NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 C 4.6375 8.2033 118.3985 59.6986 29.8189 173.7145 2 D 4.2198 9.0484 119.7285 58.2115 40.6446 177.3282 3 A 4.0950 8.8125 121.0777 54.2916 19.4011 177.6548 4 F 4.5867 8.3066 113.6553 58.3038 39.7792 176.7939 5 V 3.9610 7.6452 120.8739 62.3990 31.9357 176.1306 6 G 3.8680 7.4832 112.9131 44.2940 0.0000 171.1258 7 T 5.0281 7.7274 116.0939 61.5023 71.1436 173.9156 8 W 5.4470 9.4994 125.9341 54.6342 33.2114 174.4740 9 K 5.1176 9.3581 122.6544 54.7367 35.2760 175.1113 10 L 3.4760 8.6130 125.3830 55.3633 42.0651 175.9862 11 V 4.2548 8.4500 126.6645 64.3611 32.9839 175.5829 12 S 4.6830 7.4080 112.4277 57.2912 66.4834 172.8315 13 S 4.9470 8.3506 114.2088 56.6639 65.6610 172.4865 14 E 4.5008 8.9125 126.9715 54.9971 32.6451 175.4079 15 N 4.1281 9.0653 122.2640 54.5094 36.5615 176.0480 16 F 4.4781 8.2069 124.2290 60.8658 39.4159 176.4553 17 D 4.1159 8.1325 117.4025 57.3206 41.2010 177.7675 18 D 4.3519 8.0787 119.0237 57.3585 40.8597 177.9466 19 Y 4.0637 8.2256 120.0935 61.1098 38.7798 178.0871 20 M 3.7822 8.0229 119.6128 57.9792 31.9002 178.9163 21 K 3.8705 8.0503 118.8221 59.5475 32.0622 179.0036 22 E 3.9045 7.7221 117.8417 59.0286 29.6141 178.4297 23 V 3.8880 7.3291 116.6390 63.5329 31.6018 176.3207 24 G 3.8419 7.8999 105.9916 46.3948 0.0000 173.6001 25 V 3.7956 7.6926 119.4415 61.7098 32.2758 176.8954 26 G 3.8560 8.4191 112.9834 44.0356 0.0000 174.1123 27 F 4.0240 8.9346 123.0330 61.4391 39.1633 177.5240 28 A 3.7786 8.0496 119.3035 55.5677 18.2268 179.6138 29 T 3.6204 7.7642 113.6898 66.6381 68.4753 177.0216 30 R 3.8014 8.1016 120.3102 59.0303 30.1546 179.2943 31 K 3.7123 7.8627 118.4881 59.3180 32.0359 179.6213 32 V 3.3007 7.5914 118.3706 65.7442 30.0183 177.8837 33 A 4.1200 8.0301 121.0541 55.2211 18.0554 179.9173 34 G 3.8169 8.2548 103.2219 47.7680 0.0000 175.3384 35 M 4.2379 7.6297 119.5246 57.6141 32.2355 178.0756 36 A 4.0641 8.0624 120.4987 53.2593 19.8377 177.7856 37 K 3.7220 7.3969 112.3286 56.6870 30.0847 173.1426 38 P 5.1852 0.0000 0.0000 62.6260 32.5458 177.9190 39 N 5.0366 8.8136 118.8609 53.4325 40.6807 173.3424 40 M 4.9978 9.3158 120.0930 53.9356 35.4645 174.0334 41 I 5.1028 9.0283 126.9743 59.6332 40.4364 174.4907 42 I 5.1631 9.0164 128.1637 59.5799 40.2992 174.9119 43 S 5.0200 8.8999 119.7307 56.9174 66.9660 172.8806 44 V 4.7236 8.2163 119.5441 61.2565 34.7233 174.7270 45 N 4.6911 9.0568 125.7536 52.7690 41.4467 174.7211 46 G 3.8568 8.2759 118.6125 47.0981 0.0000 172.6484 47 D 4.7509 8.8619 123.4147 52.4922 39.5525 175.0902 48 L 4.6365 7.7320 120.8959 53.4289 43.9212 175.4193 49 V 4.4360 7.9748 124.2195 61.2921 33.9157 174.3681 50 T 4.9778 8.6278 124.0428 61.7099 71.7708 173.0702 51 I 4.8949 8.8687 126.5610 59.6171 40.2919 174.3881 52 R 5.1675 9.0060 127.8999 54.4455 33.0481 174.3459 53 S 5.4427 8.8455 119.4078 55.5871 65.8305 172.4196 54 E 5.2767 8.7113 125.0335 54.8364 33.3760 174.8176 55 S 4.9791 8.8209 117.5315 57.5410 66.1562 174.4536 56 T 3.9964 8.6611 109.7317 64.8168 68.3169 175.4412 57 F 4.4936 7.9556 123.3971 59.7848 39.9149 174.4248 58 K 4.4637 8.2911 119.8044 54.6930 36.2014 175.3510 59 N 5.3132 8.4948 119.1591 51.8743 40.7142 174.2225 60 T 4.8020 8.6966 112.2467 60.2492 72.8510 172.3723 61 E 5.2817 8.4551 121.7394 55.2254 32.7529 174.0950 62 I 4.8503 8.8518 119.9090 59.2588 41.1061 174.4026 63 S 5.0749 8.5081 119.8281 56.8614 66.1546 173.0955 64 F 4.5102 8.0029 117.4274 55.6856 41.6144 172.5295 65 K 4.9051 8.3919 120.6623 54.3902 34.3912 175.4875 66 L 4.5324 8.5068 127.4190 56.4889 41.8549 177.4957 67 G 3.9723 9.2375 113.0217 44.8794 0.0000 172.9737 68 V 4.3136 7.2096 119.3774 60.5217 32.8453 174.8706 69 E 4.5818 8.7638 128.9012 56.6449 30.3754 175.4277 70 F 5.0868 8.7915 120.1185 55.5678 42.2098 172.6887 71 D 5.0766 8.7556 119.3310 53.7544 41.8382 175.8149 72 E 4.7912 9.0759 123.4462 54.4211 33.4167 174.1030 73 I 4.9654 8.3248 