NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 D 4.5950 8.2233 120.1875 54.0030 42.7757 176.2137 4 N 4.1214 8.7557 124.3296 55.9737 38.6393 175.7793 5 N 4.2908 8.4829 117.6227 56.4504 38.9984 176.7351 6 Q 3.8614 8.0098 119.8463 59.1732 29.2416 177.5537 7 A 3.9001 8.0801 121.9426 55.3848 18.2759 179.6533 8 L 3.8657 7.9170 117.0410 57.9144 41.6598 179.8963 9 K 3.9677 8.0114 118.3900 59.6638 31.8050 179.1881 10 D 4.3508 8.7794 118.0360 56.4497 40.7709 177.5922 11 A 4.4319 7.5304 119.1136 51.0684 19.2538 176.9203 12 G 3.8420 8.2293 105.4844 46.7887 0.0000 173.9828 13 L 4.7971 7.8580 118.2600 51.7943 44.8001 176.9778 14 K 3.9150 8.5814 124.1719 56.2271 32.6212 176.5882 15 V 3.7591 8.3907 126.2955 63.0566 31.0887 175.2576 16 T 4.7055 8.0329 117.4232 59.0859 72.9711 174.6271 17 L 3.9265 8.1962 121.6967 57.9515 42.0436 176.8457 18 P 4.2654 0.0000 0.0000 65.7903 31.1130 178.8251 19 R 4.0122 7.9495 116.3777 58.8837 29.9489 179.1127 20 L 4.0295 7.8552 118.4489 57.9433 41.7413 179.6748 21 K 3.9978 8.1084 118.3002 59.5919 31.9418 179.5277 22 I 3.8471 7.6220 120.1503 63.9949 37.1429 178.1791 23 L 4.1068 7.9703 121.5255 58.0344 41.6611 178.9346 24 E 4.2225 8.0324 119.2982 58.7864 29.7374 179.0013 25 V 3.9062 7.8056 118.2717 66.2294 31.3934 178.1654 26 L 4.0978 7.7441 117.0527 57.4422 41.5088 178.6316 27 Q 4.2663 7.8569 115.9196 55.5772 29.0768 175.2909 28 Q 4.4287 7.6609 121.2211 54.1194 29.8956 174.8123 29 P 4.1830 0.0000 0.0000 65.7787 31.4102 176.9381 30 E 4.4235 8.0625 112.2525 56.8494 29.7640 176.0982 31 C 4.9061 8.1292 116.0950 59.7901 29.5332 175.1274 32 Q 3.9786 8.4983 123.2559 59.0338 28.7486 175.2886 33 H 5.1990 8.0725 115.3887 54.1678 30.1785 174.0990 34 I 4.9982 9.0584 124.3729 59.2497 41.7358 174.8078 35 S 5.1090 10.0253 123.7643 57.0529 64.5025 175.1456 36 A 3.8033 8.8368 122.2147 55.2118 17.9003 179.9304 37 E 3.9574 8.0609 116.6591 59.6299 29.6860 179.1423 38 E 3.9738 8.0397 118.2945 59.3620 29.5207 179.3011 39 L 3.9375 8.1343 120.3882 58.0720 42.1545 178.0532 40 Y 4.0950 8.3049 119.9568 60.9523 38.7295 178.3676 41 K 3.4827 8.2017 119.2579 59.2536 32.1583 179.2238 42 K 3.8916 8.0618 119.7381 59.5047 32.0370 178.9253 43 L 3.9785 7.8500 119.2841 57.7268 41.4080 179.5406 44 I 3.5604 7.5765 119.8568 64.4579 36.7703 178.2604 45 D 4.3487 7.8843 118.5420 56.8334 40.6896 177.8901 46 L 4.3367 7.4649 116.7693 54.4012 41.8151 177.4082 47 G 3.8498 8.0106 107.4191 46.1605 0.0000 174.0311 48 E 4.3046 8.1503 118.6578 55.9967 30.0734 176.4099 49 E 4.6792 8.4119 118.2441 56.2252 30.3015 176.1795 50 I 4.2250 7.7652 120.0041 60.0617 38.3127 177.0990 51 G 3.9157 8.4271 111.9907 44.0237 0.0000 174.0284 52 L 3.5171 8.0018 121.6686 57.6240 41.8340 179.2470 53 A 4.0886 7.7983 120.4245 55.4622 18.3848 179.4257 54 T 3.7718 7.8613 113.8122 66.6543 68.4114 176.7079 55 V 3.3677 7.4183 120.0048 66.1507 31.5458 177.4847 56 Y 4.0569 7.5791 116.2970 61.1267 37.7590 178.8497 57 R 3.8177 8.3210 119.6809 59.4779 30.1950 178.6903 58 V 3.4163 7.8523 118.2920 65.8973 31.4784 177.7340 59 L 3.5797 7.7231 118.9425 57.9175 41.2247 179.4129 60 N 4.4610 7.9995 116.2480 56.3049 38.4554 177.5066 61 Q 4.0306 8.0531 119.4964 59.0232 28.8488 178.6863 62 F 4.4524 8.5592 119.2432 60.7516 38.9595 177.2715 63 D 4.5811 8.3822 117.3567 57.7708 40.9706 177.9032 64 D 4.4547 8.3042 117.9887 56.9395 40.9010 177.8983 65 A 4.5417 8.0061 118.4610 51.1880 19.3120 177.8210 66 G 3.9155 7.9698 105.3726 46.0051 0.0000 175.3456 67 I 3.7391 8.0368 122.4022 63.6166 37.1951 176.3697 68 V 5.0202 7.5990 110.5377 59.8388 34.8999 175.1850 69 T 4.6646 9.1733 119.0212 61.8595 71.3135 173.2547 70 R 4.2986 8.4027 125.5303 54.7068 32.2285 174.6606 71 H 4.7467 8.1976 123.1099 54.1443 31.5747 172.5707 72 H 4.8351 8.8982 121.1426 55.0848 29.5028 174.9247 73 F 5.7007 8.9084 122.5099 54.4399 42.2015 175.1046 74 E 3.7293 8.0424 121.0021 58.4517 29.2676 177.2583 75 