NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1530 8.3001 120.3264 54.9616 33.9248 173.5022 2 A 3.3720 8.0566 127.8217 51.3470 15.5718 175.4516 3 S 4.3596 9.1027 118.5084 59.5770 64.6679 172.7777 4 M 4.4919 8.2030 121.7197 54.5652 33.5811 175.5201 5 T 4.6929 7.9447 114.3327 59.7258 71.0093 173.5429 6 G 3.9972 8.4738 113.6336 45.0967 0.0000 174.2982 7 G 3.7056 8.6424 110.3684 47.6974 0.0000 173.3441 8 Q 4.3608 7.2020 115.1047 54.5315 31.8560 171.4167 9 Q 3.2342 8.8531 122.3624 56.0636 26.7198 174.1080 10 M 2.7817 9.5962 120.2383 56.6555 32.0395 176.1529 11 G 4.0937 8.5047 101.7968 47.9773 0.0000 174.2357 12 R 4.0025 7.9196 117.3055 55.6540 30.7995 177.4386 13 G 3.9733 8.2828 110.5852 44.9591 0.0000 172.3211 14 S 4.3988 7.8344 112.2525 57.2965 65.8028 171.3753 15 M 2.7610 9.6032 124.6350 57.1170 27.8513 177.6326 16 G 3.7439 8.2473 110.1210 45.1675 0.0000 171.5226 17 A 3.7549 8.3469 117.2766 52.4425 15.8666 177.5735 18 A 4.2426 7.1242 117.2152 53.1211 21.2939 177.6353 19 S 4.2379 8.8845 118.1251 61.8147 63.4844 174.7490 20 A 4.5395 7.5507 120.2149 50.6068 21.7495 174.6455 21 A 4.6973 8.3957 123.4684 50.8836 20.4830 177.8819 22 V 4.5048 8.2944 116.3979 61.1317 32.7252 175.6587 23 S 4.7925 8.0158 114.1095 56.5825 66.0958 173.6339 24 V 4.4253 7.9677 122.4532 61.2577 33.7422 175.4833 25 G 4.0962 7.9935 113.7657 45.4021 0.0000 170.7513 26 G 3.9296 8.5148 105.3726 45.4826 0.0000 172.0310 27 Y 4.3871 8.4481 119.0349 55.3857 40.6911 175.6087 28 G 3.6694 7.5522 116.1345 43.9493 0.0000 170.8731 29 P 4.5288 0.0000 0.0000 62.5857 31.8079 175.2466 30 Q 4.7452 8.2175 115.7948 54.8651 31.9119 174.3448 31 S 4.5160 8.7026 110.0453 59.4890 65.9194 174.0996 32 S 4.8155 7.7537 113.6068 56.4618 65.2574 174.9684 33 S 4.3279 8.4272 119.4559 58.6245 61.1912 174.9406 34 A 4.2007 8.4003 127.1300 54.2944 18.7689 177.2357 35 P 4.3208 0.0000 0.0000 65.2742 31.2948 178.6484 36 V 3.5124 7.7373 118.1119 66.1662 31.5777 177.6184 37 A 4.0386 7.9397 119.9687 55.1145 18.2688 179.5676 38 S 4.0540 7.9710 113.2699 61.7494 62.9241 176.8060 39 A 3.9842 8.3247 123.4234 55.0782 18.1122 179.5428 40 A 3.9478 8.0290 118.9454 55.2028 18.4241 179.7666 41 A 3.9607 8.2410 119.4620 55.2221 18.1956 180.0740 42 S 4.0669 7.7336 113.0708 61.8249 63.3752 176.9427 43 R 4.0952 7.9933 118.2846 58.6627 29.0995 178.4224 44 L 3.9859 7.7799 120.8741 57.8943 42.1564 178.0619 45 S 4.3324 7.8524 111.0265 58.3687 63.0247 174.3238 46 S 4.3433 7.2803 116.2967 58.1225 63.7623 173.4664 47 P 4.2517 0.0000 0.0000 65.8057 30.9435 178.8663 48 A 3.9817 7.9802 118.9423 55.0161 18.3820 179.3983 49 A 3.9461 7.8993 119.0870 55.2510 18.6038 179.9335 50 S 4.0906 8.0390 112.3593 61.8323 63.0288 176.7723 51 S 4.1309 8.0270 118.5743 61.4113 62.5281 176.9444 52 R 3.9657 7.8959 120.3262 58.9691 29.7847 179.2694 53 V 3.5679 7.7959 118.2303 66.0983 31.6687 178.2050 54 S 4.1192 7.9399 114.5162 61.8889 62.6970 176.9433 55 S 4.1470 8.0906 117.4317 61.5303 62.5056 176.6392 56 A 4.0234 8.1819 123.6481 54.8659 17.9515 179.8882 57 V 3.4589 7.6113 116.7374 66.3440 31.7124 178.2014 58 S 4.0710 7.9116 112.4069 61.3995 62.1660 176.3562 59 S 4.1080 8.0339 117.7576 61.7099 62.5787 176.7206 60 L 4.0020 7.8735 121.6690 57.6400 41.1071 179.8310 61 V 3.5609 7.8051 117.4723 66.1664 31.6042 178.0762 62 S 4.2826 7.9108 113.5101 61.7202 62.8130 176.5504 63 S 4.5943 7.8706 116.8743 59.5853 63.0401 172.4697 64 G 3.2344 8.1247 111.1880 43.6144 0.0000 171.6792 65 P 4.2485 0.0000 0.0000 64.8498 31.4348 177.4061 66 T 4.6494 7.7219 106.6214 60.9453 69.4398 173.2851 67 N 4.8606 8.1035 120.1283 53.0370 41.6142 174.5849 68 Q 3.9575 8.5832 127.6441 59.3204 29.4510 178.4550 69 A 3.9917 7.9678 121.1243 55.0252 18.6152 179.3282 70 A 3.9552 7.9176 118.8407 55.2855 18.5824 179.6951 71 L 3.9787 8.0284 117.8097 57.9020 41.6880 179.8496 72 S 4.1588 8.0709 114.2161 61.5743 62.8091 176.3754 73 N 4.3263 8.0989 119.7342 56.2863 38.3017 177.5737 74 T 3.8510 7.8247 116.7967 66.6706 68.5911 176.8648 75 I 3.7007 7.7612 