NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 F 5.2371 8.3201 119.4230 57.6755 40.2603 174.3777 17 A 4.5828 8.3868 129.2051 48.5277 21.1753 174.9963 18 R 4.1044 8.3327 113.9211 59.0041 30.7452 174.5852 19 S 4.7735 7.3799 110.6233 57.4302 65.8988 174.0613 20 L 4.8916 8.6771 123.1999 55.0778 42.3938 175.8783 21 S 4.6988 8.5411 118.7034 57.8333 66.3758 172.9862 22 I 5.1253 8.1741 120.7981 59.5267 39.7263 175.7624 23 T 3.9812 8.4020 116.2057 62.9088 69.4296 174.3698 24 T 3.3822 8.7249 120.2128 64.0988 65.2990 170.4589 25 P 4.3940 0.0000 0.0000 63.6638 32.8000 175.2818 26 E 5.6829 7.5485 120.5288 55.5777 32.9933 173.8381 27 E 4.9116 8.8404 124.7733 54.8382 34.8859 173.7087 28 M 5.2755 8.6094 119.7216 54.0170 34.8592 174.4023 29 I 4.6479 8.5063 126.3523 59.4163 40.5909 174.1344 30 E 5.1285 8.7182 126.1744 54.4755 32.0939 174.7841 31 K 4.7722 8.9671 124.4277 55.1826 37.3703 175.1380 32 A 5.0402 9.9687 125.0751 49.9082 21.7891 176.4302 33 K 3.8277 7.8229 119.6847 58.5902 31.9278 175.8365 34 G 4.1696 9.0477 114.3493 44.8849 0.0000 173.5684 35 E 4.2567 7.7811 119.4478 56.3857 30.6796 176.5543 36 T 4.5551 8.4777 113.8841 61.0740 70.4945 173.5882 37 A 4.6396 8.8477 128.1364 50.2184 21.2946 174.8783 38 Y 4.4665 8.6721 124.8847 57.3304 39.6638 175.1407 39 L 4.4224 8.0513 128.2674 51.8725 42.5980 173.4801 40 P 4.1376 0.0000 0.0000 62.8341 32.2086 177.7778 41 C 5.0119 9.3550 124.1485 55.1528 38.6934 171.1358 42 K 5.2331 8.1929 120.9177 54.3936 34.0707 175.7001 43 F 5.4308 8.9584 120.3777 55.3425 40.9132 174.6653 44 T 4.5490 8.9477 117.8983 62.6127 70.5214 174.1400 45 L 5.2416 8.6012 124.6289 53.3579 44.9988 175.1925 46 S 4.9325 8.9320 114.5611 55.8292 65.9920 173.6125 47 P 3.4369 0.0000 0.0000 65.0566 31.1709 178.1087 48 E 3.9891 7.8603 115.0583 58.9165 29.8484 177.5753 49 D 4.8217 7.4322 120.9994 53.7765 38.7860 176.2243 50 Q 4.0718 7.8616 119.0633 57.6197 29.6064 177.0839 51 G 3.9375 7.8487 107.4930 43.6227 0.0000 171.3180 52 P 4.4292 0.0000 0.0000 61.9308 32.0497 175.3250 53 L 4.0533 8.4592 123.4799 55.5930 42.7334 176.5035 54 D 4.9674 8.9680 126.0302 52.6003 41.7657 173.4532 55 I 4.8083 9.0356 124.0065 59.7744 39.7578 174.3452 56 E 5.2525 8.8348 121.9601 55.0515 33.3953 173.7362 57 W 5.2092 9.4247 122.1771 55.1909 31.8316 175.0795 58 L 5.2736 9.0789 122.8559 52.9070 45.9247 175.1555 59 I 4.3620 8.7229 121.2377 59.3757 41.1492 174.5310 60 S 4.9658 8.8015 126.8384 55.8659 63.1943 171.7878 61 P 4.5103 0.0000 0.0000 62.7487 31.6707 176.8175 62 A 4.1104 8.6837 124.9994 56.1244 18.8608 179.4052 63 D 4.5229 7.6169 113.8840 56.6436 42.2221 176.1806 64 N 5.1814 7.7774 114.5558 50.4473 40.5240 174.9507 65 Q 4.0849 8.7192 117.5004 58.5899 28.9805 178.0411 66 K 3.9817 7.4944 116.4024 56.6887 32.4936 176.2804 67 V 4.4343 7.8647 120.7989 59.9188 34.5581 174.1873 68 D 4.2653 8.5014 117.4113 55.2451 39.0134 174.6365 69 Q 4.3317 7.9886 118.2297 54.5990 29.5734 176.5666 70 V 4.2265 8.2581 123.5011 61.4578 32.4125 175.6590 71 I 4.5515 8.4691 115.0484 62.1044 39.5711 175.5952 72 I 5.1330 7.4378 118.8973 59.6215 41.4338 173.3256 73 L 5.5413 9.5668 127.2909 54.7189 44.9320 174.2030 74 Y 5.3543 9.3407 120.6811 56.1202 41.5750 174.1338 75 S 4.8919 8.8427 120.6675 57.4429 67.0245 174.4667 76 G 3.7683 9.2451 109.4336 47.4380 0.0000 172.6127 77 D 4.2783 7.8679 111.8380 53.0493 38.8578 174.3792 78 K 4.3329 6.7836 115.8278 54.7883 36.3844 175.8628 79 I 4.6333 7.9756 123.9426 60.5734 38.3963 174.8396 80 Y 4.8848 9.1996 122.4116 56.5053 40.4961 175.7411 81 D 5.2106 8.8882 122.2348 53.0709 40.9422 175.8188 82 D 4.9370 7.6972 116.6495 54.1240 40.7028 175.3436 83 Y 4.6791 7.7677 115.0011 58.2067 41.8287 175.2044 84 Y 4.6966 7.8488 