NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.6230 8.3549 109.7066 44.2715 0.0000 174.0633 2 S 3.9823 9.2495 119.6948 57.1266 61.8698 169.2606 3 S 3.8509 8.1221 113.1634 59.6188 63.5703 172.8294 4 G 3.8905 8.6738 118.0376 44.6644 0.0000 173.3413 5 S 4.0143 8.6596 113.8264 60.9487 62.6651 175.7398 6 S 3.6856 8.1171 115.2160 57.5810 62.5406 174.2268 7 G 4.0608 7.6021 104.5273 46.0016 0.0000 174.7189 8 R 4.4917 8.5652 125.0235 56.2676 30.5104 175.8838 9 S 4.5777 7.4706 113.2125 58.1655 66.6978 172.2486 10 Y 4.9809 8.1865 121.1087 56.8959 41.7972 175.4179 11 E 4.4451 6.8050 117.9162 55.3774 32.4018 174.5400 12 G 3.9005 7.3567 109.3989 45.0950 0.0000 172.3346 13 I 4.1769 8.4733 121.0435 61.4667 38.0922 176.4994 14 L 4.1392 8.0266 125.6492 53.7570 45.9094 175.3231 15 Y 4.8004 8.5870 121.8000 57.0058 40.4861 174.4086 16 K 5.2703 8.6745 120.3448 53.2298 35.8666 175.2302 17 K 2.0000 7.7932 127.4586 56.4054 32.3964 176.4434 18 G 3.5701 8.3487 114.5827 47.9341 0.0000 175.2227 19 A 3.8135 8.2638 120.1265 51.7306 16.2985 176.1470 20 F 4.6785 7.7075 116.6062 56.9219 43.0557 174.5777 21 M 4.0760 8.8078 122.1675 58.5166 31.6837 178.0529 22 K 4.3267 8.0110 115.8767 55.4603 32.9995 175.6788 23 P 4.8832 0.0000 0.0000 62.1159 33.2105 175.7229 24 W 4.7637 8.4782 119.4118 57.7317 30.1876 175.9483 25 K 4.7881 8.8519 120.7262 54.6723 34.3509 175.2470 26 A 4.0048 8.6924 127.1111 50.9749 19.5240 176.2574 27 R 4.6904 8.1338 121.8829 54.3471 34.8661 174.0126 28 W 4.9818 8.7145 131.6096 56.2352 31.3833 175.5923 29 F 5.1642 8.1371 125.4765 56.5953 41.1701 175.5075 30 V 4.3299 8.6778 119.3342 61.5382 34.4445 174.1313 31 L 4.8383 8.6063 132.0990 54.1952 41.4874 173.2169 32 D 4.8674 8.7681 123.3238 53.3307 41.3828 177.1520 33 K 4.2171 8.4956 124.1743 58.7641 33.5128 178.4590 34 T 4.1175 7.9373 109.1910 63.6103 69.1249 175.4268 35 K 4.1243 8.0442 119.0565 55.4780 33.7203 175.4595 36 H 4.2361 7.8742 114.7129 56.4844 27.6967 173.2579 37 Q 5.0468 7.4783 115.4869 55.2206 34.5496 175.3348 38 L 4.9164 8.6461 122.6975 53.8166 44.0092 175.1216 39 R 4.8087 8.5986 126.7553 54.3511 32.6767 174.9182 40 Y 5.2547 7.0883 119.1476 55.2926 40.4126 174.0714 41 Y 4.6485 9.2890 121.0436 56.0445 40.2921 176.4944 42 D 4.5078 9.1558 123.3145 57.3217 41.2042 177.0277 43 H 4.9629 7.8437 112.8782 53.2052 32.3936 172.5440 44 R 3.4328 8.6135 122.6227 57.8871 29.8479 174.6620 45 M 2.5583 8.1436 126.4411 55.8375 29.3177 174.8634 46 D 4.8079 7.5786 120.5670 52.3397 43.7487 176.0687 47 T 4.0476 8.4233 116.7752 64.7647 67.2134 173.0653 48 E 4.8848 7.6801 116.7269 54.5655 33.7768 174.5213 49 C 2.8509 8.3730 115.2074 57.7386 30.1322 173.9991 50 K 3.9742 7.1221 121.0303 55.6067 31.2791 176.3276 51 G 4.2004 8.8384 109.3499 46.4744 0.0000 170.4354 52 V 5.1893 7.5768 119.5918 60.2687 35.3564 174.9648 53 I 4.5544 8.2522 126.1300 58.9070 39.8653 173.4650 54 D 4.7250 8.7180 127.0347 53.5062 39.4733 177.1630 55 L 3.6657 9.0934 125.8397 57.7455 41.8781 179.6355 56 A 4.4172 8.0322 118.8175 53.4521 18.6444 177.4723 57 E 4.5952 9.3589 116.3748 55.7938 29.9093 175.0849 58 V 4.7228 7.6697 119.7972 61.4840 32.4933 175.9675 59 E 4.0635 9.6799 128.4386 57.1360 29.7942 176.5185 60 A 4.6678 6.9589 119.1915 52.0237 21.7733 175.4267 61 V 5.1874 8.0403 116.6276 60.7352 34.9085 174.8626 62 A 4.8697 8.9961 122.3492 49.7653 23.0738 174.0533 63 P 5.4183 0.0000 0.0000 62.4054 31.5591 176.2261 64 G 4.2140 8.5840 113.9709 45.5523 0.0000 170.9918 