NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4485 8.3049 120.3255 54.7356 33.4277 174.8681 2 I 3.7429 8.0514 122.0347 61.0950 37.6252 175.4314 3 S 4.3060 8.9159 121.4591 59.1136 64.4092 174.7558 4 G 3.7802 7.2163 105.0896 45.4835 0.0000 170.4452 5 L 4.2289 7.9804 122.7118 54.4470 42.7348 177.0938 6 S 4.4581 8.2925 121.6079 59.5586 63.0197 173.1986 7 H 4.7731 6.9635 112.8858 54.8895 31.3099 171.8282 8 I 4.4560 8.1205 118.8713 59.6887 40.1264 174.9614 9 T 5.1111 8.4639 122.7537 61.7266 70.8511 173.5369 10 L 4.8604 9.0295 125.7132 52.9441 45.6095 175.3364 11 I 4.9534 8.4663 122.9722 59.9946 39.0682 175.2708 12 V 4.7051 9.0652 119.2121 59.7761 36.0850 176.8072 13 K 3.9617 9.1805 122.6913 58.7122 32.4071 176.9056 14 D 4.7715 7.7367 120.7975 51.7618 42.7564 175.2636 15 L 4.0985 9.2937 130.4430 58.2910 41.9361 178.5927 16 N 4.4627 8.4945 116.5112 56.1082 38.5695 177.5478 17 K 3.9489 8.2324 119.4357 59.8660 32.1239 179.4194 18 T 4.2479 8.1199 115.9958 66.8258 68.2711 176.8806 19 T 3.8180 8.0795 117.6521 66.6841 68.5173 176.4460 20 A 4.0696 7.9949 122.5411 55.0406 18.3063 179.1682 21 F 4.1697 8.3704 118.6921 61.7061 39.5061 177.2492 22 L 3.9406 8.3235 118.3762 58.0823 41.5409 179.7847 23 Q 4.1534 8.2777 117.9252 58.9323 28.4058 178.5354 24 N 4.3164 8.3706 117.1897 56.0500 38.7263 177.2163 25 I 3.6681 7.5017 120.0561 63.1649 37.5396 176.9544 26 F 4.4851 7.8054 114.5188 56.3461 39.2327 175.2793 27 N 4.7550 8.4094 115.7301 52.9085 35.9980 174.2590 28 A 4.4210 8.1480 118.1201 52.2472 19.7572 177.5399 29 E 4.6375 9.0222 122.5214 54.1691 31.6872 174.7832 30 E 4.1556 9.0720 129.3942 56.0936 30.0811 176.0613 31 I 4.5938 8.0191 118.8423 60.1099 39.0805 174.5248 32 Y 4.4620 7.3801 120.4255 57.4024 41.7809 172.4177 33 S 4.6840 7.2972 119.5980 57.0023 65.9292 172.7275 34 S 4.2878 8.9629 120.3809 57.0938 66.7349 172.6652 35 G 4.3255 8.6923 107.0532 44.6635 0.0000 173.8413 36 D 4.2938 9.1904 119.5827 53.1531 43.0279 175.9913 37 K 3.9454 8.7455 130.0016 59.6119 32.3691 178.8902 38 T 3.9104 7.9749 107.5364 63.6039 68.6923 174.5102 39 F 5.0368 8.3387 122.7498 57.2984 39.9155 174.9621 40 S 3.7634 8.2054 114.2551 60.7713 60.7143 172.2711 41 L 4.8487 7.6615 119.4906 52.5418 44.5109 177.3847 42 S 4.5618 8.8136 119.0229 58.2104 63.9515 174.4758 43 K 4.5254 8.6135 120.6188 57.0779 33.3838 175.4818 44 E 5.3977 8.7593 121.8441 55.4751 33.6154 174.0940 45 K 5.0466 9.5512 124.3747 54.8265 37.1619 175.0656 46 F 6.0332 8.9087 121.2085 56.1738 42.0496 174.7197 47 F 5.4667 10.0410 120.3739 55.7967 43.8492 173.6042 48 L 5.3011 8.9931 120.6690 53.2234 44.5860 175.7205 49 I 4.7178 8.6692 124.1135 59.0783 40.2311 175.7165 50 A 3.7652 9.7402 132.9605 53.2080 15.9394 177.7394 51 G 3.9722 8.3551 106.4734 46.2900 0.0000 173.5917 52 L 4.4554 8.2403 121.5772 53.0432 42.8011 175.4959 53 W 5.0348 8.9092 134.5876 57.4164 31.9066 174.5174 54 I 5.0053 9.4568 129.0708 59.7410 39.6688 174.4061 55 C 5.5507 9.3657 124.5140 58.0989 30.9770 172.8331 56 I 5.0611 9.3794 125.1408 59.8194 39.7668 174.4863 57 M 5.2543 9.1337 126.6997 53.4244 35.2347 174.4794 58 E 4.7920 8.9067 124.8587 55.8974 30.7548 175.5730 59 G 4.1105 9.0718 112.8704 46.6440 0.0000 172.7142 60 D 4.7780 8.8448 118.0268 54.4757 41.6033 177.5166 61 S 4.1950 7.9746 116.2870 58.5162 63.0844 173.7669 62 L 4.3058 8.3188 125.6923 53.8543 42.5447 176.0298 63 Q 4.3358 8.3376 123.7628 54.3518 29.5656 175.2344 64 E 4.0789 8.5086 124.0578 55.8216 30.4880 176.4256 65 R 4.0871 8.4042 122.5608 56.3631 30.4163 175.4442 66 T 4.6533 8.0385 114.2659 60.9892 71.5996 172.5224 67 Y 4.4637 8.4806 120.4174 58.0413 39.0641 175.0253 68 N 4.3290 7.9582 117.8751 54.6274 38.8374 173.8177 69 H 4.3838 7.8603 116.7906 55.0877 31.1209 172.4932 70 I 4.3727 7.7073 119.4007 59.2647 39.8917 174.6738 71 A 5.2505 8.2005 