121.6700 64.3252 37.2562 178.4005 76 S 4.0750 7.9865 113.8362 61.5732 62.3223 176.3975 77 S 4.1082 7.9847 117.7239 61.5580 62.5102 176.9205 78 V 3.5463 7.8414 120.8330 66.0157 31.3927 178.1195 79 V 3.5701 7.8668 117.9474 66.0755 31.4395 178.0650 80 S 4.1036 7.9696 114.6761 61.7729 62.8611 176.8003 81 Q 4.0218 8.0196 120.1765 59.3000 28.3804 178.5539 82 V 3.6201 8.1430 120.4356 65.8307 31.2692 178.2476 83 S 4.1445 7.8886 113.9908 61.3365 62.7015 176.0495 84 A 4.1390 7.5837 122.3449 55.3655 18.1876 179.6095 85 S 4.2955 7.9367 112.4825 60.2238 64.3199 174.9177 86 N 4.9780 7.4578 118.4443 51.0867 37.8050 172.5400 87 P 4.4167 0.0000 0.0000 65.1562 32.5523 180.0543 88 G 3.5734 8.0421 107.1682 48.0030 0.0000 173.9700 89 L 4.2466 6.9741 116.0775 54.0676 42.6047 177.5032 90 S 4.5156 8.3707 117.1739 58.0427 64.9121 175.8211 91 G 3.6858 8.5659 109.6150 48.2943 0.0000 175.5430 92 C 4.1668 8.0003 120.3912 62.3952 31.6701 175.1828 93 D 4.3726 8.0844 120.0903 57.2011 40.4309 178.7965 94 V 3.5487 7.6596 118.3629 65.9360 31.5582 177.8811 95 L 3.9490 7.7504 119.6702 57.9859 41.9478 179.0066 96 V 3.5459 7.9025 118.2485 66.1195 31.5545 177.8401 97 Q 3.9321 8.0840 119.0085 59.0641 29.0111 178.0008 98 A 3.9989 7.9504 121.7240 55.0429 18.5130 179.6559 99 L 3.9207 7.9092 117.7039 57.9794 41.8298 179.8476 100 L 4.0794 7.8821 119.5251 58.7531 40.5098 179.0444 101 E 4.3660 8.0354 120.4878 58.7218 29.3182 179.4003 102 V 3.6248 7.6905 118.2542 65.6967 31.5355 178.2443 103 V 3.5750 7.6035 117.9766 65.9885 31.5117 178.1879 104 S 4.1142 8.1765 113.7989 61.3715 62.9288 176.2625 105 A 3.9943 7.9308 124.1207 54.9648 18.1452 179.6484 106 L 3.9623 7.9335 117.4803 57.7724 41.6523 179.8616 107 V 3.5926 7.8531 118.3550 66.1223 31.5015 178.2418 108 S 4.1495 8.0425 114.8033 61.6548 62.5511 176.7953 109 I 3.7177 7.5775 122.0529 64.2886 36.6080 178.4905 110 L 4.4596 7.2447 120.2688 57.2985 41.5373 179.5238 111 G 3.7378 7.9649 104.8000 47.7441 0.0000 175.5777 112 S 4.3490 7.9522 115.6822 59.3196 63.8229 174.6702 113 S 4.6210 7.7620 117.3325 57.0102 64.6253 172.8093 114 S 4.9176 8.2228 116.4911 56.9445 64.4080 173.9064 115 I 4.4159 8.2319 124.8160 60.0448 39.2313 175.0524 116 G 4.1096 8.0845 112.2518 45.7841 0.0000 175.4340 117 Q 4.3662 8.6279 125.2885 54.1094 29.4516 175.0239 118 I 3.8948 8.2782 124.5485 60.9000 37.2244 176.0137 119 N 4.6827 8.5565 125.4145 52.6490 37.6636 173.5657 120 Y 4.0458 8.5864 126.4735 60.0181 39.5351 178.4223 121 G 3.6309 8.3157 107.6284 48.5046 0.0000 174.5618 122 A 4.2677 8.4970 120.2463 52.5357 18.5996 179.2090 123 S 4.2796 8.0088 113.8031 61.5735 62.9311 176.6071 124 A 4.0102 7.9529 123.7537 54.7948 18.2581 179.2280 125 Q 3.9726 7.9347 118.2344 59.6567 29.1421 178.1447 126 Y 4.1330 7.7390 117.1580 61.2078 37.8912 178.4147 127 T 3.9351 7.8856 116.7000 66.8027 68.4728 176.6144 128 Q 4.0376 7.9966 119.7406 58.9961 28.6403 178.6990 129 M 4.6608 7.7549 120.7437 57.8955 32.1593 178.9894 130 V 3.6579 7.7429 117.9484 66.0328 31.8861 178.1710 131 G 3.7285 8.0489 105.4801 48.0165 0.0000 175.6065 132 Q 4.0356 8.3526 120.5616 58.7846 28.7625 178.9522 133 S 4.1397 8.0779 115.3707 61.3073 62.9561 176.7990 134 V 3.5201 7.7376 121.1591 65.6639 31.3954 177.8710 135 A 3.9589 7.8307 120.1620 55.4198 18.0165 179.7042 136 Q 3.9337 8.2379 116.3569 58.9368 28.5405 178.8345 137 A 4.0624 7.8925 120.8991 54.8208 18.6085 178.9563 138 L 4.3331 7.6526 114.1465 55.5569 42.2309 178.5544 139 A 4.2575 7.8942 121.2271 52.7951 18.4377 177.5406 140 G 3.6705 7.3035 108.7910 46.5396 0.0000 172.1031 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 M 8.30 4.15 0.00 2.03 2.19 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.55 0.00 2 A 8.06 3.37 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 3 S 9.10 4.36 0.00 3.87 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 4 M 8.20 4.49 0.00 2.00 1.98 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 2.55 2.51 0.00 5 T 7.94 4.69 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 