NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.3535 8.3144 122.1420 54.4416 33.5051 174.3406 2 E 4.5377 8.2283 116.5494 53.2418 32.4821 174.0050 3 T 4.1608 8.8000 118.5184 61.1440 72.0895 174.6434 4 A 3.9898 8.7197 124.5276 55.7737 18.3719 180.1383 5 A 4.1298 7.9979 118.1529 55.3786 18.5840 179.6117 6 A 4.0564 7.8786 118.9650 55.0114 18.3584 179.8171 7 K 4.0620 8.4278 118.6763 59.4451 32.1980 178.9461 8 F 4.0964 8.2311 121.1367 61.3407 39.4062 177.0209 9 E 3.9849 8.2893 117.8275 59.3312 29.0022 179.3631 10 R 3.8624 7.8117 117.9326 59.3620 30.2978 178.0653 11 Q 3.9771 7.8984 115.7813 57.1589 29.2137 176.0338 12 H 4.5001 7.7511 114.7177 54.1064 31.8647 173.2032 13 M 4.7915 7.7479 118.5241 54.1608 33.1198 176.4729 14 D 4.7583 9.0809 123.5041 52.9545 41.8671 175.6508 15 S 4.3533 8.5074 119.6073 60.5326 63.6481 176.7225 16 S 4.2894 8.2372 115.5294 60.4676 62.7757 174.2277 17 T 4.6688 7.2520 109.1517 59.5510 71.0670 174.3127 18 S 4.2441 8.5640 117.5509 60.1843 63.8236 173.0659 19 A 4.2847 7.0177 120.9703 50.7691 21.5729 174.5734 20 A 3.3967 8.1670 121.6581 51.2221 18.0560 177.5893 21 S 4.1761 8.0834 117.7328 61.4613 63.1587 174.8407 22 S 4.5473 7.4610 113.5044 55.6335 64.9176 174.6454 23 S 4.2168 8.7186 114.6220 62.0450 62.5958 175.6843 24 N 4.4771 7.9647 119.7187 55.8172 38.0795 176.3064 25 Y 4.0710 7.8975 121.0905 61.3342 38.7179 177.9305 26 C 4.0950 8.8797 117.2947 60.0783 38.6126 175.9093 27 N 4.3663 8.1766 117.5179 56.3996 38.0803 177.3732 28 Q 3.8056 7.7457 119.0234 59.0415 28.9211 178.4311 29 M 3.6095 7.6305 119.8313 58.4811 31.7884 178.6281 30 M 3.9478 7.9588 119.1334 58.2051 32.0346 178.8780 31 K 3.9378 7.3596 120.5510 59.1134 32.2515 178.8118 32 S 4.0497 7.9537 114.3212 61.9394 62.7663 175.9540 33 R 4.1789 7.9974 115.3164 56.1005 29.7944 176.1716 34 N 4.3335 7.9407 114.3585 54.5502 36.2710 175.1087 35 L 4.3833 8.2960 118.3550 55.6803 41.9839 177.7499 36 T 5.0608 7.4976 109.2975 60.2630 69.3776 176.2559 37 K 4.0996 8.4086 124.3142 59.6660 32.7842 176.5978 38 D 4.8820 7.9057 114.5990 53.3179 42.1211 175.5044 39 R 3.8237 7.3281 115.5301 56.1859 30.8382 173.5542 40 C 4.9019 8.7338 116.0609 55.2143 40.3678 174.0098 41 K 4.1025 8.3511 127.4736 56.0822 32.4794 174.2331 42 P 4.5967 0.0000 0.0000 65.5602 31.7934 176.3836 43 V 5.2057 7.5570 109.2891 60.1123 35.9978 173.9850 44 N 4.7327 9.1892 120.3453 52.8764 42.5792 173.1086 45 T 4.9358 7.9381 120.9481 61.6581 71.8573 172.8018 46 F 4.8099 9.0113 124.3354 55.5920 42.2788 174.4820 47 V 4.3871 9.1602 124.1740 61.3483 33.0496 175.6712 48 H 5.9405 8.4158 128.7591 53.8468 26.1865 173.6303 49 E 4.8029 7.7474 118.3772 53.3087 34.5144 176.3837 50 S 4.4286 8.3220 115.0324 58.2254 65.0933 175.0279 51 L 4.0380 8.4509 123.7121 58.2074 42.0410 178.9234 52 A 4.0040 8.0222 120.4194 55.2287 18.1121 179.2218 53 D 4.3327 7.8235 116.1805 57.4994 41.2207 178.8498 54 V 3.7951 7.8433 118.7228 66.1426 31.5628 178.1629 55 Q 3.9513 8.4561 117.7995 58.7206 28.5493 178.3755 56 A 4.1132 7.9848 121.0053 54.3187 18.2729 179.5508 57 V 3.5558 7.6845 117.0734 65.8872 31.2961 176.8587 58 C 3.8582 7.9376 114.8766 57.9564 40.0226 174.0923 59 S 4.5830 7.4978 114.0254 57.9577 63.9133 174.8846 60 Q 4.5435 7.6254 126.6122 56.2335 27.1444 177.4534 61 K 4.2314 7.9739 130.2546 56.8375 32.8946 175.6586 62 N 4.7345 8.8210 127.5998 53.6602 39.2063 174.3184 63 V 4.5986 8.5503 118.3384 59.1750 36.8735 174.7127 64 A 4.1735 8.3795 124.8773 52.2972 19.0084 178.5325 65 C 4.7125 8.6762 119.6536 55.9438 41.2617 175.2041 66 K 3.6917 9.1155 122.0187 59.6082 31.6566 177.9978 67 N 4.5853 8.1047 113.4814 52.7402 37.4123 175.9348 68 