126.7922 59.6549 39.0840 175.9139 74 T 4.1586 8.6986 117.8515 60.5034 69.7669 175.4426 75 A 3.9183 8.5954 124.9775 55.2452 18.3357 178.1137 76 D 4.7791 8.0552 112.7272 53.1098 39.5604 175.7875 77 D 4.4302 8.0361 117.7098 55.9476 38.7635 174.2682 78 R 4.1897 7.9327 117.3198 55.2897 31.2078 175.5547 79 K 4.8195 8.3751 121.9465 55.0128 33.6636 175.5003 80 V 4.7764 8.9465 120.2233 59.5610 36.5979 174.4746 81 K 4.7508 8.7737 121.3944 55.0990 33.8438 176.0701 82 S 5.0761 8.4306 121.1161 56.5525 66.6415 173.0278 83 I 4.9029 8.3245 122.1366 59.4127 41.5700 173.7921 84 I 5.0847 8.5172 129.1579 59.6834 40.3069 174.5421 85 T 4.9647 8.7423 116.0853 59.7270 72.6997 172.5198 86 L 5.0012 8.4595 124.1718 53.6572 43.5178 175.4837 87 D 4.6318 8.8057 126.7747 53.4487 43.7749 176.1127 88 G 4.0073 9.7045 113.0436 46.6720 0.0000 174.1525 89 G 3.9308 8.6601 105.3203 45.0312 0.0000 173.7022 90 A 5.1384 7.8980 121.3029 49.8789 22.4768 175.9716 91 L 4.5689 8.3662 120.6332 53.8856 43.3461 176.0117 92 V 4.4908 8.7849 124.9401 61.0595 33.8779 173.8538 93 Q 5.1268 9.0629 129.7630 54.2282 31.7402 174.0607 94 V 4.8585 8.5961 125.8673 61.1811 34.5397 173.9607 95 Q 5.1748 9.0322 126.3973 54.0564 31.8333 174.6424 96 K 5.4387 8.9507 122.8699 54.4849 35.9350 175.2434 97 W 5.0556 9.0094 119.5978 56.2226 31.8500 174.1648 98 D 4.2933 9.9126 120.6636 55.4782 38.0220 174.8919 99 G 3.7571 8.2417 104.1274 45.5176 0.0000 173.9039 100 K 4.2980 7.4488 119.4702 54.4204 34.5478 174.9120 101 S 5.2707 7.6807 113.1952 57.6032 66.0771 173.1672 102 T 4.9974 9.1483 114.8602 60.9394 71.3689 172.3491 103 T 5.1852 8.5671 122.6157 61.8362 71.6648 173.2299 104 I 4.8114 8.8548 126.7473 59.3652 40.3472 174.2240 105 K 4.9121 9.1024 129.1273 54.5773 34.7778 174.7863 106 R 5.1611 8.8018 126.4924 54.2522 32.8351 175.0140 107 K 5.2171 9.0818 122.4480 55.3477 36.6175 175.5993 108 R 4.5806 8.4345 120.0666 55.6623 31.6869 176.3107 109 D 4.4189 8.7785 122.0441 53.3776 43.6971 175.4763 110 G 3.7522 8.2676 119.2796 47.1840 0.0000 173.0102 111 D 4.7322 8.8785 124.4156 53.0747 39.9108 176.0115 112 K 4.9305 8.1006 120.2363 55.2477 35.3467 174.6736 113 L 4.7224 8.5609 123.5643 53.2217 44.3090 175.0292 114 V 4.8419 8.7945 126.5821 61.0944 34.1939 174.1116 115 V 4.7020 8.9846 128.2655 61.1188 33.7730 173.6090 116 E 5.1121 9.0177 129.0603 54.5520 32.2685 174.1374 117 C 5.1994 8.7915 124.0394 57.8001 31.6574 173.0765 118 V 4.9150 8.9201 123.0061 61.3423 34.6644 173.9540 119 M 4.8310 9.3282 127.2436 53.8013 35.0386 175.0152 120 K 4.0573 9.6980 127.3342 57.8988 31.3426 175.4172 121 G 3.9473 7.9700 105.5528 46.1824 0.0000 172.1970 122 V 4.0804 7.8507 121.1695 61.9669 32.2298 174.3544 123 T 5.1771 8.4938 117.2252 59.9587 70.6438 173.1628 124 S 5.0462 8.9301 119.9477 56.7910 65.4949 172.5767 125 T 5.0321 8.6268 122.2644 61.8126 71.7001 173.0641 126 R 4.9327 9.1130 125.3293 54.2424 33.6674 174.7095 127 V 4.8529 8.5188 123.2855 61.3257 34.2928 173.9056 128 Y 5.3510 9.3759 125.0488 56.1416 41.7067 174.3486 129 E 5.4360 9.1278 119.3096 54.2473 33.5890 175.2827 130 R 3.9873 8.5323 119.1805 55.8939 30.9046 176.9099 131 A 4.1182 8.3891 125.3190 52.5108 18.4190 177.3274 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 C 8.20 4.64 0.00 3.13 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 0.00 2 D 9.05 4.22 0.00 2.90 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 3 A 8.81 4.10 1.04 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 0.00 0.00 4 F 8.31 4.59 0.00 3.28 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 5 V 7.65 3.96 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 0.77 0.00 0.00 1.01 0.00 0.00 6 G 7.48 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 0.00 0.00 0.00 7 T 7.73 5.03 4.13 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 1.22 0.00 0.00 8 W 9.50 5.45 0.00 3.12 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 9 K 9.36 5.12 0.00 1.81 1.94 