127.0251 50.2207 21.3517 175.4494 72 F 4.8111 9.5156 121.2170 55.8171 42.0211 175.1162 73 Q 5.0107 8.7014 120.8111 55.5500 30.0710 175.0134 74 I 4.7202 8.5514 115.6770 59.5309 42.1006 173.8560 75 Q 4.7296 8.6469 120.2348 54.4994 30.2657 177.2227 76 S 4.1107 8.8659 117.9110 62.2563 62.6856 177.1031 77 E 4.1297 8.1873 118.2437 58.3614 29.4845 177.9320 78 E 4.4467 8.6915 118.3116 56.8037 30.0932 177.8969 79 V 3.6216 7.4963 119.1566 66.4385 31.6324 177.3411 80 D 4.3755 8.1738 117.6276 57.4813 40.6401 178.5778 81 E 3.8224 8.0738 118.8914 59.5738 29.6968 178.2125 82 Y 3.6982 8.0760 116.8071 61.3102 37.9023 178.7707 83 T 3.7945 8.2482 116.9505 66.7279 68.4786 176.2429 84 E 3.9362 8.0529 120.7667 58.9234 29.4125 178.7556 85 R 3.7344 7.7054 118.1779 59.3750 30.5629 178.3513 86 I 3.6071 7.8363 119.9189 64.1866 37.0534 178.2537 87 K 3.8928 8.0287 120.2326 59.5286 31.7258 178.4931 88 A 3.9969 7.9663 120.2618 55.1953 18.3786 179.2655 89 L 4.2058 7.6022 115.5560 55.6693 41.7136 178.4453 90 G 3.9638 7.9336 106.5698 45.8290 0.0000 174.1706 91 V 4.0561 7.5174 111.9997 60.0658 32.6996 175.4037 92 E 4.2617 8.7552 123.0845 56.8287 30.5256 175.1303 93 M 5.3934 8.6418 126.1517 53.7238 35.1018 174.8513 94 K 4.5402 9.0638 126.1296 55.2634 33.1976 175.4292 95 P 4.3914 0.0000 0.0000 62.3179 31.9468 175.9808 96 E 4.0857 8.7408 122.2785 56.7404 30.0855 176.5290 97 R 4.5248 8.3063 123.8830 54.0353 31.8415 174.4640 98 P 4.4529 0.0000 0.0000 62.1058 32.0844 176.1686 99 R 3.9791 8.3742 120.2566 56.9257 30.8281 175.8396 100 V 4.3582 8.1920 123.0898 61.4864 34.4473 175.0507 101 Q 4.1568 8.8140 125.2344 57.0412 28.3224 172.5646 102 G 4.3860 9.0876 111.9482 44.6446 0.0000 173.8365 103 E 4.4132 7.7582 117.5078 55.3139 30.6627 176.4762 104 G 4.1965 8.2288 110.6019 43.9907 0.0000 173.1878 105 R 4.3534 8.1818 117.2677 56.4083 31.3300 176.2837 106 S 5.0904 8.5293 116.8096 57.0336 67.4159 173.2646 107 I 4.5969 8.5812 123.6569 59.7513 40.0996 174.0544 108 Y 5.2609 8.7022 124.2497 56.2415 40.9324 174.7305 109 F 5.3420 8.5830 117.5915 56.4245 41.9453 172.3266 110 Y 5.8038 9.4233 116.9120 55.6496 40.9747 176.4637 111 D 3.5077 8.4948 120.8653 52.4763 41.7520 176.5785 112 F 4.7330 7.8530 119.7884 58.5228 38.7375 175.2211 113 D 4.8382 9.0349 122.5658 54.3295 41.7775 176.1949 114 N 4.2165 8.4670 111.9491 54.4253 36.4756 173.6881 115 H 4.6582 7.8272 117.2594 54.5103 30.0509 174.2737 116 L 4.2274 8.3407 126.2891 54.3975 42.9876 175.7646 117 F 4.8985 8.9644 124.2925 55.4874 43.0255 173.6022 118 E 4.9569 9.0182 122.1995 54.3157 32.9701 174.4153 119 L 5.1727 8.8724 126.7697 53.5377 44.0267 174.6351 120 H 5.2789 9.4086 124.8995 54.2791 32.0878 174.3406 121 A 5.1607 8.1355 125.8282 51.1404 19.8590 176.6515 122 G 3.9701 6.7709 106.0426 44.5123 0.0000 173.5652 123 T 4.7508 7.8498 107.7090 58.8703 73.0721 174.3634 124 L 3.9365 8.3972 123.5089 58.2169 42.1097 178.7769 125 E 3.8982 8.1509 118.7800 59.4715 29.3999 178.3004 126 E 3.9099 7.9279 117.7491 59.1896 29.7270 178.4154 127 R 4.1573 7.7899 117.9149 59.5317 30.2685 178.2671 128 L 4.1358 8.0507 117.9512 57.3120 41.7348 177.5544 129 K 4.1213 8.1461 123.3751 57.0120 32.2791 175.9643 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 4.45 0.00 2.02 2.06 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 2.50 2.56 0.00 2 I 8.05 3.74 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.07 0.91 0.00 0.00 3 S 8.92 4.31 0.00 3.87 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 7.22 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 5 L 7.98 4.23 0.00 1.56 1.57 0.83 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 6 S 8.29 4.46 0.00 3.86 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 7 H 6.96 4.77 0.00 2.31 1.96 0.00 5.52 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 I 