NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 S 4.4036 8.4345 115.4161 58.0091 64.3559 173.8478 23 M 4.1296 8.4487 121.4102 52.2484 31.8826 174.7428 24 S 4.6137 9.3379 120.0879 57.2335 64.9777 173.3180 25 D 4.6168 9.7076 123.8053 54.5034 41.0664 177.0637 26 I 4.5308 7.9213 123.8659 58.0942 38.4823 172.3300 27 P 4.1397 0.0000 0.0000 62.7220 31.6932 177.8219 28 S 4.3924 8.5928 116.5078 60.0931 63.4137 174.3093 29 D 4.7574 7.8548 119.7255 52.9450 39.4074 175.5227 30 L 4.7699 7.1968 117.1487 53.7054 45.0246 175.4278 31 H 5.0765 8.6099 117.5093 54.7497 32.0990 173.1507 32 Y 5.3251 9.1700 116.8690 57.0045 42.8548 174.3322 33 T 5.0196 8.8236 110.7617 59.6751 71.4846 175.3963 34 A 4.0822 8.9127 125.2775 55.2786 18.5129 178.3105 35 E 4.4385 8.2093 113.4786 56.7834 29.7088 175.9434 36 H 4.4654 8.5061 114.8799 57.6325 26.5358 174.0914 37 E 5.2621 8.0686 118.1236 54.6839 32.0147 175.3092 38 W 5.1265 8.5816 119.5225 54.8937 31.8801 174.7039 39 I 5.0433 8.9444 121.3809 59.7791 40.7818 174.1290 40 R 4.8995 9.4589 128.0346 54.2261 32.6021 174.8476 41 R 4.3692 8.7961 127.3473 56.3254 30.2088 175.7386 42 S 4.5462 8.6855 120.4140 58.7189 64.2859 173.5621 43 G 4.0768 7.4307 108.4756 44.6715 0.0000 173.1545 44 D 4.3807 8.8123 118.7042 57.0412 40.8518 177.4151 45 D 5.0150 8.0124 115.6764 52.9228 41.4438 175.1799 46 T 5.1391 7.8936 115.0039 62.3755 72.6245 173.3553 47 V 4.8704 8.8227 118.2704 59.5872 35.6818 174.4834 48 R 5.1590 9.1951 124.0793 54.1113 32.4781 175.1041 49 V 4.6143 8.2755 124.7504 60.1870 35.2379 174.7122 50 G 3.6537 6.0243 111.8903 45.1689 0.0000 170.9156 51 I 5.1648 8.1341 112.7551 59.1863 40.1267 175.6988 52 T 4.4402 8.7527 114.1772 61.3781 70.2193 175.0855 53 D 4.2727 9.1140 121.3015 57.6912 41.1290 177.6628 54 Y 4.0671 8.4035 119.1898 60.7209 38.7367 177.8646 55 A 3.9374 8.3115 121.7152 55.2457 18.6422 179.5831 56 Q 3.8924 8.2643 116.3346 59.5334 28.3758 178.7483 57 S 4.0090 7.8412 113.9806 60.9188 62.4950 175.6711 58 A 3.9335 7.5713 122.5969 54.8662 18.1152 179.0576 59 L 3.9948 7.8454 118.4603 57.2388 42.5116 177.2037 60 G 3.7843 7.9910 102.8696 43.9330 0.0000 172.0393 61 D 4.4806 8.4818 117.8999 54.5118 40.9799 176.3099 62 V 4.0304 9.3388 125.5020 62.8417 32.0054 175.8280 63 V 4.3994 8.8674 120.3180 61.8819 33.7168 175.8961 64 F 4.8724 7.8468 121.3569 56.8429 42.9125 172.8609 65 V 4.3313 7.1577 124.8157 60.9522 33.9771 174.2264 66 Q 4.1203 8.9742 130.5083 54.9577 29.9270 174.1863 67 L 5.1856 8.1699 126.6340 52.1692 44.0512 174.8889 68 P 4.5748 0.0000 0.0000 62.3458 32.6682 176.2064 69 V 3.7463 8.2333 120.3911 62.4239 32.1835 175.5507 70 I 4.0425 8.1149 127.7331 62.8803 37.3395 176.4058 71 G 3.9903 9.1846 113.8968 45.2077 0.0000 173.7638 72 T 4.0208 7.9232 117.6378 63.5457 69.3046 173.5996 73 A 4.6522 8.6407 129.3313 51.8821 19.2371 176.8370 74 V 4.8622 9.4416 116.2197 59.7031 35.8279 175.1850 75 T 4.7295 8.8459 113.0248 59.1871 70.9319 173.9073 76 A 4.1842 8.4415 126.5795 54.3861 18.5462 178.5638 77 G 3.9154 9.6278 112.7675 45.0664 0.0000 173.4239 78 E 4.2154 8.3066 122.2006 56.2448 30.9527 176.0626 79 T 4.5801 8.7489 123.7145 63.8736 68.5898 174.0366 80 F 4.8499 8.2047 121.0917 56.4788 39.8698 175.0684 81 G 4.1650 7.0491 105.0829 46.6901 0.0000 171.6361 82 E 5.1759 8.3069 116.3898 54.8446 33.4431 174.4821 83 V 4.7596 8.8583 121.3015 59.9125 34.4052 174.0088 84 E 5.1732 9.2253 124.7846 54.5836 31.7154 175.0543 85 S 5.2805 9.2886 122.0511 55.8433 65.9312 174.9693 86 T 4.0226 8.6086 108.8679 63.7918 68.7729 175.0217 87 K 4.3106 7.4171 122.5712 57.1099 33.4840 176.4339 88 S 4.7592 8.3341 113.4826 56.4078 66.5579 172.6274 89 V 4.8813 8.2582 122.3110 61.1956 34.0209 174.5941 90 S 4.7090 9.0873 121.9136 56.3041 65.7163 172.9547 91 D 4.6438 8.6468 125.9682 54.2848 41.6920 175.3716 92 L 4.2541 8.1482 121.6071 52.9325 44.1244 175.0985 93 Y 5.1600 8.6384 121.1935 55.6971 40.6365 