0.00 1.33 0.00 0.00 1.59 0.00 0.00 2.83 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.42 7.81 10 L 8.61 3.48 0.00 1.26 1.44 0.28 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 11 V 8.45 4.25 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 0.82 0.00 0.00 0.93 0.00 0.00 12 S 7.41 4.68 0.00 3.84 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 13 S 8.35 4.95 0.00 3.69 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 14 E 8.91 4.50 0.00 2.03 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 2.22 2.27 0.00 15 N 9.07 4.13 0.00 3.14 2.95 0.00 0.00 6.78 8.13 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 16 F 8.21 4.48 0.00 3.09 3.11 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 0.00 0.00 0.00 17 D 8.13 4.12 0.00 2.83 2.65 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 18 D 8.08 4.35 0.00 2.95 2.74 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 0.00 0.00 0.00 0.00 19 Y 8.23 4.06 0.00 3.08 3.09 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 20 M 8.02 3.78 0.00 1.88 1.93 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 1.77 2.25 0.00 21 K 8.05 3.87 0.00 1.96 1.83 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.46 1.64 7.81 22 E 7.72 3.90 0.00 2.07 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 2.48 2.33 0.00 23 V 7.33 3.89 1.84 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 0.67 0.00 0.00 0.40 0.00 0.00 24 G 7.90 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 25 V 7.69 3.80 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 0.72 0.00 0.00 0.88 0.00 0.00 26 G 8.42 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 27 F 8.93 4.02 0.00 3.09 3.07 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 28 A 8.05 3.78 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 29 T 7.76 3.62 4.22 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 1.32 0.00 0.00 30 R 8.10 3.80 0.00 1.79 2.00 0.00 3.01 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 1.52 1.81 0.00 31 K 7.86 3.71 0.00 1.56 1.58 0.00 1.38 0.00 0.00 1.28 0.00 0.00 2.22 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.52 0.79 7.81 32 V 7.59 3.30 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 0.00 0.00 0.60 0.00 0.00 0.58 0.00 0.00 33 A 8.03 4.12 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.25 3.82 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 0.00 35 M 7.63 4.24 0.00 2.01 2.18 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 2.69 2.51 0.00 36 A 8.06 4.06 1.46 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 0.00 0.00 37 K 7.40 3.72 0.00 1.81 1.78 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.35 1.34 7.81 38 P 0.00 5.19 0.00 2.16 2.14 0.00 3.38 0.00 0.00 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.93 0.00 39 N 8.81 5.04 0.00 2.78 2.88 0.00 0.00 6.39 7.66 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 40 M 9.32 5.00 0.00 1.87 1.50 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 2.37 2.41 0.00 41 I 9.03 5.10 1.91 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 1.27 0.63 0.93 0.00 0.00 42 I 9.02 5.16 2.27 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 1.33 1.15 0.99 0.00 0.00 43 S 8.90 5.02 0.00 3.84 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 44 V 8.22 4.72 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 0.75 0.00 0.00 0.92 0.00 0.00 45 N 9.06 4.69 0.00 2.65 2.56 0.00 0.00 6.94 7.59 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 46 G 8.28 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 47 D 8.86 4.75 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 48 L 7.73 4.64 0.00 1.71 1.45 0.80 0.75 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 V 7.97 4.44 0.72 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 0.82 0.00 0.00 0.72 0.00 0.00 50 T 8.63 4.98 4.16 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 1.24 0.00 0.00 51 I 8.87 