120.6946 54.8142 39.4278 173.7012 85 P 4.1478 0.0000 0.0000 65.6835 31.5754 178.5172 86 D 4.3860 7.1552 114.8916 55.9540 41.1265 176.8559 87 L 4.5051 7.9724 118.2751 53.7892 42.2961 175.8645 88 K 3.8872 7.4770 120.8119 58.6295 32.0410 176.7104 89 G 4.0319 9.3891 114.5140 45.4844 0.0000 173.0763 90 R 4.7715 8.5144 117.4428 54.2302 32.7278 174.6688 91 V 5.2911 8.0596 118.4256 60.4074 34.2380 174.1416 92 H 4.9482 8.1200 121.4983 53.9135 32.1237 172.6046 93 F 4.8639 8.7889 119.0644 58.1011 38.9050 175.7542 94 T 4.3195 8.8500 112.9259 62.8358 69.5534 174.8735 95 S 4.7198 8.0189 116.9407 56.5763 63.4745 173.3590 96 N 4.6931 8.7468 123.8528 54.2253 37.6667 174.3539 97 D 4.8478 8.1914 119.7857 54.3143 42.3255 177.1947 98 L 4.1555 8.4607 121.3361 57.6169 42.3210 178.8224 99 K 4.0989 7.8247 116.2387 58.9220 32.8922 177.4003 100 S 4.4210 8.5803 113.8782 57.7047 63.0865 173.4375 101 G 2.0000 6.5708 110.4478 44.9846 0.0000 173.3327 102 D 4.9414 7.5534 121.2789 52.4605 40.6587 174.7393 103 A 4.8238 8.9040 122.5310 51.8971 19.3478 177.8718 104 S 4.8401 8.5347 114.7401 60.0308 64.2912 173.3982 105 I 4.8932 7.8547 114.5061 59.2488 41.6708 173.5108 106 N 5.1155 8.6253 120.0793 51.5187 41.2064 174.2912 107 V 4.1675 8.0619 124.8394 61.5409 32.1718 175.1088 108 T 4.2467 8.5957 118.8234 61.1340 70.1443 173.4587 109 N 4.5522 8.4205 118.6365 53.5207 37.1898 173.5994 110 L 4.3589 7.8107 120.3322 54.9341 43.1703 176.8814 111 Q 4.9578 8.5684 118.5731 53.7498 33.0844 176.7072 112 L 4.0021 8.5969 119.2797 58.0771 41.8842 179.6245 113 S 4.1075 8.2738 111.8017 61.6306 62.1062 174.6681 114 D 4.7624 7.9917 117.0362 54.7551 41.1006 176.7923 115 I 3.9445 7.8194 121.7142 60.4324 37.7686 176.3882 116 G 4.1269 7.4630 111.2439 45.9636 0.0000 170.2517 117 T 4.9851 7.4972 116.0326 62.4661 69.9827 174.4300 118 Y 4.8971 9.3806 124.9478 56.9641 40.7398 174.8324 119 Q 4.8510 9.4261 123.1258 54.9822 32.7459 172.5222 120 C 3.8771 8.7483 127.7051 54.6334 45.5962 172.1483 121 K 4.6967 8.4761 127.2328 54.6572 34.2004 174.6707 122 V 4.1949 8.0877 128.7617 61.4160 32.8489 174.7167 123 K 4.6246 8.1741 127.1565 54.9814 35.1804 176.0821 124 K 5.3750 9.3701 123.0192 55.5460 34.3140 173.1454 125 A 4.1106 8.1760 125.4169 51.3933 19.0774 176.5578 126 P 4.7007 0.0000 0.0000 62.8029 31.9279 176.4595 127 G 3.7639 8.0931 110.1903 45.6616 0.0000 173.1567 128 V 4.9190 7.7976 122.4741 61.3828 35.2393 174.0145 129 A 4.5943 8.0174 124.3000 51.1447 22.9577 175.0034 130 N 5.3154 8.7336 118.0796 51.0371 40.7725 173.3992 131 K 4.7451 8.9341 122.3575 54.7156 35.1314 174.7401 132 K 5.0818 8.7610 125.7670 54.7583 35.2045 175.3070 133 I 4.8313 8.8855 124.5331 59.9726 41.1580 174.3082 134 H 5.2277 8.9626 125.5882 54.7033 29.4734 174.1183 135 L 4.9522 8.9794 126.7766 53.9673 43.9286 175.5453 136 V 4.7028 8.5527 124.2300 61.0942 35.4544 174.1911 137 V 5.4523 8.2008 125.0903 60.1197 34.3511 175.1135 138 L 4.3283 8.5141 126.4858 55.0096 41.8651 176.8273 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 16 F 8.32 5.24 0.00 3.06 2.92 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 17 A 8.39 4.58 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 18 R 8.33 4.10 0.00 1.93 2.08 0.00 3.08 0.00 0.00 3.28 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 19 S 7.38 4.77 0.00 3.85 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 20 L 8.68 4.89 0.00 1.87 1.61 0.91 0.96 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 21 S 8.54 4.70 0.00 3.92 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 22 I 8.17 5.13 1.87 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 1.46 0.68 0.94 0.00 0.00 23 T 8.40 3.98 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 