NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3943 8.3049 120.3474 55.1319 33.4024 174.7096 2 L 4.1041 8.3739 126.2347 52.4349 42.6620 176.1644 3 S 4.5527 9.4114 120.2258 56.7654 66.5314 173.4173 4 P 4.1886 0.0000 0.0000 65.7212 30.9472 178.8665 5 A 3.9925 7.9375 119.0473 55.1211 18.3330 179.1025 6 D 4.4156 8.3524 119.1682 56.9481 40.9541 179.2887 7 K 3.9274 8.6254 119.0827 59.7096 32.0293 179.5124 8 T 3.8580 8.2370 116.3330 66.6864 68.3395 176.2895 9 N 4.3063 8.4100 118.6362 56.3258 38.5193 177.6340 10 V 3.5000 7.8186 119.3729 66.0271 31.5679 178.2090 11 K 3.9394 8.0728 117.9847 59.3989 31.7069 179.2522 12 A 3.9898 8.2617 120.9043 54.9654 18.3077 179.6328 13 A 3.9969 8.2696 119.4152 55.2353 18.5989 179.7999 14 W 4.1754 8.7197 127.1621 60.2840 30.4864 178.4277 15 G 3.6618 8.3015 105.6220 47.5888 0.0000 175.3232 16 K 4.0956 7.6086 121.2109 58.9746 32.5043 178.6331 17 V 3.6199 7.7292 118.8551 65.1664 31.5742 176.8880 18 G 3.5489 8.2377 106.7594 46.7868 0.0000 176.0279 19 A 4.0688 8.5161 127.6108 53.3822 18.4265 178.5482 20 H 4.1593 7.9519 112.8079 56.2106 28.7684 177.1920 21 A 3.5479 7.1380 123.7066 54.9104 18.2952 179.6072 22 G 3.6143 7.9187 102.8886 48.0355 0.0000 174.8581 23 E 3.9709 8.0708 121.8479 59.3104 29.5353 178.4558 24 Y 4.4707 8.0696 116.6955 60.7221 38.0321 178.2813 25 G 3.6896 8.5297 106.9438 47.7087 0.0000 175.5950 26 A 4.0236 7.8953 122.1730 54.9542 18.7316 178.9173 27 E 4.0102 8.4035 117.6134 59.4145 29.6330 178.9234 28 A 4.0466 7.9685 122.1174 54.4731 18.3675 179.5670 29 L 3.4672 7.6960 117.1208 57.7026 41.7784 179.3342 30 E 3.9994 8.1181 118.5763 59.4667 29.5908 178.6383 31 R 3.8837 8.2505 118.4588 59.5334 30.0631 178.6494 32 M 4.1275 7.9257 117.5574 58.8820 32.0839 178.1807 33 F 4.5647 7.5313 116.6079 60.8313 39.1428 177.3497 34 L 4.2490 7.8161 117.3031 57.3582 41.6198 179.0892 35 S 4.1611 8.0635 114.5486 59.3648 64.3051 174.5991 36 F 4.9801 7.8634 120.7314 54.0656 38.8999 173.7052 37 P 4.4787 0.0000 0.0000 65.4819 31.5526 177.7885 38 T 4.0470 8.1523 108.5364 64.7518 68.5336 176.2648 39 T 4.3709 8.5322 112.5734 64.2001 68.9567 176.4123 40 K 4.1194 8.4445 121.7975 58.9475 31.7554 178.8789 41 T 3.9256 7.6776 109.1275 64.2874 68.7290 175.3218 42 Y 4.1174 7.5947 117.7893 58.4149 38.5900 175.1867 43 F 4.7222 8.0791 119.7329 56.2837 39.9295 175.1149 44 P 4.3585 0.0000 0.0000 65.1715 31.6594 176.5066 45 H 4.7839 8.4286 113.0219 55.4874 29.0333 174.5854 46 F 4.9744 7.6565 119.1846 55.7067 41.0893 174.7012 47 D 4.4937 9.9429 125.6544 54.2173 41.0852 175.9521 48 L 4.5857 8.3347 125.5121 54.3005 42.3923 176.7173 49 S 4.3573 8.2531 114.9886 57.8513 63.5833 173.1609 50 H 4.3246 8.4834 121.1284 57.7249 29.9643 175.5741 51 G 3.8674 8.4947 114.4401 45.5152 0.0000 174.2589 52 S 4.0305 7.7800 114.3909 58.8626 63.5030 174.8886 53 A 3.9614 8.5822 130.3616 55.1777 18.1542 179.6937 54 Q 3.6767 7.8243 116.3785 58.8780 28.7241 178.8568 55 V 3.8276 7.4525 118.8241 66.0062 31.6073 177.8047 56 K 3.9578 8.3464 118.6269 59.8944 32.0491 179.4068 57 G 3.6819 8.7026 105.8653 48.0054 0.0000 175.1966 58 H 4.4685 9.2051 121.0538 59.6341 29.9043 177.8949 59 G 4.0274 8.7262 107.8207 47.6748 0.0000 175.7959 60 K 4.0040 8.2455 123.1479 58.7988 32.4328 179.0826 61 K 3.9328 7.9770 118.3729 59.4348 32.0524 179.5269 62 V 3.5954 8.1864 118.5898 65.8253 31.4910 177.7108 63 A 4.2890 8.3695 120.9162 55.6888 18.2603 179.3629 64 D 4.4335 8.8886 117.4448 57.5756 40.8288 178.9963 65 A 4.0969 8.0761 120.8926 54.8873 18.3444 179.6769 66 L 3.8486 7.9083 117.1736 58.2585 41.6568 179.5796 67 T 3.9506 8.0724 115.6306 67.0014 68.5581 176.0659 68 N 4.4075 8.3706 118.4240 56.6078 38.7357 176.7611 69 A 4.0685 8.0683 121.6086 55.0271 18.5227 179.5074 70 V 3.4250 8.0568 116.1038 66.0846 31.6900 178.0130 71 A 4.1457 8.3114 119.3953 54.1535 18.5485 177.3897 72 H 4.9019 8.0074 115.5452 55.1379 29.5672 176.9026 73 V 3.7892 7.9885 120.8179 64.6018 31.3475 176.4462 74 D 4.6444 7.9878 117.7104 54.9358 41.6817 175.5344 75 D 4.8596 8.2787 119.7547 52.7566 41.5725 176.5020 76 M 4.1239 8.0385 121.8569 58.1210 32.2908 