NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 S 4.4825 8.1933 115.4157 57.0981 64.8530 175.5134 20 P 4.1088 0.0000 0.0000 66.3030 30.9170 176.0406 21 A 4.7973 7.9730 119.7390 54.5038 18.8892 179.2348 22 K 4.0398 8.1792 118.0159 59.9636 32.6020 179.3560 23 L 3.8600 7.8120 120.9953 57.8367 42.1439 178.4378 24 I 3.0923 7.4367 119.6892 64.3831 36.8996 177.4076 25 E 3.9954 7.7816 119.4250 60.0058 29.3271 178.5749 26 M 3.9490 8.1742 118.1096 58.7518 32.1879 178.7218 27 L 3.8039 8.2917 118.8948 58.1940 41.7313 179.4330 28 Y 4.2674 7.8678 116.7304 61.1558 37.7075 178.4188 29 E 4.0845 8.7273 120.1752 59.1820 29.5578 179.4268 30 G 3.6450 8.7193 106.1922 47.8974 0.0000 175.3071 31 I 3.6606 7.7240 122.4630 64.3859 37.1957 178.3298 32 L 3.9912 7.7792 119.2482 57.7884 41.4684 179.8526 33 R 3.7219 8.1296 118.1074 59.2840 29.9601 179.1020 34 F 4.1540 7.7706 117.3566 60.6330 38.9597 177.7172 35 S 4.2460 8.2532 114.7405 61.9148 62.7009 176.5096 36 S 4.0716 7.9080 115.3687 61.7454 62.0929 176.4608 37 Q 3.6249 7.7243 119.9175 58.8324 28.2319 178.3213 38 A 4.1239 8.4924 122.4335 55.2509 18.1880 179.5223 39 K 3.8796 8.4984 118.1637 59.8945 32.2455 179.1694 40 R 3.9541 8.1000 118.2045 59.5546 29.9058 178.7619 41 C 4.3371 7.9943 115.9065 62.2698 27.7195 176.2704 42 I 3.7282 7.5630 121.8690 64.3569 36.5425 178.2043 43 E 4.0047 7.6736 117.7402 59.5978 29.5270 178.8953 44 N 4.5349 8.4001 113.6803 53.4327 38.6605 175.1954 45 E 3.7015 7.4740 118.1760 57.4793 27.8152 174.9618 46 D 4.6591 7.8860 119.9480 53.0040 41.0315 176.1397 47 I 3.6893 8.2124 127.2126 64.3760 37.1932 177.4237 48 E 3.9634 8.2142 118.3317 59.8296 29.3838 179.5714 49 K 3.8589 7.9782 117.9403 59.5706 32.1110 179.0669 50 K 4.0859 8.2375 119.6289 59.8771 32.0475 178.8327 51 I 3.7838 7.9368 119.9295 64.3015 37.1236 177.5414 52 Y 4.0593 8.2983 120.8089 60.9793 38.4348 178.0761 53 Y 3.9257 8.2061 117.8636 60.9030 37.9273 178.0320 54 I 3.7085 7.9815 120.9541 64.8619 37.3245 178.3520 55 N 4.2998 8.1451 116.7179 55.9377 37.7382 177.6155 56 R 3.4598 7.3834 120.5054 59.0639 29.8354 178.7329 57 V 3.5717 7.7307 118.3727 66.0970 31.6478 177.8085 58 T 4.2332 8.3508 112.7635 64.3772 67.0628 176.2017 59 D 4.2715 7.9612 121.3161 57.6047 40.8007 178.5584 60 I 3.5434 7.2105 119.1448 64.4727 36.9554 178.5909 61 F 3.9411 7.8269 118.2265 60.6006 38.4438 177.8410 62 T 4.0256 7.8059 115.5602 66.1516 68.1782 176.6203 63 E 3.8847 8.3241 121.7391 59.3523 29.4995 178.9635 64 L 3.8175 7.6903 117.9015 57.4653 41.5193 178.9437 65 L 4.3643 7.6832 120.0131 57.6327 41.8136 178.2387 66 N 4.3613 7.5812 115.3643 55.2932 38.8451 176.9553 67 I 3.8810 7.4032 119.7878 62.2315 37.6541 176.5749 68 L 3.8420 6.7988 119.7196 54.8215 42.1105 176.5114 69 D 4.5440 8.0721 121.2581 52.6740 42.4429 175.6384 70 Y 4.7184 7.9868 129.5809 56.2979 36.2004 174.1594 71 E 4.9214 6.9436 120.6223 57.7825 37.4300 177.6828 72 K 4.1379 8.4108 120.5601 59.7347 32.7746 179.4385 73 G 3.6156 7.8632 106.0037 48.1556 0.0000 176.1281 74 G 3.8985 8.2965 108.4067 45.1430 0.0000 174.4295 75 E 4.1095 8.6703 118.2684 59.5812 30.3607 178.1485 76 V 3.6149 7.7843 116.6511 66.0205 31.8941 177.4679 77 A 3.9063 8.1554 120.0272 55.6820 18.1285 179.6288 78 V 3.7095 8.8729 117.3394 66.1781 31.5643 177.7222 79 Y 4.0409 7.8497 118.8888 60.8349 38.7097 177.9241 80 L 3.4018 8.4618 120.0988 57.4910 41.4410 179.6101 81 T 3.9390 7.9054 116.1002 66.5652 68.3532 176.7246 82 G 3.4901 7.7134 107.3534 47.5898 0.0000 175.2278 83 L 3.7558 7.4248 122.9748 58.0066 42.1562 178.5497 84 Y 4.2239 8.2375 116.9687 61.5156 37.9180 179.0139 85 T 3.8661 8.2231 110.8121 64.9656 68.6690 175.8892 86 H 4.0597 8.3562 121.2864 59.2223 29.7692 177.2387 87 Q 3.7391 8.1060 120.2005 58.8098 28.4071 178.9558 88 I 3.6396 7.1824 120.5052 64.2016 37.2646 178.2913 89 K 3.8464 7.8518 120.4389 59.4904 31.8851 179.0232 90 V 3.6734 7.7989 118.5657 65.8203 31.4397 177.7185 91 L 3.9569 8.0730 119.1425 