G 3.8752 8.7170 114.2467 45.0330 0.0000 173.4236 76 G 3.8456 8.1236 106.9287 45.5506 0.0000 173.1916 77 K 4.6318 7.9452 119.6995 54.5628 34.8557 174.7810 78 S 4.8247 8.4941 121.5272 56.8431 65.0730 173.0019 79 V 4.4576 7.7952 124.7361 61.0653 33.9262 174.3167 80 F 5.4601 9.8567 126.8070 55.8267 42.2291 174.2755 81 E 5.2592 8.7869 118.3377 53.7072 33.3981 174.5668 82 L 4.5331 8.5305 120.8764 54.9335 42.4375 177.3278 83 S 4.4841 8.8125 120.3108 59.0344 63.2822 173.9166 84 T 4.7332 8.2825 112.6596 60.4412 71.6792 173.6600 85 Q 4.1805 8.4810 119.7274 56.8313 29.3857 175.6405 86 H 4.1748 8.0621 117.0633 56.0274 29.0335 173.8545 87 H 4.1534 8.4891 127.2243 56.5717 30.2602 173.9738 88 H 4.4199 7.5135 119.2363 54.9629 31.0371 172.1537 89 D 4.7665 8.3730 119.6996 52.6098 45.2146 174.1285 90 H 5.3594 8.7841 115.2957 54.2033 32.4423 172.7472 91 L 5.0505 9.2711 125.7837 53.2504 44.4871 174.9926 92 V 4.5757 8.8228 126.5673 61.0643 34.3421 173.8004 93 C 4.8299 8.7803 126.7182 56.6163 40.2489 174.6703 94 L 3.8762 8.8460 126.2078 57.9217 41.3969 179.0150 95 D 4.4943 8.2766 117.4500 56.3002 40.1480 177.4461 96 C 4.1378 8.0320 117.7918 60.4302 28.2821 175.0512 97 G 3.9062 8.0689 105.7070 46.1343 0.0000 172.8075 98 E 4.6163 7.8605 118.1585 54.6866 32.1201 175.4413 99 V 4.4070 8.2733 121.7526 61.3844 33.6776 174.6475 100 I 4.3588 8.6705 130.3950 60.2767 38.5310 175.4972 101 E 4.9232 8.8485 126.9428 56.2887 30.5725 175.8214 102 F 5.0877 8.5441 116.9541 55.9452 42.0697 173.0226 103 S 4.8225 8.6658 113.4900 56.8645 65.6146 172.5463 104 D 4.8759 8.7823 125.3951 51.9371 43.5411 175.1629 105 D 4.4219 9.1398 127.1454 57.7174 40.8606 179.0028 106 V 3.5625 7.7856 117.6440 66.1361 31.5222 177.5330 107 I 3.6823 8.0105 119.3608 64.8307 36.5769 178.1247 108 E 3.8795 8.2985 118.9634 59.4604 29.2591 179.4381 109 Q 3.9496 8.2848 119.7019 59.2633 29.2171 178.3216 110 R 3.9448 8.4650 119.5208 59.3079 30.1815 179.0141 111 Q 4.0057 8.2984 118.0020 58.9717 28.7019 179.1087 112 K 3.9931 7.7237 118.6989 59.5484 32.1007 179.3138 113 E 3.9971 8.1792 118.7966 59.3278 29.3443 179.5230 114 I 3.7808 7.9494 119.6771 64.3733 37.2381 178.3978 115 A 4.1915 8.0290 121.1281 54.9946 18.1994 179.3936 116 A 3.9263 8.0105 119.3837 55.3685 18.2829 179.7793 117 K 3.8095 7.9850 116.4238 58.7350 32.0886 176.9594 118 Y 4.5915 7.0563 113.1503 56.9676 38.4919 175.0832 119 N 4.1792 7.9853 115.5760 54.5278 36.6746 174.3943 120 V 4.2655 8.1422 116.7694 61.0856 33.4061 174.7385 121 Q 4.3328 8.5323 126.4262 54.4170 28.7510 175.7361 122 L 4.1079 8.5130 124.1911 55.2884 42.3206 177.0242 123 T 4.3234 8.3654 113.0442 63.0193 70.1450 173.6586 124 N 4.6415 7.5359 116.0513 52.9903 39.5605 172.4373 125 H 4.7304 8.0777 111.0958 54.8755 30.6525 173.0354 126 S 4.5759 8.4171 115.1934 56.3182 65.5833 173.4084 127 L 4.4434 8.1219 123.6538 53.8380 44.8134 174.2389 128 Y 5.2638 8.3090 124.5141 56.3073 39.9364 175.2645 129 L 4.4677 9.0146 125.4636 53.3270 43.7709 175.3512 130 Y 5.1139 8.1219 121.0452 56.7601 41.1248 175.0323 131 G 4.2458 8.6368 108.2847 46.0970 0.0000 171.6732 132 K 5.0895 8.6073 118.7683 54.8519 34.1672 178.0305 133 C 4.5569 9.5264 120.5946 57.2591 42.0246 174.0162 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 3 D 8.22 4.60 0.00 2.76 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 4 N 8.76 4.12 0.00 2.84 2.83 0.00 0.00 7.14 6.03 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 5 N 8.48 4.29 0.00 2.80 2.88 0.00 0.00 6.74 7.49 0.00 0.00 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 Q 8.01 3.86 0.00 2.15 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.83 0.00 0.00 0.00 0.00 0.00 2.41 2.66 0.00 7 A 8.08 3.90 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 8 L 7.92 3.87 0.00 1.90 1.74 0.97 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 9 K 8.01 3.97 0.00 1.96 1.85 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.59 