1.24 0.00 0.00 6 G 8.47 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 7 G 8.64 3.71 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 0.00 8 Q 7.20 4.36 0.00 2.10 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.19 0.00 0.00 0.00 0.00 0.00 2.21 2.36 0.00 9 Q 8.85 3.23 0.00 2.23 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 5.95 0.00 0.00 0.00 0.00 0.00 2.26 2.33 0.00 10 M 9.60 2.78 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.46 0.00 11 G 8.50 4.09 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 0.00 12 R 7.92 4.00 0.00 1.80 1.86 0.00 3.19 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 13 G 8.28 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 14 S 7.83 4.40 0.00 3.89 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 15 M 9.60 2.76 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.50 0.00 16 G 8.25 3.74 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 0.00 0.00 0.00 17 A 8.35 3.75 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 18 A 7.12 4.24 1.22 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 0.00 0.00 19 S 8.88 4.24 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 20 A 7.55 4.54 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 0.00 0.00 0.00 0.00 0.00 21 A 8.40 4.70 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 V 8.29 4.50 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 0.74 0.00 0.00 0.93 0.00 0.00 23 S 8.02 4.79 0.00 3.80 3.72 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 24 V 7.97 4.43 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 0.77 0.00 0.00 0.93 0.00 0.00 25 G 7.99 4.10 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 0.00 0.00 0.00 26 G 8.51 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 27 Y 8.45 4.39 0.00 2.92 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 28 G 7.55 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 0.00 0.00 0.00 29 P 0.00 4.53 0.00 2.18 2.07 0.00 3.60 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.92 0.00 30 Q 8.22 4.75 0.00 2.22 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.87 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 31 S 8.70 4.52 0.00 3.79 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 32 S 7.75 4.82 0.00 3.88 3.74 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 33 S 8.43 4.33 0.00 3.87 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 34 A 8.40 4.20 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 35 P 0.00 4.32 0.00 2.27 2.34 0.00 3.65 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.02 0.00 36 V 7.74 3.51 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 1.03 0.00 0.00 0.93 0.00 0.00 37 A 7.94 4.04 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 38 S 7.97 4.05 0.00 4.02 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 39 A 8.32 3.98 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 40 A 8.03 3.95 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 41 A 8.24 3.96 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 42 S 7.73 4.07 0.00 4.03 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 43 R 7.99 4.10 0.00 2.06 2.18 0.00 2.77 0.00 0.00 3.09 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.80 0.00 44 L 7.78 3.99 0.00 1.66 1.91 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 45 S 7.85 4.33 0.00 3.92 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 46 S 7.28 4.34 0.00 4.07 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 47 P 0.00 4.25 0.00 2.17 2.15 0.00 3.60 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 2.11 2.16 0.00 48 A 7.98 3.98 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 49 A 7.90 3.95 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 50 S 8.04 4.09 0.00 4.06 4.14 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 51 S 8.03 4.13 0.00 4.06 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 52 R 7.90 3.97 0.00 2.01 1.98 0.00 3.10 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.85 