58.5009 41.5206 179.8555 92 T 3.9062 7.8201 115.1497 66.6206 68.3029 176.8730 93 Q 3.9999 7.9361 119.3998 58.8449 28.6931 178.4944 94 A 3.9873 8.2150 121.9771 55.3429 18.3541 179.0233 95 N 4.2185 8.0983 115.4344 56.6766 38.8860 176.9549 96 V 3.5381 8.0640 120.0994 65.7622 31.6202 176.9744 97 E 4.4647 8.2192 114.3334 55.2636 29.8877 175.6843 98 N 4.0229 7.4992 114.6614 54.8752 36.8969 175.6190 99 D 4.6397 8.1782 118.8290 52.4017 41.4281 176.0311 100 A 4.0812 8.4886 129.9923 55.0465 18.1171 178.8913 101 S 4.5051 7.8001 113.2252 60.5719 63.4279 176.5770 102 K 4.1258 8.0408 122.0712 59.1090 31.7576 179.0276 103 I 3.6953 7.7365 118.6262 64.2213 37.5035 177.2265 104 D 4.4838 7.9773 119.2195 57.7324 40.5029 179.0981 105 L 4.0444 7.6395 119.3107 57.5584 41.4895 179.8215 106 V 3.8765 7.5176 119.1365 65.4239 31.7166 177.5930 107 L 3.9803 8.4096 119.1116 58.3388 41.4359 179.4209 108 N 4.4885 8.3478 115.8489 55.9198 38.6439 177.7349 109 V 3.6137 7.6293 119.5923 65.7894 31.7354 177.9526 110 A 3.9310 8.4203 120.8785 55.3085 18.2338 179.5653 111 R 3.9261 8.4484 117.7127 59.4723 30.1695 178.8509 112 G 3.6522 8.4115 105.9886 47.9064 0.0000 175.7117 113 L 4.0831 7.9851 121.4065 57.3033 41.4900 179.0187 114 L 4.0521 7.4707 120.4417 57.9917 41.9584 178.2075 115 E 4.2863 8.0039 115.3937 57.4633 30.1572 178.0669 116 A 4.2600 7.6816 121.7392 55.0105 18.5644 179.5120 117 W 4.3303 8.6066 126.8557 60.3844 30.5410 177.8595 118 R 4.2168 8.1556 116.5347 57.8041 29.7280 177.6149 119 E 4.1668 7.7350 118.4369 58.4970 29.9723 177.6301 120 I 3.9524 7.4611 117.3083 62.2756 37.9292 175.2814 121 H 4.8245 7.5043 116.7549 54.9525 29.5042 175.2877 122 S 4.0577 8.1723 114.9029 60.6878 63.3152 174.5500 123 D 4.6587 7.2798 124.3652 52.6006 39.7961 176.1629 124 E 4.1035 8.8851 116.1834 57.1164 30.9905 174.5043 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 19 S 8.19 4.48 0.00 4.04 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 0.00 20 P 0.00 4.11 0.00 2.35 2.21 0.00 3.62 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 2.16 2.23 0.00 21 A 7.97 4.80 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 22 K 8.18 4.04 0.00 2.05 2.12 0.00 1.32 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.61 1.46 7.81 23 L 7.81 3.86 0.00 1.67 1.61 0.84 1.02 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 24 I 7.44 3.09 1.10 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.42 -0.89 0.00 0.00 25 E 7.78 4.00 0.00 2.31 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 0.00 2.44 2.56 0.00 26 M 8.17 3.95 0.00 2.05 2.26 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.60 0.00 27 L 8.29 3.80 0.00 1.28 1.39 0.64 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 28 Y 7.87 4.27 0.00 3.08 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 29 E 8.73 4.08 0.00 2.09 1.98 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 2.35 2.38 0.00 30 G 8.72 3.64 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 0.00 0.00 0.00 31 I 7.72 3.66 1.98 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.55 0.78 0.00 0.00 32 L 7.78 3.99 0.00 1.87 1.69 0.96 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 33 R 8.13 3.72 0.00 1.49 1.58 0.00 2.94 0.00 0.00 3.05 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.66 0.00 34 F 7.77 4.15 0.00 3.18 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 35 S 8.25 4.25 0.00 4.05 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 S 7.91 4.07 0.00 3.96 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 37 Q 7.72 3.62 0.00 1.53 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.51 0.00 0.00 0.00 0.00 0.00 2.19 2.12 0.00 38 A 8.49 4.12 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.50 3.88 0.00 1.85 2.03 0.00 1.65 0.00 0.00 1.64 0.00 0.00 3.12 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.43 1.49 7.81 40 R 8.10 3.95 0.00 1.99 1.97 0.00 3.48 0.00 0.00 3.16 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.79 