NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 17 M 4.4968 8.1514 120.3347 54.8979 33.7327 175.9102 18 G 3.5454 8.4186 105.6331 46.9899 0.0000 174.2379 19 L 3.9511 7.9987 122.4019 57.8493 42.6809 176.6895 20 E 3.9286 8.0895 118.8030 59.4145 29.5417 177.8038 21 D 4.2335 8.4500 118.2086 57.4554 41.2416 178.2310 22 K 3.8247 8.0794 118.6185 59.6795 32.2822 179.2403 23 V 3.5378 8.0082 118.7158 66.1448 31.2916 178.2410 24 S 3.6637 7.9622 113.8177 61.0261 62.8402 176.2984 25 K 4.2274 8.0969 123.7369 58.7932 31.8851 178.9007 26 Q 4.1756 8.0531 120.7312 58.6090 28.7812 178.4717 27 L 3.9547 7.6043 119.6124 57.6069 41.4423 179.3433 28 E 4.0726 8.8537 119.2059 59.5322 29.3779 179.3085 29 S 4.1566 8.3758 114.6625 61.6911 62.6519 176.3283 30 K 4.2308 7.8586 119.2291 56.1880 32.2570 176.8226 31 G 3.7892 8.4789 107.4098 46.5664 0.0000 173.9948 32 I 4.1334 7.9999 120.8362 59.9320 37.8615 177.1628 33 K 4.2159 8.6076 127.8519 55.3678 30.5009 175.6675 34 F 4.9069 8.2080 119.6743 54.7387 40.3100 175.3973 35 E 4.5150 8.8076 119.8955 54.6314 31.2713 175.1147 36 Y 4.5091 8.5512 125.3614 58.2256 40.0824 175.5714 37 E 3.5080 7.6723 127.9963 57.4357 26.8967 175.3880 38 E 4.1886 7.9451 120.1945 56.2365 30.8382 175.3636 39 W 5.1857 7.8414 116.9008 55.1242 32.9393 174.2809 40 K 4.5656 8.8313 121.2697 54.6676 33.6053 176.0773 41 V 4.2058 8.2067 122.5414 60.5144 31.9568 173.6394 42 P 4.4038 0.0000 0.0000 62.4111 31.5581 175.4289 43 Y 4.9149 7.8487 120.4089 55.1009 41.2714 174.5396 44 S 4.4300 8.6509 113.8293 56.4518 64.8522 173.0434 45 N 4.8846 8.7878 124.2320 52.1528 39.9961 173.4496 46 N 4.9594 8.2056 121.8299 51.1280 39.2675 174.7277 47 Q 4.4418 8.4179 120.9017 54.7835 30.5097 174.4362 48 Q 4.5486 8.3745 119.4073 54.3400 31.4263 174.1753 49 N 5.2323 8.3575 121.1427 51.5958 41.9193 173.3043 50 Y 4.6515 8.4206 116.9201 56.2726 41.4130 175.2274 51 S 4.6734 8.4372 119.1058 56.5785 64.8846 174.7428 52 S 4.3574 8.5893 120.0630 58.1746 61.7505 173.0103 53 H 5.1121 8.3970 123.4768 54.3560 31.3296 174.2393 54 T 4.6630 8.1109 109.4975 60.2614 71.3581 172.6789 55 Y 4.8095 8.3803 124.4960 56.5572 41.2685 175.6755 56 T 4.0579 6.2728 118.8625 61.5107 70.0975 172.2065 57 P 4.9419 0.0000 0.0000 62.0004 32.1377 177.0520 58 D 4.1454 8.5802 119.4810 56.8183 41.1920 176.9403 59 F 4.9803 8.7016 117.3919 55.4390 42.0656 174.4961 60 L 4.5852 8.3182 124.7969 52.7213 42.5568 176.1232 61 L 4.2308 8.3026 125.9701 53.6020 42.3360 176.8821 62 P 4.2078 0.0000 0.0000 65.8636 31.3811 177.2088 63 N 4.5649 8.0316 112.9934 53.0167 37.7782 175.1100 64 G 4.0122 8.6245 110.8772 46.4414 0.0000 174.9015 65 I 3.5547 7.1302 120.2096 61.2283 37.6900 174.4202 66 F 5.0919 9.5484 123.9260 55.9490 41.0677 174.7059 67 V 4.7964 8.9600 124.9487 61.2003 33.6410 173.8482 68 E 5.0261 9.3554 129.7289 54.5593 31.8424 174.8147 69 T 4.8379 8.8466 117.7899 61.1482 70.7314 174.3955 70 K 4.2178 9.3003 125.7077 56.7343 35.5507 174.7580 71 G 3.6181 9.3533 118.1687 46.8691 0.0000 174.6933 72 L 4.3915 9.1995 123.1850 54.2491 42.9755 175.4914 73 W 4.8346 9.0707 135.0000 55.6373 29.5450 175.8109 74 E 4.0621 8.2951 124.2315 55.8520 30.8911 177.5404 75 S 3.6757 8.3634 115.9572 61.2610 62.6263 175.8840 76 D 4.3253 7.8752 121.6180 57.4241 40.5943 177.7309 77 D 4.2917 7.9246 117.7717 57.6198 41.0687 178.6870 78 R 3.1657 7.2049 118.4836 58.7132 29.7244 179.1797 79 K 3.9201 8.0006 118.3929 59.3262 32.1121 179.2212 80 K 3.7774 8.0027 118.2204 60.1477 31.9578 178.6369 81 H 4.0046 8.3470 116.0360 58.8663 28.4886 177.8238 82 L 3.9856 7.6954 120.4270 57.7767 41.4149 179.2852 83 L 4.2793 7.9488 120.4010 57.4885 41.5565 179.5891 84 I 3.5763 8.1227 119.7521 64.5025 36.7906 178.3328 85 R 3.9421 7.8756 117.7877 59.8303 30.1511 178.4647 86 E 4.0560 7.9994 117.5888 59.7483 29.3458 179.5674 87 Q 4.0205 8.8566 118.4834 58.1938 30.3708 176.9323 88 H 5.7113 8.6771 116.1136 52.7609 29.2207 172.4594 89 P 4.4944 0.0000 0.0000 64.5434 31.9514 177.8777 