NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4456 8.3049 120.3271 55.3872 33.4787 173.9625 2 R 4.4181 8.0752 118.5020 53.7658 33.6153 173.3625 3 R 4.7826 8.7401 121.3078 54.9311 33.7068 173.6703 4 Y 5.3843 9.2303 121.7380 56.5878 42.8425 174.3069 5 E 5.1870 9.9381 121.7237 54.2708 30.9029 175.3458 6 V 3.9468 8.2012 123.4207 61.6183 33.2798 175.2930 7 N 5.3960 9.7947 121.6726 51.7693 41.3238 172.8746 8 I 4.8861 8.3839 125.0820 59.3729 40.3505 174.9740 9 V 4.6108 8.2928 125.2870 61.1701 33.8432 174.6552 10 L 5.1027 8.8161 127.7450 52.5973 44.6888 175.3154 11 N 4.7665 8.2835 120.6656 53.3201 39.1373 174.3477 12 P 4.4810 0.0000 0.0000 65.3501 31.9617 177.3957 13 N 4.4357 7.4821 116.4324 55.4236 38.6249 175.4348 14 L 4.0480 7.4118 118.7061 54.8088 42.4896 177.1782 15 D 4.7415 8.3880 129.1382 53.5361 40.5138 177.3694 16 Q 3.9287 8.8048 116.3944 59.1806 28.0919 178.6050 17 S 4.3316 8.0218 110.8042 59.9242 63.6557 175.0691 18 Q 4.4341 7.5979 119.6312 56.7433 30.2981 177.5608 19 L 3.8586 7.5659 119.6549 57.6393 41.5464 178.5701 20 A 4.1318 8.1322 120.8978 54.4395 18.1154 179.4488 21 L 3.8941 7.3341 118.3545 58.5873 42.3549 179.1514 22 E 4.0017 8.0177 118.1012 59.1051 29.3857 179.3984 23 K 4.1249 7.7265 117.8883 58.8590 32.1207 178.9839 24 E 4.1023 7.9099 116.5832 58.9200 29.6169 179.1528 25 I 3.7273 7.5120 120.8382 64.0059 37.0646 178.2743 26 I 3.6579 7.4977 120.3302 64.5930 37.0030 178.4559 27 Q 3.8319 8.0154 118.6934 58.8279 28.5002 178.9597 28 R 3.8387 8.2371 119.1077 59.4818 30.2800 178.8975 29 A 4.2224 8.2442 120.4503 55.1403 18.2471 179.6830 30 L 3.9165 8.0246 117.4581 58.2005 41.9228 179.5948 31 E 4.0736 8.1484 118.3715 59.3752 29.1154 179.2138 32 N 4.3286 8.4593 116.3135 56.7220 38.7414 176.8041 33 Y 4.1091 7.6822 115.9137 59.0329 38.0670 176.4298 34 G 4.1814 7.8577 108.4247 45.4006 0.0000 173.1727 35 A 4.6083 8.1824 122.0172 50.9474 19.5787 178.1235 36 R 4.4421 8.4216 121.4457 54.9101 32.1302 176.0652 37 V 4.0206 8.3271 117.6101 61.2450 32.0501 175.0990 38 E 4.6095 8.8290 125.2465 57.4374 31.0141 176.8088 39 K 4.7734 7.7051 117.9664 55.4018 36.0967 174.5926 40 V 4.4378 8.6304 124.0610 61.0301 32.7953 173.6684 41 E 4.1312 9.3230 125.8020 53.1920 29.4460 172.9085 42 E 3.7892 8.7731 135.0000 56.6530 27.6628 173.9771 43 L 4.2676 8.2904 122.8411 53.9531 43.4191 179.4341 44 G 3.2165 7.5072 107.7003 46.3944 0.0000 173.4291 45 L 5.0455 7.9606 123.7919 53.2424 42.7948 176.2310 46 R 4.7284 8.4491 120.3608 54.3139 35.1487 174.5420 47 R 4.3723 8.6173 121.0999 56.1949 30.4069 176.7188 48 L 4.1320 8.7461 125.6192 54.2436 42.2639 177.8229 49 A 4.1980 8.7426 126.1197 54.3363 18.6958 177.4395 50 Y 4.7324 7.4282 113.0416 53.9234 40.2996 172.9197 51 P 4.2781 0.0000 0.0000 63.2951 31.2348 175.3642 52 I 4.0644 8.0338 125.1061 60.8842 38.2270 176.3568 53 A 3.8644 9.1875 127.5076 53.5389 15.8551 177.3054 54 K 3.9256 8.4080 114.3507 58.2348 30.1593 175.2292 55 D 4.9799 7.8329 118.9597 51.9118 43.3717 174.9948 56 P 4.5397 0.0000 0.0000 64.2396 32.7656 175.1199 57 Q 5.2102 6.9256 117.8403 53.2173 32.7746 174.5005 58 G 3.8585 7.9464 102.9069 45.7745 0.0000 172.0885 59 Y 4.2476 8.3215 124.9341 56.8506 40.0274 173.9977 60 F 5.1970 8.5145 125.7405 55.7844 41.1571 175.2531 61 L 4.9156 8.8753 122.4755 52.6997 45.6632 175.3878 62 W 5.1995 8.2192 131.4115 55.8860 34.5030 173.2618 63 Y 4.2292 7.3429 122.9054 55.9859 41.8672 174.1485 64 Q 4.0772 7.3252 126.5010 55.7301 29.8964 175.0174 65 V 5.0508 8.6725 119.7313 59.5106 36.7830 174.4132 66 E 5.2954 8.4958 120.4803 55.0776 32.4571 174.6580 67 M 4.9195 8.5038 117.8375 53.5627 34.8438 173.9422 68 P 4.5775 0.0000 0.0000 64.2148 29.2767 178.2839 69 E 3.9934 8.5611 118.8797 57.5540 29.9580 176.0044 70 D 4.5414 6.4861 121.2468 56.9161 40.4032 178.4877 71 R 4.6076 7.7782 118.5610 56.4409 30.6582 179.0784 