NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 3.9122 8.0176 117.2289 64.7001 69.7487 174.8336 2 T 3.2191 8.5477 113.3145 61.2504 68.0513 170.2435 3 L 3.9925 7.1223 123.4649 55.0495 42.6847 178.8491 4 T 4.0733 8.7053 115.5677 61.6757 70.2242 174.6579 5 N 4.3722 8.4390 117.2574 55.5374 38.6444 175.9816 6 P 4.3301 0.0000 0.0000 65.2202 31.5440 178.5297 7 Q 3.9452 7.8713 116.7830 58.8201 28.5802 178.9346 8 K 3.6740 7.8424 118.9491 59.2100 31.9424 179.3193 9 A 3.9310 7.6455 119.8957 54.9869 18.2315 179.4961 10 A 3.9535 8.0871 119.3480 55.3158 18.3405 179.9468 11 I 3.4070 7.6298 118.2434 64.4687 37.0860 178.8876 12 R 3.9910 7.8757 118.8230 59.5336 29.6932 179.4099 13 S 4.2942 8.2385 114.2641 61.3597 62.9876 176.5597 14 S 4.6931 8.5544 118.7961 60.7124 62.8691 176.4023 15 W 4.5870 9.0954 132.4555 60.0713 30.4217 177.7520 16 S 4.0736 8.4039 113.4891 61.4646 61.5499 176.3710 17 K 3.9149 7.6120 119.7710 59.3594 32.2016 178.8010 18 F 3.8082 7.8797 120.2628 61.5412 39.1593 176.9766 19 M 4.0121 7.7597 116.7623 57.7931 31.7490 177.9625 20 D 4.4960 7.8645 118.6524 56.3643 42.2816 176.4876 21 N 4.9888 7.8863 115.3908 51.2678 39.5848 175.5310 22 G 3.4139 7.9019 109.4304 47.9030 0.0000 174.0802 23 V 3.6783 7.7002 120.9147 65.6667 31.6302 177.9436 24 S 4.0986 7.9748 114.3268 61.8908 62.6280 176.4081 25 N 4.3412 7.7730 120.8132 55.1352 38.0173 177.8615 26 G 4.1100 8.2783 109.1648 47.3518 0.0000 175.6848 27 Q 4.1789 8.2526 120.7179 58.8360 28.7831 179.3256 28 G 3.6315 8.0291 106.5515 47.5554 0.0000 175.2689 29 F 3.6530 7.6443 123.1003 61.3009 39.2934 176.7342 30 Y 2.9314 7.3632 116.0349 60.9600 37.5283 178.8119 31 M 3.9834 7.8143 119.3579 58.3173 31.9504 178.4395 32 D 4.3187 7.9690 118.9942 57.2923 41.0002 178.6933 33 L 3.7598 7.4833 120.9441 58.2569 42.0449 179.1181 34 F 4.6221 8.2936 117.9730 60.1909 38.5070 177.7861 35 K 3.9262 7.9532 118.6928 59.5779 32.1881 178.5832 36 A 4.2287 8.0782 119.8773 54.0052 19.7717 177.4259 37 H 4.8853 8.5157 114.4469 52.7376 29.6888 172.2563 38 P 5.0970 0.0000 0.0000 64.2795 31.5901 177.4969 39 E 4.1006 8.3131 116.5091 59.0219 29.2818 178.6279 40 T 4.2239 8.1046 110.0445 64.0255 69.0870 176.0022 41 L 3.8847 8.1438 122.7557 57.7617 41.5148 179.2288 42 T 3.8521 7.9400 115.9946 66.2748 68.2644 174.7969 43 P 4.2990 0.0000 0.0000 64.6718 31.5396 177.5431 44 F 4.3237 7.9471 115.9281 57.3459 38.7636 176.9801 45 K 3.8951 7.9441 122.0653 59.6727 31.7053 178.5202 46 S 4.0339 7.8672 111.4682 61.3459 62.4650 174.9443 47 L 4.0414 7.5826 121.4134 58.0192 42.2523 177.7988 48 F 4.9028 8.6657 117.3700 57.9332 40.9732 180.0408 49 G 3.9562 8.7432 107.8762 46.7208 0.0000 174.7716 50 G 4.1692 9.1856 105.9961 45.1288 0.0000 173.4064 51 L 4.8226 7.6963 119.4229 52.5834 43.8725 177.3071 52 T 4.1900 9.1479 113.1061 60.8733 69.9197 175.4417 53 L 3.7408 8.6496 122.5313 58.1783 41.7675 179.9079 54 A 3.9874 7.5532 119.0192 54.4332 18.3692 177.9790 55 Q 4.4525 7.5623 111.7901 55.9773 29.3241 176.7550 56 L 3.7176 7.6706 120.8402 57.8923 41.7064 177.4272 57 Q 4.0394 7.8090 118.7345 57.7495 28.9681 176.1460 58 D 4.5718 9.7729 124.2156 54.8583 39.6724 174.4845 59 N 4.4977 7.9263 118.5080 52.7586 40.8421 173.6723 60 P 4.2803 0.0000 0.0000 65.7775 31.4244 179.2211 61 K 4.0664 8.7181 117.6357 59.7192 31.9331 179.0729 62 M 4.3285 8.0646 117.9985 58.4036 32.1565 178.2848 63 K 4.0239 8.5572 119.1345 59.2203 32.2024 179.1864 64 A 4.0412 8.3002 121.2649 55.0913 18.2553 179.4291 65 Q 4.0012 8.1354 118.0402 59.3924 29.2803 178.3177 66 S 4.5057 8.4570 114.3920 61.5387 62.3574 175.7044 67 L 4.0884 8.3589 123.1907 58.6447 41.7623 179.5284 68 V 3.7205 8.1871 112.1620 64.0466 31.3819 