NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 S 4.4994 8.1927 115.4227 58.1115 64.6598 174.3343 1 T 3.7444 8.3712 115.1259 63.4089 67.1090 174.9797 2 S 4.3420 8.7499 119.0343 60.9504 63.6243 175.7209 3 A 3.7147 8.0004 124.4271 54.4801 18.0836 179.4671 4 K 3.8345 8.4599 118.6064 59.6832 32.2135 179.0057 5 R 3.8717 8.2049 119.0909 59.4652 29.9564 178.5569 6 I 3.3479 7.7357 119.7268 64.2316 36.9199 178.2305 7 Q 4.0074 8.2558 120.6486 58.8166 28.8400 178.1451 8 K 3.9418 8.2396 121.0009 59.6691 31.9588 178.7388 9 E 4.1108 8.6535 119.2873 59.1707 29.3080 179.1309 10 L 4.1196 8.5877 120.8108 58.1243 42.1863 178.8589 11 A 3.9701 8.1970 120.7926 55.0892 18.3114 179.1232 12 E 3.8770 8.2345 117.8234 59.5871 29.4507 178.8077 13 I 3.9558 7.9972 117.9791 63.6129 37.8589 177.9288 14 T 3.9872 7.7138 116.4145 66.3038 68.3760 176.2725 15 L 4.2642 7.8085 121.2905 56.9741 43.4318 177.0807 16 D 4.7981 7.9018 118.2591 51.6059 41.2945 173.4330 17 P 4.7138 0.0000 0.0000 60.6029 32.4433 175.6174 18 P 4.4861 0.0000 0.0000 61.5620 31.9843 174.4212 19 P 4.2778 0.0000 0.0000 64.4135 31.8129 176.1725 20 N 4.3892 9.2789 117.5333 53.9497 35.9690 172.8274 21 C 5.4309 7.8241 116.7320 58.0744 34.9434 173.1985 22 S 4.9888 9.1716 119.2836 57.0322 66.6528 172.4632 23 A 5.0328 7.9947 119.5711 51.4041 21.9141 175.5847 24 G 2.9872 8.2610 107.0016 44.5755 0.0000 170.9799 25 P 4.7819 0.0000 0.0000 62.3794 31.3272 177.7632 26 K 4.1618 9.1992 122.8363 58.8816 32.9695 177.9746 27 G 3.9957 7.2440 106.8403 45.7486 0.0000 173.5568 28 D 4.3104 8.9339 119.7298 56.9845 41.4692 175.8390 29 N 4.5842 8.0488 117.7035 53.0585 37.9606 174.7638 30 I 4.1731 8.3854 125.3561 62.3961 38.4859 176.0076 31 Y 4.1562 9.0074 117.2213 59.8555 38.2751 174.3129 32 E 5.2654 8.5698 120.2801 54.5709 32.0597 175.2457 33 W 5.4032 9.3925 124.4456 54.8540 33.3908 174.6688 34 R 5.1552 9.0382 120.8148 54.8326 33.4105 174.0220 35 S 5.1474 9.2776 117.4441 56.9526 66.4913 172.4916 36 T 5.2509 8.8764 122.5284 61.9519 71.0374 173.3059 37 I 5.0061 8.8784 126.9925 59.4586 40.5765 174.8027 38 L 4.8290 9.0716 127.8546 53.7245 42.6795 177.2114 39 G 4.0664 9.0255 111.0090 45.8226 0.0000 171.7853 40 P 4.4516 0.0000 0.0000 61.9285 31.9821 174.0895 41 P 4.3933 0.0000 0.0000 64.2984 31.4191 176.9782 42 G 3.9367 10.8778 110.3134 45.5895 0.0000 173.6870 43 S 4.5992 8.0046 115.0908 56.9539 64.5498 175.7233 44 V 3.5974 8.0427 113.6140 63.9441 31.3924 177.3631 45 Y 5.0276 7.5523 116.0608 56.7486 38.2290 174.8718 46 E 4.0216 7.8327 121.3764 58.1710 29.8739 177.5170 47 G 4.0233 9.1387 113.6251 45.3426 0.0000 173.6555 48 G 3.7531 8.2338 107.7974 45.7343 0.0000 173.0856 49 V 4.5003 7.9222 122.7577 60.7074 33.5527 174.7588 50 F 4.6912 9.0178 126.8873 55.5647 42.2409 174.3688 51 F 5.6464 8.8076 121.4857 55.8800 41.6897 174.7382 52 L 5.1240 9.1128 121.9492 53.0488 45.9518 175.0097 53 D 5.2871 8.7867 121.3547 52.7380 43.6360 175.5052 54 I 4.8468 8.7342 122.9047 59.7363 41.1595 174.4989 55 T 4.8849 8.5886 123.2095 61.7431 71.5088 173.2539 56 F 4.5909 9.1020 126.6912 56.4745 40.1573 176.3677 57 S 4.5757 8.6809 116.8333 56.9838 64.1626 173.2620 58 P 4.3252 0.0000 0.0000 66.0722 31.2179 177.3826 59 D 4.7671 7.9039 115.7203 54.8647 40.6839 175.5614 60 Y 4.3083 8.1100 122.2723 57.8138 39.2955 174.4176 61 P 3.4147 0.0000 0.0000 62.5710 31.6520 176.6536 62 F 4.9868 7.7671 116.2769 58.3814 39.2999 176.0358 63 K 4.6535 7.5897 119.7301 53.4526 35.7066 174.4155 64 P 2.0000 0.0000 0.0000 61.0077 31.8506 174.4151 65 P 4.0869 0.0000 0.0000 62.3747 32.2998 175.6876 66 K 4.1413 8.5819 124.4006 55.6580 33.3138 175.6107 67 V 4.8961 8.2385 127.3201 61.2239 34.0804 174.5828 68 