72 V 3.4350 7.9486 119.8146 65.9461 31.5507 176.6435 73 N 4.2308 7.9024 115.6728 56.5443 38.6195 176.8600 74 D 4.4701 8.1247 119.7493 57.4708 40.4993 178.7348 75 L 2.8402 7.3225 119.1139 57.5695 42.0077 178.7624 76 A 3.9033 8.0228 121.1470 55.2722 18.2650 179.8809 77 R 3.9188 8.4363 116.9883 59.1450 29.8983 178.7410 78 E 4.0809 7.7299 117.7254 58.4956 29.6100 178.4205 79 L 4.2131 7.1780 118.0362 57.6373 42.0813 178.8807 80 R 4.0421 7.6224 116.2946 59.2704 29.9629 178.4583 81 I 3.8925 7.3403 118.3182 63.7415 37.4685 176.3408 82 R 3.9670 7.6662 120.2579 56.2626 30.2465 177.0897 83 D 4.4555 8.9879 123.8149 56.6583 39.2442 178.1926 84 N 4.3529 8.1579 116.3654 55.6482 39.7490 174.9046 85 V 4.0666 8.0519 118.5499 63.0709 30.4920 176.3799 86 R 4.1425 9.2408 127.6861 58.7097 30.5849 177.4968 87 R 4.7701 7.9096 116.5691 54.1801 34.4235 174.5230 88 V 4.6607 8.3846 121.2569 61.3668 34.3308 174.3791 89 M 4.8764 8.9042 127.2972 53.8772 35.4629 173.7662 90 V 4.7124 8.5710 125.7350 59.8347 33.8467 175.0842 91 V 4.5195 8.1650 123.2456 60.4777 34.2822 174.7329 92 K 4.3881 9.1586 127.0296 57.5010 32.5800 177.3302 93 S 4.4533 8.8195 121.5762 58.6918 61.8115 173.7342 94 Q 4.6524 8.4142 123.3476 54.0209 31.1991 176.8506 95 E 4.4755 8.3776 122.6595 55.9706 30.2751 174.0599 96 P 4.8204 0.0000 0.0000 61.5381 33.3889 174.6148 97 F 4.8497 8.3704 119.9789 56.1686 42.1163 173.7050 98 L 4.0600 7.4993 128.5054 53.2272 42.5647 175.2027 99 A 4.4361 7.9570 128.7958 51.2881 21.2333 174.8262 100 N 3.9713 8.6762 119.6972 54.0744 36.5914 173.8585 101 A 4.1060 7.9407 123.1182 51.8276 18.5040 177.7644 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 8.30 4.45 0.00 2.04 2.24 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.60 0.00 2 R 8.08 4.42 0.00 1.62 1.39 0.00 3.12 0.00 0.00 3.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.66 0.00 3 R 8.74 4.78 0.00 1.77 1.62 0.00 3.12 0.00 0.00 3.32 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.66 0.00 4 Y 9.23 5.38 0.00 2.81 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 5 E 9.94 5.19 0.00 2.01 2.33 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 2.60 2.41 0.00 6 V 8.20 3.95 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 0.88 0.00 0.00 0.96 0.00 0.00 7 N 9.79 5.40 0.00 2.83 2.92 0.00 0.00 6.60 6.80 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 8 I 8.38 4.89 1.97 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.86 1.00 0.00 0.00 9 V 8.29 4.61 2.06 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 0.53 0.00 0.00 0.84 0.00 0.00 10 L 8.82 5.10 0.00 1.63 1.48 0.95 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.28 4.77 0.00 2.70 2.75 0.00 0.00 7.31 7.55 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 12 P 0.00 4.48 0.00 2.24 2.19 0.00 3.79 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.11 0.00 13 N 7.48 4.44 0.00 3.14 2.92 0.00 0.00 7.01 7.73 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 14 L 7.41 4.05 0.00 1.65 1.55 0.85 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 15 D 8.39 4.74 0.00 2.89 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 16 Q 8.80 3.93 0.00 2.15 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.99 0.00 0.00 0.00 0.00 0.00 2.41 2.39 0.00 17 S 8.02 4.33 0.00 4.03 4.09 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 0.00 0.00 0.00 18 Q 7.60 4.43 0.00 1.90 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.85 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 19 L 7.57 3.86 0.00 1.77 1.77 0.65 1.15 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 20 A 8.13 4.13 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 L 7.33 3.89 0.00 1.82 1.72 0.91 0.92 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 22 E 8.02 4.00 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 2.30 2.45 0.00 23 K 