178.2713 69 F 4.2042 8.7502 120.7633 61.7411 39.2940 176.9873 70 C 4.3564 8.7922 116.5523 63.0850 27.9339 175.9707 71 N 4.5858 8.7270 118.5499 56.0137 37.9395 177.8433 72 G 3.2268 8.0751 107.2670 47.9745 0.0000 175.6696 73 M 3.2988 7.5468 122.2565 57.7749 31.8504 179.0938 74 S 4.1076 8.4377 115.8209 61.5404 62.7739 176.7578 75 S 4.3009 7.8366 116.1805 61.5284 62.6634 176.5767 76 F 4.6924 7.4671 121.2336 60.4268 38.6373 177.8644 77 V 3.3352 7.6712 116.5991 66.1808 31.3832 177.4653 78 D 4.5288 8.5332 116.4619 55.9359 40.9432 176.5018 79 H 4.9473 7.7738 117.2181 55.1979 29.6276 176.0764 80 L 3.8187 8.0699 121.9028 57.5305 41.4981 177.8841 81 D 4.6818 7.8657 115.8041 54.0167 41.1397 176.3826 82 D 4.7247 7.7888 120.6028 51.1819 41.3646 175.2317 83 N 4.2455 8.3341 122.1090 56.2410 39.3605 175.5550 84 D 4.3608 8.0209 119.8443 57.5281 40.9919 178.3116 85 M 4.0085 8.0552 118.8346 58.3976 32.2220 177.8834 86 L 3.9795 8.0892 120.6650 58.2842 42.1917 179.1657 87 V 3.4881 7.9406 118.0692 65.9385 31.3900 178.1205 88 V 3.4418 7.5994 117.4742 65.9294 31.4784 177.9652 89 L 4.0564 7.9755 118.6693 57.9529 41.4074 179.6536 90 I 3.5155 7.7408 119.7543 64.3511 36.9325 178.5461 91 Q 3.5012 7.9868 119.0100 58.6707 27.9000 178.9818 92 K 3.9574 8.3015 119.9731 59.5591 32.0296 179.0711 93 M 4.1923 8.0550 118.0755 58.2782 32.2030 178.1416 94 A 4.0764 8.3292 121.3897 55.0439 18.6356 179.5223 95 K 4.0421 8.3654 118.1914 59.8105 32.1147 179.0768 96 L 4.0541 7.5259 117.4932 58.0858 41.7895 178.8493 97 H 4.3625 8.2755 115.7207 58.3707 28.6954 177.2121 98 N 4.3353 8.8698 119.4636 56.8132 38.5450 176.5828 99 N 4.3298 8.1464 116.8441 55.8292 38.6818 176.5212 100 R 4.3408 7.7327 117.1067 55.7677 30.6282 177.3197 101 G 3.9155 8.0268 107.4471 45.2907 0.0000 173.4925 102 I 4.0305 7.3921 120.4396 60.5626 38.2254 176.2327 103 R 4.3879 8.7955 124.8349 55.2144 32.5061 177.0715 104 A 4.0830 8.5467 125.2297 55.3623 18.3793 180.2831 105 S 4.2225 8.0845 112.3100 61.7047 63.0173 176.4404 106 D 4.3599 7.9687 121.9389 57.1892 40.7102 178.5216 107 L 4.0133 7.9033 119.2594 57.5780 41.6409 179.4052 108 R 4.0801 8.6044 119.0550 59.9703 30.0794 178.4147 109 T 3.8804 7.9977 115.1205 66.8742 68.3962 176.2553 110 A 4.1032 8.0990 122.3244 55.4707 18.2968 179.2688 111 Y 4.0888 8.0888 115.1911 61.2856 37.9315 178.5195 112 D 4.4819 8.3031 119.7504 57.5900 40.8934 178.9464 113 I 3.8688 8.0399 120.2517 64.2496 37.0083 178.3026 114 L 4.1533 8.3948 121.4195 58.2204 41.8754 178.9676 115 I 3.5023 8.0862 120.0757 64.7073 36.9991 177.8582 116 H 4.1295 8.4106 118.9458 59.2755 29.2734 176.3960 117 Y 4.0040 8.5423 121.7485 61.2156 38.5599 178.1578 118 M 4.1404 8.4857 119.5021 58.4698 31.9339 178.6004 119 E 3.9322 8.3198 118.6564 59.7215 29.4738 179.3203 120 D 4.2405 8.0801 117.6912 56.7326 40.7763 177.5086 121 H 4.4560 7.4616 114.4216 54.3826 29.3735 174.5364 122 N 4.1964 7.5614 116.5119 54.8904 36.0299 175.0132 123 H 4.6389 8.8656 116.0189 57.1088 29.7238 175.4962 124 M 4.5862 7.8749 118.8912 54.1607 31.4530 176.5992 125 V 3.9871 8.2269 119.3141 60.7557 33.1823 175.8525 126 G 4.2170 8.3903 108.9395 45.2232 0.0000 175.7751 127 G 3.9157 8.3137 108.2196 44.1068 0.0000 174.1839 128 A 4.1613 9.1820 129.7203 55.0481 18.7479 179.2330 129 K 4.0185 8.1569 117.7779 60.0079 32.5345 178.4997 130 D 4.4199 8.2621 118.3489 57.3309 40.7434 178.6242 131 A 3.9721 7.8308 120.7902 55.0708 18.3826 179.6786 132 W 4.1858 8.8984 117.8191 59.9933 29.1007 178.5268 133 E 4.0993 8.6733 118.6379 59.5305 28.8725 179.6815 134 V 3.6320 7.8130 117.7886 65.8224 31.5276 177.8380 135 F 4.3529 8.3806 120.4728 61.5417 39.1924 177.3402 136 V 3.1026 8.3386 118.4170 