8.12 4.46 1.86 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.64 0.87 0.00 0.00 9 T 8.46 5.11 4.19 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 1.22 0.00 0.00 10 L 9.03 4.86 0.00 1.54 1.34 0.99 0.66 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 11 I 8.47 4.95 1.93 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 1.39 0.86 1.01 0.00 0.00 12 V 9.07 4.71 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 0.90 0.00 0.00 1.10 0.00 0.00 13 K 9.18 3.96 0.00 1.92 1.85 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.43 7.81 14 D 7.74 4.77 0.00 2.68 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 L 9.29 4.10 0.00 1.99 1.78 1.11 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 16 N 8.49 4.46 0.00 2.98 2.88 0.00 0.00 6.94 7.07 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 17 K 8.23 3.95 0.00 1.82 1.27 0.00 1.46 0.00 0.00 1.61 0.00 0.00 2.13 0.00 0.00 2.28 0.00 0.00 0.00 0.00 1.26 1.54 7.81 18 T 8.12 4.25 4.52 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 1.31 0.00 0.00 19 T 8.08 3.82 4.57 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 1.55 0.00 0.00 20 A 7.99 4.07 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 21 F 8.37 4.17 0.00 3.38 3.43 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.32 3.94 0.00 1.43 1.34 0.27 0.61 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 23 Q 8.28 4.15 0.00 2.22 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.83 0.00 0.00 0.00 0.00 0.00 2.79 2.64 0.00 24 N 8.37 4.32 0.00 2.64 2.80 0.00 0.00 7.07 7.07 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 25 I 7.50 3.67 1.01 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.08 -0.26 0.00 0.00 26 F 7.81 4.49 0.00 2.84 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 27 N 8.41 4.76 0.00 2.89 2.92 0.00 0.00 7.24 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 28 A 8.15 4.42 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 29 E 9.02 4.64 0.00 2.13 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 0.00 2.26 2.27 0.00 30 E 9.07 4.16 0.00 1.96 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 2.08 1.76 0.00 31 I 8.02 4.59 1.88 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.98 0.99 0.00 0.00 32 Y 7.38 4.46 0.00 2.92 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.30 4.68 0.00 3.80 3.37 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 34 S 8.96 4.29 0.00 3.82 3.53 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 35 G 8.69 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 0.00 0.00 0.00 0.00 36 D 9.19 4.29 0.00 2.67 2.72 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 37 K 8.75 3.95 0.00 1.85 1.82 0.00 1.79 0.00 0.00 1.88 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.47 7.81 38 T 7.97 3.91 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 1.21 0.00 0.00 39 F 8.34 5.04 0.00 3.03 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 40 S 8.21 3.76 0.00 4.06 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 41 L 7.66 4.85 0.00 1.69 1.56 0.87 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 42 S 8.81 4.56 0.00 4.05 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 43 K 8.61 4.53 0.00 1.78 1.80 0.00 2.06 0.00 0.00 1.76 0.00 0.00 2.79 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.46 7.81 44 E 8.76 5.40 0.00 2.15 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 2.47 2.72 0.00 45 K 9.55 5.05 0.00 1.91 1.32 0.00 1.88 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.31 1.42 7.81 46 F 8.91 6.03 0.00 3.02 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 47 F 10.04 5.47 0.00 3.04 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 48 L 8.99 5.30 0.00 1.67 1.63 0.93 0.82 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 49 I 8.67 4.72 1.95 