7.73 4.12 0.00 2.09 1.87 0.00 1.50 0.00 0.00 1.81 0.00 0.00 3.03 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.50 1.38 7.81 24 E 7.91 4.10 0.00 2.27 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 2.36 2.58 0.00 25 I 7.51 3.73 2.01 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 1.51 0.71 0.91 0.00 0.00 26 I 7.50 3.66 2.01 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 1.54 0.80 0.86 0.00 0.00 27 Q 8.02 3.83 0.00 2.15 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.77 0.00 0.00 0.00 0.00 0.00 2.47 2.49 0.00 28 R 8.24 3.84 0.00 2.06 1.98 0.00 3.31 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 29 A 8.24 4.22 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 30 L 8.02 3.92 0.00 1.78 1.62 0.79 0.45 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 31 E 8.15 4.07 0.00 2.13 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 2.31 2.31 0.00 32 N 8.46 4.33 0.00 2.73 2.84 0.00 0.00 7.07 7.44 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 33 Y 7.68 4.11 0.00 3.00 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 34 G 7.86 4.18 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 0.00 35 A 8.18 4.61 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 36 R 8.42 4.44 0.00 1.79 1.84 0.00 3.12 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 37 V 8.33 4.02 2.03 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 0.51 0.00 0.00 0.89 0.00 0.00 38 E 8.83 4.61 0.00 2.06 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 2.26 2.22 0.00 39 K 7.71 4.77 0.00 1.96 1.96 0.00 1.61 0.00 0.00 2.23 0.00 0.00 3.40 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.49 1.69 7.81 40 V 8.63 4.44 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 0.87 0.00 0.00 1.16 0.00 0.00 41 E 9.32 4.13 0.00 2.25 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 2.37 2.47 0.00 42 E 8.77 3.79 0.00 2.21 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.52 0.00 43 L 8.29 4.27 0.00 1.57 1.58 0.74 0.89 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 44 G 7.51 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 0.00 0.00 0.00 45 L 7.96 5.05 0.00 1.49 1.59 0.98 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 46 R 8.45 4.73 0.00 1.75 1.74 0.00 3.00 0.00 0.00 3.12 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.56 0.00 47 R 8.62 4.37 0.00 1.70 1.91 0.00 3.38 0.00 0.00 3.23 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 48 L 8.75 4.13 0.00 1.57 1.43 0.89 1.16 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 49 A 8.74 4.20 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 50 Y 7.43 4.73 0.00 3.09 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 51 P 0.00 4.28 0.00 2.20 2.16 0.00 3.87 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 2.04 2.03 0.00 52 I 8.03 4.06 1.70 0.00 0.00 0.51 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 0.55 0.85 0.00 0.00 53 A 9.19 3.86 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 K 8.41 3.93 0.00 1.89 1.90 0.00 1.59 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.35 1.51 7.81 55 D 7.83 4.98 0.00 2.82 2.50 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 56 P 0.00 4.54 0.00 2.11 2.28 0.00 3.62 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 2.06 1.99 0.00 57 Q 6.93 5.21 0.00 1.89 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.87 0.00 0.00 0.00 0.00 0.00 2.25 2.22 0.00 58 G 7.95 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 59 Y 8.32 4.25 0.00 3.09 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 60 F 8.51 5.20 0.00 3.02 2.92 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 61 L 8.88 4.92 0.00 1.62 1.25 1.08 0.77 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 62 W 8.22 5.20 0.00 3.42 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 63 Y 7.34 4.23 0.00 2.60 