65.4508 31.2533 177.9845 137 G 3.7045 8.2204 105.7287 47.8704 0.0000 175.3547 138 F 4.0245 8.3741 123.4497 60.9227 39.4029 177.0546 139 I 3.2045 7.7439 119.7143 64.6420 36.7442 178.1991 140 C 4.0833 8.1384 117.6279 62.2370 27.9306 176.0819 141 K 3.8416 7.9365 121.4313 59.5827 31.7597 179.0249 142 T 3.5959 7.4460 115.9909 66.4557 68.2218 176.5277 143 L 4.0524 7.8762 120.9603 57.7654 41.6856 179.8779 144 G 3.5808 8.1680 105.5859 47.8947 0.0000 175.2561 145 D 4.3637 7.9416 120.5378 57.2814 41.1676 178.2000 146 Y 4.2132 8.0297 119.7654 61.0784 38.7349 177.8218 147 M 4.0564 8.4538 119.8647 58.1767 31.7451 178.7774 148 K 3.8982 7.8089 118.0989 59.6807 32.3093 178.8843 149 E 4.0075 7.7407 117.5955 59.0813 29.3813 178.9521 150 L 4.0943 7.6098 119.9225 57.3668 41.9300 178.1538 151 S 4.4163 7.3728 123.0490 60.5966 62.3570 178.7747 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 T 8.02 3.91 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 1.22 0.00 0.00 2 T 8.55 3.22 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 1.20 0.00 0.00 3 L 7.12 3.99 0.00 1.41 1.48 0.51 1.17 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 4 T 8.71 4.07 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 1.20 0.00 0.00 5 N 8.44 4.37 0.00 2.70 2.84 0.00 0.00 6.84 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 6 P 0.00 4.33 0.00 2.12 2.06 0.00 3.55 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 2.08 2.13 0.00 7 Q 7.87 3.95 0.00 2.16 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 8 K 7.84 3.67 0.00 1.68 1.64 0.00 1.52 0.00 0.00 1.54 0.00 0.00 2.72 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.15 1.46 7.81 9 A 7.65 3.93 1.33 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 10 A 8.09 3.95 1.44 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 0.00 0.00 11 I 7.63 3.41 1.47 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.31 0.29 -0.03 0.00 0.00 12 R 7.88 3.99 0.00 2.03 1.99 0.00 3.06 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 13 S 8.24 4.29 0.00 3.97 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 0.00 14 S 8.55 4.69 0.00 4.48 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 15 W 9.10 4.59 0.00 3.78 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 16 S 8.40 4.07 0.00 4.00 4.16 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 17 K 7.61 3.91 0.00 1.91 1.84 0.00 2.04 0.00 0.00 1.85 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.66 7.81 18 F 7.88 3.81 0.00 2.86 2.28 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 19 M 7.76 4.01 0.00 1.90 1.96 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 1.51 0.00 20 D 7.86 4.50 0.00 2.78 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 21 N 7.89 4.99 0.00 2.57 2.58 0.00 0.00 6.74 7.03 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 22 G 7.90 3.41 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 0.00 23 V 7.70 3.68 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 1.10 0.00 0.00 0.99 0.00 0.00 24 S 7.97 4.10 0.00 3.94 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 N 7.77 4.34 0.00 1.44 1.42 0.00 0.00 6.46 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 26 G 8.28 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 27 Q 8.25 4.18 0.00 2.29 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.42 2.65 0.00 28 G 8.03 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 29 F 7.64 3.65 0.00 2.56 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 30 Y 7.36 2.93 0.00 2.85 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 0.00 0.00 0.00 31 M 7.81 3.98 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.89 0.00 32 D 7.97 