G 3.9448 8.2371 108.5040 45.7090 0.0000 174.3727 69 Q 4.2150 8.6561 119.4996 56.1706 29.2905 176.4784 70 T 4.5837 8.2728 108.6008 61.7024 69.2470 173.9524 71 N 4.9451 7.8577 119.1846 54.0057 38.6540 174.8899 72 C 5.3288 7.3585 115.9495 56.5764 44.3989 172.8636 73 Y 5.0849 8.9390 118.9088 56.3018 42.2982 173.8623 74 Q 5.1365 9.4362 125.8671 54.0339 31.5227 174.7755 75 S 4.5541 8.5147 121.7917 58.4460 63.1519 174.2866 76 Y 4.2863 8.9126 122.3208 60.1825 37.9031 176.2108 77 S 5.1386 7.7837 112.3998 56.1322 66.0709 174.2718 78 T 4.0760 8.3696 110.6739 62.0577 69.5428 173.4665 79 M 4.9043 9.0358 122.7109 53.4135 36.6115 174.4887 80 S 5.0958 8.9562 116.1172 57.9651 63.7425 173.1037 81 I 5.2216 8.9752 119.9472 59.5612 41.7810 174.1410 82 T 5.0345 8.9480 119.2366 62.0118 71.9454 172.7811 83 D 4.9469 9.6426 127.8493 53.4347 42.8667 174.8305 84 C 5.4032 9.5310 121.7034 55.3454 42.9803 172.8153 85 R 5.0652 8.5463 124.8641 53.9748 32.4590 174.5865 86 E 4.0582 9.0116 128.0101 56.8974 30.4665 176.5235 87 T 4.4121 8.1138 116.6685 60.5260 71.1224 174.4803 88 G 3.6486 8.6923 109.2690 49.1541 0.0000 175.8013 89 S 4.2772 7.8624 111.9425 58.4474 63.2329 173.8065 90 S 4.1707 7.4489 115.4119 58.6096 61.8440 173.3001 91 K 4.5747 8.6935 127.7024 54.1543 34.9590 175.7445 92 Y 4.2828 8.7372 125.3068 57.4391 39.1437 173.8232 93 P 3.2489 0.0000 0.0000 62.8982 32.0559 176.9908 94 N 4.6658 8.2254 119.9188 52.1298 37.0265 173.3914 95 C 4.6682 7.8236 116.8562 56.6508 38.7580 173.3247 96 A 5.0257 8.7325 124.9159 50.4286 22.0151 174.5989 97 Y 5.1122 9.0534 118.0186 56.0077 42.3727 174.8510 98 K 4.5954 8.9896 122.5522 55.0379 34.4440 175.1704 99 T 4.5054 8.6484 124.8488 63.6385 69.5607 174.4375 100 T 4.5379 9.0525 122.7604 61.9211 72.0752 173.0789 101 Q 4.8218 8.6945 127.7072 55.6341 30.6240 174.1402 102 A 4.4120 8.1050 124.6424 51.8070 23.7816 174.7196 103 N 5.8500 8.7226 115.6751 50.8752 41.1061 174.5645 104 K 4.7141 8.3619 121.7362 54.8233 37.5067 175.4081 105 H 4.7148 9.4942 119.4492 55.9226 29.9911 174.9267 106 I 4.7768 8.4840 115.0281 59.2638 40.8914 174.3499 107 I 4.9457 8.3168 124.0276 59.7034 40.1539 175.1408 108 V 4.7279 8.5709 119.2059 59.3546 36.1033 174.2480 109 A 5.1255 8.8545 124.7388 50.8029 20.9133 175.6844 110 C 5.2109 8.4778 119.2228 54.8444 38.1723 172.9874 111 E 4.7748 7.9667 116.5581 57.0210 32.6375 176.2058 112 G 4.1690 9.2843 106.3103 44.6417 0.0000 171.7465 113 N 5.0793 8.1677 116.2208 50.8473 40.6025 172.3575 114 P 4.3821 0.0000 0.0000 62.5387 32.0874 175.8240 115 Y 4.7055 8.3207 120.8082 57.2616 38.7182 174.7521 116 V 4.4710 8.0172 119.3895 58.2977 35.9584 173.7055 117 P 4.3531 0.0000 0.0000 62.9319 31.1264 176.8031 118 V 4.4420 8.2724 114.9450 61.2142 34.1983 175.3699 119 H 5.0676 7.7449 119.5577 54.7855 33.4673 171.7511 120 F 4.6591 8.9034 128.1231 57.7483 39.3685 174.2807 121 D 4.5933 8.5834 126.8441 56.1599 42.2437 175.5567 122 A 4.6478 6.8209 117.4945 51.5797 22.6736 174.8050 123 S 5.0228 8.6529 112.5834 57.0447 66.3222 174.7689 124 V 4.1525 8.8266 115.4977 61.7218 32.7269 175.0871 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 K 8.31 4.35 0.00 1.79 1.70 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.01 7.81 2 E 8.23 4.54 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 2.20 2.38 0.00 3 T 8.80 4.16 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 4 A 8.72 3.99 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 5 A 8.00 4.13 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 6 A 7.88 4.06 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 7 K 8.43 4.06 0.00 1.96 2.09 0.00 1.67 