4.89 2.01 0.00 0.00 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 1.17 1.18 0.92 0.00 0.00 52 R 9.01 5.17 0.00 1.87 1.76 0.00 3.26 0.00 0.00 3.10 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.67 0.00 53 S 8.85 5.44 0.00 3.93 3.67 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.71 5.28 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 2.30 2.30 0.00 55 S 8.82 4.98 0.00 3.95 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 56 T 8.66 4.00 4.30 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 0.00 0.00 0.00 1.25 0.00 0.00 57 F 7.96 4.49 0.00 2.87 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 58 K 8.29 4.46 0.00 1.36 1.37 0.00 1.37 0.00 0.00 1.40 0.00 0.00 2.56 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.79 0.21 7.81 59 N 8.49 5.31 0.00 2.56 2.71 0.00 0.00 6.74 7.54 0.00 0.00 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 T 8.70 4.80 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 1.20 0.00 0.00 61 E 8.46 5.28 0.00 1.97 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 2.21 2.31 0.00 62 I 8.85 4.85 2.12 0.00 0.00 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 1.46 0.87 1.12 0.00 0.00 63 S 8.51 5.07 0.00 3.62 3.60 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 64 F 8.00 4.51 0.00 2.54 1.70 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 65 K 8.39 4.91 0.00 1.82 1.71 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.85 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.44 1.43 7.81 66 L 8.51 4.53 0.00 1.73 1.68 0.96 1.21 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 67 G 9.24 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 0.00 0.00 0.00 68 V 7.21 4.31 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 0.86 0.00 0.00 0.98 0.00 0.00 69 E 8.76 4.58 0.00 2.04 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 2.26 2.36 0.00 70 F 8.79 5.09 0.00 3.09 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 71 D 8.76 5.08 0.00 2.65 2.65 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 72 E 9.08 4.79 0.00 1.88 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.31 0.00 73 I 8.32 4.97 1.86 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 1.38 0.76 0.88 0.00 0.00 74 T 8.70 4.16 4.22 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 1.03 0.00 0.00 75 A 8.60 3.92 1.39 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 0.00 0.00 76 D 8.06 4.78 0.00 2.79 2.80 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 77 D 8.04 4.43 0.00 2.83 2.80 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 78 R 7.93 4.19 0.00 1.48 1.38 0.00 2.21 0.00 0.00 2.61 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.46 0.00 79 K 8.38 4.82 0.00 1.73 1.70 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.43 7.81 80 V 8.95 4.78 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 0.34 0.00 0.00 0.85 0.00 0.00 81 K 8.77 4.75 0.00 1.64 1.64 0.00 1.59 0.00 0.00 1.75 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.53 7.81 82 S 8.43 5.08 0.00 2.72 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 83 I 8.32 4.90 1.86 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 1.25 1.54 0.89 0.00 0.00 84 I 8.52 5.08 1.51 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.33 0.77 0.00 0.00 85 T 8.74 4.96 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 86 L 8.46 5.00 0.00 1.67 1.64 1.07 1.17 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 87 D 8.81 4.63 0.00 2.69 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 88 G 9.70 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 0.00 0.00 0.00 89 G 8.66 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 0.00 0.00 0.00 90 A 7.90 5.14 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 91 L 8.37 4.57 0.00 1.28 1.40 0.19 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 92 V 8.78 4.49 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 0.92 