175.6058 94 A 4.4736 9.5116 125.7406 51.9292 18.7867 177.1569 95 P 3.8543 0.0000 0.0000 64.6566 31.9164 176.4075 96 I 4.7563 7.2459 109.1040 58.8288 40.7180 174.7451 97 S 4.6122 8.5734 117.1656 57.4715 63.9884 175.8040 98 G 3.8424 7.4006 111.6876 46.5009 0.0000 171.2220 99 K 5.0212 7.9497 123.6270 52.9344 35.7594 172.3600 100 V 4.0656 8.9022 126.0544 62.6624 31.7512 176.2821 101 S 4.9386 8.9345 122.6907 58.7580 64.8819 173.9792 102 E 4.9267 7.8398 118.4582 55.3455 33.8802 174.3891 103 V 4.8071 8.2478 114.0976 59.6624 36.3942 175.2406 104 N 3.9789 8.2658 122.9719 52.2689 38.5568 175.9425 105 S 4.1801 8.5190 122.7628 60.7690 63.2446 175.6856 106 D 4.3741 8.1205 123.0074 57.0551 40.2675 177.9672 107 L 4.2042 7.3046 117.3459 56.3064 41.6537 178.6902 108 D 4.5017 7.7452 119.3364 57.3748 40.9646 178.3447 109 G 3.8646 7.9038 103.9298 46.0265 0.0000 173.8097 110 T 4.7088 7.9455 116.9189 60.5518 68.9946 172.9231 111 P 4.2952 0.0000 0.0000 65.7654 31.6661 178.0653 112 Q 4.3844 7.9848 116.2313 57.3192 28.5590 177.7618 113 L 4.3056 7.9467 122.5407 57.0637 41.3352 179.3760 114 V 3.5768 7.5526 117.6994 66.0201 31.4789 177.6250 115 N 5.1377 8.1107 116.2334 55.9246 39.0324 177.1982 116 S 4.3764 8.4320 115.8461 60.4746 64.4873 174.0480 117 D 5.0303 8.3091 121.6829 52.2682 41.6563 173.8536 118 P 4.3205 0.0000 0.0000 65.4697 31.8262 177.4671 119 Y 4.0508 7.7138 113.6896 57.3209 40.5099 175.4968 120 G 3.8835 8.2055 107.0443 45.5253 0.0000 175.5745 121 A 4.2864 6.8628 129.0636 54.6131 19.0809 179.9658 122 G 4.0263 8.3960 104.4356 44.9338 0.0000 174.1152 123 W 4.6426 8.0496 116.4942 57.1002 28.7235 175.7270 124 L 4.2796 9.0485 120.4850 56.0450 42.6567 176.4048 125 L 5.1109 7.5905 116.0629 55.3996 43.7162 172.5260 126 D 5.4210 9.0546 119.1765 52.5863 44.0648 175.5387 127 I 4.6309 8.4654 122.4300 59.5529 40.2354 174.2320 128 Q 5.0258 9.3833 128.4353 54.4386 31.4404 174.3048 129 V 4.6076 9.0226 120.3191 59.5859 34.0979 174.8738 130 D 4.6610 8.5568 125.1779 52.4214 41.3681 176.8816 131 S 4.3193 8.8042 122.5768 61.1227 63.0451 176.2853 132 S 4.2701 7.8057 115.7837 61.8482 62.8517 175.4727 133 D 4.4822 8.0354 118.3027 56.6594 40.8227 176.4138 134 V 4.4992 7.6154 109.5703 58.8139 35.8359 174.7657 135 A 4.0071 8.4576 123.4891 52.1193 18.7545 178.1819 136 A 4.1780 8.4467 123.9471 51.9291 20.4997 178.6534 137 L 3.9873 8.6490 124.1686 58.5986 41.4838 180.3471 138 E 3.9748 8.2026 116.7325 61.4783 29.8138 181.2943 139 S 4.4330 7.9854 115.3769 61.4081 63.1070 176.3837 140 A 3.9939 8.3376 123.8894 55.1979 18.0093 179.3173 141 L 3.8945 8.4013 119.4104 58.4533 41.8337 179.2705 142 T 3.8915 7.7368 109.1678 64.5091 68.5930 175.6982 143 T 4.2170 7.5931 110.3336 62.0369 69.4766 174.5517 144 L 4.6660 7.1762 121.7136 53.7354 43.7026 175.9781 145 L 4.7843 9.1294 121.1847 53.8472 43.7593 176.7362 146 D 4.9840 8.6808 122.0407 52.5221 41.4670 176.9773 147 A 3.9438 8.9276 119.7265 55.4760 18.2079 179.2693 148 E 3.8337 8.2336 116.8922 59.3785 29.5275 178.7598 149 A 3.9925 8.4506 119.9719 55.2347 18.5293 178.6742 150 Y 4.1655 8.2647 118.2875 60.8290 38.8865 177.9303 151 R 3.7204 8.2119 120.1751 59.6156 29.8538 178.6378 152 G 3.6233 7.7597 104.0578 47.6207 0.0000 175.1635 153 T 4.0151 7.3647 110.3969 62.5069 69.4532 174.9851 154 L 3.9659 6.7071 121.8405 54.1490 42.6859 176.8902 155 T 4.1569 8.0742 117.1345 63.7860 68.8638 174.2481 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 22 S 8.43 4.40 0.00 4.02 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 23 M 8.45 4.13 0.00 2.14 1.90 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.16 0.00 24 S 9.34 4.61 0.00 4.24 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 25 D 9.71 4.62 0.00 3.02 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 26 I 7.92 4.53 1.85 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 1.61 0.69 0.66 0.00 0.00 27 P 0.00 4.14 0.00 1.75 