NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 L 4.4216 8.1693 120.6327 55.2165 43.1144 175.5331 8 H 4.8845 8.2932 115.3299 53.7682 31.4677 171.4351 9 K 4.6266 9.4261 120.9786 56.3565 33.5401 177.4042 10 E 4.9404 9.3425 123.3480 53.6535 33.3738 173.8442 11 P 5.0286 0.0000 0.0000 63.3353 32.2701 175.1301 12 A 4.9647 8.5577 121.6365 51.2853 22.8604 175.6059 13 T 4.6242 8.4780 115.7122 61.2043 71.7939 173.7930 14 L 4.2176 8.7178 128.4047 55.9409 42.3876 175.5807 15 I 4.3606 8.5785 126.4921 61.9491 38.8917 176.0043 16 K 4.3831 7.5408 118.7533 55.5671 35.4844 173.5296 17 A 4.5786 8.7573 130.7038 51.8778 19.5641 176.9795 18 I 4.1094 8.6544 125.3600 63.2403 37.9798 175.4181 19 D 4.8457 6.9228 115.5776 52.4536 41.2478 174.3470 20 G 4.0571 8.9559 106.8282 48.1925 0.0000 173.7233 21 D 5.0069 8.2553 116.1850 52.9568 41.4077 175.5727 22 T 5.1762 8.1700 116.9718 62.2297 71.2219 173.4219 23 V 4.9073 9.0859 118.9547 59.5993 36.8079 174.4585 24 K 4.9932 9.4370 123.3146 55.1351 33.8616 175.7399 25 L 5.2759 9.6662 124.9226 53.0038 46.5243 175.6294 26 M 4.7817 9.5116 122.6554 55.1385 33.3573 174.3793 27 Y 4.8331 9.6000 129.6273 55.7365 41.7154 175.7269 28 K 3.4193 9.0326 127.7343 57.6365 29.4375 175.6327 29 G 3.9274 8.2723 100.7146 46.4335 0.0000 173.2549 30 Q 4.6548 7.9498 120.6568 52.8805 32.2272 172.5209 31 P 5.0205 0.0000 0.0000 63.4970 32.0612 175.6179 32 M 4.9070 9.7407 122.6025 54.0167 37.1033 173.6460 33 T 4.8543 8.4572 116.8589 61.0909 69.3562 173.2468 34 F 5.1433 10.4429 127.1713 55.6904 42.2879 174.4217 35 R 5.0079 9.3331 122.6566 54.1545 32.9001 174.6691 36 L 4.2821 9.0878 127.3652 54.7855 41.8816 177.3253 37 L 3.9673 8.9094 124.7984 55.5141 42.8918 177.7189 38 L 4.3281 8.7662 118.8611 54.6995 39.6532 173.9763 39 V 5.0654 7.4138 110.3206 59.6650 36.0646 174.9465 40 D 4.8889 8.9601 121.1333 53.3699 43.7680 174.4326 41 T 4.8501 8.9040 116.9556 59.7999 70.2270 173.3207 42 P 4.3488 0.0000 0.0000 62.3788 32.2176 175.7929 43 E 4.2054 8.6171 122.6323 56.5203 30.0478 177.2907 44 T 4.2558 8.3747 112.6836 60.8377 70.0183 173.8067 45 K 4.0770 7.9471 120.9424 56.4953 33.7346 175.5673 46 H 3.7985 8.6055 117.6986 56.4220 30.8684 174.0312 47 P 4.0503 0.0000 0.0000 65.6201 31.3244 178.4391 48 K 4.1442 8.3727 117.2770 58.1673 32.4132 177.0273 49 K 4.2344 7.6492 116.1692 56.0378 33.8608 177.4154 50 G 3.7967 8.7591 105.8233 44.3444 0.0000 172.8819 51 V 3.9074 7.9906 118.2828 62.8158 31.3778 175.5005 52 E 4.4346 9.6709 129.5804 54.8576 31.5368 176.1403 53 K 3.8473 8.2603 122.9687 58.2631 32.4335 176.7347 54 Y 4.4914 7.9599 123.2066 59.3302 36.0697 170.9021 55 G 3.8757 7.9963 107.4836 47.6408 0.0000 173.8414 56 P 4.2961 0.0000 0.0000 64.9237 31.4374 178.6646 57 E 4.0187 8.2000 116.5704 59.4049 29.5038 179.0656 58 A 4.0166 8.7950 121.2669 55.3094 18.3432 179.9022 59 S 4.0787 8.2298 113.4327 61.6799 62.9136 176.7708 60 A 4.0251 8.2253 123.5091 55.0909 18.0647 179.2298 61 F 3.9396 8.5365 119.2602 61.7887 39.5810 177.2038 62 T 3.9583 8.3636 115.1609 66.6674 68.3666 176.1031 63 K 3.8288 8.3672 121.5441 59.6350 32.2025 178.6055 64 K 3.8159 8.5446 118.6044 59.7765 31.8250 178.8403 65 M 3.8423 7.8295 117.1023 58.7434 32.2628 178.1035 66 K 4.1392 8.4088 118.8289 59.3308 32.0879 179.3380 67 E 3.9880 8.6086 118.3237 59.2615 29.4818 177.6014 68 N 4.5596 8.0850 113.2860 53.4997 38.9662 175.2213 69 A 4.4743 7.3095 121.9398 51.7460 19.3645 178.0307 70 K 4.1934 9.5968 121.4840 58.2983 32.8266 178.0427 71 K 4.6753 9.0416 118.3432 54.4894 35.6935 175.5050 72 I 4.9850 8.4091 125.0391 59.5878 40.1263 174.4146 73 E 5.2220 9.3166 125.3055 54.7140 33.9603 174.8538 74 V 4.5048 9.1554 117.0276 59.5604 34.6662 174.7744 75 E 5.0768 9.0734 125.2754 54.3408 31.9551 174.9296 76 F 4.6098 8.8845 125.3959 57.6717 40.1412 175.4846 77 D 5.0302 8.4828 120.2615 53.4102 43.2454 175.7803 78 K 4.3315 9.0340 117.0271 57.8688 33.2103 178.4533 79 G 4.1806 8.3884 111.3181 44.6327 0.0000 173.7359 80 Q 4.0544 8.6888 122.6237 56.6505 29.3822 176.6533 81 R 4.6390 8.4884 119.2198 56.4288 31.0779 176.0233 82 T 5.5712 