90 E 4.2114 8.1443 116.7246 57.2137 30.2376 175.8997 91 L 4.9020 7.7739 119.8370 53.0272 44.1223 175.1418 92 D 4.8791 8.6810 121.4348 52.8159 43.0945 174.9394 93 I 5.0870 8.4121 126.6766 59.8567 40.0225 175.2495 94 R 4.8206 9.5456 126.3253 54.4048 33.8447 175.0107 95 I 5.0060 8.8160 120.3699 59.5492 41.1488 175.1006 96 V 4.9026 8.5270 125.3034 61.4809 34.2600 174.7937 97 F 5.8961 9.1791 126.3610 55.3863 41.5855 176.7901 98 S 4.3738 8.9389 114.6592 60.3297 64.0286 174.3829 99 S 4.3953 7.7938 109.8879 57.8604 64.5035 175.7947 100 S 4.0193 8.7787 122.7712 58.5353 63.1275 175.9516 101 R 4.0060 7.2267 119.6500 58.2459 30.8581 177.2873 102 T 3.5212 6.9745 113.2428 63.6141 68.9603 173.1572 103 K 4.5292 7.9123 123.8822 55.2212 33.2761 176.9182 104 L 4.3345 8.3833 123.7732 58.3613 41.8570 176.7588 105 Y 4.7556 6.7678 113.5654 55.5091 40.4271 173.3591 106 K 3.9581 8.8871 119.5391 58.1891 32.2878 177.4824 107 G 3.8845 8.8460 109.8674 45.9280 0.0000 173.3058 108 S 3.6078 7.7499 115.6007 57.2461 62.3009 171.8784 109 P 4.6496 0.0000 0.0000 62.9652 31.4185 175.6141 110 T 5.5022 7.8594 114.9282 61.2439 71.9004 173.2849 111 S 5.0048 8.6164 120.0842 56.8851 65.3074 174.4934 112 Y 4.6066 9.0571 121.6347 61.6350 37.5449 179.6647 113 G 2.8740 7.6144 105.8136 47.6056 0.0000 175.2585 114 E 4.1306 8.0388 122.7905 58.3454 29.2345 178.9365 115 F 4.0828 8.5034 119.9621 62.0932 39.2378 177.0300 116 C 4.5260 8.6069 115.7952 62.9168 27.9640 176.0287 117 E 3.8536 8.3581 120.4741 59.0738 28.8965 179.0713 118 K 4.0877 8.3249 119.1489 58.6096 32.2011 177.0196 119 H 4.7277 7.5055 113.4751 54.8179 29.3235 173.9212 120 G 3.9167 7.7828 107.1743 46.7155 0.0000 173.7488 121 I 4.4674 8.6922 121.9716 59.4339 38.4909 176.0920 122 K 4.4650 8.7371 127.4927 56.1813 33.1655 176.1349 123 F 6.3000 8.4915 118.4799 54.7020 41.7012 173.2598 124 A 4.6117 8.7843 117.7840 51.4290 22.2164 174.6695 125 D 4.9962 8.6303 118.9579 53.9013 42.5689 174.8214 126 K 4.0864 9.3608 124.5768 56.4290 31.4387 176.0053 127 L 4.7757 7.0991 117.6217 52.4216 45.7658 176.5780 128 I 3.5132 8.0383 121.0392 60.4450 37.1968 175.2228 129 P 3.9823 0.0000 0.0000 62.8745 32.8973 177.2899 130 A 4.0182 8.3634 122.3541 55.0705 18.1716 179.9209 131 E 3.9578 8.1004 116.2085 59.5307 29.8564 179.1956 132 W 4.7429 8.0552 119.5556 59.5362 29.0415 178.3503 133 I 3.7945 7.4508 117.9982 64.0989 36.6595 177.7558 134 K 4.3291 8.2018 116.5360 55.5599 32.4981 177.0652 135 E 4.0671 7.7606 121.1524 55.3619 29.9962 174.7443 136 P 4.2708 0.0000 0.0000 62.9894 31.5257 175.9653 137 K 4.2986 8.4246 123.0576 57.1789 33.1099 175.8195 138 K 4.4647 8.3539 120.8251 55.6373 35.4641 175.1158 139 E 4.0297 9.0209 123.9902 56.8541 30.4103 176.9552 140 V 4.1874 8.1534 121.9037 60.2979 34.0001 175.2720 141 P 4.6755 0.0000 0.0000 62.1627 28.7686 176.8991 142 F 4.1954 8.0613 121.4727 60.9000 39.7831 176.9330 143 D 4.5502 8.2545 120.6931 57.4358 40.8191 178.0349 144 R 4.3150 8.0608 114.4747 56.7273 29.7848 175.4672 145 L 4.8994 7.3843 117.8673 52.6860 45.2376 175.5435 146 K 4.6928 8.2173 117.5619 54.6996 35.4010 176.1541 147 R 4.4438 8.3527 122.0713 54.5889 31.3156 176.3953 148 K 4.1086 8.6432 122.0204 57.3808 32.3582 176.5670 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 17 M 8.15 4.50 0.00 2.08 2.12 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.52 0.00 18 G 8.42 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 L 8.00 3.95 0.00 1.77 1.68 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 20 E 8.09 3.93 0.00 2.28 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 2.67 2.50 0.00 21 D 8.45 4.23 0.00 2.76 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 22 K 8.08 3.82 0.00 1.97 1.84 0.00 1.73 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.76 7.81 23 V 8.01 3.54 2.18 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 0.95 0.00 0.00 0.93 0.00 0.00 24 S 7.96 3.66 0.00 4.13 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 