T 4.9774 8.5264 117.1232 59.7067 72.4948 173.1995 69 F 4.4205 9.2118 123.4996 58.0593 39.4716 176.5474 70 R 4.1289 9.3236 123.8186 59.4008 30.7743 177.7362 71 T 4.2956 8.1087 115.1128 62.9954 69.1635 175.2889 72 R 4.0226 8.6923 125.7640 56.5195 30.6404 175.9497 73 I 4.9433 8.1922 121.1331 59.5620 41.1106 173.9509 74 Y 4.0013 8.9312 128.0737 56.8838 38.2356 174.0903 75 H 4.5080 7.6034 124.5161 55.0698 33.0121 174.3717 76 C 4.1229 8.3784 121.3619 60.2512 29.8602 174.3356 77 N 4.7671 8.2271 116.6610 52.8245 38.8664 173.8100 78 I 4.7436 7.4443 119.2745 59.4577 40.1906 175.1135 79 N 4.7515 8.5618 124.1152 51.1170 39.1194 175.9532 80 S 4.1928 8.5379 111.8766 61.0384 62.9145 174.8920 81 Q 4.2393 8.4444 118.6304 55.5134 28.9564 176.4620 82 G 4.2098 8.5593 106.9279 46.3475 0.0000 173.7042 83 V 3.9558 7.7802 119.9443 62.6026 32.1243 174.4566 84 I 4.7532 8.1875 127.4892 59.8049 38.8854 174.9228 85 C 4.4302 9.2742 129.4665 58.4825 31.5298 172.3305 86 L 4.5497 8.0845 127.5460 52.7945 45.1278 175.6030 87 D 4.3632 9.2192 126.7100 57.8655 40.7192 178.8119 88 I 4.0048 7.9307 116.7389 63.8484 37.8404 176.4583 89 L 4.5004 7.7656 117.0043 53.1616 42.5070 176.1908 90 K 4.6684 9.0918 118.7662 56.8741 31.9255 176.7418 91 D 4.9403 9.2391 125.5830 55.3001 40.7189 174.9349 92 N 4.9634 8.0508 113.2567 52.4405 39.3666 173.9440 93 W 4.3790 7.9320 126.1443 56.8035 31.5494 175.4074 94 S 4.4642 6.7634 117.6442 55.6037 64.9977 172.9140 95 P 4.8668 0.0000 0.0000 64.1524 31.1663 177.2671 96 A 4.0457 7.3440 120.0858 53.0354 18.7320 177.5990 97 L 4.1805 6.6862 116.0988 53.9314 42.8109 176.3598 98 T 5.3853 7.7514 110.5857 58.2114 73.2261 174.5909 99 I 3.7841 9.7020 121.7391 64.3429 37.7669 178.3581 100 S 4.2077 8.1958 115.7429 61.5671 62.6856 176.5821 101 K 4.0003 8.1145 121.0367 59.2890 31.7126 179.5224 102 V 3.6604 7.9524 118.5694 66.2109 31.4119 178.1995 103 L 4.0219 8.2369 118.7972 57.5751 41.4100 179.3036 104 L 3.9990 8.2627 119.3657 57.9471 41.5785 179.4992 105 S 4.1032 8.3129 113.0094 61.4547 62.2724 176.3132 106 I 3.7222 7.9879 122.5062 64.6128 36.7356 178.0346 107 C 4.0753 8.4006 117.9303 63.0938 27.8852 176.2820 108 S 4.1177 8.3382 114.6403 61.1832 61.7213 175.9032 109 L 4.0773 7.8207 122.3742 58.2167 41.9139 178.7847 110 L 4.1103 7.9471 117.8829 57.7281 41.5034 179.2184 111 T 4.5577 7.4386 115.3197 64.8850 68.8696 174.5384 112 D 4.5440 8.2956 121.1599 52.3299 42.9426 174.8503 113 C 4.3176 8.3600 119.0423 58.1165 30.4438 173.8830 114 N 4.7946 8.0110 117.1548 50.2394 38.4921 173.5471 115 P 4.2447 0.0000 0.0000 64.4252 31.7008 178.0083 116 A 4.1571 7.8183 120.9410 53.5842 19.4190 176.6833 117 D 4.9814 7.5437 114.7186 52.4097 41.0833 174.1496 118 P 4.5113 0.0000 0.0000 62.8485 32.5539 176.3808 119 L 4.4027 8.7956 121.3903 54.9363 44.0365 176.8508 120 V 4.2872 7.3445 117.0312 60.0201 32.8789 175.5477 121 G 3.6348 8.4394 113.5458 47.6976 0.0000 173.2739 122 S 4.1397 7.9856 116.4039 61.1499 62.8912 176.5809 123 I 3.5816 7.5477 122.6114 63.9832 36.7943 177.9033 124 A 3.9053 7.8645 121.6099 55.6120 18.1324 179.6496 125 T 3.8665 8.1542 111.5565 65.1293 67.4043 176.3433 126 Q 3.9534 8.2764 121.6970 59.2761 28.8378 177.5024 127 Y 3.9492 8.0580 119.7626 61.1262 38.8193 177.9454 128 M 4.1636 7.8190 118.6647 58.0576 32.2940 178.1209 129 T 4.3504 8.4253 108.3878 62.4649 71.2668 175.1511 130 N 4.9565 8.3884 120.1226 51.1964 40.1446 174.3096 131 R 3.7504 7.9679 122.3691 59.1484 30.5617 176.9466 132 A 3.9366 7.9879 120.0966 55.4384 18.2502 179.1501 133 E 3.8136 8.0544 116.7855 59.3312 29.5917 178.1519 134 H 4.9239 8.2015 119.7557 59.1107 29.8418 176.9900 135 D 4.2695 8.4441 120.7061 57.0019 40.6154 178.5302 