NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 T 4.2789 8.1749 115.2433 61.9967 67.7337 174.1109 13 N 4.4397 8.4747 128.4289 50.7897 37.0398 171.4082 14 L 4.2151 8.9963 120.5093 55.1756 43.2203 176.8665 15 L 4.3049 8.7635 124.5248 54.6027 42.5311 176.5217 16 Y 4.3249 8.4983 122.2975 58.1245 39.5826 174.8419 17 T 3.8783 6.6495 117.1211 60.8339 70.1267 173.7111 18 R 3.8623 8.1660 126.7684 57.6644 30.3209 176.4711 19 N 4.3028 7.6183 117.9835 53.8151 39.1854 174.6444 20 D 4.8327 8.3357 127.8195 52.9727 40.1525 176.7672 21 V 3.8811 7.4143 119.4777 62.8896 32.7661 176.0222 22 S 4.1656 8.6317 121.2173 59.2748 64.1886 175.4077 23 D 4.5535 8.8220 123.9583 57.6479 40.5514 178.8339 24 S 4.0741 8.0746 113.1833 61.7394 62.3272 175.9990 25 E 3.9896 8.4415 120.9782 59.0843 29.2298 179.4064 26 K 4.0803 8.5163 118.9869 59.5490 32.1875 179.2925 27 K 3.8885 8.3111 118.4076 59.4340 32.0277 179.1800 28 A 3.9644 7.9680 120.8000 55.5738 18.2639 179.8547 29 T 3.7824 8.6931 115.2893 66.8190 68.5295 177.0659 30 V 3.5703 8.2233 120.5554 65.9468 31.5623 177.7574 31 E 3.8975 8.2099 119.1005 59.0397 29.5037 178.4667 32 L 3.9381 7.9841 120.3917 58.0787 42.1624 178.9439 33 L 3.8766 8.1979 119.1651 58.0707 41.6527 179.3225 34 N 4.5005 8.2560 116.2134 56.1984 38.2299 177.5130 35 R 3.9122 7.8665 119.9226 59.4190 30.1898 178.6435 36 Q 4.0461 7.8189 117.5393 58.7883 28.6845 178.4652 37 V 3.4978 8.1030 119.7226 66.2018 31.4802 177.9970 38 I 3.6999 7.7311 119.2104 64.4985 36.9342 178.1781 39 Q 3.9623 7.8957 120.2726 59.2478 28.8473 178.3432 40 F 3.8729 9.0580 119.0563 60.6343 39.0131 177.6003 41 I 3.7235 8.2877 119.8776 64.5870 36.8256 178.0213 42 D 4.3141 8.1327 118.7505 57.2388 41.0384 178.0212 43 L 3.8217 8.0850 121.2899 57.9469 41.8291 179.1425 44 S 4.1052 8.2938 114.6861 61.2747 63.0254 176.5336 45 L 3.8980 7.9323 122.6156 57.5399 41.3975 179.5054 46 I 3.4290 7.9522 120.0679 64.5322 36.9857 178.3990 47 T 3.8062 8.1133 116.9467 66.8233 68.2554 176.7341 48 K 3.2752 7.4314 120.0406 58.8477 31.5979 179.3802 49 Q 4.0921 7.4424 118.1216 58.9360 28.8099 178.9103 50 A 3.8618 7.5551 121.3854 55.3460 18.2377 178.7394 51 H 3.9941 7.6859 115.3451 59.6516 29.8536 177.0280 52 W 4.6385 8.2505 119.2498 59.0224 28.7634 177.4313 53 N 5.0563 8.0299 114.8305 52.3328 38.5518 174.4340 54 M 4.8363 7.1231 116.7744 54.7452 33.2491 175.6137 55 R 4.4106 8.9912 117.7501 55.9403 34.5388 173.8121 56 G 4.0005 8.9121 104.6314 43.7907 0.0000 172.7887 57 A 3.9490 8.5487 121.5644 53.8798 18.6330 176.9743 58 N 4.1732 8.9666 118.5665 54.7033 37.4791 176.2565 59 F 4.1763 7.7601 117.9699 60.6849 39.3842 175.7807 60 I 2.9873 7.8791 117.1301 64.0597 37.7300 177.6923 61 A 3.8039 7.7232 120.7556 55.1152 18.1977 179.6549 62 V 3.2626 7.2962 116.9092 66.0395 31.1032 177.5404 63 H 3.8059 8.2811 118.3804 59.4402 29.6052 177.1186 64 E 3.8005 8.0388 120.2459 59.2368 29.2589 178.7593 65 M 3.6091 7.8584 118.4743 58.6329 32.2054 178.2375 66 L 3.2004 7.4589 118.9390 57.5694 41.6376 178.9724 67 D 4.1166 7.4338 117.3846 57.0788 41.1693 178.5681 68 G 3.5271 7.5826 106.0587 47.8330 0.0000 175.5037 69 F 3.8313 7.5337 120.4944 60.1500 38.8322 177.5894 70 R 3.8922 7.9679 118.1525 59.8690 29.9143 178.6207 71 T 3.8597 7.7448 114.7791 66.6561 68.4716 176.5244 72 A 4.1159 8.0343 122.1744 55.0415 18.3726 179.5083 73 L 4.2011 8.7298 117.8909 58.3268 41.7571 179.8725 74 I 3.7707 8.0188 119.5455 64.5083 37.0391 178.3036 75 D 4.3590 8.1159 119.4366 57.6061 40.5877 178.5348 76 H 4.1374 8.2575 116.6548 58.7174 28.6780 177.2673 77 L 3.7202 8.1953 122.2967 58.5690 41.7977 178.7478 78 D 4.3380 8.5026 118.8263 57.7188 40.7605 179.0331 79 T 3.8301 7.8711 116.0640 66.9528 68.4727 176.6016 80 M 3.9680 8.1875 120.4396 58.1577 31.9612 178.5943 81 A 3.9602 8.1439 121.1250 55.3413 18.4870 179.5687 82 E 3.9095 8.4559 117.3731 59.4561 