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.71 0.84 0.00 0.00 50 A 9.74 3.77 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 51 G 8.36 3.97 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 0.00 0.00 0.00 52 L 8.24 4.46 0.00 1.92 1.73 1.08 0.84 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 53 W 8.91 5.03 0.00 3.38 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 54 I 9.46 5.01 2.14 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.86 1.01 0.00 0.00 55 C 9.37 5.55 0.00 2.69 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 56 I 9.38 5.06 2.23 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 1.61 1.30 1.07 0.00 0.00 57 M 9.13 5.25 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.56 0.00 58 E 8.91 4.79 0.00 2.06 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 2.34 2.45 0.00 59 G 9.07 4.11 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 0.00 0.00 0.00 60 D 8.84 4.78 0.00 2.69 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.97 4.19 0.00 3.87 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 62 L 8.32 4.31 0.00 1.62 1.57 0.92 0.95 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 63 Q 8.34 4.34 0.00 1.88 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.96 0.00 0.00 0.00 0.00 0.00 2.14 2.37 0.00 64 E 8.51 4.08 0.00 2.11 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 2.26 2.29 0.00 65 R 8.40 4.09 0.00 1.73 1.86 0.00 3.16 0.00 0.00 3.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 66 T 8.04 4.65 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 1.29 0.00 0.00 67 Y 8.48 4.46 0.00 2.83 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 68 N 7.96 4.33 0.00 2.75 2.70 0.00 0.00 6.77 8.17 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 69 H 7.86 4.38 0.00 3.17 2.98 0.00 5.48 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 I 7.71 4.37 1.76 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.75 0.34 0.00 0.00 71 A 8.20 5.25 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 72 F 9.52 4.81 0.00 3.08 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 73 Q 8.70 5.01 0.00 1.97 2.03 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 2.36 2.37 0.00 74 I 8.55 4.72 1.69 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.64 0.38 0.00 0.00 75 Q 8.65 4.73 0.00 2.14 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.74 0.00 0.00 0.00 0.00 0.00 2.34 2.48 0.00 76 S 8.87 4.11 0.00 3.86 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 77 E 8.19 4.13 0.00 1.93 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 2.32 2.47 0.00 78 E 8.69 4.45 0.00 2.29 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 0.00 2.31 2.35 0.00 79 V 7.50 3.62 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 1.14 0.00 0.00 0.98 0.00 0.00 80 D 8.17 4.38 0.00 2.72 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 81 E 8.07 3.82 0.00 1.91 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 2.23 2.18 0.00 82 Y 8.08 3.70 0.00 3.26 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 83 T 8.25 3.79 4.42 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 1.21 0.00 0.00 84 E 8.05 3.94 0.00 2.12 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 2.27 2.41 0.00 85 R 7.71 3.73 0.00 1.90 1.88 0.00 3.11 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.50 0.00 86 I 7.84 3.61 1.59 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.69 0.56 0.00 0.00 87 K 8.03 3.89 0.00 1.99 1.91 0.00 1.55 0.00 0.00 1.67 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.52 7.81 88 A 7.97 4.00 1.41 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 0.00 0.00 0.00 89 L 7.60 4.21 0.00 1.86 1.86 0.84 0.75 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 90 G 7.93 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 