4.32 0.00 2.96 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 33 L 7.48 3.76 0.00 0.83 0.97 0.88 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 34 F 8.29 4.62 0.00 3.02 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 35 K 7.95 3.93 0.00 1.87 2.00 0.00 1.81 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.46 7.81 36 A 8.08 4.23 1.21 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 37 H 8.52 4.89 0.00 3.27 3.47 0.00 5.63 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 P 0.00 5.10 0.00 2.18 2.13 0.00 3.92 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.02 0.00 39 E 8.31 4.10 0.00 2.19 2.26 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 2.43 2.36 0.00 40 T 8.10 4.22 4.59 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 1.37 0.00 0.00 41 L 8.14 3.88 0.00 1.78 1.59 0.84 -0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 42 T 7.94 3.85 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 43 P 0.00 4.30 0.00 1.63 1.92 0.00 3.88 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.13 0.00 44 F 7.95 4.32 0.00 3.14 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 K 7.94 3.90 0.00 1.94 1.80 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.47 7.81 46 S 7.87 4.03 0.00 3.85 3.80 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 47 L 7.58 4.04 0.00 1.45 1.32 0.90 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 48 F 8.67 4.90 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 49 G 8.74 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 50 G 9.19 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 51 L 7.70 4.82 0.00 1.64 1.49 0.92 0.64 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 52 T 9.15 4.19 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 1.24 0.00 0.00 53 L 8.65 3.74 0.00 1.71 1.73 0.80 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 54 A 7.55 3.99 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 55 Q 7.56 4.45 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.90 0.00 0.00 0.00 0.00 0.00 2.48 2.25 0.00 56 L 7.67 3.72 0.00 1.48 1.32 0.49 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 57 Q 7.81 4.04 0.00 1.94 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.01 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 58 D 9.77 4.57 0.00 2.82 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 N 7.93 4.50 0.00 2.94 2.69 0.00 0.00 7.15 7.23 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 60 P 0.00 4.28 0.00 2.22 2.13 0.00 3.66 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 61 K 8.72 4.07 0.00 2.08 2.08 0.00 1.76 0.00 0.00 1.97 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.53 1.51 7.81 62 M 8.06 4.33 0.00 2.21 1.86 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.77 0.00 63 K 8.56 4.02 0.00 1.86 1.88 0.00 1.74 0.00 0.00 1.66 0.00 0.00 3.08 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.64 7.81 64 A 8.30 4.04 1.44 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 0.00 0.00 65 Q 8.14 4.00 0.00 2.30 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.72 0.00 0.00 0.00 0.00 0.00 1.96 2.17 0.00 66 S 8.46 4.51 0.00 4.10 4.16 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 67 L 8.36 4.09 0.00 1.94 1.93 0.99 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 68 V 8.19 3.72 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 0.80 0.00 0.00 1.19 0.00 0.00 69 F 8.75 4.20 0.00 3.50 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 70 C 8.79 4.36 0.00 3.38 3.17 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 71 N 8.73 4.59 0.00 2.88 2.88 0.00 0.00 6.92 8.02 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 