7.5977 106.5931 59.0161 71.9371 173.1433 83 D 4.7233 8.2405 123.0325 51.4453 41.4706 177.1593 84 K 3.8938 8.2119 117.5369 59.5357 32.2633 177.1741 85 Y 4.2569 7.8366 115.3500 57.9105 38.1906 176.0712 86 G 3.8816 8.4546 108.6457 45.6351 0.0000 173.5482 87 R 4.3659 8.2933 119.3494 54.7767 31.6482 176.4945 88 G 3.4230 8.4941 111.4936 46.2838 0.0000 172.4055 89 L 5.2530 9.3102 123.8711 52.2596 43.2993 175.5954 90 A 4.5244 8.2332 124.3649 50.8453 23.5768 173.5840 91 Y 4.8130 8.7331 117.2024 56.9040 39.6964 175.3284 92 I 4.8059 9.0449 125.5547 59.6440 40.1443 174.1425 93 Y 5.1315 9.6234 124.7819 56.0769 41.0727 174.5145 94 A 4.8675 9.3969 126.1611 50.1970 21.3757 176.3358 95 D 4.2034 10.0308 125.6234 55.8820 38.9632 175.2027 96 G 3.9062 8.1376 102.9985 45.7479 0.0000 172.9448 97 K 4.4687 8.3005 120.7990 54.6579 33.4515 175.4715 98 M 3.8396 8.6207 123.6730 55.1471 32.8328 176.7132 99 V 3.6670 8.8545 128.1356 66.1270 31.5921 177.5020 100 N 4.2974 8.0367 115.7438 56.4434 38.3611 176.8149 101 E 3.8989 8.1211 119.7680 59.0065 29.9533 178.0727 102 A 4.1676 8.3624 121.3810 55.5343 18.4649 179.5943 103 L 3.3979 8.1222 117.1984 57.7068 41.5931 180.0421 104 V 3.8004 7.4479 119.2660 65.6245 31.3242 177.9755 105 R 4.0150 8.5081 117.7202 59.3080 29.9271 177.4838 106 Q 4.3032 7.5452 114.5529 55.0956 29.1493 176.0638 107 G 3.8646 8.1797 108.9945 46.6571 0.0000 174.8655 108 L 4.4816 8.0508 118.0060 54.2086 42.2531 176.3229 109 A 4.8754 7.5153 120.0159 50.3958 22.9418 175.1180 110 K 4.7775 8.6191 118.7007 54.7785 35.9893 175.7694 111 V 4.3185 9.8554 123.6127 63.1406 31.9829 174.8949 112 A 4.4593 8.5408 128.9160 49.7274 23.3993 174.4344 113 Y 2.8717 7.5662 113.2484 58.9823 35.2904 173.6983 114 V 3.6480 7.2054 118.6684 62.4709 30.6171 173.5049 115 Y 4.7773 7.9211 123.8489 55.4494 38.2219 175.7398 116 K 4.2307 8.7028 124.6293 56.5903 32.6357 175.1437 117 P 4.7662 0.0000 0.0000 63.0331 31.9286 176.2632 118 N 4.9623 8.1125 117.0286 53.7146 37.7693 175.0856 119 N 5.1980 7.7549 110.8381 52.7924 38.9354 176.5180 120 T 3.8563 8.5942 118.4583 67.3566 68.7038 174.7567 121 H 4.8955 8.1943 116.5036 55.5277 29.4045 176.0567 122 E 3.9788 8.6533 123.3264 59.7106 29.3417 178.7847 123 Q 3.9563 8.0729 117.3489 59.3153 28.8321 177.7399 124 H 4.0625 8.3410 118.5381 59.7251 29.7820 176.8545 125 L 3.9639 8.4807 120.6846 57.8733 41.4158 179.8905 126 R 3.8989 8.5675 118.5107 59.1327 30.0105 178.9873 127 K 3.8594 8.5985 119.6953 59.6825 32.1054 179.0835 128 S 4.1193 7.9510 115.4823 61.2823 62.6727 176.2554 129 E 3.9069 8.5725 122.5042 59.0465 29.3058 178.6284 130 A 3.7176 8.1208 121.1905 55.0650 18.3495 179.4030 131 Q 3.7632 7.9911 117.7690 59.2730 29.0771 178.3690 132 A 3.9903 8.1019 121.9278 55.0326 18.3969 179.8289 133 K 3.4868 7.9366 117.4276 59.1724 31.7565 179.2485 134 K 3.7819 8.0822 119.1717 59.4051 32.0861 177.6074 135 E 4.3777 7.9944 115.3305 54.7849 30.1344 176.1051 136 K 4.4871 8.2260 118.0175 56.1105 30.6501 174.9000 137 L 4.3267 8.2844 117.9967 55.5384 44.5570 178.0832 138 N 3.4880 9.2688 119.0611 53.9606 38.2648 176.0580 139 I 3.1132 5.4200 124.9233 64.8111 37.8587 176.6292 140 W 4.8152 8.0638 118.6317 56.5430 29.0231 176.6975 141 S 4.8305 8.2324 119.4623 57.8242 62.6862 173.9132 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 7 L 8.17 4.42 0.00 1.73 1.79 0.97 0.84 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 8 H 8.29 4.88 0.00 3.15 3.26 0.00 5.72 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 9 K 9.43 4.63 0.00 1.59 1.70 0.00 1.63 0.00 0.00 0.97 0.00 0.00 2.30 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.11 1.24 7.81 10 E 9.34 4.94 0.00 2.09 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 2.32 2.36 0.00 11 P 0.00 5.03 0.00 2.10 2.07 0.00 3.83 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 12 A 8.56 4.96 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 13 T 8.48 4.62 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 1.23 0.00 0.00 14 L 8.72 4.22 0.00 1.66 1.58 0.92 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 15 I 8.58 