NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3054 0.0000 0.0000 61.9061 32.5707 175.7432 3 K 3.9286 8.6232 121.3582 55.5948 32.4774 175.0809 4 K 3.9526 9.1224 127.5612 57.1999 33.8067 175.1554 5 V 5.0435 8.2755 124.0834 61.2347 34.5325 174.2844 6 L 4.9803 8.8847 126.1366 53.0697 46.4545 175.6352 7 T 5.4562 7.7572 109.5835 59.3205 71.3683 173.0284 8 G 4.2097 8.3806 112.5873 45.1257 0.0000 170.3274 9 V 4.9001 8.1645 112.2441 59.3903 34.5822 176.0903 10 V 4.3072 8.7540 125.0529 62.9488 32.1694 176.4743 11 V 4.4654 8.6019 120.5195 60.9294 33.1773 175.6184 12 S 4.6725 7.6077 114.7076 57.4604 65.5969 174.4719 13 D 4.9451 8.6874 123.9871 52.9449 40.2595 176.7302 14 K 4.4297 7.7953 115.6249 57.6174 31.7070 176.4789 15 M 4.8157 7.4478 118.4020 53.1652 34.9333 175.5028 16 Q 4.0449 8.5032 120.5737 56.6720 29.1963 177.0954 17 K 4.7470 8.8787 120.2500 56.9207 30.0042 174.8671 18 T 5.2223 7.2635 113.1535 62.1289 72.2777 173.7238 19 V 5.0533 8.1265 113.8627 61.1314 36.7857 173.7422 20 T 4.6601 8.5401 121.2355 62.8509 70.4811 173.9615 21 V 4.7982 8.6729 125.5133 60.7793 34.5579 174.1242 22 L 4.4187 8.5788 131.8293 54.8688 43.2057 175.7019 23 V 4.3624 8.9337 127.0197 61.0056 33.4514 174.7800 24 E 4.6505 8.7502 127.4883 56.5880 30.7416 176.2740 25 R 4.7179 8.4922 115.7241 55.7289 33.0525 173.6906 26 Q 5.2611 8.3171 118.5415 54.1291 33.0373 174.3930 27 F 4.7538 8.2360 113.5119 55.8317 41.5023 171.4988 28 P 4.8717 0.0000 0.0000 62.4820 32.1836 175.9578 29 H 4.3016 9.2899 125.9331 55.4448 30.1441 174.2173 30 P 4.4118 0.0000 0.0000 64.9153 31.1225 176.2652 31 L 4.4763 8.0311 116.3049 55.6096 45.4348 176.0015 32 Y 4.7388 8.1328 113.1862 56.7305 37.7252 175.1143 33 G 3.8465 6.7744 108.5694 44.4368 0.0000 173.9729 34 K 4.9749 7.0345 124.6356 51.6591 31.9474 175.2328 35 V 3.8953 8.4652 127.6863 63.3691 31.9032 175.0938 36 I 4.5081 8.6881 121.2783 59.0508 40.6950 174.5371 37 K 4.9962 7.8934 121.5015 55.1452 35.3646 174.9383 38 R 4.6347 8.3418 120.2242 56.2761 34.2348 173.0058 39 S 5.2383 8.5328 116.0172 57.1694 66.6950 172.7944 40 K 4.5538 8.6270 120.1164 54.9710 35.7596 174.4878 41 K 5.0212 8.3365 125.2457 55.0386 34.0101 175.2633 42 Y 4.7195 8.7196 121.2505 56.1247 41.6953 174.7316 43 L 5.0159 8.6285 121.9832 53.5019 43.6211 175.5596 44 A 4.9029 8.8236 126.6510 50.9692 21.6438 175.5154 45 H 4.5355 9.2757 120.9556 55.6022 31.0954 173.7567 46 D 5.0860 9.1644 128.6100 51.4361 40.9393 174.8631 47 P 4.3899 0.0000 0.0000 64.2148 31.4671 177.3319 48 E 4.6321 8.2518 116.8484 56.0807 31.3131 175.1934 49 E 3.9483 8.1685 116.1560 57.6152 27.0871 175.6317 50 K 4.5271 8.5993 114.2298 56.8689 33.2537 176.5160 51 Y 4.7404 8.2304 116.9974 54.2656 37.6752 175.0726 52 K 4.0135 8.0212 123.2194 56.2446 33.4474 177.0860 53 L 4.0287 8.1152 120.8765 56.1330 42.7173 176.6879 54 G 4.0844 8.7671 111.5875 45.3029 0.0000 173.6217 55 D 4.9340 7.6506 118.6167 54.4385 42.4463 176.0465 56 V 4.5447 8.8080 122.5391 61.5482 33.1130 175.0343 57 V 4.7661 8.3353 120.8638 59.7206 35.0848 174.2856 58 E 5.1863 8.7095 120.7617 55.0514 31.7103 175.9056 59 I 4.9731 9.1241 125.3352 59.5032 40.6713 174.2944 60 I 5.0076 8.3307 123.0144 58.8629 41.3655 173.1342 61 E 2.8606 9.3425 130.8955 57.0698 29.8064 175.8815 62 S 4.7423 7.3871 122.0005 55.8471 66.3328 174.2752 63 R 3.9488 8.3126 120.5975 55.5387 30.3556 174.3075 64 P 4.4611 0.0000 0.0000 63.1347 31.7354 176.3572 65 I 4.2629 8.1299 122.6735 60.9475 39.0909 175.3490 66 S 4.5102 7.4037 111.7514 57.8432 64.9501 175.9255 67 K 3.9902 7.9387 121.2693 56.9920 32.4922 178.1159 68 R 3.5388 8.7834 118.6833 58.2622 29.4787 177.3777 69 K 4.5982 10.0050 118.0947 56.1227 30.9893 176.9621 70 R 4.9496 8.3631 126.0812 55.0533 32.2002 175.0122 71 F 5.2156 8.1297 116.0446 57.0286 43.8417 173.8288 72 R 4.9426 