NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.6818 8.2893 120.3274 55.4375 33.6602 174.4800 2 D 4.7347 8.6993 120.8478 49.8528 44.1769 172.8086 3 E 3.9214 9.5891 120.1944 59.6904 29.6793 179.7547 4 I 3.6675 7.8242 118.9738 64.7114 37.2549 177.7160 5 D 4.3930 8.7647 119.8427 57.4975 40.6544 178.9736 6 L 3.9980 7.8214 118.8728 58.0945 41.4058 179.9096 7 R 4.0773 7.9743 117.6843 59.1247 29.8527 179.3275 8 I 3.7673 7.7652 119.6836 64.4357 37.1292 178.4789 9 L 3.9709 8.3553 120.2829 57.6505 41.2008 179.3807 10 K 3.8842 8.3742 119.0618 59.5116 32.2522 178.7180 11 I 4.1068 7.6031 119.7908 64.5077 36.0941 178.3943 12 L 4.2726 8.2625 120.1106 57.7289 41.1649 179.5562 13 Q 4.0551 8.1632 116.9716 58.6358 28.5036 177.6905 14 Y 4.4842 7.0561 115.1189 58.4866 38.6092 175.4406 15 N 4.7089 8.2775 119.1851 51.9926 40.9721 173.7987 16 A 4.4215 8.6691 128.7245 53.1533 19.3579 177.0085 17 K 4.3617 7.7977 114.3942 57.0531 32.9972 176.6858 18 Y 4.5093 7.7416 117.0732 58.3416 39.1259 175.3074 19 S 4.8316 8.6787 116.2598 56.7875 65.6911 175.0031 20 L 3.9645 8.4961 123.6840 58.5458 41.3167 179.3284 21 D 4.3942 8.1758 117.7731 57.6628 40.9274 178.4747 22 E 3.9081 8.0847 118.0990 59.7884 29.5470 179.8724 23 I 3.5904 8.2734 119.5870 64.0862 37.1043 178.1899 24 A 3.9633 9.2347 122.0319 55.3859 18.0009 179.7046 25 R 3.7839 8.0677 116.1050 59.5071 30.1844 178.0313 26 E 4.0253 7.7486 118.0132 58.8695 29.7669 178.0954 27 I 3.9594 8.0485 118.0589 60.6878 38.5164 175.4478 28 R 3.8239 8.1755 118.0407 56.4989 27.2561 175.0940 29 I 4.6716 7.1006 108.6357 57.4659 41.3332 173.8694 30 P 4.3242 0.0000 0.0000 62.5503 32.6964 177.6129 31 K 3.9347 8.7218 122.9071 59.7057 32.2803 179.2746 32 S 4.1547 8.0219 114.0952 61.5126 62.9358 176.6190 33 T 3.9242 7.7193 118.9361 66.3071 68.2892 176.0330 34 L 3.9403 8.0417 122.3378 58.5603 42.1344 178.8281 35 S 4.0758 8.3654 113.0270 61.6296 62.0673 175.7293 36 Y 4.0286 7.9411 121.7982 60.8201 38.5996 177.9214 37 R 3.6788 8.3923 119.3637 59.3544 30.2860 179.1646 38 I 3.7079 8.0153 119.6788 64.3583 37.0847 178.6561 39 K 4.2485 7.8716 120.6198 58.6238 31.7203 179.3804 40 K 3.7340 7.8707 120.1886 59.5096 32.1643 178.8622 41 L 3.9116 8.1271 119.5832 57.7383 40.9219 179.6137 42 E 4.2772 7.9577 119.5626 58.9304 29.3182 179.3599 43 K 3.9723 7.9004 117.0626 59.3580 32.1943 178.2879 44 D 4.6361 8.2198 116.7553 54.2373 41.1033 177.4616 45 G 3.9011 7.9086 107.9969 45.5225 0.0000 175.0802 46 V 3.5625 7.8488 119.8728 65.4661 31.7044 176.3247 47 I 4.0872 7.4981 122.2953 59.9633 37.4574 176.3804 48 K 4.0784 8.2401 125.0204 56.5223 32.8640 176.4376 49 G 3.6332 6.3200 104.7999 45.6810 0.0000 171.1842 50 Y 4.3597 8.1364 115.7266 56.1981 41.0246 174.7563 51 Y 5.1117 8.3252 120.8489 56.0258 41.5051 174.6380 52 A 4.4500 8.5168 124.5632 51.2139 19.9859 176.5766 53 Y 4.5185 8.6056 124.6087 56.6571 38.8197 174.4074 54 I 4.0156 7.6120 128.3540 59.1289 39.0903 175.1233 55 N 4.1588 8.1124 123.6622 52.3480 39.2175 173.8365 56 P 4.2056 0.0000 0.0000 65.2826 31.2409 178.3774 57 A 3.9782 8.1635 119.4399 55.4637 18.1324 179.5500 58 S 3.8785 7.5939 111.8389 61.1343 62.8822 176.0293 59 L 4.4676 7.4592 118.4533 53.6037 41.9706 175.8987 60 N 4.3107 8.6903 116.3669 54.4308 36.3651 174.1805 61 L 4.8385 7.8253 120.1568 54.3805 39.8423 176.1944 62 D 4.6678 8.6337 121.5324 54.4401 42.9679 176.0480 63 Y 4.2858 8.6321 121.7591 56.1668 38.6118 172.8293 64 I 4.7817 7.6735 125.1122 59.6730 39.4568 174.8783 65 V 4.7905 8.4927 119.0637 59.5508 36.4209 174.7791 66 I 4.7430 8.5382 123.1111 60.0410 40.5565 174.4893 67 T 5.2734 9.2808 124.6612 61.6520 71.6065 173.4753 68 S 5.2279 9.0529 121.1970 57.1211 65.6982 173.2812 69 V 4.8691 9.0832 122.6305 61.2550 