25 K 8.10 4.23 0.00 2.00 1.90 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.87 0.00 0.00 3.67 0.00 0.00 0.00 0.00 1.46 1.70 7.81 26 Q 8.05 4.18 0.00 2.09 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.25 0.00 27 L 7.60 3.95 0.00 1.48 1.42 0.22 0.58 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 28 E 8.85 4.07 0.00 2.22 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 0.00 2.51 2.72 0.00 29 S 8.38 4.16 0.00 4.02 4.15 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 30 K 7.86 4.23 0.00 1.76 1.92 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.55 7.81 31 G 8.48 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 0.00 0.00 0.00 32 I 8.00 4.13 2.01 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.90 1.02 0.00 0.00 33 K 8.61 4.22 0.00 1.75 1.79 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.39 7.81 34 F 8.21 4.91 0.00 3.26 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 35 E 8.81 4.51 0.00 2.13 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 2.25 2.37 0.00 36 Y 8.55 4.51 0.00 3.21 2.98 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 0.00 37 E 7.67 3.51 0.00 1.53 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 0.00 1.87 1.47 0.00 38 E 7.95 4.19 0.00 1.81 1.96 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 2.20 1.47 0.00 39 W 7.84 5.19 0.00 3.24 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 40 K 8.83 4.57 0.00 1.79 1.76 0.00 1.73 0.00 0.00 1.62 0.00 0.00 2.77 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.41 7.81 41 V 8.21 4.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.98 0.00 0.00 42 P 0.00 4.40 0.00 2.09 1.97 0.00 3.72 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.10 0.00 43 Y 7.85 4.91 0.00 2.98 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 44 S 8.65 4.43 0.00 3.95 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 45 N 8.79 4.88 0.00 3.08 2.88 0.00 0.00 7.08 7.79 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 46 N 8.21 4.96 0.00 2.80 2.78 0.00 0.00 6.93 7.28 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 47 Q 8.42 4.44 0.00 2.04 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.71 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 48 Q 8.37 4.55 0.00 1.99 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.77 0.00 0.00 0.00 0.00 0.00 1.99 2.26 0.00 49 N 8.36 5.23 0.00 2.63 2.65 0.00 0.00 6.83 7.46 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 50 Y 8.42 4.65 0.00 2.85 2.83 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 51 S 8.44 4.67 0.00 3.45 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 52 S 8.59 4.36 0.00 4.01 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 53 H 8.40 5.11 0.00 3.14 3.26 0.00 5.66 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.11 4.66 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 55 Y 8.38 4.81 0.00 2.75 2.84 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 56 T 6.27 4.06 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 1.06 0.00 0.00 57 P 0.00 4.94 0.00 2.21 2.11 0.00 3.47 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.88 0.00 58 D 8.58 4.15 0.00 2.68 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 0.00 0.00 0.00 0.00 59 F 8.70 4.98 0.00 3.12 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 60 L 8.32 4.59 0.00 1.54 1.59 -0.01 1.10 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 61 L 8.30 4.23 0.00 1.94 1.57 1.02 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.21 0.00 2.03 2.13 0.00 3.66 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 2.03 2.09 0.00 63 N 8.03 4.56 0.00 3.10 3.07 0.00 0.00 6.45 7.14 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 64 G 8.62 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 0.00 0.00 0.00 65 I 7.13 3.55 1.90 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 1.15 0.58 0.77 0.00 0.00 66 F 9.55 5.09 0.00 3.14 2.95 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 