136 R 3.8051 8.0771 119.4930 59.9412 29.9811 178.5045 137 M 3.7163 7.9317 118.0731 58.0444 31.7073 178.6838 138 A 3.9618 7.8280 121.1656 55.1878 18.5609 179.9442 139 R 4.1140 8.0677 118.1949 58.7807 30.0721 179.1017 140 Q 3.9893 8.1166 119.3554 59.1793 29.0765 178.3985 141 W 4.3783 8.7388 120.1127 60.0184 28.9367 178.6934 142 T 4.1859 8.2527 115.9806 66.5592 68.0693 176.6106 143 K 3.9188 8.2088 121.4794 59.5582 32.0670 178.9105 144 R 3.6446 8.1505 118.0876 58.7640 30.0008 177.0836 145 Y 4.8438 8.0782 113.4245 57.3035 40.0794 176.0931 146 A 4.2856 7.5694 123.1762 54.5231 19.6776 176.2615 147 T 4.6836 7.2502 114.5626 64.2520 70.3423 172.3740 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 0 S 8.19 4.50 0.00 4.10 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 1 T 8.37 3.74 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 1.33 0.00 0.00 2 S 8.75 4.34 0.00 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 0.00 3 A 8.00 3.71 1.45 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 0.00 0.00 4 K 8.46 3.83 0.00 1.88 1.86 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.45 7.81 5 R 8.20 3.87 0.00 1.98 2.05 0.00 2.96 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.63 0.00 6 I 7.74 3.35 1.51 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.04 0.40 0.00 0.00 7 Q 8.26 4.01 0.00 2.09 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 8 K 8.24 3.94 0.00 1.91 2.03 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.50 7.81 9 E 8.65 4.11 0.00 2.23 2.14 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 2.43 2.64 0.00 10 L 8.59 4.12 0.00 1.92 1.87 0.32 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 11 A 8.20 3.97 1.38 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 0.00 0.00 0.00 0.00 0.00 0.00 12 E 8.23 3.88 0.00 2.11 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 0.00 2.37 2.36 0.00 13 I 8.00 3.96 2.12 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.29 1.21 0.00 0.00 14 T 7.71 3.99 4.36 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 0.00 0.00 0.00 1.18 0.00 0.00 15 L 7.81 4.26 0.00 1.69 1.92 0.93 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 16 D 7.90 4.80 0.00 2.68 2.56 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 17 P 0.00 4.71 0.00 2.37 2.17 0.00 3.40 0.00 0.00 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 18 P 0.00 4.49 0.00 2.24 2.05 0.00 3.66 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 2.16 2.16 0.00 19 P 0.00 4.28 0.00 2.07 2.03 0.00 3.83 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 20 N 9.28 4.39 0.00 3.01 3.10 0.00 0.00 6.51 7.66 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 21 C 7.82 5.43 0.00 2.99 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 22 S 9.17 4.99 0.00 3.88 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 23 A 7.99 5.03 1.50 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 0.00 0.00 24 G 8.26 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 0.00 0.00 0.00 25 P 0.00 4.78 0.00 1.92 1.93 0.00 3.18 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.66 0.00 26 K 9.20 4.16 0.00 1.76 1.87 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.18 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.50 7.81 27 G 7.24 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.93 4.31 0.00 2.70 2.77 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 29 N 8.05 4.58 0.00 2.86 2.82 0.00 0.00 6.88 7.65 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 30 I 8.39 4.17 1.91 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 1.58 0.94 0.76 0.00 0.00 31 Y 9.01 4.16 0.00 3.23 3.29 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 