7.81 10 D 8.78 4.35 0.00 2.73 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 11 A 7.53 4.43 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 12 G 8.23 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 13 L 7.86 4.80 0.00 1.81 1.62 1.12 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 14 K 8.58 3.92 0.00 1.73 1.74 0.00 1.78 0.00 0.00 1.64 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.44 7.81 15 V 8.39 3.76 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 0.89 0.00 0.00 0.97 0.00 0.00 16 T 8.03 4.71 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 1.22 0.00 0.00 17 L 8.20 3.93 0.00 1.78 1.70 0.92 0.90 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 18 P 0.00 4.27 0.00 2.16 2.05 0.00 3.65 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 19 R 7.95 4.01 0.00 1.95 2.22 0.00 3.42 0.00 0.00 3.41 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 20 L 7.86 4.03 0.00 1.89 1.73 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 21 K 8.11 4.00 0.00 1.82 1.86 0.00 1.90 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.39 0.00 0.00 0.00 0.00 1.62 1.49 7.81 22 I 7.62 3.85 1.91 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.72 0.79 0.00 0.00 23 L 7.97 4.11 0.00 2.08 1.89 0.71 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 24 E 8.03 4.22 0.00 2.20 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 2.35 2.32 0.00 25 V 7.81 3.91 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 1.03 0.00 0.00 0.96 0.00 0.00 26 L 7.74 4.10 0.00 1.88 1.76 1.06 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 27 Q 7.86 4.27 0.00 2.29 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.93 0.00 0.00 0.00 0.00 0.00 2.35 2.51 0.00 28 Q 7.66 4.43 0.00 2.29 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.70 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 29 P 0.00 4.18 0.00 2.03 2.14 0.00 3.66 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 2.03 2.10 0.00 30 E 8.06 4.42 0.00 2.08 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 2.26 2.27 0.00 31 C 8.13 4.91 0.00 3.18 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 32 Q 8.50 3.98 0.00 2.26 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.61 6.87 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 33 H 8.07 5.20 0.00 3.12 3.32 0.00 5.90 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 I 9.06 5.00 2.06 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 1.37 1.67 1.02 0.00 0.00 35 S 10.03 5.11 0.00 4.17 4.05 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 0.00 0.00 0.00 36 A 8.84 3.80 0.82 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 0.00 0.00 37 E 8.06 3.96 0.00 2.13 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 2.48 2.51 0.00 38 E 8.04 3.97 0.00 2.21 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 0.00 2.37 2.37 0.00 39 L 8.13 3.94 0.00 1.89 1.74 0.83 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 40 Y 8.30 4.09 0.00 2.91 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 41 K 8.20 3.48 0.00 2.01 1.77 0.00 1.71 0.00 0.00 1.60 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.67 7.81 42 K 8.06 3.89 0.00 1.90 2.00 0.00 1.49 0.00 0.00 1.63 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.49 7.81 43 L 7.85 3.98 0.00 1.85 1.64 0.90 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 44 I 7.58 3.56 1.67 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 0.92 0.24 0.78 0.00 0.00 45 D 7.88 4.35 0.00 2.76 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 46 L 7.46 4.34 0.00 1.76 1.68 0.90 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 47 G 8.01 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 48 E 8.15 4.30 0.00 2.05 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 2.31 2.40 0.00 49 E 8.41 4.68 0.00 1.93 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 2.21 2.29 0.00 50 I 7.77 4.23 