176.7344 77 P 4.2263 0.0000 0.0000 65.2787 31.6260 178.2346 78 N 4.4716 8.0554 114.9092 56.2955 38.4955 177.2466 79 A 3.9938 7.6305 120.8170 54.3028 18.6647 178.6558 80 L 4.4909 7.9002 115.5958 54.6290 41.9641 178.3092 81 S 4.0386 7.7645 115.8325 61.6307 62.4432 176.0826 82 A 4.0134 8.0203 122.7747 55.1172 18.0751 179.2550 83 L 3.9804 7.7569 118.2573 58.4280 42.3632 178.9902 84 S 4.1728 8.7225 115.4866 61.9567 62.7880 176.5994 85 D 4.3403 8.1121 121.3756 57.2477 40.5368 178.6157 86 L 3.9957 7.8475 120.5510 58.2737 41.9169 178.7099 87 H 4.2591 8.4572 116.1654 58.3601 28.5272 177.6296 88 A 2.6520 7.5445 121.6497 54.8200 18.3214 178.7590 89 H 4.6080 7.6246 111.7900 56.6212 29.4778 174.6921 90 K 4.3828 7.7343 118.1118 57.7345 35.0430 176.9094 91 L 3.9554 8.2747 120.0741 57.6390 42.2001 178.7399 92 R 3.6616 8.5429 114.9561 56.9717 27.4365 177.2903 93 V 3.3675 7.7644 116.8336 62.0513 32.6780 174.7790 94 D 4.5442 8.8736 126.6780 54.3281 41.4376 175.6943 95 P 4.4846 0.0000 0.0000 65.0618 31.4573 178.6891 96 V 3.6079 8.0161 117.8812 65.9041 31.3228 177.5163 97 N 4.3718 8.2631 115.8463 55.5724 38.3007 177.3141 98 F 3.9972 7.9971 120.0789 60.0932 38.9172 177.6250 99 K 4.0343 7.8920 118.2506 59.8422 32.3371 179.4044 100 L 3.6318 7.5371 119.7297 57.3660 41.6053 179.0239 101 L 3.9446 7.8212 120.3520 57.9644 41.9771 178.9241 102 S 4.1161 8.1231 115.2606 61.9535 62.7524 175.9715 103 H 4.1777 8.1937 120.5682 59.8840 29.5956 176.9958 104 C 4.0843 8.1696 118.2346 62.5895 27.9185 175.8477 105 L 3.9912 8.4541 122.4820 58.0732 41.6702 178.8281 106 L 4.0266 8.1448 120.3405 58.1695 42.0540 179.1132 107 V 3.3888 7.8855 118.4664 66.0762 30.9926 178.1916 108 T 3.7108 7.8696 115.4554 66.5213 68.3201 176.5263 109 L 3.8172 7.8028 120.5700 57.6735 41.4247 179.4196 110 A 3.0169 7.0193 119.0327 54.8862 18.2610 179.3490 111 A 3.8765 7.5776 117.8254 54.7858 18.4898 178.6379 112 H 4.5114 7.6425 112.2120 55.3821 31.0077 175.4339 113 L 4.8403 7.5802 121.1703 52.2504 41.3924 175.4595 114 P 4.2701 0.0000 0.0000 65.1206 32.0962 178.3544 115 A 4.3838 7.9871 120.6103 54.1479 19.5353 178.0570 116 E 4.1835 8.0810 113.4154 58.6324 30.5502 177.4833 117 F 4.4215 8.0438 122.7535 57.5790 37.7348 174.7085 118 T 4.1744 7.2635 114.9593 60.5099 71.4140 173.4240 119 P 4.0922 0.0000 0.0000 65.8005 31.2981 178.6070 120 A 3.9184 7.9088 118.7458 55.3724 18.3062 179.7508 121 V 3.5181 7.4565 116.7535 66.0176 31.6014 177.4688 122 H 3.6517 7.9782 118.1215 59.2628 29.6329 176.9838 123 A 3.9583 7.8365 122.2300 55.3320 17.9710 179.8638 124 S 4.2265 7.9734 113.6789 61.7556 62.8912 176.9501 125 L 4.1882 8.5471 122.1735 57.6874 41.2911 179.1145 126 D 4.3910 8.2298 118.1863 57.2328 41.1799 178.4149 127 K 3.9693 8.0434 118.8710 59.3025 32.0334 179.0647 128 F 4.1956 8.5501 121.2122 61.4863 39.4261 177.0405 129 L 3.6503 8.6610 118.6352 57.7793 41.2931 179.5543 130 A 3.9478 8.1756 120.6626 55.0866 18.3127 179.8350 131 S 3.9356 8.0803 113.7722 61.7462 62.8287 177.0324 132 V 3.3805 7.3960 120.8184 65.9747 31.0893 178.2350 133 S 3.8387 7.8085 114.7925 61.7433 62.4315 176.7660 134 T 3.6409 7.6985 117.4547 66.5296 68.4999 176.4799 135 V 3.6430 7.6216 119.9972 66.0778 31.3441 178.1291 136 L 4.0373 7.9283 117.7566 56.7786 41.5214 178.4546 137 T 4.2784 6.9681 107.4671 61.4190 68.8262 176.2076 138 S 4.0972 7.7510 119.0644 61.3621 62.9145 175.1289 139 K 4.4927 7.6789 117.2597 56.2876 32.3064 176.8238 140 Y 4.0630 7.8052 119.2858 60.7624 38.0268 176.6344 141 R 4.2255 7.7789 119.6055 56.5225 29.2881 174.5284 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 4.39 0.00 1.99 2.03 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.57 0.00 2 L 8.37 4.10 0.00 1.79 1.62 1.07 0.70 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 3 S 9.41 4.55 0.00 4.08 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 4 P 0.00 4.19 0.00 2.17 2.13 0.00 3.60 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 2.11 2.15 0.00 5 A 7.94 3.99 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.35 4.42 0.00 2.93 2.76 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 7 K 