4.36 1.97 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.89 0.94 0.00 0.00 16 K 7.54 4.38 0.00 1.80 1.61 0.00 1.72 0.00 0.00 1.84 0.00 0.00 2.85 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.36 1.39 7.81 17 A 8.76 4.58 1.26 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 0.00 0.00 18 I 8.65 4.11 2.00 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 1.38 0.89 0.91 0.00 0.00 19 D 6.92 4.85 0.00 2.74 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 20 G 8.96 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 21 D 8.26 5.01 0.00 2.80 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 22 T 8.17 5.18 4.41 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 1.26 0.00 0.00 23 V 9.09 4.91 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 0.84 0.00 0.00 0.98 0.00 0.00 24 K 9.44 4.99 0.00 1.67 1.79 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.57 7.81 25 L 9.67 5.28 0.00 1.73 1.66 0.32 0.57 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 M 9.51 4.78 0.00 2.16 2.01 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 2.62 2.56 0.00 27 Y 9.60 4.83 0.00 3.29 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 28 K 9.03 3.42 0.00 1.47 1.65 0.00 1.32 0.00 0.00 1.53 0.00 0.00 2.90 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.11 0.75 7.81 29 G 8.27 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 30 Q 7.95 4.65 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.94 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 31 P 0.00 5.02 0.00 2.16 2.10 0.00 3.83 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 32 M 9.74 4.91 0.00 1.70 2.32 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.52 0.00 33 T 8.46 4.85 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 1.21 0.00 0.00 34 F 10.44 5.14 0.00 3.02 2.87 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 35 R 9.33 5.01 0.00 1.84 1.73 0.00 3.36 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.60 0.00 36 L 9.09 4.28 0.00 1.54 1.61 0.94 0.96 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 37 L 8.91 3.97 0.00 0.82 1.17 0.23 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.77 4.33 0.00 2.00 1.82 1.15 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 39 V 7.41 5.07 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 0.79 0.00 0.00 1.01 0.00 0.00 40 D 8.96 4.89 0.00 2.79 2.44 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 41 T 8.90 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 1.25 0.00 0.00 42 P 0.00 4.35 0.00 2.32 2.05 0.00 3.60 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 2.25 2.04 0.00 43 E 8.62 4.21 0.00 2.07 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 0.00 2.33 2.38 0.00 44 T 8.37 4.26 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 45 K 7.95 4.08 0.00 1.95 1.64 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.37 7.81 46 H 8.61 3.80 0.00 3.22 3.22 0.00 5.88 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 47 P 0.00 4.05 0.00 2.17 2.07 0.00 3.21 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 48 K 8.37 4.14 0.00 1.81 2.10 0.00 1.48 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.39 7.81 49 K 7.65 4.23 0.00 2.03 1.81 0.00 1.96 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.35 1.30 7.81 50 G 8.76 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 51 V 7.99 3.91 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 0.78 0.00 0.00 0.98 0.00 0.00 52 E 9.67 4.43 0.00 1.85 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 2.40 2.49 0.00 53 K 8.26 3.85 0.00 1.63 1.64 0.00 1.63 0.00 0.00 1.58 0.00 0.00 2.61 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.30 0.98 7.81 54 Y 7.96 4.49 0.00 3.23 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 55 G 8.00 3.88 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 0.00 0.00 0.00 56 P 0.00 4.30 0.00 2.15 2.11 0.00 3.50 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.16 0.00 57 E 8.20 4.02 0.00 2.37 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 0.00 2.62 2.54 0.00 58 A 8.80 4.02 