0.00 0.00 0.00 91 V 7.52 4.06 2.35 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 0.77 0.00 0.00 1.13 0.00 0.00 92 E 8.76 4.26 0.00 2.16 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 2.79 2.48 0.00 93 M 8.64 5.39 0.00 2.10 1.98 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.63 0.00 94 K 9.06 4.54 0.00 1.86 1.81 0.00 1.74 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.62 1.55 7.81 95 P 0.00 4.39 0.00 2.22 2.10 0.00 3.85 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 2.03 1.99 0.00 96 E 8.74 4.09 0.00 2.01 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 2.35 2.42 0.00 97 R 8.31 4.52 0.00 1.91 1.88 0.00 3.42 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.57 0.00 98 P 0.00 4.45 0.00 2.19 2.07 0.00 3.83 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 99 R 8.37 3.98 0.00 1.81 1.93 0.00 3.21 0.00 0.00 3.17 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 100 V 8.19 4.36 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 0.99 0.00 0.00 1.00 0.00 0.00 101 Q 8.81 4.16 0.00 2.11 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.47 0.00 0.00 0.00 0.00 0.00 2.29 1.96 0.00 102 G 9.09 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 0.00 0.00 0.00 0.00 103 E 7.76 4.41 0.00 2.20 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 2.36 2.28 0.00 104 G 8.23 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 0.00 105 R 8.18 4.35 0.00 1.78 1.87 0.00 3.09 0.00 0.00 3.35 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.67 0.00 106 S 8.53 5.09 0.00 3.75 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 0.00 107 I 8.58 4.60 1.91 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.78 0.94 0.00 0.00 108 Y 8.70 5.26 0.00 2.98 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 0.00 109 F 8.58 5.34 0.00 3.42 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 0.00 110 Y 9.42 5.80 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 0.00 111 D 8.49 3.51 0.00 1.72 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 0.00 0.00 0.00 0.00 112 F 7.85 4.73 0.00 3.04 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 0.00 113 D 9.03 4.84 0.00 2.69 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 0.00 114 N 8.47 4.22 0.00 2.78 2.90 0.00 0.00 7.14 8.16 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 0.00 115 H 7.83 4.66 0.00 3.61 2.77 0.00 5.80 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 L 8.34 4.23 0.00 1.45 1.37 0.51 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 117 F 8.96 4.90 0.00 1.89 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 0.00 118 E 9.02 4.96 0.00 1.89 1.70 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 1.75 1.47 0.00 119 L 8.87 5.17 0.00 1.57 1.38 0.30 1.11 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 0.00 120 H 9.41 5.28 0.00 3.31 3.12 0.00 5.75 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 0.00 121 A 8.14 5.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 G 6.77 3.97 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 0.00 0.00 0.00 123 T 7.85 4.75 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 1.21 0.00 0.00 124 L 8.40 3.94 0.00 1.78 1.71 0.92 0.77 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 0.00 125 E 8.15 3.90 0.00 2.08 1.94 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 2.38 2.38 0.00 126 E 7.93 3.91 0.00 2.01 2.13 0.00 0.00 0.00 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 2.59 0.00 127 R 7.79 4.16 0.00 1.96 2.15 0.00 3.39 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.73 0.00 128 L 8.05 4.14 0.00 1.64 1.71 0.92 1.01 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 0.00 129 K 8.15 4.12 0.00 1.87 1.88 0.00 1.83 0.00 0.00 1.75 0.00 0.00 3.14 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.47 1.48 7.81