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.55 7.81 8 F 8.23 4.10 0.00 3.21 3.26 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 9 E 8.29 3.98 0.00 2.26 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 2.50 2.72 0.00 10 R 7.81 3.86 0.00 1.81 2.10 0.00 3.37 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 11 Q 7.90 3.98 0.00 1.52 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.52 0.00 0.00 0.00 0.00 0.00 2.20 2.46 0.00 12 H 7.75 4.50 0.00 1.93 2.65 0.00 5.61 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.75 4.79 0.00 1.99 2.18 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.64 0.00 14 D 9.08 4.76 0.00 2.81 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.51 4.35 0.00 3.97 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 16 S 8.24 4.29 0.00 3.87 3.94 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 17 T 7.25 4.67 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 1.28 0.00 0.00 18 S 8.56 4.24 0.00 3.96 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 19 A 7.02 4.28 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 20 A 8.17 3.40 1.03 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 21 S 8.08 4.18 0.00 3.99 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 22 S 7.46 4.55 0.00 3.99 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 23 S 8.72 4.22 0.00 4.07 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 24 N 7.96 4.48 0.00 2.89 3.12 0.00 0.00 6.46 7.36 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 25 Y 7.90 4.07 0.00 3.10 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 26 C 8.88 4.09 0.00 3.09 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 27 N 8.18 4.37 0.00 2.87 2.90 0.00 0.00 7.14 7.74 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 28 Q 7.75 3.81 0.00 1.87 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 29 M 7.63 3.61 0.00 0.69 1.17 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.50 0.00 30 M 7.96 3.95 0.00 1.64 1.85 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.28 0.00 31 K 7.36 3.94 0.00 1.75 1.86 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.31 7.81 32 S 7.95 4.05 0.00 3.89 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 33 R 8.00 4.18 0.00 1.86 2.08 0.00 3.64 0.00 0.00 3.22 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.09 0.00 34 N 7.94 4.33 0.00 2.88 2.94 0.00 0.00 6.91 7.47 0.00 0.00 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 L 8.30 4.38 0.00 1.71 1.62 0.69 0.43 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 36 T 7.50 5.06 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 1.41 0.00 0.00 37 K 8.41 4.10 0.00 1.84 1.91 0.00 1.75 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.45 1.49 7.81 38 D 7.91 4.88 0.00 2.69 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 39 R 7.33 3.82 0.00 1.91 1.85 0.00 2.89 0.00 0.00 3.32 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.44 0.00 40 C 8.73 4.90 0.00 3.14 3.16 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 41 K 8.35 4.10 0.00 1.80 1.77 0.00 1.78 0.00 0.00 1.60 0.00 0.00 3.29 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.60 1.44 7.81 42 P 0.00 4.60 0.00 2.15 2.14 0.00 3.64 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 2.15 2.18 0.00 43 V 7.56 5.21 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 0.72 0.00 0.00 0.95 0.00 0.00 44 N 9.19 4.73 0.00 2.59 2.34 0.00 0.00 7.14 6.82 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 45 T 7.94 4.94 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 0.83 0.00 0.00 46 F 9.01 4.81 0.00 2.95 2.85 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 