0.00 32 E 8.57 5.27 0.00 2.03 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 2.47 0.00 33 W 9.39 5.40 0.00 3.21 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 34 R 9.04 5.16 0.00 1.85 1.72 0.00 2.97 0.00 0.00 2.98 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.70 0.00 35 S 9.28 5.15 0.00 3.95 3.63 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 36 T 8.88 5.25 4.35 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 1.27 0.00 0.00 37 I 8.88 5.01 1.88 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 1.24 0.84 0.96 0.00 0.00 38 L 9.07 4.83 0.00 1.57 1.66 0.96 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 39 G 9.03 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 0.00 0.00 0.00 40 P 0.00 4.45 0.00 2.30 2.09 0.00 3.82 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 2.22 2.17 0.00 41 P 0.00 4.39 0.00 2.21 2.11 0.00 3.89 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 2.03 2.01 0.00 42 G 10.88 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 43 S 8.00 4.60 0.00 4.11 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 44 V 8.04 3.60 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 0.87 0.00 0.00 0.04 0.00 0.00 45 Y 7.55 5.03 0.00 3.21 3.28 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 46 E 7.83 4.02 0.00 2.19 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 2.38 2.36 0.00 47 G 9.14 4.02 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 0.00 0.00 0.00 48 G 8.23 3.75 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 0.00 0.00 0.00 49 V 7.92 4.50 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 0.47 0.00 0.00 0.85 0.00 0.00 50 F 9.02 4.69 0.00 2.90 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 51 F 8.81 5.65 0.00 3.04 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 52 L 9.11 5.12 0.00 1.43 1.32 0.55 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 53 D 8.79 5.29 0.00 2.57 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 54 I 8.73 4.85 1.79 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.78 0.01 0.00 0.00 55 T 8.59 4.88 4.14 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 1.32 0.00 0.00 56 F 9.10 4.59 0.00 2.58 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 57 S 8.68 4.58 0.00 4.07 4.02 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 58 P 0.00 4.33 0.00 2.09 2.11 0.00 3.71 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 59 D 7.90 4.77 0.00 2.71 2.91 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 60 Y 8.11 4.31 0.00 3.27 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 61 P 0.00 3.41 0.00 1.95 1.38 0.00 2.20 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.50 0.00 62 F 7.77 4.99 0.00 3.24 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 63 K 7.59 4.65 0.00 1.71 1.58 0.00 1.73 0.00 0.00 1.84 0.00 0.00 3.19 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.44 7.81 64 P 0.00 2.00 0.00 1.68 1.42 0.00 3.55 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.83 0.00 65 P 0.00 4.09 0.00 1.39 0.89 0.00 2.98 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.53 0.00 66 K 8.58 4.14 0.00 1.68 1.54 0.00 1.51 0.00 0.00 1.51 0.00 0.00 2.75 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.32 1.30 7.81 67 V 8.24 4.90 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 0.79 0.00 0.00 0.70 0.00 0.00 68 T 8.53 4.98 4.35 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 1.20 0.00 0.00 69 F 9.21 4.42 0.00 3.02 3.26 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 70 R 9.32 4.13 0.00 2.00 2.12 0.00 3.42 0.00 0.00 3.29 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.82 