1.89 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 1.34 0.51 0.91 0.00 0.00 51 G 8.43 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 52 L 8.00 3.52 0.00 0.51 1.29 0.42 0.94 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 53 A 7.80 4.09 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 54 T 7.86 3.77 4.34 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 1.15 0.00 0.00 55 V 7.42 3.37 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 0.92 0.00 0.00 0.98 0.00 0.00 56 Y 7.58 4.06 0.00 3.28 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 57 R 8.32 3.82 0.00 1.83 1.88 0.00 3.07 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 58 V 7.85 3.42 1.78 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 -0.06 0.00 0.00 0.77 0.00 0.00 59 L 7.72 3.58 0.00 1.48 0.73 0.11 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 60 N 8.00 4.46 0.00 3.10 2.89 0.00 0.00 7.02 8.39 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 61 Q 8.05 4.03 0.00 2.23 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.77 0.00 0.00 0.00 0.00 0.00 2.39 2.51 0.00 62 F 8.56 4.45 0.00 3.15 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 63 D 8.38 4.58 0.00 3.15 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 64 D 8.30 4.45 0.00 2.86 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 65 A 8.01 4.54 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.97 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 67 I 8.04 3.74 1.68 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.53 0.32 0.00 0.00 68 V 7.60 5.02 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 0.88 0.00 0.00 1.18 0.00 0.00 69 T 9.17 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 1.09 0.00 0.00 70 R 8.40 4.30 0.00 1.63 1.57 0.00 2.92 0.00 0.00 2.89 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.50 0.00 71 H 8.20 4.75 0.00 1.79 2.06 0.00 5.66 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 H 8.90 4.84 0.00 3.12 3.28 0.00 5.67 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 F 8.91 5.70 0.00 2.90 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 74 E 8.04 3.73 0.00 1.16 1.21 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 2.07 2.03 0.00 75 G 8.72 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 76 G 8.12 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 77 K 7.95 4.63 0.00 1.89 1.73 0.00 1.77 0.00 0.00 1.89 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.51 7.81 78 S 8.49 4.82 0.00 3.81 3.12 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 79 V 7.80 4.46 1.49 0.00 0.00 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 0.95 0.00 0.00 80 F 9.86 5.46 0.00 2.93 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 81 E 8.79 5.26 0.00 2.05 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 2.28 2.19 0.00 82 L 8.53 4.53 0.00 1.55 1.64 0.93 0.89 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 83 S 8.81 4.48 0.00 3.82 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 84 T 8.28 4.73 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 1.23 0.00 0.00 85 Q 8.48 4.18 0.00 2.08 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.20 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 86 H 8.06 4.17 0.00 3.13 3.30 0.00 5.74 0.00 0.00 0.00 0.00 6.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 H 8.49 4.15 0.00 3.13 3.16 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 88 H 7.51 4.42 0.00 2.99 3.10 0.00 5.52 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 D 8.37 4.77 0.00 1.58 2.27 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 90 H 8.78 5.36 0.00 3.18 3.08 0.00 5.77 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 L 9.27 5.05 0.00 1.94 1.52 0.77 0.51 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 92 V 8.82 4.58 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 0.65 0.00 0.00 -0.11 0.00 0.00 93 C 