47 V 9.16 4.39 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 1.07 0.00 0.00 1.12 0.00 0.00 48 H 8.42 5.94 0.00 3.09 3.54 0.00 5.61 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.75 4.80 0.00 1.96 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 0.00 2.26 2.28 0.00 50 S 8.32 4.43 0.00 4.08 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 51 L 8.45 4.04 0.00 1.84 1.74 1.02 0.96 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 52 A 8.02 4.00 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 53 D 7.82 4.33 0.00 2.88 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 54 V 7.84 3.80 2.20 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 1.25 0.00 0.00 1.12 0.00 0.00 55 Q 8.46 3.95 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.34 2.50 0.00 56 A 7.98 4.11 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 57 V 7.68 3.56 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 1.07 0.00 0.00 1.02 0.00 0.00 58 C 7.94 3.86 0.00 2.93 2.88 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 59 S 7.50 4.58 0.00 3.95 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 60 Q 7.63 4.54 0.00 2.01 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.99 0.00 0.00 0.00 0.00 0.00 2.54 2.44 0.00 61 K 7.97 4.23 0.00 1.54 1.60 0.00 1.61 0.00 0.00 1.52 0.00 0.00 2.76 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.47 7.81 62 N 8.82 4.73 0.00 2.88 2.71 0.00 0.00 7.00 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 63 V 8.55 4.60 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 0.75 0.00 0.00 0.84 0.00 0.00 64 A 8.38 4.17 1.19 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 0.00 0.00 0.00 65 C 8.68 4.71 0.00 3.14 2.98 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 66 K 9.12 3.69 0.00 1.74 1.90 0.00 1.87 0.00 0.00 1.78 0.00 0.00 3.05 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.60 7.81 67 N 8.10 4.59 0.00 2.81 2.89 0.00 0.00 6.19 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 68 G 8.24 3.94 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 0.00 0.00 0.00 69 Q 8.66 4.22 0.00 2.25 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.71 0.00 0.00 0.00 0.00 0.00 2.36 2.27 0.00 70 T 8.27 4.58 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 1.18 0.00 0.00 71 N 7.86 4.95 0.00 3.08 3.16 0.00 0.00 6.04 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 72 C 7.36 5.33 0.00 2.70 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 73 Y 8.94 5.08 0.00 2.81 2.83 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 9.44 5.14 0.00 1.90 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.00 0.00 0.00 0.00 0.00 0.00 2.16 2.21 0.00 75 S 8.51 4.55 0.00 3.93 3.83 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.91 4.29 0.00 3.08 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 77 S 7.78 5.14 0.00 3.89 3.91 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 0.00 0.00 0.00 78 T 8.37 4.08 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 1.05 0.00 0.00 79 M 9.04 4.90 0.00 1.95 2.01 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.48 0.00 80 S 8.96 5.10 0.00 3.95 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 81 I 8.98 5.22 1.90 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.67 1.02 0.00 0.00 82 T 8.95 5.03 4.40 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 1.29 0.00 0.00 83 D 9.64 4.95 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 84 C 9.53 5.40 0.00 2.90 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 85 R 8.55 5.07 0.00 1.87 1.81 0.00 3.14 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 86 