NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4162 8.1585 120.3263 55.3682 34.6359 177.4016 2 A 3.8279 8.0347 120.7019 54.8795 18.3949 176.2000 3 E 4.0490 8.3222 116.5488 58.9233 30.0942 177.9504 4 V 3.5704 7.6188 118.3541 65.9001 31.6011 177.8871 5 I 3.6744 7.7602 119.4588 64.4373 37.0195 178.5012 6 K 3.9513 8.0332 119.2530 59.6235 31.6518 179.3922 7 S 4.1221 7.8776 112.3025 61.4014 62.6297 176.0067 8 I 3.9070 7.6539 122.0905 64.6891 36.9088 178.3894 9 M 4.2865 8.4427 119.6363 58.0422 31.8477 178.7019 10 R 4.0170 8.2411 119.1910 58.3331 29.8682 177.6474 11 K 4.3673 7.6221 115.3920 55.6807 32.3479 175.5714 12 F 4.7628 7.8612 122.6065 55.4208 39.6015 173.2780 13 P 4.5503 0.0000 0.0000 62.7255 32.0659 175.8246 14 L 4.7291 8.8115 122.6020 52.4199 45.4784 176.4202 15 G 4.1153 8.8157 109.8016 46.7159 0.0000 172.5508 16 V 4.8759 8.3412 114.2745 59.4097 35.1875 174.5084 17 A 4.8438 8.6658 123.9190 50.8133 23.7416 174.9268 18 I 4.5931 8.2598 119.4394 59.7135 39.7245 175.7704 19 V 4.4687 7.9250 121.4776 60.4775 33.1426 175.6595 20 T 5.3393 9.0486 114.0755 60.7461 72.9658 172.1795 21 T 4.9739 8.9213 115.7961 61.4340 71.8664 172.0580 22 N 4.6244 8.8021 122.8028 51.7392 38.8797 174.0220 23 W 4.8107 8.9377 135.0000 55.6190 29.7038 176.0919 24 K 3.9470 9.7711 127.7246 56.9546 29.2923 176.3565 25 G 3.9148 8.5011 107.8355 45.1824 0.0000 174.1917 26 E 4.0300 7.9257 121.6766 55.2783 29.9278 175.4584 27 L 4.2745 8.1986 127.0190 54.4817 42.1543 176.5404 28 V 4.9192 8.1516 116.3319 60.1766 36.4549 174.6627 29 G 4.7594 8.8210 108.3398 46.9490 0.0000 172.0439 30 M 5.2117 8.5486 115.0054 54.3417 34.4812 174.5088 31 T 4.5942 8.8617 118.9058 63.9853 69.8642 173.9815 32 V 4.5486 8.8988 119.1777 59.3061 35.8948 175.8291 33 N 4.9607 9.0674 119.1483 52.1263 37.6618 174.7188 34 T 4.3601 7.5818 107.3650 61.6272 70.1972 173.4400 35 F 4.6697 8.0877 124.7423 58.8525 40.2745 173.6199 36 N 4.5146 7.7078 123.0043 52.3320 43.0795 172.8826 37 S 4.5207 8.2635 116.5129 57.9800 63.7493 173.1917 38 L 4.5160 8.7879 125.0106 56.3506 43.5835 176.3249 39 S 4.6043 7.6857 111.4420 56.9545 65.6572 174.2207 40 L 4.1674 8.6488 124.3251 55.6730 42.6236 176.1311 41 N 4.7393 7.7310 116.4478 50.6295 40.0727 171.7854 42 P 4.3779 0.0000 0.0000 61.5112 32.4098 174.5607 43 P 4.7850 0.0000 0.0000 62.3684 32.0310 174.8304 44 L 5.2194 8.9413 125.2225 52.8696 45.5637 176.3915 45 V 5.0367 8.8311 115.3881 59.8925 36.0213 174.5305 46 S 5.7738 8.9019 115.2788 57.8226 66.7085 172.8382 47 F 5.4105 7.9518 114.5170 55.8885 41.6009 172.3906 48 F 5.5991 8.9444 118.2664 55.8251 40.8069 175.3741 49 A 4.8962 8.9294 125.3929 49.7771 22.0664 174.7575 50 D 4.1397 8.7360 122.5847 54.2764 41.7944 177.3042 51 R 4.2790 8.8694 126.3137 58.9136 30.4532 179.2508 52 M 4.1062 7.9080 116.5998 57.9087 31.9614 177.4196 53 K 4.1503 8.1966 115.4444 56.2272 32.9111 177.5114 54 G 3.9327 7.9949 107.4612 46.4195 0.0000 175.4577 55 N 4.4967 7.9612 118.2134 55.5378 38.1183 176.6749 56 D 4.5929 8.0624 120.6713 56.0822 39.6504 178.4062 57 I 3.5666 7.3655 120.9790 63.9081 36.9193 176.3422 58 P 2.9700 0.0000 0.0000 65.1744 31.1744 177.9857 59 Y 4.2100 7.2227 114.7666 60.9239 37.7723 177.9899 60 K 4.0465 7.9871 118.3252 58.9033 32.1287 178.1566 61 E 4.6608 7.7542 116.1123 55.2114 30.1923 175.7669 62 S 4.9219 7.4581 114.8158 56.7251 66.7257 175.0841 63 K 4.0893 8.6522 121.6930 58.5596 33.0243 176.0355 64 Y 5.4717 7.9402 115.5994 56.4690 42.4358 174.1350 65 F 5.3780 8.9819 114.5699 55.8832 42.1336 173.1960 66 V 4.9019 9.1512 119.8054 61.2204 34.5638 174.3380 67 V 4.2316 8.7058 127.6436 61.3646 33.1808 173.9221 68 N 4.9111 8.6615 126.5854 51.6981 40.6366 174.0142 69 F 4.7223 8.5305 123.0850 55.9651 40.7886 174.8995 70 T 4.6730 8.2965 117.5480 60.0326 70.7364 172.8099 71 D 5.0399 8.9002 123.3900 53.0843 40.1125 175.7535 72 N 4.6423 7.6452 119.7847 