1.23 0.00 0.00 24 T 8.72 3.38 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 1.24 0.00 0.00 25 P 0.00 4.39 0.00 2.07 2.07 0.00 3.62 0.00 0.00 3.71 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 26 E 7.55 5.68 0.00 1.76 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 2.26 2.12 0.00 27 E 8.84 4.91 0.00 1.93 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 2.31 2.30 0.00 28 M 8.61 5.28 0.00 2.01 1.96 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.56 0.00 29 I 8.51 4.65 1.86 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 1.13 0.84 0.90 0.00 0.00 30 E 8.72 5.13 0.00 1.94 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 2.18 2.32 0.00 31 K 8.97 4.77 0.00 1.67 1.61 0.00 1.82 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.53 7.81 32 A 9.97 5.04 1.24 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 0.00 0.00 33 K 7.82 3.83 0.00 1.86 1.75 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.46 1.61 7.81 34 G 9.05 4.17 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 0.00 0.00 0.00 0.00 0.00 0.00 35 E 7.78 4.26 0.00 1.99 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 2.32 2.26 0.00 36 T 8.48 4.56 4.22 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 1.21 0.00 0.00 37 A 8.85 4.64 1.14 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 0.00 0.00 0.00 0.00 0.00 0.00 38 Y 8.67 4.47 0.00 2.86 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 39 L 8.05 4.42 0.00 1.01 1.36 0.11 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 4.14 0.00 1.97 2.07 0.00 3.63 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 2.11 2.22 0.00 41 C 9.35 5.01 0.00 3.13 3.35 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 42 K 8.19 5.23 0.00 1.78 1.69 0.00 1.76 0.00 0.00 1.93 0.00 0.00 2.87 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.65 1.50 7.81 43 F 8.96 5.43 0.00 3.03 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 0.00 44 T 8.95 4.55 4.31 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 1.30 0.00 0.00 45 L 8.60 5.24 0.00 1.88 1.77 1.13 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 46 S 8.93 4.93 0.00 3.73 4.07 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 47 P 0.00 3.44 0.00 1.79 1.68 0.00 3.44 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.40 0.00 48 E 7.86 3.99 0.00 2.02 2.03 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 2.18 2.26 0.00 49 D 7.43 4.82 0.00 2.83 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 50 Q 7.86 4.07 0.00 2.03 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.02 0.00 0.00 0.00 0.00 0.00 2.49 2.28 0.00 51 G 7.85 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 0.00 0.00 0.00 52 P 0.00 4.43 0.00 2.26 2.21 0.00 3.70 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 2.08 1.96 0.00 53 L 8.46 4.05 0.00 1.75 1.81 0.80 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 54 D 8.97 4.97 0.00 2.87 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 55 I 9.04 4.81 1.98 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.50 0.93 0.00 0.00 56 E 8.83 5.25 0.00 2.04 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 2.13 2.26 0.00 57 W 9.42 5.21 0.00 3.24 3.12 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 58 L 9.08 5.27 0.00 1.55 1.52 0.93 0.50 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 59 I 8.72 4.36 1.20 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 1.13 -0.07 0.00 0.00 60 S 8.80 4.97 0.00 3.68 3.73 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 P 0.00 4.51 0.00 2.10 2.09 0.00 3.93 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.06 0.00 62 A 8.68 4.11 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 