.3073 56.5283 41.2358 173.3199 89 F 5.6529 9.4263 127.1069 56.1588 37.6506 175.2099 90 W 4.4731 7.9045 119.1909 55.4689 29.8708 176.1995 91 D 4.4404 9.1455 121.4983 52.9093 40.4013 174.2826 92 P 4.4741 0.0000 0.0000 63.2848 31.7371 176.3837 93 L 4.7551 8.2523 117.9547 54.4142 42.4337 175.7549 94 N 4.9482 7.8098 114.5288 51.5173 42.5324 173.8527 95 A 4.3449 8.5075 125.0001 51.6405 19.7366 177.1601 96 V 4.4584 8.0446 115.6660 58.4762 34.0674 175.1440 97 P 4.3003 0.0000 0.0000 65.9457 31.3931 176.9513 98 H 4.8545 7.9947 114.4926 55.3643 29.9010 176.7807 99 D 4.2628 7.8094 123.0892 58.1853 41.0494 175.1546 100 P 4.1998 0.0000 0.0000 66.1124 31.1156 178.0836 101 D 4.3414 8.0697 118.0670 56.9605 40.7923 178.6546 102 V 3.8077 7.7556 118.5818 66.2262 31.5993 178.3240 103 K 3.8234 8.2395 118.1564 59.2744 31.8026 179.3006 104 A 4.0026 8.3349 121.5417 54.8358 18.2543 179.5057 105 L 3.9132 8.1285 118.9537 58.4397 42.1750 179.2936 106 L 4.1144 8.0029 118.9642 57.6263 41.4764 179.5326 107 R 3.8876 8.0705 118.9338 59.3794 29.9754 178.6308 108 L 4.0869 8.0865 118.7025 57.7459 41.5197 179.3338 109 A 4.1152 8.1976 120.7578 55.2269 18.1173 179.9737 110 T 3.8872 7.7019 114.2957 66.6983 68.3980 177.2460 111 V 3.3417 7.5554 119.2514 65.7242 31.5071 176.7352 112 W 4.3181 8.2026 116.3037 56.0387 29.4058 175.5944 113 N 4.1649 7.5801 116.4870 54.9295 37.0507 173.1741 114 I 4.7107 7.3059 110.4780 58.2180 41.1487 175.3812 115 P 4.4621 0.0000 0.0000 63.2333 32.2698 175.4295 116 V 5.1384 8.4958 123.0016 61.0624 34.7391 174.1935 117 A 4.9292 9.1530 128.8693 50.3931 21.6777 176.4192 118 T 5.3659 9.0457 110.4632 60.5939 69.9858 173.7739 119 N 4.1401 7.3957 119.2375 50.2919 41.4344 175.1543 120 V 3.3570 7.5463 119.8010 66.0452 31.6336 177.6906 121 A 4.1047 7.8828 119.8720 55.8081 18.2222 179.6681 122 T 3.8427 8.3804 113.9320 66.4808 68.4473 176.9221 123 A 4.0071 8.0081 122.8092 55.2644 18.3773 179.4180 124 D 4.5766 8.7524 117.7417 57.7826 40.7626 178.9537 125 F 3.9203 8.2183 116.7078 60.6275 39.1845 177.6579 126 I 3.9895 8.0906 119.2964 64.5314 36.8114 178.4301 127 I 2.4974 7.6926 117.9931 63.2579 37.8104 176.9972 128 Q 4.1618 7.7326 116.4322 55.4093 29.4647 176.0758 129 S 4.3660 7.4716 116.6918 56.9911 63.1123 172.8839 130 P 4.2814 0.0000 0.0000 66.5320 31.0180 177.4394 131 H 5.1369 8.1536 114.1718 55.6200 28.5241 176.8902 132 F 4.1502 8.1912 124.2713 60.5846 39.2746 175.7910 133 N 4.8973 7.8367 115.2469 52.8823 38.6494 173.8315 134 D 5.1502 7.5686 118.5587 52.2002 44.3532 175.3815 135 A 4.5239 8.4299 122.4432 52.1508 19.5724 177.4094 136 V 4.4330 8.7379 119.6170 60.6246 35.0779 173.0913 137 D 5.1459 8.7352 123.5659 54.2231 41.9144 175.6329 138 I 4.7714 9.0992 114.8494 59.0585 41.3796 174.2322 139 L 5.0034 8.5401 123.9118 54.3842 42.6026 176.1465 140 I 4.9183 8.8875 116.3586 58.0678 41.5598 172.8212 141 P 4.3993 0.0000 0.0000 63.3257 32.0398 176.8886 142 D 4.7058 8.6909 122.1457 52.8870 40.0130 176.1229 143 Y 4.2845 8.7249 128.5566 61.1552 39.0526 177.8439 144 Q 4.1062 8.6472 123.3422 61.3387 28.0086 181.6150 145 R 4.1866 7.9797 122.4762 61.0225 29.1453 180.1938 146 Y 4.1522 7.7094 118.9199 60.7030 39.2458 177.5535 147 L 3.5036 8.1196 121.2934 57.8747 42.1958 178.6040 148 A 3.9451 7.8991 120.6599 55.3819 17.9871 179.3717 149 D 4.3550 7.5124 116.4965 57.3481 40.9755 178.9123 150 R 3.8905 7.3180 117.2196 58.1112 30.0250 177.2362 151 L 4.3447 7.1724 121.5388 54.7108 42.0035 176.0963 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 8.40 4.37 0.00 1.96 2.05 0.00 0.00 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.49 0.00 2 E 8.66 4.09 0.00 1.78 1.82 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 2.31 1.98 0.00 3 L 8.63 5.00 0.00 1.52 1.73 0.91 0.81 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 4 T 8.80 4.77 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 1.37 0.00 0.00 5 T 8.47 5.30 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 1.24 0.00 0.00 6 R 8.88 4.72 0.00 1.90 1.80 0.00 3.03 0.00 0.00 3.17 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.61 0.00 7 T 8.38 4.92 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 1.24 0.00 0.00 8 L 9.47 4.36 0.00 1.55 1.57 0.94 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 9 P 0.00 4.61 0.00 2.15 2.06 0.00 3.96 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.01 0.00 10 A 8.40 4.14 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 11 R 