34.6444 174.0435 70 K 4.9301 9.3612 128.1699 55.2515 33.5133 175.8177 71 A 4.9247 8.7156 127.2328 50.9914 19.9055 176.9771 72 K 4.3794 9.3515 122.7745 56.4080 32.7993 177.1056 73 Y 4.2172 9.1928 122.5233 56.9071 38.8183 175.5408 74 G 4.2401 8.7446 117.1517 45.0853 0.0000 172.2610 75 K 3.8148 8.5934 123.3647 56.9743 31.7325 176.8727 76 N 4.2469 9.2184 117.9127 51.7110 35.6297 172.2484 77 A 4.0513 7.8506 121.5487 56.3993 18.2326 180.3669 78 H 4.2810 8.2293 116.9680 59.6513 28.8190 178.7773 79 V 3.6656 7.6817 120.7128 65.9854 31.6269 179.6854 80 E 4.1635 8.3456 119.8549 59.2896 29.4072 179.2188 81 L 3.9462 8.0181 120.2984 58.0686 42.0217 178.9491 82 G 3.1693 7.8638 105.4642 48.0384 0.0000 175.3698 83 N 4.3442 7.6301 118.7082 55.5188 38.3956 177.4951 84 K 4.0846 7.8894 119.9165 59.2866 31.9778 179.4027 85 L 3.9629 7.8906 119.1580 57.6457 41.2875 179.3905 86 A 4.0219 7.8619 119.9447 54.2242 18.3657 178.5763 87 Q 4.3443 7.3393 112.7738 55.4854 29.7544 175.9439 88 I 3.9802 7.1396 124.0900 60.2794 37.8174 173.7522 89 P 4.5171 0.0000 0.0000 64.2911 31.7811 176.3254 90 G 3.7797 9.1917 111.2672 45.1726 0.0000 173.0608 91 V 4.2253 7.5097 119.9726 62.1662 31.5721 175.2660 92 W 4.8148 8.4919 124.2998 56.3262 29.9929 176.2437 93 G 3.7240 7.0622 107.7218 44.2797 0.0000 171.7333 94 V 4.8206 7.5597 123.1161 61.2695 34.6158 173.9637 95 Y 5.0217 9.1725 124.4843 56.2778 42.3995 173.8082 96 F 4.9185 9.0921 124.9161 56.7145 41.1184 175.0501 97 V 4.4715 7.8468 118.5714 59.4546 35.8463 174.4312 98 L 4.7698 8.7848 121.5660 53.6709 42.7222 174.3774 99 G 3.7163 8.2607 116.9630 46.6023 0.0000 175.4751 100 D 4.3806 7.8045 123.3542 53.0506 40.9396 178.1877 101 N 4.6278 8.2948 112.8951 53.6190 36.5054 172.4058 102 D 4.4830 6.8083 117.8937 52.5535 43.3576 174.1593 103 F 5.5021 8.7856 115.8059 56.4148 42.1664 174.8752 104 I 4.9741 9.2626 123.5103 59.5681 39.9577 174.6027 105 V 4.7970 9.2723 127.5603 61.3170 34.2984 173.8672 106 M 4.7330 8.5652 127.7367 53.6261 33.7624 175.0808 107 A 5.1614 8.4950 124.3220 50.4572 23.5894 174.6406 108 R 4.9694 8.2016 116.9012 55.0475 34.2773 174.5762 109 Y 4.9889 8.6404 118.7784 56.7781 42.7022 176.5783 110 K 4.8306 9.6414 120.5045 58.8281 32.4609 177.9516 111 T 4.7110 7.5162 107.1684 58.7513 73.3262 174.5681 112 R 2.5100 7.8350 119.6948 59.1554 29.9044 177.8560 113 E 3.8483 7.9723 117.7146 59.4831 29.4303 178.7579 114 E 3.8448 7.8992 118.5955 59.2254 29.6383 178.4876 115 F 3.3125 8.2475 120.8428 61.3607 39.4449 176.9299 116 M 3.5676 8.3993 118.2789 58.1950 31.5749 178.3446 117 E 3.7415 8.0155 118.0992 59.2984 29.9696 178.7654 118 K 4.0369 7.8572 117.3030 59.6690 32.4357 177.9562 119 F 4.1576 7.7606 120.4054 59.3090 39.4809 177.0171 120 L 3.6772 6.9241 118.5647 58.5828 41.8552 179.0912 121 E 3.8078 8.2324 117.9180 59.6666 29.6596 179.4131 122 R 3.8835 7.5692 117.8650 59.3443 30.1580 178.6005 123 V 3.3852 7.5772 118.3286 65.9337 31.2733 177.3061 124 M 4.3134 7.9578 116.2216 56.5172 31.8613 176.8097 125 S 4.5644 7.4158 112.9178 58.3623 64.7009 174.9540 126 I 3.7392 7.1815 122.5516 60.7179 37.4298 173.9277 127 P 4.3178 0.0000 0.0000 66.0736 31.5069 178.0451 128 E 4.1886 8.1282 116.2305 58.2218 30.3620 176.1537 129 V 4.3538 7.4996 120.5489 62.5927 31.8275 174.8786 130 E 4.4708 9.7018 129.8561 58.0861 30.4898 175.9845 131 R 4.9623 7.6900 116.2484 55.2451 34.9353 173.8162 132 T 5.2313 8.3582 109.9270 60.3385 72.4332 173.3546 133 S 4.5680 9.2151 117.5631 57.2787 65.5407 172.5012 134 T 4.9371 8.7397 124.3002 62.3066 70.1648 174.1992 135 Q 4.5158 9.0675 125.9946 54.0342 31.0867 174.9797 136 V 3.9861 8.2117 125.1226 61.9703 32.2319 175.6116 137 V 3.7474 8.3924 129.7948 63.1653 31.2810 176.2034 138 V 4.0941 8.3806 120.7151 