52.5474 38.3899 175.3592 73 E 3.9558 8.6056 126.9841 59.1155 29.5126 178.6846 74 E 3.8958 8.0301 119.6786 59.2982 29.6405 178.9520 75 L 3.9748 7.7922 118.4905 57.7915 41.2734 179.4600 76 F 4.4888 7.5253 118.5440 60.1276 38.7841 177.3614 77 N 4.5313 8.2588 116.2087 56.1773 38.4433 177.4210 78 I 3.5805 7.8473 121.2768 64.3664 37.1568 177.6433 79 F 4.3424 8.2279 115.9549 57.5388 38.5486 176.7536 80 A 4.4943 7.5546 121.2428 52.7223 20.7834 177.8228 81 L 4.5338 8.2085 114.2915 55.8110 43.4731 177.6452 82 K 4.2480 7.4912 116.0744 54.7950 32.9889 175.1381 83 P 4.3168 0.0000 0.0000 62.6590 32.0274 177.5545 84 V 3.6052 8.7432 121.9647 66.3279 31.0979 178.5949 85 K 4.0503 8.0469 116.0592 59.1876 32.7085 177.5947 86 E 4.2957 8.1181 119.8303 57.3490 29.3968 178.0228 87 R 3.4788 7.5085 118.5071 59.0257 29.8566 178.0046 88 F 4.3741 7.8594 113.3543 57.8392 39.4252 176.8344 89 R 4.1925 7.8015 120.4994 58.6016 30.0213 177.4067 90 E 4.3813 7.5995 115.2744 56.4287 30.1470 175.9803 91 I 4.6330 7.5166 113.6685 59.0876 40.7358 175.4680 92 K 4.4969 8.4638 125.5266 55.1461 32.8268 176.1380 93 Y 5.5084 7.9991 121.7568 54.9026 41.2984 173.7588 94 K 4.6576 8.9993 118.6603 55.1466 36.4633 174.7079 95 E 4.7722 8.7099 120.2098 55.2891 31.1633 175.6003 96 G 4.5339 8.8133 113.8480 44.4534 0.0000 172.2777 97 I 3.5151 8.4656 122.5706 62.5043 38.2716 176.9176 98 G 3.7016 9.3039 114.3104 46.3171 0.0000 174.3055 99 G 3.9310 8.3555 105.8393 44.9810 0.0000 174.1972 100 C 4.4034 7.9646 118.8532 58.9707 29.1911 171.3850 101 P 4.8919 0.0000 0.0000 62.8561 32.1207 175.4652 102 I 4.2983 8.9509 125.2639 59.3302 39.3770 174.9055 103 L 4.5250 8.9117 128.4582 54.3831 42.0929 177.8153 104 Y 4.0681 8.8525 125.4152 60.8984 38.8696 176.6671 105 D 4.5755 7.9834 116.1311 54.5269 41.0546 176.2125 106 S 4.2483 7.6047 117.3202 58.4697 63.4020 173.9914 107 Y 4.4838 8.0298 122.8988 58.7734 39.1485 174.8267 108 A 5.1504 7.2857 120.5129 51.4756 22.8130 174.4128 109 Y 5.4726 8.6627 116.6490 56.0427 42.1910 173.6504 110 I 5.0034 8.8695 120.5807 59.6851 40.9364 174.3471 111 E 4.9929 9.3705 126.1300 54.8243 31.5229 174.9617 112 A 5.0821 8.7544 125.7289 49.8621 22.9888 174.3533 113 K 4.5940 8.8263 122.5914 54.4506 34.0558 175.4697 114 L 4.3115 8.3784 130.1496 56.7292 41.8281 175.4889 115 Y 4.5484 9.0748 127.7123 59.2159 40.5196 174.9150 116 D 4.7344 7.7791 115.6393 53.5983 44.8260 174.1991 117 T 5.2102 8.4175 112.1784 60.0134 72.0807 173.2273 118 I 4.4979 8.4394 124.7955 59.4726 40.7576 174.2998 119 D 4.8883 8.7217 127.9687 53.9391 41.4746 176.6521 120 V 4.1065 8.4958 123.1821 61.6492 34.3149 174.5203 121 G 3.8950 8.4333 119.3963 47.1704 0.0000 172.9397 122 D 4.7120 8.5710 124.0880 53.5918 39.8504 175.2502 123 H 5.4063 7.9089 116.3583 54.4765 33.4541 172.2429 124 S 5.0860 8.9858 115.8419 56.8339 66.0541 173.8106 125 I 4.5008 8.6769 125.8397 60.8218 38.2022 175.0388 126 I 4.2014 8.2746 129.9654 59.9464 38.4632 175.1379 127 V 4.9121 8.7645 127.9463 61.0272 33.8484 174.4854 128 G 4.6012 9.4829 115.3279 44.3566 0.0000 171.4966 129 E 4.6933 9.1798 124.9743 54.9501 31.1362 175.5829 130 V 4.0196 8.4894 127.9788 63.4943 31.3066 175.4704 131 I 4.2373 8.7230 130.1318 63.6703 38.1303 176.1183 132 D 4.6033 7.7895 118.9438 53.1353 45.3213 174.8503 133 G 4.3298 7.8645 106.7860 44.8460 0.0000 171.5131 134 Y 4.6877 8.6259 119.2740 56.0174 42.3694 174.4822 135 Q 4.6898 8.7907 122.8790 54.6396 29.3627 175.1395 136 I 4.1392 8.5207 126.2520 62.6550 38.2464 177.0013 137 R 4.6621 7.9520 120.6287 54.5893 32.4537 174.5081 138 D 4.6257 9.0549 126.5501 55.9182 41.6940 176.6193 139 N 4.6546 8.0901 115.9936 50.6064 37.5606 178.3972 140 F 4.9958 7.4293 117.6840 55.0021 40.7740 174.6604 141 T 4.3858 8.4165 119.0146 60.7019 68.4650 172.4857 142 P 4.6824 0.0000 0.0000 62.7245 32.1078 176.0558 143 L 5.2675 8.6017 120.4050 53.3353 44.6265 176.0420 144 