29.6238 179.5590 83 R 3.9745 8.1197 118.5588 59.2156 30.1062 178.3333 84 A 3.9349 8.0236 120.5272 55.3834 18.4727 179.8311 85 V 3.8252 7.7192 117.8901 65.6915 31.2939 178.2009 86 Q 4.0416 8.0861 117.4854 58.6204 28.5684 177.7750 87 L 4.3876 7.4763 116.9370 54.6226 41.9589 177.8402 88 G 3.8591 8.2742 108.4333 45.2305 0.0000 174.4694 89 G 3.8424 7.7720 109.4529 44.1629 0.0000 172.3477 90 V 4.2480 8.0014 118.2523 60.5085 33.3270 175.4570 91 A 4.2538 8.6322 130.8217 51.9667 18.8565 176.1356 92 L 4.6720 9.6955 124.5552 53.2377 42.9388 177.0097 93 G 4.2091 8.4414 111.0810 44.7189 0.0000 172.6998 94 T 4.2254 7.7974 110.5357 60.9993 71.0739 174.9310 95 T 3.8626 8.5085 116.8959 65.4820 67.3164 176.2415 96 Q 3.9893 8.0267 118.9904 59.3999 28.6502 178.6848 97 V 3.5907 7.4401 119.0461 65.4749 31.4788 177.9844 98 I 3.6676 7.8582 119.5193 64.5431 36.8110 177.7637 99 N 4.2775 8.2780 116.9765 56.8511 38.8046 176.5475 100 S 4.3933 8.0700 114.3014 59.8805 63.5323 174.8965 101 K 4.4781 7.7255 118.7479 55.7936 33.1370 176.1983 102 T 3.9333 8.0436 115.4958 61.7512 67.5384 171.9332 103 P 4.6073 0.0000 0.0000 62.8614 31.9578 175.3183 104 L 4.5111 7.6076 120.2405 52.9144 42.7084 176.4712 105 K 3.9395 8.6575 124.9913 56.1841 32.6782 176.0762 106 S 4.0797 8.7533 119.5898 59.1292 62.6409 173.0257 107 Y 4.2592 8.6257 128.2147 55.8675 39.4374 172.6958 108 P 4.2650 0.0000 0.0000 63.4565 31.5072 175.7789 109 L 4.7000 8.5615 122.1362 54.5037 41.6639 176.4166 110 D 4.8270 7.8764 115.5111 52.5626 40.4129 175.4832 111 I 4.2948 7.3890 113.0810 60.5999 39.5330 174.7788 112 H 5.1580 8.3198 113.4927 55.4692 33.6777 173.8320 113 N 4.7038 8.2593 116.6119 53.9370 40.3007 175.3108 114 V 3.6806 8.3447 126.5644 66.5144 31.6942 178.5363 115 Q 4.0677 8.1191 117.1187 58.9639 28.5113 178.4646 116 D 4.3307 8.0378 119.3536 57.7663 40.9795 178.3379 117 H 4.4048 8.0616 117.8418 58.3558 28.6462 177.6938 118 L 4.0084 8.4058 121.1502 57.9781 41.5215 179.9267 119 K 4.0279 8.3041 118.2488 59.4856 32.0778 179.3357 120 E 4.0277 8.4394 118.9803 59.4134 29.3734 179.4872 121 L 4.2512 8.8939 119.1907 57.6719 41.6234 179.1200 122 A 4.0567 8.3695 121.1012 55.4258 18.2755 179.3582 123 D 4.3558 8.1098 116.9465 57.7602 40.9750 179.3484 124 R 3.9811 7.9906 117.8846 59.5860 30.0162 178.7970 125 Y 3.7700 8.9321 116.6564 60.8493 37.8442 178.4635 126 A 3.9930 8.5325 122.1050 55.1845 18.4865 179.7048 127 I 3.6121 7.7577 118.2404 64.6564 37.1780 178.9347 128 V 3.5282 7.7413 118.7813 65.6615 31.2789 177.8384 129 A 3.9016 8.6518 121.4615 55.4392 18.1344 179.4273 130 N 4.2991 8.6191 115.2989 56.2759 38.5672 177.3084 131 D 4.3488 8.1518 119.7278 57.4399 40.9947 178.7250 132 V 3.8496 8.0348 119.8150 64.8286 31.0408 178.1902 133 R 3.8854 7.7769 118.7050 59.2192 30.0710 178.3499 134 K 4.1287 7.9404 118.0237 58.9912 32.1011 179.1348 135 A 3.9963 8.0456 121.1902 54.8295 17.9242 179.5357 136 I 3.6755 7.2322 117.4764 64.7697 37.3626 178.1030 137 G 3.6764 7.9378 106.2587 48.0280 0.0000 174.1584 138 E 3.9811 7.6618 119.5069 57.5991 29.9228 176.2837 139 A 4.2528 7.5322 122.4696 51.8025 18.9691 177.4428 140 K 4.0068 8.7445 123.3891 59.4364 32.6704 177.9435 141 D 4.3427 7.9591 119.5561 54.1218 41.8249 175.7252 142 D 4.3684 8.8223 127.6055 57.9664 40.9738 178.5385 143 D 4.3609 8.1293 118.3613 57.9906 40.7418 179.1543 144 T 3.8636 7.8908 115.9269 66.4279 68.3356 176.7099 145 A 3.9404 8.1498 122.9994 54.9413 18.2568 179.2217 146 D 4.1882 8.1599 116.6117 57.5892 41.4058 178.2902 147 I 3.6553 7.7281 120.2614 64.7093 37.1752 178.4800 148 L 3.9831 8.1287 119.6346 57.8725 41.3686 179.7616 149 T 3.8295 8.0745 115.8517 66.4295 68.2287 176.5419 150 A 3.9475 8.2580 122.7328 55.1343 18.3819 179.5906 151 A 3.3343 7.9485 119.2467 54.9878 18.3513 179.7160 152 S 3.9293 8.4968 112.0071 61.5905 61.9878 176.0507 153 R 3.7639 8.2346 