67 V 8.96 4.80 2.40 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 1.27 0.00 0.00 1.12 0.00 0.00 68 E 9.36 5.03 0.00 2.16 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 2.38 2.26 0.00 69 T 8.85 4.84 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 1.41 0.00 0.00 70 K 9.30 4.22 0.00 1.42 1.13 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.93 1.52 7.81 71 G 9.35 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 72 L 9.20 4.39 0.00 1.73 1.73 1.15 1.05 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 73 W 9.07 4.83 0.00 2.77 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 E 8.30 4.06 0.00 1.95 1.93 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 2.45 2.33 0.00 75 S 8.36 3.68 0.00 3.71 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 D 7.88 4.33 0.00 2.67 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 77 D 7.92 4.29 0.00 2.76 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 78 R 7.20 3.17 0.00 1.48 1.14 0.00 2.21 0.00 0.00 2.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 79 K 8.00 3.92 0.00 1.91 1.81 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.65 7.81 80 K 8.00 3.78 0.00 1.84 1.61 0.00 1.69 0.00 0.00 1.94 0.00 0.00 2.79 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.51 7.81 81 H 8.35 4.00 0.00 3.59 3.57 0.00 5.82 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 L 7.70 3.99 0.00 1.84 1.68 0.82 0.69 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 83 L 7.95 4.28 0.00 1.79 1.72 0.91 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 84 I 8.12 3.58 1.73 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 1.46 0.76 0.88 0.00 0.00 85 R 7.88 3.94 0.00 2.00 2.04 0.00 3.27 0.00 0.00 3.28 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.98 0.00 86 E 8.00 4.06 0.00 2.17 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 2.33 2.36 0.00 87 Q 8.86 4.02 0.00 2.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 7.29 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 88 H 8.68 5.71 0.00 3.22 3.12 0.00 5.63 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.49 0.00 2.18 2.18 0.00 3.74 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.94 0.00 90 E 8.14 4.21 0.00 2.15 2.24 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 2.37 2.28 0.00 91 L 7.77 4.90 0.00 1.75 1.61 0.64 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 92 D 8.68 4.88 0.00 2.70 2.53 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 0.00 0.00 0.00 0.00 93 I 8.41 5.09 1.93 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.82 1.06 0.00 0.00 94 R 9.55 4.82 0.00 1.36 1.52 0.00 2.21 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.31 0.00 95 I 8.82 5.01 1.44 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.61 -0.75 0.00 0.00 96 V 8.53 4.90 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 1.03 0.00 0.00 1.03 0.00 0.00 97 F 9.18 5.90 0.00 3.09 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 S 8.94 4.37 0.00 3.87 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 99 S 7.79 4.40 0.00 3.77 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 0.00 100 S 8.78 4.02 0.00 3.71 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 0.00 101 R 7.23 4.01 0.00 1.77 1.90 0.00 3.33 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.68 0.00 102 T 6.97 3.52 2.94 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 0.73 0.00 0.00 103 K 7.91 4.53 0.00 1.54 1.44 0.00 1.87 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.25 1.28 7.81 104 L 8.38 4.33 0.00 1.59 1.96 1.14 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 105 Y 6.77 4.76 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 0.00 106 K 8.89 3.96 0.00 1.88 1.89 0.00 1.93 0.00 0.00 1.73 0.00 0.00 2.81 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.49 1.45 7.81 107 G 8.85 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 0.00 108 S 7.75 3.61 0.00 2.72 