65 T 4.6479 8.1923 109.1351 58.5769 71.2162 172.0330 66 P 2.9700 0.0000 0.0000 62.2505 31.8980 176.0508 67 T 4.4474 7.2811 114.4537 59.5578 71.4454 173.1905 68 I 3.8545 7.9868 122.0086 62.8630 37.8562 174.5317 69 G 4.2100 9.1653 112.6017 46.0351 0.0000 173.8530 70 A 3.0867 6.0793 120.6473 50.6371 18.6793 175.1679 71 P 4.3575 0.0000 0.0000 62.8108 31.9752 176.1459 72 K 4.3917 8.3667 118.7250 56.9239 31.8151 177.7072 73 T 4.2342 7.1935 108.4291 63.1008 70.1691 175.6086 74 V 3.7077 7.2583 122.6283 60.9272 32.1481 174.5953 75 D 4.9965 8.1287 120.0250 52.5246 42.0476 175.1424 76 E 4.2706 8.6386 115.5597 58.9726 30.5832 177.2139 77 K 4.5416 7.9306 120.0358 55.2706 31.7958 176.6812 78 A 4.6691 7.9762 121.7350 53.6531 25.7347 177.3399 79 F 4.4314 7.9016 113.1414 58.5674 40.1540 174.7178 80 F 5.5274 9.3987 118.0594 55.4905 41.2376 173.5046 81 D 4.7131 9.9082 124.5647 53.5181 42.8164 175.4720 82 V 4.8578 8.8060 122.5999 61.2438 34.0029 174.2959 83 K 4.7700 9.4780 128.6441 55.4597 33.8877 176.0703 84 T 5.1199 7.7178 113.5105 60.3984 71.9198 174.0736 85 T 3.9727 8.5836 111.1969 64.9902 68.4524 175.9937 86 R 3.9130 7.5694 120.4480 57.2245 30.7983 177.2863 87 R 4.2311 6.7055 110.7834 55.2273 32.0424 173.5738 88 V 3.8771 7.7352 117.8132 62.7341 32.4207 174.7138 89 Y 4.7055 8.7844 123.7123 56.1112 41.9542 174.1961 90 N 4.8142 7.9316 119.9450 51.5621 40.8170 173.8200 91 F 5.8381 8.1228 121.7889 55.0428 44.1539 173.5826 92 C 4.9948 8.1472 111.9543 57.6009 32.2852 173.6639 93 A 5.0182 8.6071 123.5631 50.6529 20.9300 176.6985 94 Q 4.5549 8.2170 114.9602 55.1625 29.4551 175.6862 95 D 4.5773 7.4085 116.8608 52.8567 44.0379 176.9150 96 V 3.9909 8.9242 125.9453 65.0939 31.8578 176.4590 97 P 4.3757 0.0000 0.0000 66.1446 30.1863 178.3972 98 S 4.1448 8.2746 115.4280 60.8525 62.6348 176.9560 99 A 4.1051 8.0344 122.8769 55.4415 18.2564 179.3297 100 Q 3.9293 8.1154 116.5574 59.7044 28.7463 179.9229 101 Q 3.8553 7.5970 116.3879 58.4849 28.5681 178.8227 102 W 3.9432 8.3282 120.5147 59.9083 28.4644 178.3203 103 V 3.4436 7.5235 117.6809 65.7338 30.9844 177.2159 104 D 4.6719 8.5159 118.6354 57.8697 40.5910 179.5709 105 R 3.7871 7.8135 117.1200 59.3664 30.3871 178.7205 106 I 3.9771 8.2413 119.6128 64.8260 37.0329 178.7191 107 Q 4.1024 9.2446 117.8638 58.5920 28.6038 178.0187 108 S 4.3887 8.1011 112.8138 59.3400 63.8448 173.8563 109 C 4.8918 7.7993 120.1375 58.7545 33.3642 172.3696 110 L 4.2285 8.1946 128.0580 55.4279 39.9743 179.3635 111 S 4.7262 8.9561 115.3545 56.7564 65.7255 172.3424 112 S 4.4058 8.6601 122.5421 58.4605 63.8636 173.8160 113 G 4.1812 8.2287 116.2789 44.1827 0.0000 170.2704 114 P 4.3273 0.0000 0.0000 62.5785 32.1123 176.3490 115 S 4.4056 8.3877 116.4313 57.0344 64.1489 170.0105 116 S 3.6294 8.7501 124.8824 58.8957 61.2610 172.6356 117 G 3.5702 8.7365 112.9157 45.8451 0.0000 171.4443 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 G 8.35 3.62 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 0.00 0.00 0.00 2 S 9.25 3.98 0.00 4.10 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 3 S 8.12 3.85 0.00 3.98 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 4 G 8.67 3.89 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 0.00 0.00 0.00 5 S 8.66 4.01 0.00 3.85 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 6 S 8.12 3.69 0.00 4.08 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 7 G 7.60 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 8 R 8.57 