8.63 3.93 0.00 1.73 1.83 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.46 1.73 7.81 8 T 8.24 3.86 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 1.21 0.00 0.00 9 N 8.41 4.31 0.00 2.86 2.86 0.00 0.00 6.70 7.82 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 10 V 7.82 3.50 1.83 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 0.21 0.00 0.00 0.87 0.00 0.00 11 K 8.07 3.94 0.00 1.83 1.85 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.48 7.81 12 A 8.26 3.99 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 13 A 8.27 4.00 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 14 W 8.72 4.18 0.00 3.46 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 15 G 8.30 3.66 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 0.00 16 K 7.61 4.10 0.00 1.97 1.88 0.00 1.88 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.46 1.71 7.81 17 V 7.73 3.62 1.53 0.00 0.00 0.00 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 0.82 0.00 0.00 18 G 8.24 3.55 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 0.00 0.00 0.00 19 A 8.52 4.07 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 20 H 7.95 4.16 0.00 2.35 2.28 0.00 5.66 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 A 7.14 3.55 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 22 G 7.92 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 23 E 8.07 3.97 0.00 1.96 1.99 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 2.44 2.43 0.00 24 Y 8.07 4.47 0.00 2.97 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 25 G 8.53 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 0.00 0.00 0.00 26 A 7.90 4.02 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 27 E 8.40 4.01 0.00 2.12 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 2.30 2.35 0.00 28 A 7.97 4.05 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 29 L 7.70 3.47 0.00 1.83 1.39 1.03 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 30 E 8.12 4.00 0.00 2.10 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 2.42 2.50 0.00 31 R 8.25 3.88 0.00 2.03 1.94 0.00 3.13 0.00 0.00 3.03 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 32 M 7.93 4.13 0.00 1.72 2.01 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 2.66 2.66 0.00 33 F 7.53 4.56 0.00 3.21 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 34 L 7.82 4.25 0.00 1.64 1.70 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.06 4.16 0.00 3.32 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 36 F 7.86 4.98 0.00 3.24 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 37 P 0.00 4.48 0.00 2.21 2.16 0.00 3.67 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.18 0.00 38 T 8.15 4.05 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 1.28 0.00 0.00 39 T 8.53 4.37 4.56 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 1.36 0.00 0.00 40 K 8.44 4.12 0.00 1.97 1.84 0.00 1.59 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.25 1.67 7.81 41 T 7.68 3.93 3.98 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 1.19 0.00 0.00 42 Y 7.59 4.12 0.00 2.76 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 43 F 8.08 4.72 0.00 2.90 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 44 P 0.00 4.36 0.00 2.20 2.17 0.00 3.92 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.92 0.00 45 H 8.43 4.78 0.00 3.41 3.49 0.00 5.48 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 F 7.66 4.97 0.00 3.00 2.89 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 0.00 0.00 0.00 47 D 9.94 4.49 0.00 2.48 2.52 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 48 L 8.33 4.59 0.00 1.53 1.42 0.43 0.37 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 49 S 8.25 4.36 0.00 4.03 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 50 H 8.48 4.32 0.00 3.13 3.29 0.00 5.94 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 51 G 8.49 3.87 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 0.00 0.00 0.00 52 S 7.78 4.03 0.00 3.94 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 53 A 8.58 3.96 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 