D 7.62 4.52 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 64 N 7.78 5.18 0.00 2.94 2.87 0.00 0.00 6.11 7.44 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 65 Q 8.72 4.08 0.00 2.07 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.92 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 66 K 7.49 3.98 0.00 2.02 1.80 0.00 1.85 0.00 0.00 1.78 0.00 0.00 3.06 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.50 1.54 7.81 67 V 7.86 4.43 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 0.75 0.00 0.00 0.91 0.00 0.00 68 D 8.50 4.27 0.00 2.73 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 69 Q 7.99 4.33 0.00 2.05 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.99 7.00 0.00 0.00 0.00 0.00 0.00 2.57 2.51 0.00 70 V 8.26 4.23 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 0.58 0.00 0.00 0.71 0.00 0.00 71 I 8.47 4.55 1.95 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 1.49 0.76 0.59 0.00 0.00 72 I 7.44 5.13 1.85 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.69 0.68 0.00 0.00 73 L 9.57 5.54 0.00 2.11 1.82 1.24 0.79 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 74 Y 9.34 5.35 0.00 2.97 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 75 S 8.84 4.89 0.00 3.89 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 76 G 9.25 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 0.00 0.00 0.00 77 D 7.87 4.28 0.00 2.75 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 78 K 6.78 4.33 0.00 1.42 1.13 0.00 1.62 0.00 0.00 1.54 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.20 1.51 7.81 79 I 7.98 4.63 1.95 0.00 0.00 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 1.78 0.64 1.24 0.00 0.00 80 Y 9.20 4.88 0.00 3.27 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 81 D 8.89 5.21 0.00 2.77 2.78 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 82 D 7.70 4.94 0.00 2.48 2.23 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 83 Y 7.77 4.68 0.00 3.05 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 84 Y 7.85 4.70 0.00 3.21 2.92 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 85 P 0.00 4.15 0.00 1.99 2.02 0.00 3.47 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 86 D 7.16 4.39 0.00 2.32 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 87 L 7.97 4.51 0.00 2.00 1.79 1.08 0.73 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 88 K 7.48 3.89 0.00 1.77 1.86 0.00 1.79 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.42 7.81 89 G 9.39 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 90 R 8.51 4.77 0.00 1.70 2.04 0.00 3.26 0.00 0.00 3.20 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.54 0.00 91 V 8.06 5.29 2.04 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 0.66 0.00 0.00 0.89 0.00 0.00 92 H 8.12 4.95 0.00 3.28 3.34 0.00 5.71 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 93 F 8.79 4.86 0.00 3.09 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 94 T 8.85 4.32 4.46 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 1.39 0.00 0.00 95 S 8.02 4.72 0.00 4.11 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 96 N 8.75 4.69 0.00 2.87 2.95 0.00 0.00 5.86 8.06 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 97 D 8.19 4.85 0.00 2.62 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 98 L 8.46 4.16 0.00 1.54 1.40 -0.20 -0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 99 K 7.82 4.10 0.00 1.95 1.93 0.00 1.66 0.00 0.00 1.82 0.00 0.00 3.23 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.42 1.44 7.81 100 S 8.58 4.42 0.00 3.89 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 0.00 101 G 6.57 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 0.00 0.00 0.00 