72 G 8.08 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 0.00 0.00 0.00 73 M 7.55 3.30 0.00 0.75 1.50 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.44 0.00 74 S 8.44 4.11 0.00 3.99 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 S 7.84 4.30 0.00 4.05 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 76 F 7.47 4.69 0.00 3.07 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 77 V 7.67 3.34 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.50 0.00 0.00 78 D 8.53 4.53 0.00 2.66 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 79 H 7.77 4.95 0.00 3.33 3.27 0.00 5.82 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 L 8.07 3.82 0.00 1.41 1.45 0.41 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 81 D 7.87 4.68 0.00 2.59 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 82 D 7.79 4.72 0.00 2.64 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 83 N 8.33 4.25 0.00 2.69 2.75 0.00 0.00 7.08 8.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 D 8.02 4.36 0.00 2.72 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 85 M 8.06 4.01 0.00 2.12 2.14 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.46 0.00 86 L 8.09 3.98 0.00 2.00 1.88 0.97 0.79 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 87 V 7.94 3.49 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 0.94 0.00 0.00 1.09 0.00 0.00 88 V 7.60 3.44 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 1.00 0.00 0.00 0.92 0.00 0.00 89 L 7.98 4.06 0.00 2.04 2.04 0.99 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 90 I 7.74 3.52 1.68 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 0.08 -0.10 0.60 0.00 0.00 91 Q 7.99 3.50 0.00 1.73 0.88 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 1.63 2.15 0.00 92 K 8.30 3.96 0.00 2.02 1.88 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.46 7.81 93 M 8.05 4.19 0.00 2.42 2.31 0.00 0.00 0.00 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.89 0.00 94 A 8.33 4.08 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 95 K 8.37 4.04 0.00 2.14 1.93 0.00 1.83 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.58 7.81 96 L 7.53 4.05 0.00 1.71 1.70 0.95 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 97 H 8.28 4.36 0.00 3.29 3.40 0.00 5.82 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 N 8.87 4.34 0.00 2.94 2.99 0.00 0.00 7.12 6.58 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 99 N 8.15 4.33 0.00 3.00 2.86 0.00 0.00 7.03 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 0.00 100 R 7.73 4.34 0.00 1.91 1.87 0.00 2.97 0.00 0.00 3.01 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.79 0.00 101 G 8.03 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 0.00 102 I 7.39 4.03 2.08 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.58 0.97 0.00 0.00 103 R 8.80 4.39 0.00 1.90 1.92 0.00 3.11 0.00 0.00 3.18 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.64 0.00 104 A 8.55 4.08 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 0.00 105 S 8.08 4.22 0.00 4.08 4.16 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 0.00 106 D 7.97 4.36 0.00 2.90 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 0.00 107 L 7.90 4.01 0.00 1.95 1.80 0.95 0.63 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 0.00 108 R 8.60 4.08 0.00 1.93 2.17 0.00 3.29 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.79 0.00 109 T 8.00 3.88 4.37 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 0.92 0.00 0.00 110 A 8.10 4.10 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 0.00 111 Y 8.09 4.09 0.00 3.28 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 0.00 