8.6776 122.1666 54.4756 32.9195 175.5123 73 V 3.5787 7.7517 122.8888 63.9394 31.5737 174.2107 74 L 4.1406 9.5931 133.3189 56.3183 41.5065 177.3450 75 R 4.9540 8.5860 111.2962 54.2441 34.4691 175.2911 76 L 4.7373 8.6062 121.5505 54.8028 42.5838 176.1269 77 V 4.3300 8.1850 124.8125 63.9047 33.5184 175.9070 78 E 4.8361 7.5625 114.1750 55.6139 32.0179 175.1674 79 S 4.7763 9.4704 118.6741 56.5028 64.0003 172.7240 80 G 3.5533 8.2404 118.5838 46.4136 0.0000 174.1325 81 R 4.8464 7.9203 115.5890 54.5444 30.0770 178.2468 82 M 4.2367 7.7650 118.8113 57.8620 32.1633 178.1987 83 D 4.3931 8.0628 119.6110 56.3354 39.4606 178.5612 84 L 4.0128 8.0078 120.3435 57.5945 41.8038 179.4459 85 V 3.7936 7.9283 117.3645 65.6679 31.2487 177.8268 86 E 3.9545 7.9262 118.1263 59.5402 29.4754 178.8635 87 K 4.0729 7.8020 118.1144 60.3079 32.0499 177.2205 88 Y 4.5219 8.1515 119.4986 58.6094 38.7933 176.7457 89 L 3.4364 8.3802 119.2612 58.0323 42.1310 180.1370 90 I 3.5690 8.1649 119.6446 64.4513 36.9310 178.2662 91 R 3.7177 7.1032 117.5057 59.4820 29.8597 178.1519 92 R 3.3789 7.9417 118.7101 59.2241 29.5261 178.3620 93 Q 3.9091 7.8691 119.3047 59.0176 29.0746 177.6681 94 N 4.3397 8.0142 117.3289 55.7361 38.3502 176.5813 95 Y 4.4045 7.2404 118.8330 61.4790 36.5594 178.2417 96 E 4.0221 7.9357 118.2292 59.6933 29.2711 179.1746 97 S 4.5464 7.7338 111.6276 58.8138 62.5240 174.7724 98 L 4.6684 8.1004 121.6849 55.6380 44.4093 177.9387 99 S 4.5737 7.0092 108.4883 58.4809 62.2850 174.6136 100 K 4.1188 8.3632 118.8115 57.5488 32.8281 175.5300 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 2 P 0.00 4.31 0.00 2.19 2.12 0.00 3.74 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.99 0.00 3 K 8.62 3.93 0.00 1.73 1.92 0.00 1.76 0.00 0.00 1.80 0.00 0.00 2.80 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.48 7.81 4 K 9.12 3.95 0.00 1.94 1.80 0.00 1.46 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.51 1.50 7.81 5 V 8.28 5.04 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 0.94 0.00 0.00 0.98 0.00 0.00 6 L 8.88 4.98 0.00 1.16 1.20 -0.23 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 7 T 7.76 5.46 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 1.23 0.00 0.00 8 G 8.38 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 9 V 8.16 4.90 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 0.77 0.00 0.00 0.90 0.00 0.00 10 V 8.75 4.31 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 1.01 0.00 0.00 1.04 0.00 0.00 11 V 8.60 4.47 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 0.65 0.00 0.00 0.77 0.00 0.00 12 S 7.61 4.67 0.00 3.92 3.68 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 13 D 8.69 4.95 0.00 2.84 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 14 K 7.80 4.43 0.00 1.88 1.91 0.00 1.67 0.00 0.00 1.73 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.44 7.81 15 M 7.45 4.82 0.00 1.93 1.95 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.48 0.00 16 Q 8.50 4.04 0.00 2.13 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.09 0.00 0.00 0.00 0.00 0.00 2.46 2.39 0.00 17 K 8.88 4.75 0.00 2.00 1.95 0.00 1.92 0.00 0.00 1.81 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.42 7.81 18 T 7.26 5.22 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 1.27 0.00 0.00 19 V 8.13 5.05 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 1.04 0.00 0.00 0.90 0.00 0.00 20 T 8.54 4.66 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 1.15 0.00 0.00 21 V 8.67 4.80 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 0.89 0.00 0.00 0.87 0.00 0.00 22 L 8.58 4.42 0.00 1.48 1.36 0.87 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 23 V 8.93 4.36 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.93 0.00 0.00 24 E 8.75 4.65 0.00 1.90 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 2.32 2.31 0.00 25 R 8.49 4.72 0.00 1.96 2.04 0.00 2.90 0.00 0.00 3.