0.00 71 T 8.11 4.30 4.65 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 1.30 0.00 0.00 72 R 8.69 4.02 0.00 1.16 1.27 0.00 2.21 0.00 0.00 2.31 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.33 0.00 73 I 8.19 4.94 1.85 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 1.03 0.82 0.37 0.00 0.00 74 Y 8.93 4.00 0.00 2.23 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 H 7.60 4.51 0.00 2.94 2.78 0.00 5.73 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 C 8.38 4.12 0.00 3.02 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 77 N 8.23 4.77 0.00 2.70 2.94 0.00 0.00 6.90 7.32 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 78 I 7.44 4.74 1.43 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.18 0.50 0.00 0.00 79 N 8.56 4.75 0.00 2.93 2.93 0.00 0.00 6.29 6.96 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 80 S 8.54 4.19 0.00 4.03 4.10 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 81 Q 8.44 4.24 0.00 2.18 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.01 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 82 G 8.56 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 83 V 7.78 3.96 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 0.97 0.00 0.00 0.92 0.00 0.00 84 I 8.19 4.75 1.89 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 1.38 1.07 0.91 0.00 0.00 85 C 9.27 4.43 0.00 2.90 2.91 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 86 L 8.08 4.55 0.00 1.76 1.44 0.93 1.26 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 87 D 9.22 4.36 0.00 2.75 2.74 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 88 I 7.93 4.00 1.95 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.87 1.01 0.00 0.00 89 L 7.77 4.50 0.00 1.83 1.64 0.90 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 90 K 9.09 4.67 0.00 1.70 0.82 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.81 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.34 1.48 7.81 91 D 9.24 4.94 0.00 2.66 2.66 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 92 N 8.05 4.96 0.00 2.69 2.77 0.00 0.00 7.11 7.95 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 93 W 7.93 4.38 0.00 3.58 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 94 S 6.76 4.46 0.00 3.64 3.28 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 95 P 0.00 4.87 0.00 2.08 2.00 0.00 3.71 0.00 0.00 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.29 0.00 96 A 7.34 4.05 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 97 L 6.69 4.18 0.00 0.27 1.09 0.63 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 98 T 7.75 5.39 4.45 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 1.33 0.00 0.00 99 I 9.70 3.78 1.86 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.40 1.02 0.00 0.00 100 S 8.20 4.21 0.00 3.98 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 0.00 101 K 8.11 4.00 0.00 2.01 1.88 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.57 7.81 102 V 7.95 3.66 2.29 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 1.09 0.00 0.00 1.19 0.00 0.00 103 L 8.24 4.02 0.00 1.78 1.73 1.03 0.70 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 0.00 104 L 8.26 4.00 0.00 1.95 1.75 0.99 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 105 S 8.31 4.10 0.00 4.02 4.08 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 I 7.99 3.72 2.00 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 1.57 0.56 1.01 0.00 0.00 107 C 8.40 4.08 0.00 3.14 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 0.00 108 S 8.34 4.12 0.00 3.91 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 0.00 109 L 7.82 4.08 0.00 1.80 1.85 0.91 0.84 