7.59 4.22 0.00 1.76 1.85 0.00 3.17 0.00 0.00 3.18 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.56 0.00 12 K 8.39 4.27 0.00 1.40 1.56 0.00 1.47 0.00 0.00 1.79 0.00 0.00 2.50 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 0.56 7.81 13 H 9.63 5.21 0.00 3.19 3.26 0.00 5.79 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 I 9.26 4.97 2.03 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.67 1.08 0.00 0.00 15 A 9.15 5.11 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 16 L 9.14 5.07 0.00 1.55 1.56 1.02 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 17 V 8.94 4.61 1.56 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 0.63 0.00 0.00 0.65 0.00 0.00 18 A 8.41 5.36 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 19 H 9.30 4.77 0.00 3.29 3.34 0.00 5.68 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 20 D 9.25 4.49 0.00 2.80 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 21 H 8.43 4.40 0.00 3.30 3.40 0.00 5.87 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 C 8.22 4.67 0.00 3.29 3.10 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 23 K 7.96 4.12 0.00 2.01 1.92 0.00 1.73 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.53 1.71 7.81 24 Q 8.14 4.10 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.90 0.00 0.00 0.00 0.00 0.00 2.36 2.02 0.00 25 M 8.12 4.38 0.00 2.15 2.48 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.56 0.00 26 L 8.34 4.20 0.00 1.68 1.84 0.17 0.77 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 27 M 8.52 4.12 0.00 2.10 2.34 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.98 0.00 28 S 8.30 4.16 0.00 4.00 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 29 W 8.32 4.15 0.00 3.76 3.56 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 0.00 0.00 0.00 0.00 30 V 8.27 3.47 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 0.91 0.00 0.00 1.23 0.00 0.00 31 E 8.48 4.06 0.00 2.26 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 2.32 2.31 0.00 32 R 8.03 3.84 0.00 1.70 1.91 0.00 3.11 0.00 0.00 3.14 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.46 0.00 33 H 7.30 4.65 0.00 2.47 2.80 0.00 5.70 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 7.45 3.88 0.00 2.20 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.17 6.74 0.00 0.00 0.00 0.00 0.00 2.47 2.41 0.00 35 P 0.00 4.58 0.00 2.03 2.09 0.00 3.61 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 36 L 7.72 4.24 0.00 1.74 1.76 1.18 0.61 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 37 L 8.13 4.19 0.00 1.71 1.75 0.77 1.01 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 38 E 8.62 4.02 0.00 2.24 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 2.32 2.35 0.00 39 Q 7.87 4.32 0.00 2.24 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.65 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 40 H 8.00 4.97 0.00 3.06 3.50 0.00 5.64 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 41 V 8.50 4.16 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 0.87 0.00 0.00 0.89 0.00 0.00 42 L 8.35 5.22 0.00 1.74 1.59 0.95 0.92 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 43 Y 9.18 5.24 0.00 2.82 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 44 A 8.76 5.16 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 45 T 8.46 4.03 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 1.15 0.00 0.00 46 G 8.97 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 47 T 7.73 3.89 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 1.24 0.00 0.00 48 T 8.03 3.98 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 1.28 0.00 0.00 49 G 8.51 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 0.00 0.00 0.00 50 N 8.16 4.42 0.00 2.89 2.88 0.00 0.00 7.07 6.67 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 51 L 8.11 4.05 0.00 1.87 1.74 0.95 0.53 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 52 I 7.90 3.73 2.03 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.81 0.94 0.00 0.00 53 S 8.08 4.43 0.00 4.11 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 54 R 8.06 3.92 0.00 1.95 1.89 0.00 3.25 0.00 0.00 3.23 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.52 0.00 55 A 7.68 4.63 1.34 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 0.00 0.00 0.00 56 T 8.27 4.38 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 1.27 0.00 0.00 57 G 8.17 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 0.00 