V 4.7281 8.8202 113.9212 59.8508 36.0875 173.8750 145 Y 4.9191 9.0569 125.4582 56.4449 40.5623 174.1308 146 M 4.5349 8.6018 125.3950 54.6995 36.4144 173.9500 147 N 3.7922 8.8645 123.3871 54.9484 37.9072 174.8733 148 R 4.3490 7.4209 111.4496 56.2407 28.2871 176.2616 149 K 4.5735 7.0365 117.1064 54.5883 36.2689 174.8323 150 Y 5.0001 8.4689 119.7383 56.9555 39.2885 174.8068 151 Y 4.7413 9.2105 123.1001 56.3565 40.5355 176.0114 152 K 4.9321 8.6686 121.6518 55.6547 34.1379 176.2863 153 L 4.2271 8.3240 121.5548 54.0728 42.5089 176.4953 154 S 4.5787 8.5358 118.6857 57.4493 61.7635 174.0569 155 S 4.9754 8.0947 124.7737 56.1520 63.2589 174.7838 156 L 4.2542 8.0839 127.5433 55.7441 41.5360 173.2211 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 8.16 4.42 0.00 2.06 2.18 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.49 0.00 2 A 8.03 3.83 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 E 8.32 4.05 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 2.40 2.31 0.00 4 V 7.62 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 1.06 0.00 0.00 0.93 0.00 0.00 5 I 7.76 3.67 2.04 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 1.50 0.63 0.92 0.00 0.00 6 K 8.03 3.95 0.00 1.83 1.89 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.50 1.64 7.81 7 S 7.88 4.12 0.00 3.96 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 8 I 7.65 3.91 1.85 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 1.51 0.86 0.85 0.00 0.00 9 M 8.44 4.29 0.00 2.12 2.22 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.87 0.00 10 R 8.24 4.02 0.00 2.12 2.13 0.00 3.06 0.00 0.00 3.27 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 11 K 7.62 4.37 0.00 1.80 1.79 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.49 7.81 12 F 7.86 4.76 0.00 3.02 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.55 0.00 1.91 1.85 0.00 3.27 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.80 0.00 14 L 8.81 4.73 0.00 1.64 1.57 1.18 0.73 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 15 G 8.82 4.12 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 0.00 0.00 0.00 16 V 8.34 4.88 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.48 0.00 0.00 17 A 8.67 4.84 0.75 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 18 I 8.26 4.59 1.42 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.65 0.14 0.00 0.00 19 V 7.92 4.47 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 -0.13 0.00 0.00 -0.07 0.00 0.00 20 T 9.05 5.34 4.45 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 1.11 0.00 0.00 21 T 8.92 4.97 4.53 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 0.87 0.00 0.00 22 N 8.80 4.62 0.00 2.78 2.92 0.00 0.00 6.83 7.95 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 23 W 8.94 4.81 0.00 3.23 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 24 K 9.77 3.95 0.00 1.50 1.67 0.00 1.46 0.00 0.00 1.60 0.00 0.00 3.26 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.33 1.34 7.81 25 G 8.50 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 7.93 4.03 0.00 1.87 1.93 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 2.35 2.25 0.00 27 L 8.20 4.27 0.00 0.76 0.13 0.22 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 28 V 8.15 4.92 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 0.93 0.00 0.00 0.94 0.00 0.00 29 G 8.82 4.76 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 30 M 8.55 5.21 0.00 2.17 2.19 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.51 0.00 31 T 8.86 4.59 4.31 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 1.27 0.00 0.00 32 V 8.90 4.55 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 0.53 0.00 0.00 0.76 0.00 0.00 33 N 9.07 4.96 0.00 2.80 2.72 0.00 0.00 6.26 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 34 T 7.58 4.36 3.40 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 1.27 0.00 0.00 