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 0.00 110 L 7.95 4.11 0.00 1.82 1.69 0.78 0.17 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 0.00 111 T 7.44 4.56 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 1.26 0.00 0.00 112 D 8.30 4.54 0.00 2.60 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 0.00 113 C 8.36 4.32 0.00 2.72 2.55 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 0.00 114 N 8.01 4.79 0.00 2.82 2.71 0.00 0.00 6.55 8.03 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 0.00 115 P 0.00 4.24 0.00 2.18 2.13 0.00 3.68 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 116 A 7.82 4.16 1.29 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 0.00 0.00 0.00 117 D 7.54 4.98 0.00 2.58 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 0.00 118 P 0.00 4.51 0.00 2.17 1.99 0.00 3.81 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 1.96 1.92 0.00 119 L 8.80 4.40 0.00 1.46 1.71 0.89 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 120 V 7.34 4.29 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 0.92 0.00 0.00 0.82 0.00 0.00 121 G 8.44 3.63 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 0.00 0.00 0.00 122 S 7.99 4.14 0.00 4.07 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 0.00 123 I 7.55 3.58 1.69 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.18 0.53 0.00 0.00 124 A 7.86 3.91 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 0.00 125 T 8.15 3.87 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 0.00 126 Q 8.28 3.95 0.00 2.35 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.54 0.00 0.00 0.00 0.00 0.00 2.58 2.42 0.00 127 Y 8.06 3.95 0.00 2.84 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 0.00 128 M 7.82 4.16 0.00 1.99 2.25 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.93 2.64 0.00 129 T 8.43 4.35 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 1.28 0.00 0.00 130 N 8.39 4.96 0.00 2.63 2.68 0.00 0.00 6.65 7.66 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 0.00 131 R 7.97 3.75 0.00 1.82 1.76 0.00 3.42 0.00 0.00 2.63 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.63 0.00 132 A 7.99 3.94 1.29 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 0.00 0.00 0.00 133 E 8.05 3.81 0.00 2.10 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 2.30 2.32 0.00 134 H 8.20 4.92 0.00 3.35 3.52 0.00 5.68 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 0.00 135 D 8.44 4.27 0.00 2.68 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 0.00 136 R 8.08 3.81 0.00 1.93 2.00 0.00 3.07 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 137 M 7.93 3.72 0.00 0.51 1.14 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.62 0.00 138 A 7.83 3.96 1.19 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 0.00 0.00 139 R 8.07 4.11 0.00 1.82 1.98 0.00 3.11 0.00 0.00 3.17 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.64 0.00 140 Q 8.12 3.99 0.00 2.21 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.47 2.43 0.00 141 W 8.74 4.38 0.00 3.70 3.72 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 0.00 142 T 8.25 4.19 4.62 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 1.41 0.00 0.00 143 K 8.21 3.92 0.00 1.85 1.96 0.00 1.62 0.00 0.00 1.55 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.42 7.81 144 R 8.15 3.64 0.00 1.67 1.15 0.00 3.02 0.00 0.00 2.79 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.19 0.00 145 Y 8.08 4.84 0.00 3.16 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 0.00 146 A 7.57 4.29 0.62 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 0.00 147 T 7.25 4.68 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 1.19 0.00 0.00