0.00 0.00 0.92 0.00 0.00 93 Q 9.06 5.13 0.00 1.99 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.53 0.00 0.00 0.00 0.00 0.00 2.18 2.15 0.00 94 V 8.60 4.86 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 0.94 0.00 0.00 0.93 0.00 0.00 95 Q 9.03 5.17 0.00 2.13 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.53 0.00 0.00 0.00 0.00 0.00 2.16 2.26 0.00 96 K 8.95 5.44 0.00 1.69 1.66 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.36 7.81 97 W 9.01 5.06 0.00 3.35 3.17 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 98 D 9.91 4.29 0.00 2.47 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 99 G 8.24 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 0.00 0.00 0.00 100 K 7.45 4.30 0.00 0.79 0.84 0.00 0.66 0.00 0.00 1.41 0.00 0.00 2.84 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.02 0.90 7.81 101 S 7.68 5.27 0.00 3.84 3.73 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 0.00 102 T 9.15 5.00 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 103 T 8.57 5.19 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 1.27 0.00 0.00 104 I 8.85 4.81 1.83 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 1.09 0.88 0.85 0.00 0.00 105 K 9.10 4.91 0.00 1.76 1.61 0.00 1.57 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.37 7.81 106 R 8.80 5.16 0.00 1.52 1.65 0.00 2.95 0.00 0.00 3.02 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.41 0.00 107 K 9.08 5.22 0.00 1.81 1.90 0.00 1.31 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.41 7.81 108 R 8.43 4.58 0.00 1.55 1.76 0.00 2.89 0.00 0.00 2.90 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 1.13 0.00 109 D 8.78 4.42 0.00 2.60 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.27 3.75 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 0.00 0.00 0.00 111 D 8.88 4.73 0.00 2.85 2.81 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 0.00 112 K 8.10 4.93 0.00 1.84 1.93 0.00 1.87 0.00 0.00 1.68 0.00 0.00 2.80 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.55 7.81 113 L 8.56 4.72 0.00 0.27 0.95 -0.31 0.64 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 0.00 114 V 8.79 4.84 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 0.96 0.00 0.00 0.93 0.00 0.00 115 V 8.98 4.70 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 0.90 0.00 0.00 0.80 0.00 0.00 116 E 9.02 5.11 0.00 2.04 1.73 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 2.16 2.22 0.00 117 C 8.79 5.20 0.00 1.80 1.68 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 0.00 118 V 8.92 4.92 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 1.01 0.00 0.00 0.95 0.00 0.00 119 M 9.33 4.83 0.00 2.11 1.88 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 2.48 2.41 0.00 120 K 9.70 4.06 0.00 1.97 1.87 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.75 0.00 0.00 3.45 0.00 0.00 0.00 0.00 1.34 1.48 7.81 121 G 7.97 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 0.00 0.00 0.00 122 V 7.85 4.08 2.31 0.00 0.00 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 0.00 0.00 0.97 0.00 0.00 123 T 8.49 5.18 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 1.25 0.00 0.00 124 S 8.93 5.05 0.00 4.18 3.61 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 0.00 125 T 8.63 5.03 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 1.20 0.00 0.00 126 R 9.11 4.93 0.00 1.67 1.61 0.00 2.41 0.00 0.00 2.74 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.38 0.00 127 V 8.52 4.85 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 1.07 0.00 0.00 0.92 0.00 0.00 128 Y 9.38 5.35 0.00 2.99 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 0.00 129 E 9.13 5.44 0.00 2.10 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 2.24 2.30 0.00 130 R 8.53 3.99 0.00 1.49 1.53 0.00 2.94 0.00 0.00 2.77 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.13 0.00 131 A 8.39 4.12 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