35 F 8.09 4.67 0.00 3.01 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 36 N 7.71 4.51 0.00 2.52 2.36 0.00 0.00 6.72 7.15 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 37 S 8.26 4.52 0.00 3.88 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 38 L 8.79 4.52 0.00 1.58 1.81 0.93 1.08 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 39 S 7.69 4.60 0.00 3.83 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 40 L 8.65 4.17 0.00 1.65 1.68 0.91 0.91 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 41 N 7.73 4.74 0.00 2.61 2.68 0.00 0.00 6.99 7.69 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 42 P 0.00 4.38 0.00 2.04 2.01 0.00 3.76 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.90 0.00 43 P 0.00 4.78 0.00 2.11 2.30 0.00 3.71 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.97 0.00 44 L 8.94 5.22 0.00 1.43 1.42 0.49 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 45 V 8.83 5.04 2.39 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 0.98 0.00 0.00 1.35 0.00 0.00 46 S 8.90 5.77 0.00 3.85 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 47 F 7.95 5.41 0.00 3.02 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 48 F 8.94 5.60 0.00 2.90 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 49 A 8.93 4.90 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 50 D 8.74 4.14 0.00 2.71 2.56 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 51 R 8.87 4.28 0.00 2.01 1.93 0.00 3.26 0.00 0.00 3.38 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.51 0.00 52 M 7.91 4.11 0.00 2.01 2.23 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.64 0.00 53 K 8.20 4.15 0.00 1.75 1.87 0.00 1.84 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.42 1.43 7.81 54 G 7.99 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 55 N 7.96 4.50 0.00 3.01 3.03 0.00 0.00 6.91 7.68 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 56 D 8.06 4.59 0.00 2.86 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 I 7.37 3.57 1.66 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 1.59 0.77 0.92 0.00 0.00 58 P 0.00 2.97 0.00 0.81 1.07 0.00 3.29 0.00 0.00 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.62 0.00 59 Y 7.22 4.21 0.00 3.00 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 K 7.99 4.05 0.00 1.87 1.89 0.00 1.67 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.49 7.81 61 E 7.75 4.66 0.00 2.24 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 0.00 2.38 2.51 0.00 62 S 7.46 4.92 0.00 3.93 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 63 K 8.65 4.09 0.00 1.57 1.31 0.00 1.55 0.00 0.00 1.78 0.00 0.00 2.85 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.56 1.44 7.81 64 Y 7.94 5.47 0.00 2.87 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 65 F 8.98 5.38 0.00 3.53 3.47 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 66 V 9.15 4.90 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.99 0.00 0.00 67 V 8.71 4.23 1.75 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 -0.72 0.00 0.00 1.09 0.00 0.00 68 N 8.66 4.91 0.00 2.41 2.40 0.00 0.00 6.45 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 69 F 8.53 4.72 0.00 2.39 2.35 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 70 T 8.30 4.67 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 0.44 0.00 0.00 71 D 8.90 5.04 0.00 3.04 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 72 N 7.65 4.64 0.00 2.64 2.57 0.00 0.00 7.23 9.00 0.00 0.00 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 E 8.61 3.96 0.00 2.00 1.75 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 2.45 2.40 0.00 74 E 8.03 3.90 0.00 1.94 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 2.27 2.33 0.00 75 L 7.79 3.97 0.00 1.58 1.41 0.74 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 76 F 7.53 4.49 0.00 2.76 