0.00 53 V 7.80 3.57 2.26 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 0.98 0.00 0.00 0.97 0.00 0.00 54 S 7.94 4.12 0.00 4.09 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 55 S 8.09 4.15 0.00 4.04 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 56 A 8.18 4.02 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 57 V 7.61 3.46 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 1.06 0.00 0.00 1.01 0.00 0.00 58 S 7.91 4.07 0.00 3.97 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 59 S 8.03 4.11 0.00 4.06 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 60 L 7.87 4.00 0.00 1.70 1.71 0.94 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 61 V 7.81 3.56 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 0.82 0.00 0.00 0.95 0.00 0.00 62 S 7.91 4.28 0.00 3.93 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 63 S 7.87 4.59 0.00 3.96 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 64 G 8.12 3.23 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 0.00 65 P 0.00 4.25 0.00 2.04 2.16 0.00 3.62 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 66 T 7.72 4.65 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 1.19 0.00 0.00 67 N 8.10 4.86 0.00 2.87 2.72 0.00 0.00 6.93 6.59 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 68 Q 8.58 3.96 0.00 2.20 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.78 0.00 0.00 0.00 0.00 0.00 2.42 2.49 0.00 69 A 7.97 3.99 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 70 A 7.92 3.96 1.40 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 0.00 0.00 0.00 71 L 8.03 3.98 0.00 1.87 1.74 1.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 72 S 8.07 4.16 0.00 4.07 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 0.00 73 N 8.10 4.33 0.00 2.97 2.91 0.00 0.00 6.97 6.48 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 74 T 7.82 3.85 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 1.21 0.00 0.00 75 I 7.76 3.70 1.87 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 1.66 1.07 0.91 0.00 0.00 76 S 7.99 4.07 0.00 3.99 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 77 S 7.98 4.11 0.00 3.93 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 78 V 7.84 3.55 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 1.03 0.00 0.00 0.95 0.00 0.00 79 V 7.87 3.57 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 0.97 0.00 0.00 0.96 0.00 0.00 80 S 7.97 4.10 0.00 4.09 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 81 Q 8.02 4.02 0.00 2.31 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.80 0.00 0.00 0.00 0.00 0.00 2.60 2.37 0.00 82 V 8.14 3.62 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 1.02 0.00 0.00 0.95 0.00 0.00 83 S 7.89 4.14 0.00 4.06 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 84 A 7.58 4.14 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 85 S 7.94 4.30 0.00 3.89 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 86 N 7.46 4.98 0.00 2.79 2.74 0.00 0.00 7.22 8.70 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 87 P 0.00 4.42 0.00 2.21 2.30 0.00 3.79 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.96 0.00 88 G 8.04 3.57 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 0.00 0.00 0.00 89 L 6.97 4.25 0.00 1.72 1.60 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 90 S 8.37 4.52 0.00 3.86 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 91 G 8.57 3.69 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 0.00 0.00 0.00 92 C 8.00 4.17 0.00 3.00 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 93 D 8.08 4.37 0.00 2.90 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 94 V 7.66 3.55 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 0.95 0.00 0.00 1.01 0.00 0.00 95 L 7.75 3.95 0.00 1.79 1.76 0.92 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 96 V 7.90 3.55 2.23 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 0.89 0.00 0.00 0.97 0.00 0.00 97 Q 8.08 3.93 0.00 2.34 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.89 