121.7028 59.8702 29.6429 178.1138 154 D 3.8041 7.5546 118.2142 57.0426 40.7712 178.7223 155 L 3.6949 7.5998 119.5098 57.8049 41.5974 179.3833 156 D 4.4454 8.2501 119.1760 56.9368 40.5674 178.8041 157 K 4.0795 7.3212 119.6650 59.4505 32.2214 178.9970 158 F 3.9095 7.9581 118.5475 60.1993 38.6178 177.2357 159 L 3.9631 8.4035 120.4716 58.0213 41.8043 178.7931 160 W 4.4071 8.2433 128.0233 60.7457 30.4332 177.8732 161 F 3.9732 8.3320 116.6856 60.5088 38.6529 177.5046 162 I 3.8433 8.4566 119.6837 64.5340 36.8988 178.1584 163 E 4.0232 8.5465 119.6308 59.7721 29.2004 179.5645 164 S 4.2306 8.2593 113.2487 60.3830 62.9008 175.2288 165 N 4.6945 7.7368 117.8036 52.2685 39.1229 174.9954 166 I 4.1470 7.2982 122.9838 60.5802 37.8190 175.8742 167 E 4.1418 9.4695 124.7192 56.7379 29.1628 176.7635 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 12 T 8.17 4.28 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 1.21 0.00 0.00 13 N 8.47 4.44 0.00 2.82 2.78 0.00 0.00 7.16 6.97 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 14 L 9.00 4.22 0.00 1.53 1.66 0.91 1.14 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 15 L 8.76 4.30 0.00 1.47 1.63 1.04 0.84 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 16 Y 8.50 4.32 0.00 3.00 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 17 T 6.65 3.88 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 1.08 0.00 0.00 18 R 8.17 3.86 0.00 1.77 1.95 0.00 3.28 0.00 0.00 3.18 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.60 0.00 19 N 7.62 4.30 0.00 2.64 2.64 0.00 0.00 7.08 7.78 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 20 D 8.34 4.83 0.00 2.81 2.71 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 0.00 0.00 0.00 0.00 21 V 7.41 3.88 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 0.78 0.00 0.00 1.01 0.00 0.00 22 S 8.63 4.17 0.00 4.08 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.82 4.55 0.00 2.79 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 24 S 8.07 4.07 0.00 3.88 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 25 E 8.44 3.99 0.00 2.16 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 2.32 2.34 0.00 26 K 8.52 4.08 0.00 1.90 1.95 0.00 1.65 0.00 0.00 1.86 0.00 0.00 2.88 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.43 1.79 7.81 27 K 8.31 3.89 0.00 2.01 1.85 0.00 1.67 0.00 0.00 1.65 0.00 0.00 3.21 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.57 7.81 28 A 7.97 3.96 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 29 T 8.69 3.78 4.36 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 1.18 0.00 0.00 30 V 8.22 3.57 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 0.98 0.00 0.00 1.00 0.00 0.00 31 E 8.21 3.90 0.00 2.22 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 2.30 2.31 0.00 32 L 7.98 3.94 0.00 1.79 1.78 0.96 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.20 3.88 0.00 1.80 1.63 0.92 0.47 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 34 N 8.26 4.50 0.00 2.83 2.87 0.00 0.00 6.75 7.25 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 35 R 7.87 3.91 0.00 2.08 2.10 0.00 3.10 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 1.64 1.68 0.00 36 Q 7.82 4.05 0.00 2.08 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.52 0.00 0.00 0.00 0.00 0.00 2.54 2.41 0.00 37 V 8.10 3.50 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 1.09 0.00 0.00 0.90 0.00 0.00 38 I 7.73 3.70 2.05 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 1.42 0.67 0.93 0.00 0.00 39 Q 7.90 3.96 0.00 2.28 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 40 F 9.06 3.87 0.00 3.23 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 41 I 8.29 3.72 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 1.45 1.13 0.94 0.00 0.00 42 D 8.13 4.31 0.00 2.94 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 43 L 8.09 