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 Q 7.33 4.08 0.00 2.03 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.72 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 65 V 8.67 5.05 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 0.59 0.00 0.00 0.96 0.00 0.00 66 E 8.50 5.30 0.00 2.15 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 2.16 2.22 0.00 67 M 8.50 4.92 0.00 2.00 2.09 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 2.70 2.59 0.00 68 P 0.00 4.58 0.00 2.25 2.09 0.00 3.82 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 2.16 2.15 0.00 69 E 8.56 3.99 0.00 2.12 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 2.29 2.33 0.00 70 D 6.49 4.54 0.00 2.86 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 71 R 7.78 4.61 0.00 2.02 2.17 0.00 3.22 0.00 0.00 3.30 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.68 0.00 72 V 7.95 3.44 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 0.73 0.00 0.00 0.51 0.00 0.00 73 N 7.90 4.23 0.00 2.75 2.81 0.00 0.00 7.11 8.08 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 74 D 8.12 4.47 0.00 2.90 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 75 L 7.32 2.84 0.00 0.73 1.45 0.69 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 76 A 8.02 3.90 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 77 R 8.44 3.92 0.00 2.06 2.00 0.00 3.14 0.00 0.00 3.10 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 78 E 7.73 4.08 0.00 2.18 2.06 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 2.58 2.46 0.00 79 L 7.18 4.21 0.00 1.73 1.69 0.87 0.76 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 80 R 7.62 4.04 0.00 1.92 1.99 0.00 3.18 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.84 0.00 81 I 7.34 3.89 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 1.53 0.72 0.91 0.00 0.00 82 R 7.67 3.97 0.00 1.83 1.97 0.00 3.51 0.00 0.00 3.38 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.56 0.00 83 D 8.99 4.46 0.00 2.77 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 84 N 8.16 4.35 0.00 2.81 2.88 0.00 0.00 6.77 7.68 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 85 V 8.05 4.07 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 0.74 0.00 0.00 0.97 0.00 0.00 86 R 9.24 4.14 0.00 1.61 1.92 0.00 3.27 0.00 0.00 3.16 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.76 0.00 87 R 7.91 4.77 0.00 1.69 1.80 0.00 3.29 0.00 0.00 3.30 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 88 V 8.38 4.66 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 0.83 0.00 0.00 0.95 0.00 0.00 89 M 8.90 4.88 0.00 2.20 1.89 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.58 0.00 90 V 8.57 4.71 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 0.67 0.00 0.00 0.73 0.00 0.00 91 V 8.17 4.52 2.34 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 1.07 0.00 0.00 1.03 0.00 0.00 92 K 9.16 4.39 0.00 1.85 1.79 0.00 1.87 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.66 1.70 7.81 93 S 8.82 4.45 0.00 3.79 3.87 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 0.00 0.00 0.00 94 Q 8.41 4.65 0.00 2.05 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.90 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 95 E 8.38 4.48 0.00 2.08 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 2.38 0.00 96 P 0.00 4.82 0.00 2.20 2.09 0.00 3.73 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.94 0.00 97 F 8.37 4.85 0.00 2.92 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 98 L 7.50 4.06 0.00 1.35 1.19 0.82 0.83 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 99 A 7.96 4.44 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 0.00 100 N 8.68 3.97 0.00 2.82 2.78 0.00 0.00 7.06 7.96 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 0.00 101 A 7.94 4.11 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