4.49 0.00 1.80 1.97 0.00 3.27 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.70 0.00 9 S 7.47 4.58 0.00 3.73 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 10 Y 8.19 4.98 0.00 2.78 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 E 6.81 4.45 0.00 1.73 1.78 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 2.05 2.55 0.00 12 G 7.36 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 0.00 0.00 0.00 13 I 8.47 4.18 2.01 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.05 0.77 0.00 0.00 14 L 8.03 4.14 0.00 0.27 0.13 -0.82 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 15 Y 8.59 4.80 0.00 3.10 3.19 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 16 K 8.67 5.27 0.00 1.97 1.56 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.62 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.17 1.02 7.81 17 K 7.79 2.00 0.00 0.87 1.21 0.00 1.65 0.00 0.00 1.53 0.00 0.00 3.15 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.19 0.84 7.81 18 G 8.35 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 0.00 0.00 0.00 19 A 8.26 3.81 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 20 F 7.71 4.68 0.00 3.10 2.90 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 21 M 8.81 4.08 0.00 2.14 2.32 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.53 0.00 22 K 8.01 4.33 0.00 1.86 1.84 0.00 1.82 0.00 0.00 1.83 0.00 0.00 3.16 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.55 1.45 7.81 23 P 0.00 4.88 0.00 2.32 2.19 0.00 3.88 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.07 0.00 24 W 8.48 4.76 0.00 3.17 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 25 K 8.85 4.79 0.00 1.73 1.73 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.54 7.81 26 A 8.69 4.00 0.64 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 0.00 0.00 27 R 8.13 4.69 0.00 1.97 2.12 0.00 3.19 0.00 0.00 3.36 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.66 0.00 28 W 8.71 4.98 0.00 3.51 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 29 F 8.14 5.16 0.00 2.54 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 30 V 8.68 4.33 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 1.07 0.00 0.00 1.03 0.00 0.00 31 L 8.61 4.84 0.00 1.80 1.57 1.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 32 D 8.77 4.87 0.00 2.62 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 33 K 8.50 4.22 0.00 1.84 1.94 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.42 7.81 34 T 7.94 4.12 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 35 K 8.04 4.12 0.00 1.73 1.82 0.00 1.85 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.33 7.81 36 H 7.87 4.24 0.00 3.47 3.56 0.00 5.21 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 37 Q 7.48 5.05 0.00 1.94 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.85 0.00 0.00 0.00 0.00 0.00 2.35 2.47 0.00 38 L 8.65 4.92 0.00 1.89 1.43 1.06 0.38 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 39 R 8.60 4.81 0.00 1.90 1.61 0.00 3.10 0.00 0.00 3.15 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.78 0.00 40 Y 7.09 5.25 0.00 2.70 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 41 Y 9.29 4.65 0.00 3.11 3.02 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 42 D 9.16 4.51 0.00 2.64 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 43 H 7.84 4.96 0.00 3.13 3.12 0.00 5.73 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 R 8.61 3.43 0.00 1.44 1.61 0.00 2.21 0.00 0.00 2.27 