3.82 0.00 1.59 1.43 0.53 -0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 44 S 8.29 4.11 0.00 4.05 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 45 L 7.93 3.90 0.00 1.87 1.75 0.95 0.71 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 46 I 7.95 3.43 1.91 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.01 0.53 0.00 0.00 47 T 8.11 3.81 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 1.18 0.00 0.00 48 K 7.43 3.28 0.00 1.21 0.74 0.00 0.80 0.00 0.00 0.76 0.00 0.00 2.66 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.02 1.23 7.81 49 Q 7.44 4.09 0.00 1.97 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.51 2.61 0.00 50 A 7.56 3.86 1.27 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 0.00 0.00 51 H 7.69 3.99 0.00 2.88 3.08 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 W 8.25 4.64 0.00 3.49 3.06 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 0.00 0.00 0.00 53 N 8.03 5.06 0.00 2.88 2.98 0.00 0.00 6.68 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 54 M 7.12 4.84 0.00 2.22 2.22 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.91 0.00 55 R 8.99 4.41 0.00 1.85 1.71 0.00 3.02 0.00 0.00 3.07 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.53 0.00 56 G 8.91 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.55 3.95 1.26 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 0.00 0.00 58 N 8.97 4.17 0.00 2.95 2.83 0.00 0.00 6.83 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 59 F 7.76 4.18 0.00 3.20 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 60 I 7.88 2.99 1.96 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.18 0.89 0.00 0.00 61 A 7.72 3.80 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 62 V 7.30 3.26 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 0.92 0.00 0.00 0.82 0.00 0.00 63 H 8.28 3.81 0.00 2.17 2.81 0.00 5.83 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 E 8.04 3.80 0.00 1.88 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 2.25 2.42 0.00 65 M 7.86 3.61 0.00 1.77 1.81 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 1.33 0.00 66 L 7.46 3.20 0.00 1.58 1.43 0.78 0.80 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 67 D 7.43 4.12 0.00 2.38 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 68 G 7.58 3.53 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 0.00 0.00 0.00 69 F 7.53 3.83 0.00 3.01 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 70 R 7.97 3.89 0.00 1.73 2.02 0.00 3.21 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.68 0.00 71 T 7.74 3.86 4.42 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 1.23 0.00 0.00 72 A 8.03 4.12 1.71 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 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.73 4.20 0.00 2.09 1.83 0.94 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 74 I 8.02 3.77 2.13 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 1.56 0.74 0.94 0.00 0.00 75 D 8.12 4.36 0.00 2.82 2.67 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 76 H 8.26 4.14 0.00 3.52 3.27 0.00 5.64 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 8.20 3.72 0.00 1.95 1.93 1.04 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 78 D 8.50 4.34 0.00 2.82 2.70 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 79 T 7.87 3.83 4.38 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 1.18 0.00 0.00 80 M 8.19 3.97 0.00 1.89 2.03 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.37 0.00 81 A 8.14 3.96 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 82 E 8.46 3.91 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 2.50 0.00 83 R 8.12 3.97 0.00 1.98 2.04 0.00 3.12 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 84 A 8.02 3.93 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.72 3.83 2.18 