61.3716 32.5592 176.1064 139 K 4.2479 7.5773 119.6796 55.4619 34.7593 174.4988 140 I 4.2887 8.2546 127.8371 59.9169 37.0934 175.5231 141 I 3.9720 8.2646 127.4588 63.5168 37.5127 176.7842 142 K 4.3427 7.6237 117.0346 55.7858 34.5572 174.9048 143 E 4.5947 8.4419 126.3290 55.5965 30.9528 174.4361 144 S 4.6829 8.0127 123.6138 55.7568 63.5589 173.5963 145 P 4.3887 0.0000 0.0000 65.3614 31.6949 178.3760 146 N 4.2322 7.9538 115.5522 55.1415 37.2606 174.9900 147 I 3.7943 7.2925 119.7621 60.4581 35.7695 175.5489 148 V 4.1908 8.0905 118.0622 61.0072 32.7638 176.3023 149 I 4.4255 8.0412 120.9936 59.5696 38.1990 175.6053 150 F 4.2937 9.0133 123.3537 57.5322 38.9633 176.0996 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 8.29 4.68 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.53 0.00 2 D 8.70 4.73 0.00 2.89 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 3 E 9.59 3.92 0.00 2.03 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 2.39 2.38 0.00 4 I 7.82 3.67 2.11 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.80 0.93 0.00 0.00 5 D 8.76 4.39 0.00 2.80 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 6 L 7.82 4.00 0.00 1.96 1.74 0.94 0.73 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 7 R 7.97 4.08 0.00 2.05 1.98 0.00 3.36 0.00 0.00 3.20 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.94 0.00 8 I 7.77 3.77 2.04 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.87 0.94 0.00 0.00 9 L 8.36 3.97 0.00 1.78 1.69 0.90 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 10 K 8.37 3.88 0.00 1.87 2.04 0.00 1.85 0.00 0.00 1.75 0.00 0.00 3.09 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.61 1.58 7.81 11 I 7.60 4.11 2.09 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 1.53 0.59 1.03 0.00 0.00 12 L 8.26 4.27 0.00 1.73 1.84 1.04 1.12 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 13 Q 8.16 4.06 0.00 2.16 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.85 0.00 0.00 0.00 0.00 0.00 2.24 1.59 0.00 14 Y 7.06 4.48 0.00 3.21 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 15 N 8.28 4.71 0.00 2.48 2.44 0.00 0.00 7.29 7.97 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 16 A 8.67 4.42 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 17 K 7.80 4.36 0.00 1.80 1.83 0.00 1.50 0.00 0.00 1.64 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.25 7.81 18 Y 7.74 4.51 0.00 3.04 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 S 8.68 4.83 0.00 4.08 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 20 L 8.50 3.96 0.00 1.71 1.80 0.93 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 21 D 8.18 4.39 0.00 2.77 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 22 E 8.08 3.91 0.00 2.30 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 23 I 8.27 3.59 1.86 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 1.35 0.81 0.89 0.00 0.00 24 A 9.23 3.96 1.43 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 0.00 0.00 25 R 8.07 3.78 0.00 1.87 2.12 0.00 3.24 0.00 0.00 3.13 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 26 E 7.75 4.03 0.00 2.06 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 2.24 2.25 0.00 27 I 8.05 3.96 1.91 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 1.50 0.78 0.91 0.00 0.00 28 R 8.18 3.82 0.00 1.95 2.00 0.00 3.13 0.00 0.00 3.26 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.53 0.00 29 I 7.10 4.67 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.52 0.98 0.00 0.00 30 P 0.00 4.32 0.00 2.19 2.02 0.00 3.61 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 2.11 2.14 0.00 31 K 8.72 3.93 0.00 1.82 1.81 0.00 1.72 0.00 0.00 1.97 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.51 7.81 32 S 8.02 