0.00 0.00 0.00 0.00 0.00 2.35 2.63 0.00 98 A 7.95 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 99 L 7.91 3.92 0.00 1.85 1.72 0.95 0.61 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 0.00 100 L 7.88 4.08 0.00 1.90 1.92 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 101 E 8.04 4.37 0.00 2.30 2.04 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 2.33 2.31 0.00 102 V 7.69 3.62 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 0.99 0.00 0.00 0.97 0.00 0.00 103 V 7.60 3.57 2.26 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 1.07 0.00 0.00 1.01 0.00 0.00 104 S 8.18 4.11 0.00 4.10 4.10 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 0.00 105 A 7.93 3.99 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 0.00 106 L 7.93 3.96 0.00 1.87 1.70 0.91 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 107 V 7.85 3.59 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 1.00 0.00 0.00 108 S 8.04 4.15 0.00 4.09 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 0.00 109 I 7.58 3.72 2.01 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 1.51 0.95 0.89 0.00 0.00 110 L 7.24 4.46 0.00 1.77 1.71 0.89 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 111 G 7.96 3.74 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 0.00 0.00 0.00 112 S 7.95 4.35 0.00 4.07 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 0.00 113 S 7.76 4.62 0.00 3.99 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 0.00 114 S 8.22 4.92 0.00 3.86 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 0.00 115 I 8.23 4.42 1.87 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 0.39 0.90 0.00 0.00 116 G 8.08 4.11 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 0.00 0.00 0.00 117 Q 8.63 4.37 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.96 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 118 I 8.28 3.89 1.99 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 1.33 0.79 0.98 0.00 0.00 119 N 8.56 4.68 0.00 2.76 2.88 0.00 0.00 7.25 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 0.00 120 Y 8.59 4.05 0.00 3.12 2.99 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 0.00 0.00 0.00 121 G 8.32 3.63 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 0.00 0.00 0.00 122 A 8.50 4.27 1.47 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 0.00 0.00 123 S 8.01 4.28 0.00 3.93 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 0.00 124 A 7.95 4.01 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 0.00 125 Q 7.93 3.97 0.00 1.98 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.59 0.00 0.00 0.00 0.00 0.00 2.09 2.25 0.00 126 Y 7.74 4.13 0.00 3.19 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 0.00 127 T 7.89 3.94 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 1.22 0.00 0.00 128 Q 8.00 4.04 0.00 2.29 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.61 0.00 129 M 7.75 4.66 0.00 2.13 2.41 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.60 0.00 130 V 7.74 3.66 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 0.97 0.00 0.00 1.02 0.00 0.00 131 G 8.05 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 0.00 0.00 0.00 132 Q 8.35 4.04 0.00 2.35 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.73 0.00 0.00 0.00 0.00 0.00 2.37 2.48 0.00 133 S 8.08 4.14 0.00 4.07 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 0.00 134 V 7.74 3.52 2.23 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 1.09 0.00 0.00 0.97 0.00 0.00 135 A 7.83 3.96 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 0.00 136 Q 8.24 3.93 0.00 2.12 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.52 0.00 137 A 7.89 4.06 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 0.00 138 L 7.65 4.33 0.00 1.74 1.72 0.97 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 139 A 7.89 4.26 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 0.00 140 G 7.30 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 0.00 0.00 0.00