112 D 8.30 4.48 0.00 3.02 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 I 8.04 3.87 2.22 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.04 0.95 0.00 0.00 114 L 8.39 4.15 0.00 1.38 1.82 0.53 1.01 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 0.00 115 I 8.09 3.50 2.08 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.56 1.00 0.00 0.00 116 H 8.41 4.13 0.00 3.41 3.56 0.00 5.80 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 Y 8.54 4.00 0.00 3.38 3.34 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 0.00 118 M 8.49 4.14 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.95 3.02 0.00 119 E 8.32 3.93 0.00 2.13 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 2.35 2.45 0.00 120 D 8.08 4.24 0.00 2.47 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 0.00 121 H 7.46 4.46 0.00 2.53 2.96 0.00 6.00 0.00 0.00 0.00 0.00 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 N 7.56 4.20 0.00 2.80 2.90 0.00 0.00 6.85 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 0.00 123 H 8.87 4.64 0.00 3.36 3.45 0.00 5.62 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 M 7.87 4.59 0.00 2.11 2.10 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.69 0.00 125 V 8.23 3.99 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 0.79 0.00 0.00 1.03 0.00 0.00 126 G 8.39 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 0.00 0.00 0.00 0.00 127 G 8.31 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 0.00 128 A 9.18 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 129 K 8.16 4.02 0.00 1.93 1.91 0.00 1.84 0.00 0.00 1.88 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.60 1.71 7.81 130 D 8.26 4.42 0.00 2.85 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 0.00 131 A 7.83 3.97 1.32 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 0.00 0.00 132 W 8.90 4.19 0.00 3.66 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 0.00 133 E 8.67 4.10 0.00 2.21 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 2.69 2.56 0.00 134 V 7.81 3.63 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 1.08 0.00 0.00 1.03 0.00 0.00 135 F 8.38 4.35 0.00 2.88 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 0.00 136 V 8.34 3.10 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 1.01 0.00 0.00 0.90 0.00 0.00 137 G 8.22 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 F 8.37 4.02 0.00 3.15 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 0.00 139 I 7.74 3.20 1.31 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 0.85 -0.10 0.45 0.00 0.00 140 C 8.14 4.08 0.00 2.95 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 0.00 141 K 7.94 3.84 0.00 1.80 1.71 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.31 1.41 7.81 142 T 7.45 3.60 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 0.94 0.00 0.00 143 L 7.88 4.05 0.00 1.81 1.73 1.04 0.82 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 0.00 144 G 8.17 3.58 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 0.00 0.00 0.00 145 D 7.94 4.36 0.00 2.82 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 0.00 146 Y 8.03 4.21 0.00 3.08 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 0.00 147 M 8.45 4.06 0.00 2.09 2.12 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 2.89 2.66 0.00 148 K 7.81 3.90 0.00 1.92 1.84 0.00 1.69 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.69 7.81 149 E 7.74 4.01 0.00 1.74 1.82 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 2.28 2.49 0.00 150 L 7.61 4.09 0.00 1.62 1.61 0.92 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 151 S 7.37 4.42 0.00 3.66 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