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 N 8.26 4.53 0.00 2.88 2.89 0.00 0.00 7.00 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 I 7.85 3.58 1.90 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.96 0.29 0.00 0.00 79 F 8.23 4.34 0.00 3.16 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 80 A 7.55 4.49 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 81 L 8.21 4.53 0.00 1.67 1.71 0.97 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 82 K 7.49 4.25 0.00 1.73 1.62 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.41 1.29 7.81 83 P 0.00 4.32 0.00 2.15 1.96 0.00 3.57 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.06 0.00 84 V 8.74 3.61 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 1.24 0.00 0.00 0.99 0.00 0.00 85 K 8.05 4.05 0.00 1.96 1.95 0.00 1.62 0.00 0.00 1.63 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.49 7.81 86 E 8.12 4.30 0.00 2.07 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 2.19 2.42 0.00 87 R 7.51 3.48 0.00 1.50 0.66 0.00 3.01 0.00 0.00 2.53 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.59 0.00 88 F 7.86 4.37 0.00 2.96 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 R 7.80 4.19 0.00 1.91 2.01 0.00 3.32 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.63 0.00 90 E 7.60 4.38 0.00 1.78 1.95 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 2.26 2.32 0.00 91 I 7.52 4.63 1.94 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.87 0.94 0.00 0.00 92 K 8.46 4.50 0.00 1.47 1.73 0.00 1.78 0.00 0.00 1.87 0.00 0.00 2.84 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.43 1.00 7.81 93 Y 8.00 5.51 0.00 3.13 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 94 K 9.00 4.66 0.00 1.75 1.83 0.00 1.25 0.00 0.00 1.62 0.00 0.00 2.68 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.22 1.31 7.81 95 E 8.71 4.77 0.00 1.96 1.90 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 2.45 2.44 0.00 96 G 8.81 4.53 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 97 I 8.47 3.52 1.75 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.11 0.85 0.80 0.00 0.00 98 G 9.30 3.70 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 0.00 0.00 0.00 99 G 8.36 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 0.00 100 C 7.96 4.40 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 0.00 101 P 0.00 4.89 0.00 2.19 1.68 0.00 3.72 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.35 0.00 102 I 8.95 4.30 1.58 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.72 -0.00 0.00 0.00 103 L 8.91 4.53 0.00 1.42 1.50 0.40 0.77 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 0.00 104 Y 8.85 4.07 0.00 2.93 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 0.00 105 D 7.98 4.58 0.00 2.66 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 0.00 106 S 7.60 4.25 0.00 3.90 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 0.00 107 Y 8.03 4.48 0.00 3.04 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 0.00 108 A 7.29 5.15 1.20 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 0.00 0.00 0.00 0.00 0.00 0.00 109 Y 8.66 5.47 0.00 3.17 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 0.00 110 I 8.87 5.00 2.03 0.00 0.00 1.19 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 0.95 1.06 0.00 0.00 111 E 9.37 4.99 0.00 2.04 1.95 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 2.47 2.70 0.00 112 A 8.75 5.08 0.59 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 0.00 0.00 0.00 0.00 0.00 0.00 113 K 8.83 4.59 0.00 1.96 1.72 0.00 1.72 0.00 0.00 1.60 0.00 0.00 2.65 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.24 0.95 7.81 114 L 8.38 4.31 0.00 1.80 1.62 1.18 1.01 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 0.00 115 Y 9.07 4.55 0.00 3.03 3.15 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 0.00 0.00 0.00 0.00 116 D 7.78 4.73 0.00 2.79 