4.15 0.00 4.10 4.12 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 33 T 7.72 3.92 4.43 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 1.28 0.00 0.00 34 L 8.04 3.94 0.00 1.77 1.88 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.37 4.08 0.00 4.00 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 36 Y 7.94 4.03 0.00 3.24 3.22 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 37 R 8.39 3.68 0.00 2.04 1.95 0.00 3.24 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 1.70 1.83 0.00 38 I 8.02 3.71 1.88 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 1.55 1.31 0.98 0.00 0.00 39 K 7.87 4.25 0.00 1.89 1.80 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.54 7.81 40 K 7.87 3.73 0.00 1.25 1.68 0.00 1.48 0.00 0.00 1.55 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.32 1.33 7.81 41 L 8.13 3.91 0.00 1.81 1.67 0.90 0.78 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 42 E 7.96 4.28 0.00 2.19 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.55 0.00 43 K 7.90 3.97 0.00 1.80 1.86 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.75 1.60 7.81 44 D 8.22 4.64 0.00 2.58 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 45 G 7.91 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 0.00 0.00 0.00 46 V 7.85 3.56 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 0.76 0.00 0.00 0.91 0.00 0.00 47 I 7.50 4.09 1.76 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.58 0.45 0.00 0.00 48 K 8.24 4.08 0.00 1.66 1.83 0.00 1.83 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.35 7.81 49 G 6.32 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 50 Y 8.14 4.36 0.00 2.91 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 Y 8.33 5.11 0.00 2.96 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 52 A 8.52 4.45 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 53 Y 8.61 4.52 0.00 2.89 2.96 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 54 I 7.61 4.02 1.68 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.63 0.76 0.00 0.00 55 N 8.11 4.16 0.00 2.62 2.55 0.00 0.00 7.22 7.71 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 56 P 0.00 4.21 0.00 2.14 2.02 0.00 3.57 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.01 0.00 57 A 8.16 3.98 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 58 S 7.59 3.88 0.00 3.93 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 59 L 7.46 4.47 0.00 1.68 1.66 0.85 0.99 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 60 N 8.69 4.31 0.00 2.93 2.94 0.00 0.00 7.01 6.65 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 61 L 7.83 4.84 0.00 1.62 1.64 0.87 0.80 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 62 D 8.63 4.67 0.00 2.65 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 63 Y 8.63 4.29 0.00 3.15 3.06 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 64 I 7.67 4.78 1.81 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.85 1.03 0.00 0.00 65 V 8.49 4.79 1.88 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 0.10 0.00 0.00 0.91 0.00 0.00 66 I 8.54 4.74 1.83 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 1.19 0.62 0.88 0.00 0.00 67 T 9.28 5.27 4.43 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 1.46 0.00 0.00 68 S 9.05 5.23 0.00 3.92 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 69 V 9.08 4.87 2.30 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 1.06 0.00 0.00 1.07 0.00 0.00 70 K 9.36 4.93 0.00 1.79 1.84 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.47 1.45 7.81 71 A 8.72 4.92 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 72 K 9.35 4.38 0.00 1.73 1.84 0.00 1.89 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.67 1.47 7.81 73 Y 9.19 