8.78 4.83 0.00 2.96 3.21 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 94 L 8.85 3.88 0.00 1.53 1.73 1.00 1.26 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 95 D 8.28 4.49 0.00 2.79 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 96 C 8.03 4.14 0.00 2.99 3.05 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 0.00 0.00 0.00 97 G 8.07 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 0.00 0.00 0.00 98 E 7.86 4.62 0.00 1.91 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 0.00 2.36 2.25 0.00 99 V 8.27 4.41 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 0.73 0.00 0.00 1.04 0.00 0.00 100 I 8.67 4.36 1.91 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 1.24 0.37 0.97 0.00 0.00 101 E 8.85 4.92 0.00 1.87 1.86 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 2.31 2.34 0.00 102 F 8.54 5.09 0.00 3.05 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 0.00 103 S 8.67 4.82 0.00 3.84 3.76 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 0.00 104 D 8.78 4.88 0.00 2.93 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 0.00 105 D 9.14 4.42 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 0.00 106 V 7.79 3.56 2.25 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 1.02 0.00 0.00 0.94 0.00 0.00 107 I 8.01 3.68 2.09 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 1.57 0.49 0.96 0.00 0.00 108 E 8.30 3.88 0.00 2.13 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 2.55 2.44 0.00 109 Q 8.28 3.95 0.00 2.19 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 110 R 8.47 3.94 0.00 1.97 1.97 0.00 3.50 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.82 0.00 111 Q 8.30 4.01 0.00 2.18 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.33 2.57 0.00 112 K 7.72 3.99 0.00 1.98 1.85 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.58 7.81 113 E 8.18 4.00 0.00 2.21 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 2.32 2.50 0.00 114 I 7.95 3.78 2.06 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 1.53 1.31 1.06 0.00 0.00 115 A 8.03 4.19 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 0.00 116 A 8.01 3.93 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 0.00 117 K 7.98 3.81 0.00 1.82 1.84 0.00 1.57 0.00 0.00 1.01 0.00 0.00 2.60 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.07 1.30 7.81 118 Y 7.06 4.59 0.00 3.03 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 0.00 119 N 7.99 4.18 0.00 2.90 2.90 0.00 0.00 6.66 7.30 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 0.00 120 V 8.14 4.27 2.13 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 0.80 0.00 0.00 1.04 0.00 0.00 121 Q 8.53 4.33 0.00 2.07 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.68 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 122 L 8.51 4.11 0.00 1.64 1.63 0.95 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 123 T 8.37 4.32 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 1.22 0.00 0.00 124 N 7.54 4.64 0.00 2.77 2.82 0.00 0.00 5.83 7.90 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 0.00 125 H 8.08 4.73 0.00 3.19 3.23 0.00 5.47 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 S 8.42 4.58 0.00 3.25 3.77 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.12 4.44 0.00 1.73 1.68 0.98 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 128 Y 8.31 5.26 0.00 2.50 2.13 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 0.00 129 L 9.01 4.47 0.00 1.46 1.48 0.56 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 130 Y 8.12 5.11 0.00 2.91 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.64 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 0.00 0.00 0.00 0.00 132 K 8.61 5.09 0.00 1.64 1.73 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.73 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.45 7.81 133 C 9.53 4.56 0.00 2.95 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