54 Q 7.82 3.68 0.00 1.44 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.85 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 55 V 7.45 3.83 2.32 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 1.16 0.00 0.00 1.14 0.00 0.00 56 K 8.35 3.96 0.00 1.94 1.88 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.59 7.81 57 G 8.70 3.68 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 0.00 0.00 0.00 58 H 9.21 4.47 0.00 3.73 3.63 0.00 5.82 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 G 8.73 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 60 K 8.25 4.00 0.00 1.89 1.85 0.00 1.65 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.45 1.48 7.81 61 K 7.98 3.93 0.00 2.07 1.91 0.00 1.83 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.52 1.66 7.81 62 V 8.19 3.60 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 1.06 0.00 0.00 0.85 0.00 0.00 63 A 8.37 4.29 1.55 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 0.00 0.00 64 D 8.89 4.43 0.00 2.92 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 65 A 8.08 4.10 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 66 L 7.91 3.85 0.00 1.97 1.08 0.83 0.67 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 67 T 8.07 3.95 4.64 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 1.41 0.00 0.00 68 N 8.37 4.41 0.00 2.90 3.00 0.00 0.00 7.16 8.27 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 69 A 8.07 4.07 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 70 V 8.06 3.43 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 0.69 0.00 0.00 -0.04 0.00 0.00 71 A 8.31 4.15 1.35 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 0.00 0.00 0.00 0.00 0.00 0.00 72 H 8.01 4.90 0.00 3.32 3.30 0.00 5.63 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 V 7.99 3.79 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 0.70 0.00 0.00 0.99 0.00 0.00 74 D 7.99 4.64 0.00 2.69 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 75 D 8.28 4.86 0.00 2.68 2.54 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 76 M 8.04 4.12 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.67 0.00 77 P 0.00 4.23 0.00 2.00 2.09 0.00 3.67 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 2.01 2.15 0.00 78 N 8.06 4.47 0.00 3.22 2.85 0.00 0.00 7.05 7.05 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 79 A 7.63 3.99 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 80 L 7.90 4.49 0.00 1.75 1.65 0.86 0.81 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 81 S 7.76 4.04 0.00 4.04 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 82 A 8.02 4.01 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 83 L 7.76 3.98 0.00 1.86 1.72 1.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 84 S 8.72 4.17 0.00 3.97 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 85 D 8.11 4.34 0.00 2.92 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 86 L 7.85 4.00 0.00 1.80 1.81 0.90 0.83 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 87 H 8.46 4.26 0.00 3.47 3.61 0.00 5.87 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 A 7.54 2.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 H 7.62 4.61 0.00 3.26 3.30 0.00 5.61 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 K 7.73 4.38 0.00 1.64 1.70 0.00 1.76 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.28 1.34 7.81 91 L 8.27 3.96 0.00 1.62 1.62 0.62 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 92 R 8.54 3.66 0.00 1.86 2.05 0.00 3.25 0.00 0.00 3.12 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.54 0.00 93 V 7.76 3.37 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 -0.03 0.00 0.00 0.53 0.00 0.00 94 D 8.87 4.54 0.00 2.90 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 95 P 0.00 4.48 0.00 2.08 1.74 0.00 3.64 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.42 0.00 96 V 8.02 3.61 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 1.01 0.00 0.00 0.93 0.00 0.00 97 N 8.26 4.37 0.00 2.57 2.68 0.00 0.00 6.97 8.29 0.00 0.00 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 F 8.00 4.00 0.00 3.13 3.04 