1.40 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 0.00 0.00 59 S 8.23 4.08 0.00 4.07 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 60 A 8.23 4.03 1.42 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 0.00 0.00 61 F 8.54 3.94 0.00 3.23 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 62 T 8.36 3.96 4.45 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 1.32 0.00 0.00 63 K 8.37 3.83 0.00 1.91 1.97 0.00 1.65 0.00 0.00 1.65 0.00 0.00 3.06 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.63 1.52 7.81 64 K 8.54 3.82 0.00 1.97 1.69 0.00 1.60 0.00 0.00 1.55 0.00 0.00 3.07 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.44 7.81 65 M 7.83 3.84 0.00 1.98 1.76 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 2.48 2.53 0.00 66 K 8.41 4.14 0.00 1.99 1.82 0.00 1.71 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.56 7.81 67 E 8.61 3.99 0.00 1.93 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 2.34 2.38 0.00 68 N 8.08 4.56 0.00 2.77 2.82 0.00 0.00 7.02 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 69 A 7.31 4.47 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 70 K 9.60 4.19 0.00 1.82 1.87 0.00 1.64 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.45 1.56 7.81 71 K 9.04 4.68 0.00 1.75 1.66 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.38 7.81 72 I 8.41 4.99 2.07 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 1.34 0.97 0.85 0.00 0.00 73 E 9.32 5.22 0.00 1.91 1.79 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 2.21 2.27 0.00 74 V 9.16 4.50 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 -0.11 0.00 0.00 0.62 0.00 0.00 75 E 9.07 5.08 0.00 2.27 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 0.00 2.55 2.46 0.00 76 F 8.88 4.61 0.00 3.09 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 77 D 8.48 5.03 0.00 2.74 3.05 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 78 K 9.03 4.33 0.00 1.79 1.88 0.00 1.77 0.00 0.00 1.74 0.00 0.00 3.21 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.44 7.81 79 G 8.39 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 0.00 0.00 0.00 0.00 80 Q 8.69 4.05 0.00 2.04 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.95 6.79 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 81 R 8.49 4.64 0.00 1.61 1.55 0.00 2.98 0.00 0.00 3.53 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.14 0.00 82 T 7.60 5.57 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 1.15 0.00 0.00 83 D 8.24 4.72 0.00 2.90 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 84 K 8.21 3.89 0.00 1.47 1.72 0.00 1.09 0.00 0.00 1.42 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.99 0.21 7.81 85 Y 7.84 4.26 0.00 3.15 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 86 G 8.45 3.88 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 0.00 0.00 0.00 87 R 8.29 4.37 0.00 1.77 1.90 0.00 3.33 0.00 0.00 3.40 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 88 G 8.49 3.42 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 0.00 0.00 0.00 89 L 9.31 5.25 0.00 1.54 1.62 0.95 0.73 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 90 A 8.23 4.52 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 91 Y 8.73 4.81 0.00 3.12 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 92 I 9.04 4.81 1.75 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 0.90 0.83 0.85 0.00 0.00 93 Y 9.62 5.13 0.00 2.85 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 94 A 9.40 4.87 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 95 D 10.03 4.20 0.00 2.73 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 96 G 8.14 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 0.00 0.00 0.00 97 K 8.30 4.47 0.00 2.01 1.79 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.40 7.81 98 M 8.62 3.84 0.00 1.96 1.74 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 2.43 0.00 99 V 8.85 3.67 2.05 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 1.14 0.00 0.00 0.96 0.00 0.00 100 N 8.04 4.30 0.00 2.93 2.93 0.00 0.00 6.78 7.66 