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 1.15 0.00 0.00 0.97 0.00 0.00 86 Q 8.09 4.04 0.00 2.21 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.00 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 87 L 7.48 4.39 0.00 1.75 1.66 0.89 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 88 G 8.27 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 89 G 7.77 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 90 V 8.00 4.25 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 0.86 0.00 0.00 0.93 0.00 0.00 91 A 8.63 4.25 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 92 L 9.70 4.67 0.00 1.57 1.61 0.92 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 93 G 8.44 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 94 T 7.80 4.23 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 95 T 8.51 3.86 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 96 Q 8.03 3.99 0.00 2.29 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.68 0.00 0.00 0.00 0.00 0.00 2.42 2.37 0.00 97 V 7.44 3.59 2.22 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 1.03 0.00 0.00 0.94 0.00 0.00 98 I 7.86 3.67 2.02 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 1.72 0.76 0.93 0.00 0.00 99 N 8.28 4.28 0.00 2.73 3.08 0.00 0.00 7.37 7.22 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 0.00 100 S 8.07 4.39 0.00 4.09 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 0.00 101 K 7.73 4.48 0.00 1.87 1.85 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.34 7.81 102 T 8.04 3.93 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 1.26 0.00 0.00 103 P 0.00 4.61 0.00 2.22 2.14 0.00 3.82 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.99 0.00 104 L 7.61 4.51 0.00 1.90 1.68 0.90 0.81 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 0.00 105 K 8.66 3.94 0.00 1.73 1.76 0.00 1.82 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.45 7.81 106 S 8.75 4.08 0.00 3.90 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 0.00 107 Y 8.63 4.26 0.00 3.11 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 0.00 108 P 0.00 4.27 0.00 2.00 1.87 0.00 2.53 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.51 0.00 109 L 8.56 4.70 0.00 1.70 1.79 0.98 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 110 D 7.88 4.83 0.00 2.73 2.70 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 0.00 111 I 7.39 4.29 1.72 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 1.25 0.24 0.79 0.00 0.00 112 H 8.32 5.16 0.00 3.18 3.33 0.00 5.92 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 8.26 4.70 0.00 2.85 2.91 0.00 0.00 6.83 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 0.00 114 V 8.34 3.68 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 1.04 0.00 0.00 1.15 0.00 0.00 115 Q 8.12 4.07 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.68 0.00 0.00 0.00 0.00 0.00 2.47 2.41 0.00 116 D 8.04 4.33 0.00 2.85 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 0.00 117 H 8.06 4.40 0.00 3.45 3.45 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 L 8.41 4.01 0.00 2.02 1.75 0.89 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 119 K 8.30 4.03 0.00 1.96 1.87 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.61 7.81 120 E 8.44 4.03 0.00 2.26 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 2.43 2.14 0.00 121 L 8.89 4.25 0.00 1.88 1.73 0.90 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 122 A 8.37 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 0.00 123 D 8.11 4.36 0.00 3.02 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 0.00 124 R 7.99 3.98 0.00 1.98 2.02 0.00 3.40 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.04 0.00 125 Y 8.93 3.77 0.00 3.14 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 0.00 126 A 8.53 3.99 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 0.00 127 