4.22 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 74 G 8.74 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 0.00 0.00 0.00 0.00 75 K 8.59 3.81 0.00 1.78 1.68 0.00 1.96 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.05 7.81 76 N 9.22 4.25 0.00 2.75 2.84 0.00 0.00 6.76 7.45 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 77 A 7.85 4.05 1.40 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 0.00 0.00 78 H 8.23 4.28 0.00 3.06 3.12 0.00 5.82 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 V 7.68 3.67 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 0.86 0.00 0.00 0.93 0.00 0.00 80 E 8.35 4.16 0.00 2.06 2.15 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 2.31 2.31 0.00 81 L 8.02 3.95 0.00 1.80 1.77 0.79 0.96 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 82 G 7.86 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 0.00 0.00 0.00 83 N 7.63 4.34 0.00 2.63 2.86 0.00 0.00 7.21 7.50 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 84 K 7.89 4.08 0.00 1.87 1.76 0.00 1.60 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.40 1.63 7.81 85 L 7.89 3.96 0.00 1.65 1.61 0.49 0.55 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 86 A 7.86 4.02 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 87 Q 7.34 4.34 0.00 2.25 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.78 0.00 0.00 0.00 0.00 0.00 2.49 2.38 0.00 88 I 7.14 3.98 2.10 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.11 1.05 0.00 0.00 89 P 0.00 4.52 0.00 2.18 2.09 0.00 3.72 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 2.08 2.14 0.00 90 G 9.19 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 91 V 7.51 4.23 2.39 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 0.87 0.00 0.00 1.27 0.00 0.00 92 W 8.49 4.81 0.00 3.38 3.11 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 93 G 7.06 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 0.00 0.00 0.00 94 V 7.56 4.82 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 0.79 0.00 0.00 0.83 0.00 0.00 95 Y 9.17 5.02 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 96 F 9.09 4.92 0.00 2.89 2.93 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 97 V 7.85 4.47 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 0.68 0.00 0.00 0.78 0.00 0.00 98 L 8.78 4.77 0.00 1.58 1.54 0.94 0.99 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 99 G 8.26 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 0.00 0.00 0.00 100 D 7.80 4.38 0.00 2.71 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.29 4.63 0.00 2.87 3.01 0.00 0.00 7.03 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 0.00 102 D 6.81 4.48 0.00 2.99 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 0.00 103 F 8.79 5.50 0.00 3.23 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 9.26 4.97 2.03 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 1.11 1.02 0.94 0.00 0.00 105 V 9.27 4.80 2.21 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 1.08 0.00 0.00 1.03 0.00 0.00 106 M 8.57 4.73 0.00 0.96 0.57 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.38 0.00 107 A 8.49 5.16 1.04 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 0.00 0.00 108 R 8.20 4.97 0.00 1.53 1.72 0.00 3.09 0.00 0.00 3.21 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.88 0.00 109 Y 8.64 4.99 0.00 3.17 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 K 9.64 4.83 0.00 1.84 1.92 0.00 1.65 0.00 0.00 1.64 0.00 0.00 3.04 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.69 1.41 7.81 111 T 7.52 4.71 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 1.22 0.00 0.00 112 R 7.84 2.51 0.00 1.24 1.69 0.00 3.23 0.00 0.00 3.36 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 