1.75 0.00 2.63 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 1.53 0.00 28 S 8.59 4.39 0.00 3.97 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 29 D 7.85 4.76 0.00 2.74 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 30 L 7.20 4.77 0.00 1.14 1.02 0.17 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 31 H 8.61 5.08 0.00 3.11 3.23 0.00 5.77 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 9.17 5.33 0.00 2.80 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 0.00 0.00 0.00 0.00 33 T 8.82 5.02 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 1.28 0.00 0.00 34 A 8.91 4.08 1.35 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 0.00 0.00 35 E 8.21 4.44 0.00 2.15 2.24 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 2.41 2.49 0.00 36 H 8.51 4.47 0.00 3.59 3.80 0.00 5.61 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 E 8.07 5.26 0.00 2.01 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 2.34 2.27 0.00 38 W 8.58 5.13 0.00 3.04 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 I 8.94 5.04 1.89 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 1.11 0.59 0.92 0.00 0.00 40 R 9.46 4.90 0.00 2.04 2.05 0.00 3.12 0.00 0.00 3.07 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.54 0.00 41 R 8.80 4.37 0.00 1.81 1.84 0.00 3.25 0.00 0.00 3.27 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.79 0.00 42 S 8.69 4.55 0.00 3.91 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 43 G 7.43 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 0.00 0.00 0.00 44 D 8.81 4.38 0.00 2.66 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 45 D 8.01 5.02 0.00 2.95 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 46 T 7.89 5.14 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 1.15 0.00 0.00 47 V 8.82 4.87 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 0.67 0.00 0.00 0.89 0.00 0.00 48 R 9.20 5.16 0.00 1.78 1.89 0.00 2.80 0.00 0.00 2.55 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.48 0.00 49 V 8.28 4.61 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 0.82 0.00 0.00 0.80 0.00 0.00 50 G 6.02 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 0.00 0.00 0.00 51 I 8.13 5.16 2.01 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 1.41 0.77 0.89 0.00 0.00 52 T 8.75 4.44 4.73 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 1.47 0.00 0.00 53 D 9.11 4.27 0.00 3.03 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Y 8.40 4.07 0.00 3.24 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 55 A 8.31 3.94 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 56 Q 8.26 3.89 0.00 2.31 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.76 0.00 0.00 0.00 0.00 0.00 2.43 2.61 0.00 57 S 7.84 4.01 0.00 3.94 3.81 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 58 A 7.57 3.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 L 7.85 3.99 0.00 1.70 1.78 0.89 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 60 G 7.99 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 61 D 8.48 4.48 0.00 2.71 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 62 V 9.34 4.03 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 0.76 0.00 0.00 0.95 0.00 0.00 63 V 8.87 4.40 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 0.75 0.00 0.00 0.98 0.00 0.00 64 F 7.85 4.87 0.00 3.06 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 65 V 7.16 4.33 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 0.66 0.00 0.00 0.76 0.00 0.00 66 Q 8.97 4.12 0.00 2.37 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.53 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 67 L 8.17 5.19 0.00 1.46 1.47 0.71 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 68 P 0.00 4.57 0.00 2.05 2.27 0.00 3.70 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.68 0.00 69 V 8.23 3.75 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 