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 0.00 109 P 0.00 4.65 0.00 2.21 2.10 0.00 3.73 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 1.99 2.01 0.00 110 T 7.86 5.50 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 1.41 0.00 0.00 111 S 8.62 5.00 0.00 3.92 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 0.00 112 Y 9.06 4.61 0.00 2.38 2.45 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 0.00 113 G 7.61 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 0.00 0.00 0.00 114 E 8.04 4.13 0.00 2.20 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 2.34 2.26 0.00 115 F 8.50 4.08 0.00 3.25 3.59 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.61 4.53 0.00 3.34 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 0.00 117 E 8.36 3.85 0.00 2.29 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 2.54 2.71 0.00 118 K 8.32 4.09 0.00 1.63 1.76 0.00 1.62 0.00 0.00 1.36 0.00 0.00 2.80 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.05 1.32 7.81 119 H 7.51 4.73 0.00 3.09 3.24 0.00 6.01 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 0.00 120 G 7.78 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 0.00 121 I 8.69 4.47 2.19 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.82 1.14 0.00 0.00 122 K 8.74 4.47 0.00 1.48 1.57 0.00 1.42 0.00 0.00 1.68 0.00 0.00 2.83 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.43 7.81 123 F 8.49 6.30 0.00 3.70 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 0.00 124 A 8.78 4.61 0.70 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 0.00 0.00 125 D 8.63 5.00 0.00 2.59 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 0.00 126 K 9.36 4.09 0.00 1.90 1.88 0.00 1.64 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.41 7.81 127 L 7.10 4.78 0.00 1.48 1.43 0.88 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 128 I 8.04 3.51 1.78 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 1.48 0.39 1.02 0.00 0.00 129 P 0.00 3.98 0.00 1.00 1.49 0.00 2.20 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 1.52 0.00 130 A 8.36 4.02 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 E 8.10 3.96 0.00 2.01 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 0.00 2.30 2.37 0.00 132 W 8.06 4.74 0.00 3.51 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 I 7.45 3.79 2.03 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.78 0.91 0.00 0.00 134 K 8.20 4.33 0.00 1.73 1.86 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.70 7.81 135 E 7.76 4.07 0.00 2.30 1.87 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 2.36 2.60 0.00 136 P 0.00 4.27 0.00 2.17 2.08 0.00 3.79 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 1.98 0.00 137 K 8.42 4.30 0.00 1.79 1.77 0.00 1.82 0.00 0.00 1.77 0.00 0.00 3.01 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.43 1.60 7.81 138 K 8.35 4.46 0.00 1.71 1.71 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.48 1.37 7.81 139 E 9.02 4.03 0.00 1.88 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 2.36 2.33 0.00 140 V 8.15 4.19 1.62 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 0.19 0.00 0.00 0.80 0.00 0.00 141 P 0.00 4.68 0.00 2.24 2.20 0.00 3.67 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 1.99 1.96 0.00 142 F 8.06 4.20 0.00 3.10 3.24 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 0.00 143 D 8.25 4.55 0.00 2.75 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 0.00 144 R 8.06 4.32 0.00 1.88 1.97 0.00 3.28 0.00 0.00 3.24 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.75 0.00 145 L 7.38 4.90 0.00 1.73 1.57 0.85 0.64 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 0.00 146 K 8.22 4.69 0.00 1.70 1.68 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.39 7.81 147 R 8.35 4.44 0.00 1.81 1.84 0.00 3.26 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 148 K 8.64 4.11 0.00 1.89 1.79 0.00 1.65 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.42 1.45 7.81