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 99 K 7.89 4.03 0.00 1.95 2.04 0.00 1.25 0.00 0.00 1.75 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.39 1.35 7.81 100 L 7.54 3.63 0.00 1.66 1.29 0.76 -0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 101 L 7.82 3.94 0.00 1.61 1.59 0.89 0.99 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 0.00 102 S 8.12 4.12 0.00 4.12 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 0.00 103 H 8.19 4.18 0.00 3.22 3.55 0.00 5.61 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 0.00 104 C 8.17 4.08 0.00 3.19 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 0.00 105 L 8.45 3.99 0.00 2.04 1.76 1.01 0.60 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 0.00 106 L 8.14 4.03 0.00 2.13 1.69 1.13 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 107 V 7.89 3.39 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 0.86 0.00 0.00 0.79 0.00 0.00 108 T 7.87 3.71 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 1.17 0.00 0.00 109 L 7.80 3.82 0.00 1.93 1.69 1.01 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 110 A 7.02 3.02 0.58 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 0.00 0.00 111 A 7.58 3.88 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 0.00 112 H 7.64 4.51 0.00 2.54 3.13 0.00 5.60 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 0.00 113 L 7.58 4.84 0.00 1.79 1.75 1.06 0.88 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 0.00 114 P 0.00 4.27 0.00 2.18 2.18 0.00 3.83 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 1.99 1.95 0.00 115 A 7.99 4.38 1.32 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 0.00 0.00 0.00 116 E 8.08 4.18 0.00 2.04 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 2.34 2.39 0.00 117 F 8.04 4.42 0.00 3.07 3.01 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 0.00 118 T 7.26 4.17 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 1.21 0.00 0.00 119 P 0.00 4.09 0.00 2.13 2.11 0.00 3.58 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.16 0.00 120 A 7.91 3.92 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 0.00 121 V 7.46 3.52 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 0.92 0.00 0.00 0.95 0.00 0.00 122 H 7.98 3.65 0.00 2.39 3.20 0.00 5.66 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 A 7.84 3.96 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 0.00 124 S 7.97 4.23 0.00 4.04 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 0.00 125 L 8.55 4.19 0.00 1.86 1.93 1.19 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 126 D 8.23 4.39 0.00 3.05 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 0.00 127 K 8.04 3.97 0.00 2.10 1.88 0.00 1.73 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.59 7.81 128 F 8.55 4.20 0.00 3.04 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 0.00 129 L 8.66 3.65 0.00 1.70 1.68 1.09 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 130 A 8.18 3.95 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 0.00 131 S 8.08 3.94 0.00 3.91 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 0.00 132 V 7.40 3.38 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 0.96 0.00 0.00 0.22 0.00 0.00 133 S 7.81 3.84 0.00 3.93 3.71 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 0.00 134 T 7.70 3.64 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 1.11 0.00 0.00 135 V 7.62 3.64 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 0.97 0.00 0.00 0.89 0.00 0.00 136 L 7.93 4.04 0.00 1.51 1.24 0.88 0.92 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 0.00 137 T 6.97 4.28 3.46 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 0.12 0.00 0.00 138 S 7.75 4.10 0.00 4.12 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 0.00 139 K 7.68 4.49 0.00 1.72 1.83 0.00 1.76 0.00 0.00 1.87 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.39 1.45 7.81 140 Y 7.81 4.06 0.00 2.88 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 0.00 141 R 7.78 4.23 0.00 1.90 1.90 0.00 3.09 0.00 0.00 3.31 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.65 0.00