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.75 0.00 26 Q 8.32 5.26 0.00 1.93 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.98 0.00 0.00 0.00 0.00 0.00 2.23 2.33 0.00 27 F 8.24 4.75 0.00 3.06 3.13 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 28 P 0.00 4.87 0.00 2.06 2.10 0.00 3.89 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.15 0.00 29 H 9.29 4.30 0.00 3.18 3.34 0.00 5.61 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.41 0.00 2.15 2.15 0.00 3.54 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.90 0.00 31 L 8.03 4.48 0.00 1.35 1.20 0.80 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 8.13 4.74 0.00 2.73 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 33 G 6.77 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 0.00 0.00 0.00 34 K 7.03 4.97 0.00 1.83 1.89 0.00 1.77 0.00 0.00 1.60 0.00 0.00 2.86 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.47 7.81 35 V 8.47 3.90 2.05 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 0.81 0.00 0.00 0.94 0.00 0.00 36 I 8.69 4.51 1.67 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.21 0.85 0.00 0.00 37 K 7.89 5.00 0.00 1.59 1.72 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.85 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.30 1.34 7.81 38 R 8.34 4.63 0.00 2.01 1.87 0.00 3.28 0.00 0.00 3.31 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 39 S 8.53 5.24 0.00 3.85 3.79 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 40 K 8.63 4.55 0.00 1.69 1.62 0.00 1.43 0.00 0.00 1.44 0.00 0.00 2.13 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.30 1.00 7.81 41 K 8.34 5.02 0.00 1.55 1.60 0.00 1.59 0.00 0.00 1.33 0.00 0.00 2.73 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.13 1.30 7.81 42 Y 8.72 4.72 0.00 2.66 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.63 5.02 0.00 1.66 1.65 0.94 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 44 A 8.82 4.90 1.18 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 0.00 0.00 45 H 9.28 4.54 0.00 3.23 3.23 0.00 5.75 0.00 0.00 0.00 0.00 6.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 D 9.16 5.09 0.00 2.66 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 47 P 0.00 4.39 0.00 2.24 2.20 0.00 3.76 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.04 0.00 48 E 8.25 4.63 0.00 1.99 1.93 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 2.26 2.30 0.00 49 E 8.17 3.95 0.00 2.05 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 0.00 2.33 2.24 0.00 50 K 8.60 4.53 0.00 1.66 1.91 0.00 1.39 0.00 0.00 1.94 0.00 0.00 3.15 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.58 1.37 7.81 51 Y 8.23 4.74 0.00 2.98 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 52 K 8.02 4.01 0.00 1.92 1.99 0.00 1.51 0.00 0.00 1.73 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.73 1.41 7.81 53 L 8.12 4.03 0.00 1.66 1.65 0.97 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 54 G 8.77 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 55 D 7.65 4.93 0.00 2.88 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 56 V 8.81 4.54 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 0.98 0.00 0.00 0.94 0.00 0.00 57 V 8.34 4.77 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 0.97 0.00 0.00 0.84 0.00 0.00 58 E 8.71 5.19 0.00 1.92 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 2.22 2.26 0.00 59 I 9.12 4.97 1.52 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.75 1.04 0.00 0.00 60 I 8.33 5.01 1.90 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 1.10 1.50 0.99 0.00 0.00 61 E 9.34 2.86 0.00 1.90 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 2.12 2.00 0.00 62 S 7.39 4.74 0.00 3.69 3.68 