113 E 7.97 3.85 0.00 2.04 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 2.37 2.39 0.00 114 E 7.90 3.84 0.00 2.10 2.21 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 2.47 2.38 0.00 115 F 8.25 3.31 0.00 3.26 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 M 8.40 3.57 0.00 1.91 2.13 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 2.63 2.99 0.00 117 E 8.02 3.74 0.00 1.84 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.28 0.00 118 K 7.86 4.04 0.00 1.53 1.87 0.00 1.91 0.00 0.00 1.79 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.46 7.81 119 F 7.76 4.16 0.00 2.99 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 0.00 120 L 6.92 3.68 0.00 0.84 1.32 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 121 E 8.23 3.81 0.00 1.87 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 2.27 2.28 0.00 122 R 7.57 3.88 0.00 1.72 1.93 0.00 3.10 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 123 V 7.58 3.39 1.80 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 0.82 0.00 0.00 -0.19 0.00 0.00 124 M 7.96 4.31 0.00 1.99 2.03 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 2.81 2.51 0.00 125 S 7.42 4.56 0.00 3.85 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 0.00 126 I 7.18 3.74 1.90 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.62 0.89 0.00 0.00 127 P 0.00 4.32 0.00 2.16 2.07 0.00 3.57 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.09 0.00 128 E 8.13 4.19 0.00 1.96 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 2.39 2.38 0.00 129 V 7.50 4.35 2.22 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 0.72 0.00 0.00 0.90 0.00 0.00 130 E 9.70 4.47 0.00 2.04 2.22 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 2.32 2.36 0.00 131 R 7.69 4.96 0.00 1.77 1.79 0.00 3.31 0.00 0.00 3.42 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 132 T 8.36 5.23 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 1.26 0.00 0.00 133 S 9.22 4.57 0.00 3.90 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 0.00 134 T 8.74 4.94 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 1.14 0.00 0.00 135 Q 9.07 4.52 0.00 1.96 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.98 0.00 0.00 0.00 0.00 0.00 2.28 2.26 0.00 136 V 8.21 3.99 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 0.29 0.00 0.00 0.67 0.00 0.00 137 V 8.39 3.75 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 0.80 0.00 0.00 0.90 0.00 0.00 138 V 8.38 4.09 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 0.68 0.00 0.00 0.90 0.00 0.00 139 K 7.58 4.25 0.00 1.66 1.63 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.44 7.81 140 I 8.25 4.29 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.73 0.94 0.00 0.00 141 I 8.26 3.97 1.88 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 1.31 0.35 0.93 0.00 0.00 142 K 7.62 4.34 0.00 1.68 1.64 0.00 1.84 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.30 1.39 7.81 143 E 8.44 4.59 0.00 1.94 1.80 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 2.10 2.33 0.00 144 S 8.01 4.68 0.00 3.80 3.67 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.39 0.00 2.21 2.26 0.00 3.74 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 1.91 1.82 0.00 146 N 7.95 4.23 0.00 2.70 2.89 0.00 0.00 6.06 7.81 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 0.00 147 I 7.29 3.79 1.42 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.46 -0.08 0.00 0.00 148 V 8.09 4.19 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 0.72 0.00 0.00 0.92 0.00 0.00 149 I 8.04 4.43 1.82 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 0.57 0.94 0.00 0.00 150 F 9.01 4.29 0.00 2.98 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