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.50 0.00 45 M 8.14 2.56 0.00 2.05 1.92 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.47 0.00 46 D 7.58 4.81 0.00 3.03 2.99 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 47 T 8.42 4.05 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 48 E 7.68 4.88 0.00 1.94 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 2.25 2.31 0.00 49 C 8.37 2.85 0.00 2.29 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 50 K 7.12 3.97 0.00 1.46 1.57 0.00 1.61 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.17 1.20 7.81 51 G 8.84 4.20 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 0.00 52 V 7.58 5.19 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 0.68 0.00 0.00 0.77 0.00 0.00 53 I 8.25 4.55 1.89 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.92 0.95 0.00 0.00 54 D 8.72 4.72 0.00 2.87 3.06 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 55 L 9.09 3.67 0.00 1.95 2.06 1.02 0.64 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 56 A 8.03 4.42 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 57 E 9.36 4.60 0.00 2.33 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 2.27 2.43 0.00 58 V 7.67 4.72 2.36 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 0.96 0.00 0.00 1.15 0.00 0.00 59 E 9.68 4.06 0.00 1.95 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 2.35 2.26 0.00 60 A 6.96 4.67 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 61 V 8.04 5.19 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 1.33 0.00 0.00 62 A 9.00 4.87 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 63 P 0.00 5.42 0.00 2.19 2.25 0.00 3.44 0.00 0.00 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.89 0.00 64 G 8.58 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 0.00 0.00 0.00 0.00 65 T 8.19 4.65 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 1.19 0.00 0.00 66 P 0.00 2.97 0.00 1.74 1.19 0.00 3.54 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.79 0.00 67 T 7.28 4.45 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 1.23 0.00 0.00 68 I 7.99 3.85 1.88 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.48 0.92 0.00 0.00 69 G 9.17 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 0.00 0.00 0.00 0.00 70 A 6.08 3.09 0.25 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 0.00 0.00 71 P 0.00 4.36 0.00 1.87 1.73 0.00 3.43 0.00 0.00 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.51 0.00 72 K 8.37 4.39 0.00 1.72 1.82 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.32 1.35 7.81 73 T 7.19 4.23 4.29 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 0.00 0.00 0.00 1.20 0.00 0.00 74 V 7.26 3.71 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 0.28 0.00 0.00 0.85 0.00 0.00 75 D 8.13 5.00 0.00 2.67 2.69 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 76 E 8.64 4.27 0.00 2.19 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.36 0.00 77 K 7.93 4.54 0.00 1.89 1.88 0.00 1.69 0.00 0.00 1.85 0.00 0.00 2.91 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.56 1.48 7.81 78 A 7.98 4.67 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 79 F 7.90 4.43 0.00 3.23 3.11 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 0.00 0.00 0.00 80 F 9.40 5.53 0.00 3.12 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 81 D 9.91 4.71 0.00 2.58 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 82 V 8.81 4.86 2.27 