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 63 R 8.31 3.95 0.00 1.71 1.78 0.00 3.20 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 64 P 0.00 4.46 0.00 2.05 1.95 0.00 3.64 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.06 0.00 65 I 8.13 4.26 1.86 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.71 0.84 0.00 0.00 66 S 7.40 4.51 0.00 3.97 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 67 K 7.94 3.99 0.00 1.81 1.76 0.00 1.87 0.00 0.00 1.82 0.00 0.00 3.10 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.52 1.48 7.81 68 R 8.78 3.54 0.00 1.97 2.02 0.00 3.26 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 69 K 10.00 4.60 0.00 1.85 1.83 0.00 1.66 0.00 0.00 1.78 0.00 0.00 3.11 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.65 1.41 7.81 70 R 8.36 4.95 0.00 1.82 1.62 0.00 3.20 0.00 0.00 3.36 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 71 F 8.13 5.22 0.00 2.95 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 R 8.68 4.94 0.00 1.77 1.85 0.00 3.14 0.00 0.00 3.25 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.60 0.00 73 V 7.75 3.58 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 -0.21 0.00 0.00 0.61 0.00 0.00 74 L 9.59 4.14 0.00 1.74 1.51 0.95 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 75 R 8.59 4.95 0.00 1.92 2.01 0.00 3.03 0.00 0.00 3.29 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.63 0.00 76 L 8.61 4.74 0.00 1.78 1.62 1.06 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 77 V 8.18 4.33 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 0.85 0.00 0.00 0.95 0.00 0.00 78 E 7.56 4.84 0.00 2.03 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 2.13 2.16 0.00 79 S 9.47 4.78 0.00 3.88 3.79 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 80 G 8.24 3.55 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 0.00 0.00 0.00 81 R 7.92 4.85 0.00 1.96 1.97 0.00 3.31 0.00 0.00 3.46 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.67 0.00 82 M 7.76 4.24 0.00 2.04 2.13 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.56 0.00 83 D 8.06 4.39 0.00 2.87 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 8.01 4.01 0.00 1.87 1.76 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.93 3.79 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 1.16 0.00 0.00 1.03 0.00 0.00 86 E 7.93 3.95 0.00 2.26 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.49 0.00 87 K 7.80 4.07 0.00 1.88 1.92 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.70 1.64 7.81 88 Y 8.15 4.52 0.00 2.99 3.01 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 89 L 8.38 3.44 0.00 1.91 1.64 0.92 0.62 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 90 I 8.16 3.57 1.88 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.04 0.84 0.00 0.00 91 R 7.10 3.72 0.00 2.05 2.01 0.00 3.27 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.56 0.00 92 R 7.94 3.38 0.00 1.27 1.63 0.00 2.81 0.00 0.00 2.90 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.62 0.00 93 Q 7.87 3.91 0.00 2.17 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.55 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 94 N 8.01 4.34 0.00 2.75 2.75 0.00 0.00 6.91 7.00 0.00 0.00 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 Y 7.24 4.40 0.00 2.96 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 96 E 7.94 4.02 0.00 2.05 2.05 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 2.37 2.43 0.00 97 S 7.73 4.55 0.00 3.96 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 98 L 8.10 4.67 0.00 1.78 1.69 1.04 0.93 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 99 S 7.01 4.57 0.00 3.94 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 0.00 100 K 8.36 4.12 0.00 1.72 1.68 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.35 1.43 7.81