I 7.76 3.61 2.04 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 1.42 0.74 0.91 0.00 0.00 128 V 7.74 3.53 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 0.70 0.00 0.00 0.80 0.00 0.00 129 A 8.65 3.90 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 0.00 130 N 8.62 4.30 0.00 2.76 2.88 0.00 0.00 6.76 8.11 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 0.00 131 D 8.15 4.35 0.00 2.83 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 0.00 132 V 8.03 3.85 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 0.89 0.00 0.00 0.99 0.00 0.00 133 R 7.78 3.89 0.00 1.95 2.13 0.00 3.22 0.00 0.00 3.34 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 134 K 7.94 4.13 0.00 1.96 1.83 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.44 7.81 135 A 8.05 4.00 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 0.00 136 I 7.23 3.68 1.97 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.83 0.89 0.00 0.00 137 G 7.94 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 0.00 0.00 0.00 138 E 7.66 3.98 0.00 1.89 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 2.31 2.24 0.00 139 A 7.53 4.25 1.31 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 0.00 0.00 0.00 0.00 0.00 0.00 140 K 8.74 4.01 0.00 1.88 1.88 0.00 1.75 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.41 7.81 141 D 7.96 4.34 0.00 2.72 2.54 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 0.00 0.00 0.00 142 D 8.82 4.37 0.00 2.70 2.70 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 0.00 143 D 8.13 4.36 0.00 2.84 2.70 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 0.00 144 T 7.89 3.86 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 1.17 0.00 0.00 145 A 8.15 3.94 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 D 8.16 4.19 0.00 2.87 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 0.00 147 I 7.73 3.66 1.98 0.00 0.00 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 1.49 0.85 0.83 0.00 0.00 148 L 8.13 3.98 0.00 1.77 1.67 0.88 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 149 T 8.07 3.83 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 1.18 0.00 0.00 150 A 8.26 3.95 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 0.00 151 A 7.95 3.33 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 0.00 152 S 8.50 3.93 0.00 3.86 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 0.00 153 R 8.23 3.76 0.00 2.00 1.96 0.00 3.08 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 154 D 7.55 3.80 0.00 2.55 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 0.00 0.00 0.00 0.00 155 L 7.60 3.69 0.00 1.67 1.58 0.76 0.51 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 0.00 156 D 8.25 4.45 0.00 2.59 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 0.00 157 K 7.32 4.08 0.00 1.70 1.60 0.00 1.59 0.00 0.00 1.56 0.00 0.00 2.54 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.94 1.48 7.81 158 F 7.96 3.91 0.00 2.88 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 0.00 0.00 0.00 159 L 8.40 3.96 0.00 1.90 1.92 1.05 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 160 W 8.24 4.41 0.00 3.43 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 F 8.33 3.97 0.00 3.19 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 0.00 162 I 8.46 3.84 2.00 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.20 0.88 0.00 0.00 163 E 8.55 4.02 0.00 2.29 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 2.39 2.59 0.00 164 S 8.26 4.23 0.00 3.52 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 0.00 165 N 7.74 4.69 0.00 2.78 2.77 0.00 0.00 7.00 6.74 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 0.00 166 I 7.30 4.15 2.02 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 1.31 0.72 0.92 0.00 0.00 167 E 9.47 4.14 0.00 1.91 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 2.34 2.25 0.00