0.00 41 C 7.99 4.34 0.00 3.30 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 42 I 7.56 3.73 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 1.55 1.14 0.98 0.00 0.00 43 E 7.67 4.00 0.00 1.90 2.02 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 2.35 2.49 0.00 44 N 8.40 4.53 0.00 2.78 2.90 0.00 0.00 7.15 7.20 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 45 E 7.47 3.70 0.00 2.15 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 2.26 2.47 0.00 46 D 7.89 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 47 I 8.21 3.69 1.89 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 1.66 0.84 0.93 0.00 0.00 48 E 8.21 3.96 0.00 2.00 2.01 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 2.41 2.44 0.00 49 K 7.98 3.86 0.00 1.88 2.10 0.00 1.74 0.00 0.00 1.88 0.00 0.00 3.23 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.46 1.48 7.81 50 K 8.24 4.09 0.00 2.02 2.13 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.51 1.57 7.81 51 I 7.94 3.78 1.90 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 0.78 0.92 0.00 0.00 52 Y 8.30 4.06 0.00 2.89 2.87 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 53 Y 8.21 3.93 0.00 3.07 2.95 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 54 I 7.98 3.71 1.87 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.02 0.92 0.00 0.00 55 N 8.15 4.30 0.00 2.75 2.78 0.00 0.00 6.76 6.95 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 56 R 7.38 3.46 0.00 1.25 1.10 0.00 2.68 0.00 0.00 2.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 57 V 7.73 3.57 2.30 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 1.14 0.00 0.00 1.09 0.00 0.00 58 T 8.35 4.23 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 1.24 0.00 0.00 59 D 7.96 4.27 0.00 2.82 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 60 I 7.21 3.54 1.60 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.60 0.63 0.00 0.00 61 F 7.83 3.94 0.00 3.13 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 T 7.81 4.03 4.41 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 1.21 0.00 0.00 63 E 8.32 3.88 0.00 2.09 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 0.00 2.22 2.28 0.00 64 L 7.69 3.82 0.00 1.19 1.02 0.28 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 65 L 7.68 4.36 0.00 2.08 1.83 1.24 1.26 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 66 N 7.58 4.36 0.00 2.95 2.85 0.00 0.00 7.04 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 67 I 7.40 3.88 1.79 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.60 0.85 0.00 0.00 68 L 6.80 3.84 0.00 1.81 1.04 1.05 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 69 D 8.07 4.54 0.00 2.64 2.47 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 0.00 0.00 0.00 0.00 70 Y 7.99 4.72 0.00 3.06 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 71 E 6.94 4.92 0.00 2.11 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 2.28 2.40 0.00 72 K 8.41 4.14 0.00 1.81 1.89 0.00 1.72 0.00 0.00 1.73 0.00 0.00 2.81 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.53 7.81 73 G 7.86 3.62 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 0.00 0.00 0.00 74 G 8.30 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 0.00 0.00 0.00 75 E 8.67 4.11 0.00 2.06 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 76 V 7.78 3.61 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 1.10 0.00 0.00 0.98 0.00 0.00 77 A 8.16 3.91 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 78 V 8.87 3.71 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 1.04 0.00 0.00 1.09 0.00 0.00 79 Y 7.85 4.04 0.00 3.08 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 80 L 8.46 3.40 0.00 1.40 0.81 0.98 0.63 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 81 T 7.91 3.94 4.47 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 0.00 0.00 0.00 1.33 0.00 0.00 82 G 7.71 3.49 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 