0.99 0.00 0.00 0.94 0.00 0.00 70 I 8.11 4.04 1.87 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 1.34 0.64 0.95 0.00 0.00 71 G 9.18 3.99 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 72 T 7.92 4.02 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 1.23 0.00 0.00 73 A 8.64 4.65 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 V 9.44 4.86 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 0.82 0.00 0.00 1.06 0.00 0.00 75 T 8.85 4.73 4.26 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 1.23 0.00 0.00 76 A 8.44 4.18 1.28 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 0.00 0.00 77 G 9.63 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 78 E 8.31 4.22 0.00 2.15 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 2.40 2.36 0.00 79 T 8.75 4.58 4.28 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 1.06 0.00 0.00 80 F 8.20 4.85 0.00 2.84 3.14 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 81 G 7.05 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 82 E 8.31 5.18 0.00 2.08 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.30 0.00 83 V 8.86 4.76 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 0.86 0.00 0.00 0.87 0.00 0.00 84 E 9.23 5.17 0.00 2.10 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 0.00 2.23 2.24 0.00 85 S 9.29 5.28 0.00 3.93 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 86 T 8.61 4.02 4.23 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 1.21 0.00 0.00 87 K 7.42 4.31 0.00 1.88 1.84 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.38 7.81 88 S 8.33 4.76 0.00 3.84 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 V 8.26 4.88 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 0.80 0.00 0.00 0.93 0.00 0.00 90 S 9.09 4.71 0.00 3.82 3.56 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 91 D 8.65 4.64 0.00 2.20 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 0.00 0.00 0.00 92 L 8.15 4.25 0.00 0.42 0.31 0.89 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 93 Y 8.64 5.16 0.00 2.79 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 94 A 9.51 4.47 1.52 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 0.00 0.00 95 P 0.00 3.85 0.00 2.08 2.17 0.00 3.68 0.00 0.00 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.30 0.00 96 I 7.25 4.76 1.87 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 1.41 0.65 0.92 0.00 0.00 97 S 8.57 4.61 0.00 3.89 3.84 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 98 G 7.40 3.84 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 0.00 0.00 0.00 99 K 7.95 5.02 0.00 1.39 1.64 0.00 1.82 0.00 0.00 1.57 0.00 0.00 2.97 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.25 1.21 7.81 100 V 8.90 4.07 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 0.82 0.00 0.00 0.79 0.00 0.00 101 S 8.93 4.94 0.00 3.84 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 0.00 102 E 7.84 4.93 0.00 2.05 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 0.00 2.32 2.32 0.00 103 V 8.25 4.81 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 0.68 0.00 0.00 0.89 0.00 0.00 104 N 8.27 3.98 0.00 1.44 1.81 0.00 0.00 7.16 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 0.00 105 S 8.52 4.18 0.00 4.05 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 0.00 106 D 8.12 4.37 0.00 2.75 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 0.00 107 L 7.30 4.20 0.00 1.48 1.53 0.73 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 108 D 7.75 4.50 0.00 2.75 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 0.00 109 G 7.90 3.86 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 0.00 0.00 0.00 110 T 7.95 4.71 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 111 P 0.00 4.30 0.00 2.39 2.34 0.00 3.78 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 2.14 2.22 0.00 112 Q 7.98 4.38 0.00 2.11 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.65 