0.00 0.00 0.00 102 D 7.55 4.94 0.00 2.60 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 0.00 103 A 8.90 4.82 1.48 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 0.00 0.00 104 S 8.53 4.84 0.00 3.89 3.32 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 0.00 105 I 7.85 4.89 1.31 0.00 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.07 0.02 0.00 0.00 106 N 8.63 5.12 0.00 2.50 2.52 0.00 0.00 6.95 8.47 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 0.00 107 V 8.06 4.17 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 0.99 0.00 0.00 0.53 0.00 0.00 108 T 8.60 4.25 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 0.00 109 N 8.42 4.55 0.00 2.95 2.81 0.00 0.00 7.70 6.66 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 0.00 110 L 7.81 4.36 0.00 1.70 1.58 0.91 1.01 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 0.00 111 Q 8.57 4.96 0.00 2.09 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.78 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 112 L 8.60 4.00 0.00 1.69 1.74 0.94 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.27 4.11 0.00 3.84 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 0.00 114 D 7.99 4.76 0.00 2.94 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 0.00 115 I 7.82 3.94 1.91 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 1.34 1.51 1.03 0.00 0.00 116 G 7.46 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 117 T 7.50 4.99 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 1.27 0.00 0.00 118 Y 9.38 4.90 0.00 2.96 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 0.00 119 Q 9.43 4.85 0.00 2.04 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.83 0.00 0.00 0.00 0.00 0.00 2.18 2.30 0.00 120 C 8.75 3.88 0.00 1.23 2.25 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 0.00 121 K 8.48 4.70 0.00 1.66 1.49 0.00 1.58 0.00 0.00 1.49 0.00 0.00 2.70 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.21 1.23 7.81 122 V 8.09 4.19 1.71 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 0.05 0.00 0.00 0.43 0.00 0.00 123 K 8.17 4.62 0.00 1.67 1.61 0.00 1.71 0.00 0.00 1.53 0.00 0.00 2.72 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.29 1.27 7.81 124 K 9.37 5.38 0.00 1.72 1.62 0.00 1.80 0.00 0.00 1.94 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.28 7.81 125 A 8.18 4.11 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 0.00 126 P 0.00 4.70 0.00 2.15 2.14 0.00 3.66 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.05 0.00 127 G 8.09 3.76 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 0.00 0.00 0.00 128 V 7.80 4.92 2.04 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 0.75 0.00 0.00 0.94 0.00 0.00 129 A 8.02 4.59 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 0.00 130 N 8.73 5.32 0.00 2.56 2.73 0.00 0.00 5.90 7.13 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 0.00 131 K 8.93 4.75 0.00 1.72 1.51 0.00 1.68 0.00 0.00 1.79 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.35 1.54 7.81 132 K 8.76 5.08 0.00 1.70 1.59 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.34 1.37 7.81 133 I 8.89 4.83 2.01 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.80 0.93 0.00 0.00 134 H 8.96 5.23 0.00 3.16 3.30 0.00 5.60 0.00 0.00 0.00 0.00 6.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 8.98 4.95 0.00 1.81 1.76 0.91 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 136 V 8.55 4.70 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 0.91 0.00 0.00 0.97 0.00 0.00 137 V 8.20 5.45 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 1.04 0.00 0.00 0.99 0.00 0.00 138 L 8.51 4.33 0.00 1.65 1.55 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00