0.00 0.00 58 M 7.78 4.19 0.00 2.11 1.99 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.47 0.00 59 N 8.46 4.64 0.00 2.64 2.68 0.00 0.00 6.73 7.71 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 60 V 8.09 4.41 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 0.87 0.00 0.00 0.93 0.00 0.00 61 N 9.02 4.61 0.00 2.22 2.65 0.00 0.00 6.48 7.30 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 62 A 8.33 4.78 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 63 M 8.83 4.63 0.00 2.05 2.03 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.83 0.00 64 L 9.01 4.26 0.00 1.70 1.58 0.95 0.93 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 65 S 8.70 4.29 0.00 3.90 3.72 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 66 G 9.07 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 0.00 0.00 0.00 67 P 0.00 4.15 0.00 1.97 2.01 0.00 3.56 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 1.98 1.93 0.00 68 M 7.76 4.43 0.00 1.97 2.07 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.52 0.00 69 G 8.09 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 70 G 8.89 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 0.00 0.00 0.00 71 D 8.00 4.31 0.00 2.75 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 72 Q 8.00 4.00 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.92 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 73 Q 7.88 3.93 0.00 2.29 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.55 0.00 74 V 7.78 3.59 2.11 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 0.98 0.00 0.00 0.92 0.00 0.00 75 G 8.33 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 0.00 0.00 0.00 76 A 8.34 3.96 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 77 L 7.88 3.79 0.00 1.72 1.47 0.72 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 78 I 7.79 3.52 1.99 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 1.51 0.64 0.93 0.00 0.00 79 S 7.67 2.79 0.00 3.88 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 80 E 7.26 4.05 0.00 1.96 1.82 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 2.12 2.15 0.00 81 G 7.31 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 0.00 0.00 0.00 82 K 7.94 4.16 0.00 1.60 1.59 0.00 1.51 0.00 0.00 1.58 0.00 0.00 2.79 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.24 1.20 7.81 83 I 7.29 4.37 1.72 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.65 0.84 0.00 0.00 84 D 9.00 4.85 0.00 2.50 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 85 V 7.62 4.69 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 1.18 0.00 0.00 1.00 0.00 0.00 86 L 8.99 5.10 0.00 1.81 1.54 0.87 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 87 I 9.01 4.67 1.69 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.82 0.15 0.00 0.00 88 F 9.40 5.36 0.00 3.02 2.96 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 89 F 9.43 5.65 0.00 2.94 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 W 7.90 4.47 0.00 3.11 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 0.00 0.00 0.00 91 D 9.15 4.44 0.00 2.79 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 92 P 0.00 4.47 0.00 1.89 1.10 0.00 3.48 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 1.66 1.42 0.00 93 L 8.25 4.76 0.00 1.54 1.62 0.85 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 94 N 7.81 4.95 0.00 2.76 2.62 0.00 0.00 7.03 7.35 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 95 A 8.51 4.34 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 96 V 8.04 4.46 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 0.89 0.00 0.00 0.88 0.00 0.00 97 P 0.00 4.30 0.00 2.22 2.23 0.00 3.80 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.01 0.00 98 H 7.99 4.85 0.00 3.56 3.55 0.00 5.47 0.00 0.00 0.00 0.00 7.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 D 7.81 4.26 0.00 2.87 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 0.00 100 P 0.00 4.20 0.00 2.30 2.29 0.00 3.75 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.07 0.00 101 D 8.07 4.34 0.00 3.05 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 0.00 102 V 7.76 3.81 2.16 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 0.67 0.00 0.00 1.20 0.00 0.00 103 K 8.24 3.82 0.00 1.90 1.76 0.00 1.28 0.00 0.00 1.74 0.00 0.00 2.85 0.00 0.00 2.52 0.00 0.00 0.00 0.00 1.33 1.31 7.81 104 A 8.33 4.00 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 0.00 105 L 8.13 3.91 0.00 1.90 1.99 0.89 