2.49 0.00 113 L 7.95 4.31 0.00 1.65 1.72 0.93 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 114 V 7.55 3.58 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 0.81 0.00 0.00 0.95 0.00 0.00 115 N 8.11 5.14 0.00 2.85 2.90 0.00 0.00 7.32 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.43 4.38 0.00 4.04 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 0.00 117 D 8.31 5.03 0.00 2.75 2.59 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 0.00 118 P 0.00 4.32 0.00 1.86 2.20 0.00 3.78 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.84 0.00 119 Y 7.71 4.05 0.00 2.82 2.41 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 0.00 120 G 8.21 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 0.00 0.00 0.00 0.00 121 A 6.86 4.29 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 0.00 122 G 8.40 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 0.00 123 W 8.05 4.64 0.00 3.75 3.62 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 0.00 124 L 9.05 4.28 0.00 1.59 1.66 0.92 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 125 L 7.59 5.11 0.00 1.83 1.59 0.55 -0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 126 D 9.05 5.42 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 0.00 127 I 8.47 4.63 1.81 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 0.98 0.68 0.94 0.00 0.00 128 Q 9.38 5.03 0.00 2.04 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.77 0.00 0.00 0.00 0.00 0.00 2.24 2.48 0.00 129 V 9.02 4.61 2.17 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 0.75 0.00 0.00 1.00 0.00 0.00 130 D 8.56 4.66 0.00 2.66 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 S 8.80 4.32 0.00 4.01 4.01 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 0.00 0.00 0.00 132 S 7.81 4.27 0.00 3.93 3.95 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 0.00 133 D 8.04 4.48 0.00 2.66 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 0.00 134 V 7.62 4.50 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 0.68 0.00 0.00 0.97 0.00 0.00 135 A 8.46 4.01 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 0.00 136 A 8.45 4.18 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 0.00 137 L 8.65 3.99 0.00 1.68 1.73 0.96 0.91 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 0.00 138 E 8.20 3.97 0.00 2.06 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.00 0.00 139 S 7.99 4.43 0.00 4.01 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 0.00 140 A 8.34 3.99 1.35 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 0.00 0.00 141 L 8.40 3.89 0.00 1.76 1.88 0.47 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 142 T 7.74 3.89 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 1.26 0.00 0.00 143 T 7.59 4.22 4.26 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 1.22 0.00 0.00 144 L 7.18 4.67 0.00 1.67 1.84 0.92 0.92 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 0.00 145 L 9.13 4.78 0.00 1.88 1.75 1.10 1.20 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 0.00 146 D 8.68 4.98 0.00 2.85 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 0.00 147 A 8.93 3.94 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 0.00 148 E 8.23 3.83 0.00 2.05 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 0.00 2.37 2.37 0.00 149 A 8.45 3.99 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 Y 8.26 4.17 0.00 2.95 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 0.00 151 R 8.21 3.72 0.00 1.88 2.02 0.00 3.13 0.00 0.00 3.03 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 152 G 7.76 3.62 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 0.00 153 T 7.36 4.02 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 0.00 154 L 6.71 3.97 0.00 1.42 1.13 0.37 -0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 155 T 8.07 4.16 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