L 7.42 3.76 0.00 1.23 1.38 0.72 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 84 Y 8.24 4.22 0.00 2.95 2.95 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 85 T 8.22 3.87 4.23 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 1.28 0.00 0.00 86 H 8.36 4.06 0.00 3.29 3.44 0.00 5.79 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 87 Q 8.11 3.74 0.00 0.93 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.53 0.00 88 I 7.18 3.64 1.92 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 1.39 0.76 0.87 0.00 0.00 89 K 7.85 3.85 0.00 1.91 1.83 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.41 7.81 90 V 7.80 3.67 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 1.05 0.00 0.00 0.69 0.00 0.00 91 L 8.07 3.96 0.00 1.90 1.73 1.02 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 92 T 7.82 3.91 4.37 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 1.20 0.00 0.00 93 Q 7.94 4.00 0.00 2.27 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.36 2.57 0.00 94 A 8.21 3.99 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 95 N 8.10 4.22 0.00 3.00 3.01 0.00 0.00 6.82 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 96 V 8.06 3.54 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.96 0.00 0.00 97 E 8.22 4.46 0.00 2.11 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 2.48 2.23 0.00 98 N 7.50 4.02 0.00 2.84 2.87 0.00 0.00 6.69 8.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 D 8.18 4.64 0.00 2.63 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.49 4.08 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 0.00 101 S 7.80 4.51 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 0.00 102 K 8.04 4.13 0.00 2.01 1.89 0.00 1.89 0.00 0.00 1.57 0.00 0.00 2.96 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.45 1.44 7.81 103 I 7.74 3.70 1.89 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 1.66 0.82 0.92 0.00 0.00 104 D 7.98 4.48 0.00 3.00 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 0.00 105 L 7.64 4.04 0.00 1.92 1.73 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 106 V 7.52 3.88 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 1.49 0.00 0.00 1.00 0.00 0.00 107 L 8.41 3.98 0.00 1.82 1.75 0.96 0.70 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 0.00 108 N 8.35 4.49 0.00 2.77 2.87 0.00 0.00 6.64 6.99 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 0.00 109 V 7.63 3.61 2.28 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 1.09 0.00 0.00 1.03 0.00 0.00 110 A 8.42 3.93 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 0.00 111 R 8.45 3.93 0.00 2.01 1.94 0.00 3.11 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 112 G 8.41 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 0.00 113 L 7.99 4.08 0.00 1.12 0.88 1.12 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 114 L 7.47 4.05 0.00 1.72 1.77 1.08 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 115 E 8.00 4.29 0.00 2.16 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 0.00 2.53 2.34 0.00 116 A 7.68 4.26 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 0.00 0.00 0.00 0.00 0.00 117 W 8.61 4.33 0.00 3.73 3.44 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 0.00 0.00 0.00 0.00 118 R 8.16 4.22 0.00 1.99 2.01 0.00 3.29 0.00 0.00 3.21 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.80 0.00 119 E 7.74 4.17 0.00 2.21 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 2.28 2.37 0.00 120 I 7.46 3.95 1.43 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 1.55 0.76 0.61 0.00 0.00 121 H 7.50 4.82 0.00 2.93 3.19 0.00 5.82 0.00 0.00 0.00 0.00 8.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 S 8.17 4.06 0.00 3.78 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 0.00 123 D 7.28 4.66 0.00 2.85 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.89 4.10 0.00 2.21 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 2.18 2.29 0.00