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.00 4.11 0.00 1.66 1.66 0.33 0.97 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 0.00 107 R 8.07 3.89 0.00 2.01 2.07 0.00 3.07 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 108 L 8.09 4.09 0.00 2.06 1.84 1.03 0.97 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 0.00 109 A 8.20 4.12 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 0.00 110 T 7.70 3.89 4.40 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 1.19 0.00 0.00 111 V 7.56 3.34 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 0.00 0.00 0.84 0.00 0.00 112 W 8.20 4.32 0.00 3.46 3.23 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 0.00 113 N 7.58 4.16 0.00 2.76 2.95 0.00 0.00 6.93 9.23 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 0.00 114 I 7.31 4.71 2.13 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.90 0.97 0.00 0.00 115 P 0.00 4.46 0.00 2.23 2.15 0.00 3.89 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.18 0.00 116 V 8.50 5.14 2.16 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 0.91 0.00 0.00 1.05 0.00 0.00 117 A 9.15 4.93 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 0.00 118 T 9.05 5.37 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 1.44 0.00 0.00 119 N 7.40 4.14 0.00 2.61 2.55 0.00 0.00 5.83 7.68 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 0.00 120 V 7.55 3.36 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 1.30 0.00 0.00 0.76 0.00 0.00 121 A 7.88 4.10 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 0.00 122 T 8.38 3.84 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 1.22 0.00 0.00 123 A 8.01 4.01 0.93 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 0.00 124 D 8.75 4.58 0.00 3.07 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 0.00 125 F 8.22 3.92 0.00 3.25 3.20 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 0.00 126 I 8.09 3.99 2.10 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.77 1.08 0.00 0.00 127 I 7.69 2.50 1.87 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 -0.36 0.68 0.00 0.00 128 Q 7.73 4.16 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.65 0.00 0.00 0.00 0.00 0.00 2.30 2.27 0.00 129 S 7.47 4.37 0.00 4.19 3.85 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 0.00 130 P 0.00 4.28 0.00 2.23 2.31 0.00 3.75 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 1.99 1.97 0.00 131 H 8.15 5.14 0.00 3.28 3.36 0.00 5.64 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 F 8.19 4.15 0.00 3.12 3.21 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 0.00 133 N 7.84 4.90 0.00 2.78 2.86 0.00 0.00 6.86 7.94 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 0.00 134 D 7.57 5.15 0.00 2.53 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 0.00 135 A 8.43 4.52 1.20 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 0.00 0.00 0.00 136 V 8.74 4.43 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 0.69 0.00 0.00 0.95 0.00 0.00 137 D 8.74 5.15 0.00 2.58 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 0.00 138 I 9.10 4.77 1.92 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.01 0.95 0.00 0.00 139 L 8.54 5.00 0.00 1.57 1.65 0.99 0.78 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 0.00 140 I 8.89 4.92 2.22 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.47 1.16 0.00 0.00 141 P 0.00 4.40 0.00 1.76 1.78 0.00 3.52 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 1.07 0.00 142 D 8.69 4.71 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 0.00 143 Y 8.72 4.28 0.00 3.41 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 0.00 144 Q 8.65 4.11 0.00 2.09 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.85 6.68 0.00 0.00 0.00 0.00 0.00 2.37 2.02 0.00 145 R 7.98 4.19 0.00 1.81 1.97 0.00 3.24 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.51 0.00 146 Y 7.71 4.15 0.00 2.88 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 0.00 147 L 8.12 3.50 0.00 1.03 1.34 0.84 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 148 A 7.90 3.95 1.36 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 0.00 0.00 0.00 0.00 0.00 0.00 149 D 7.51 4.36 0.00 2.63 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 R 7.32 3.89 0.00 1.66 1.80 0.00 3.08 0.00 0.00 2.77 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.98 0.00 151 L 7.17 4.34 0.00 1.60 1.52 0.87 0.75 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