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 0.00 117 T 8.42 5.21 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 1.21 0.00 0.00 118 I 8.44 4.50 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 1.22 0.62 0.88 0.00 0.00 119 D 8.72 4.89 0.00 2.53 2.58 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 0.00 120 V 8.50 4.11 1.91 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 0.88 0.00 0.00 0.88 0.00 0.00 121 G 8.43 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 0.00 0.00 0.00 122 D 8.57 4.71 0.00 2.90 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 H 7.91 5.41 0.00 2.97 3.13 0.00 5.76 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 S 8.99 5.09 0.00 3.63 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 I 8.68 4.50 1.83 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.33 1.05 0.00 0.00 126 I 8.27 4.20 0.56 0.00 0.00 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 0.40 0.48 0.47 0.00 0.00 127 V 8.76 4.91 2.37 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 1.11 0.00 0.00 0.99 0.00 0.00 128 G 9.48 4.60 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 0.00 0.00 0.00 129 E 9.18 4.69 0.00 2.02 1.90 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 2.29 2.37 0.00 130 V 8.49 4.02 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 0.79 0.00 0.00 0.99 0.00 0.00 131 I 8.72 4.24 2.04 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.14 0.96 0.00 0.00 132 D 7.79 4.60 0.00 2.63 2.10 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 0.00 133 G 7.86 4.33 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 0.00 134 Y 8.63 4.69 0.00 2.04 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 0.00 135 Q 8.79 4.69 0.00 1.92 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 7.04 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 136 I 8.52 4.14 1.94 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.90 0.92 0.00 0.00 137 R 7.95 4.66 0.00 1.78 1.92 0.00 3.27 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.67 0.00 138 D 9.05 4.63 0.00 2.74 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 N 8.09 4.65 0.00 2.73 2.64 0.00 0.00 6.45 7.43 0.00 0.00 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 F 7.43 5.00 0.00 2.79 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 0.00 141 T 8.42 4.39 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 1.25 0.00 0.00 142 P 0.00 4.68 0.00 2.34 2.32 0.00 3.69 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.02 0.00 143 L 8.60 5.27 0.00 1.77 1.85 1.28 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 144 V 8.82 4.73 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 0.71 0.00 0.00 0.99 0.00 0.00 145 Y 9.06 4.92 0.00 2.72 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 0.00 146 M 8.60 4.53 0.00 1.99 1.69 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.51 0.00 147 N 8.86 3.79 0.00 2.96 2.84 0.00 0.00 7.28 7.14 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 0.00 148 R 7.42 4.35 0.00 1.96 2.08 0.00 3.26 0.00 0.00 3.91 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 149 K 7.04 4.57 0.00 1.51 1.12 0.00 1.46 0.00 0.00 1.55 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.21 1.40 7.81 150 Y 8.47 5.00 0.00 2.94 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 0.00 151 Y 9.21 4.74 0.00 2.84 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 0.00 152 K 8.67 4.93 0.00 1.71 1.80 0.00 1.79 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.50 1.55 7.81 153 L 8.32 4.23 0.00 1.91 1.58 0.94 0.60 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 0.00 154 S 8.54 4.58 0.00 3.83 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 0.00 155 S 8.09 4.98 0.00 3.95 3.80 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 0.00 156 L 8.08 4.25 0.00 1.76 1.50 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00