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 0.00 101 E 8.12 3.90 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 2.29 2.31 0.00 102 A 8.36 4.17 1.66 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 0.00 0.00 103 L 8.12 3.40 0.00 1.82 1.61 1.05 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 104 V 7.45 3.80 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 1.36 0.00 0.00 0.99 0.00 0.00 105 R 8.51 4.01 0.00 1.94 2.20 0.00 3.33 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.72 0.00 106 Q 7.55 4.30 0.00 1.73 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.29 0.00 0.00 0.00 0.00 0.00 2.40 2.11 0.00 107 G 8.18 3.86 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 0.00 0.00 0.00 108 L 8.05 4.48 0.00 1.25 1.49 0.44 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.52 4.88 1.15 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 0.00 0.00 110 K 8.62 4.78 0.00 2.02 1.94 0.00 1.11 0.00 0.00 1.30 0.00 0.00 2.68 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.38 1.42 7.81 111 V 9.86 4.32 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 0.78 0.00 0.00 0.94 0.00 0.00 112 A 8.54 4.46 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 Y 7.57 2.87 0.00 3.03 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 0.00 114 V 7.21 3.65 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 0.84 0.00 0.00 0.94 0.00 0.00 115 Y 7.92 4.78 0.00 3.09 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 0.00 116 K 8.70 4.23 0.00 1.81 1.82 0.00 1.78 0.00 0.00 1.79 0.00 0.00 3.10 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.50 1.50 7.81 117 P 0.00 4.77 0.00 2.21 2.16 0.00 3.81 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.01 0.00 118 N 8.11 4.96 0.00 3.08 2.92 0.00 0.00 6.63 7.58 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 0.00 119 N 7.75 5.20 0.00 3.00 3.01 0.00 0.00 6.08 7.22 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 0.00 120 T 8.59 3.86 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 1.03 0.00 0.00 121 H 8.19 4.90 0.00 2.88 3.09 0.00 5.63 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 E 8.65 3.98 0.00 2.09 2.08 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 2.33 2.38 0.00 123 Q 8.07 3.96 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.61 0.00 0.00 0.00 0.00 0.00 2.46 2.37 0.00 124 H 8.34 4.06 0.00 3.22 3.52 0.00 5.87 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 0.00 125 L 8.48 3.96 0.00 1.87 1.74 1.09 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 126 R 8.57 3.90 0.00 1.86 1.94 0.00 3.35 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 1.74 1.69 0.00 127 K 8.60 3.86 0.00 1.73 1.99 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.44 7.81 128 S 7.95 4.12 0.00 3.85 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 0.00 129 E 8.57 3.91 0.00 2.12 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 2.14 2.61 0.00 130 A 8.12 3.72 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 0.00 131 Q 7.99 3.76 0.00 2.22 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.32 2.49 0.00 132 A 8.10 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 133 K 7.94 3.49 0.00 1.21 1.14 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.26 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.30 0.53 7.81 134 K 8.08 3.78 0.00 1.92 1.85 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.42 7.81 135 E 7.99 4.38 0.00 1.97 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 2.28 2.55 0.00 136 K 8.23 4.49 0.00 1.88 1.88 0.00 2.06 0.00 0.00 1.97 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.51 7.81 137 L 8.28 4.33 0.00 1.86 1.70 0.91 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 138 N 9.27 3.49 0.00 2.55 1.42 0.00 0.00 7.12 7.32 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 0.00 139 I 5.42 3.11 1.06 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 -0.03 -0.46 0.00 0.00 140 W 8.06 4.82 0.00 3.42 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 0.00 141 S 8.23 4.83 0.00 3.92 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