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 1.07 0.00 0.00 1.39 0.00 0.00 83 K 9.48 4.77 0.00 1.86 1.67 0.00 1.67 0.00 0.00 1.69 0.00 0.00 2.92 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.35 1.32 7.81 84 T 7.72 5.12 4.32 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 1.47 0.00 0.00 85 T 8.58 3.97 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 1.31 0.00 0.00 86 R 7.57 3.91 0.00 1.89 2.01 0.00 3.37 0.00 0.00 3.44 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 87 R 6.71 4.23 0.00 1.74 1.88 0.00 2.94 0.00 0.00 3.30 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.30 0.00 88 V 7.74 3.88 1.91 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 0.64 0.00 0.00 0.81 0.00 0.00 89 Y 8.78 4.71 0.00 2.53 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 90 N 7.93 4.81 0.00 2.17 2.02 0.00 0.00 6.67 8.15 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 91 F 8.12 5.84 0.00 1.65 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 0.00 0.00 0.00 92 C 8.15 4.99 0.00 1.78 2.34 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 93 A 8.61 5.02 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.22 4.55 0.00 2.20 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 7.09 0.00 0.00 0.00 0.00 0.00 2.51 2.61 0.00 95 D 7.41 4.58 0.00 2.75 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 96 V 8.92 3.99 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.99 0.00 0.00 97 P 0.00 4.38 0.00 2.33 2.30 0.00 3.86 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.08 0.00 98 S 8.27 4.14 0.00 4.01 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 0.00 99 A 8.03 4.11 1.57 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 0.00 0.00 100 Q 8.12 3.93 0.00 2.19 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.79 0.00 0.00 0.00 0.00 0.00 2.58 2.60 0.00 101 Q 7.60 3.86 0.00 2.09 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.74 0.00 0.00 0.00 0.00 0.00 2.27 2.34 0.00 102 W 8.33 3.94 0.00 3.25 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 0.00 103 V 7.52 3.44 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.74 0.00 0.00 104 D 8.52 4.67 0.00 2.78 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 0.00 105 R 7.81 3.79 0.00 1.81 1.91 0.00 2.41 0.00 0.00 2.77 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.31 0.00 106 I 8.24 3.98 2.13 0.00 0.00 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 1.84 1.00 1.12 0.00 0.00 107 Q 9.24 4.10 0.00 2.23 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.98 0.00 0.00 0.00 0.00 0.00 2.46 2.56 0.00 108 S 8.10 4.39 0.00 3.93 4.05 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 0.00 109 C 7.80 4.89 0.00 2.95 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 0.00 110 L 8.19 4.23 0.00 1.78 1.20 1.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 111 S 8.96 4.73 0.00 3.80 3.70 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 0.00 112 S 8.66 4.41 0.00 3.90 3.79 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 0.00 0.00 0.00 113 G 8.23 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 0.00 114 P 0.00 4.33 0.00 2.19 2.07 0.00 3.76 0.00 0.00 3.58 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 S 8.39 4.41 0.00 3.84 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 0.00 116 S 8.75 3.63 0.00 4.06 3.89 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 0.00 117 G 8.74 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 0.00 0.00 0.00