E 9.01 4.06 0.00 2.02 1.76 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 2.13 1.95 0.00 87 T 8.11 4.41 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 1.18 0.00 0.00 88 G 8.69 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 89 S 7.86 4.28 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 90 S 7.45 4.17 0.00 3.87 3.89 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 91 K 8.69 4.57 0.00 1.78 1.66 0.00 1.76 0.00 0.00 1.59 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.48 7.81 92 Y 8.74 4.28 0.00 2.93 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 93 P 0.00 3.25 0.00 1.81 1.41 0.00 3.73 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 1.80 1.82 0.00 94 N 8.23 4.67 0.00 2.87 2.75 0.00 0.00 7.02 7.88 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 95 C 7.82 4.67 0.00 3.13 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 96 A 8.73 5.03 1.09 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 0.00 0.00 97 Y 9.05 5.11 0.00 2.86 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 98 K 8.99 4.60 0.00 1.84 1.83 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.42 7.81 99 T 8.65 4.51 4.32 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 1.27 0.00 0.00 100 T 9.05 4.54 4.40 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 1.24 0.00 0.00 101 Q 8.69 4.82 0.00 1.98 1.96 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 2.40 0.00 102 A 8.11 4.41 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 0.00 103 N 8.72 5.85 0.00 2.57 2.72 0.00 0.00 7.05 7.61 0.00 0.00 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 K 8.36 4.71 0.00 1.70 1.80 0.00 1.70 0.00 0.00 1.87 0.00 0.00 2.79 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.49 7.81 105 H 9.49 4.71 0.00 3.16 3.21 0.00 5.58 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.48 4.78 1.60 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.84 1.10 0.00 0.00 107 I 8.32 4.95 1.75 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 1.12 0.59 0.78 0.00 0.00 108 V 8.57 4.73 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 0.58 0.00 0.00 0.81 0.00 0.00 109 A 8.85 5.13 1.25 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 0.00 0.00 0.00 110 C 8.48 5.21 0.00 1.93 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 0.00 0.00 0.00 111 E 7.97 4.77 0.00 2.09 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 0.00 1.96 2.08 0.00 112 G 9.28 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 0.00 113 N 8.17 5.08 0.00 2.64 2.70 0.00 0.00 6.91 7.69 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 0.00 114 P 0.00 4.38 0.00 2.24 2.05 0.00 3.83 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 1.96 0.00 115 Y 8.32 4.71 0.00 2.83 2.91 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 0.00 0.00 0.00 116 V 8.02 4.47 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 0.80 0.00 0.00 0.94 0.00 0.00 117 P 0.00 4.35 0.00 0.49 1.17 0.00 3.39 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.83 0.00 118 V 8.27 4.44 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 0.59 0.00 0.00 0.93 0.00 0.00 119 H 7.74 5.07 0.00 3.29 3.09 0.00 5.85 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.90 4.66 0.00 2.77 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 0.00 121 D 8.58 4.59 0.00 2.60 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 A 6.82 4.65 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 0.00 123 S 8.65 5.02 0.00 3.95 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 0.00 124 V 8.83 4.15 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 0.70 0.00 0.00 0.94 0.00 0.00