NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3857 8.2931 118.1941 54.7442 32.5069 175.6011 2 G 3.6990 8.5154 111.7882 45.2839 0.0000 171.1708 3 S 4.6550 8.3458 110.7676 57.0039 64.0676 173.2745 4 V 4.0929 7.4537 119.3895 61.2047 32.4579 175.5643 5 V 3.5726 8.5582 127.6375 63.3244 31.7164 175.2160 6 E 4.5395 8.3577 124.3038 55.8421 30.6966 175.6121 7 H 3.8388 7.7578 119.8503 55.8637 30.4113 173.9707 8 P 4.3364 0.0000 0.0000 65.8100 31.7841 178.3608 9 E 4.3300 8.4605 117.3757 59.1524 29.2551 178.9957 10 F 3.8162 8.0956 117.8463 60.2801 38.5588 177.6071 11 L 4.1858 7.4629 116.4745 57.3279 41.4384 178.9671 12 K 4.3297 7.8373 116.6359 56.7289 32.4727 177.3179 13 A 4.4004 7.5260 123.8028 53.3560 18.7045 177.7544 14 G 4.7889 9.6824 110.8783 46.5190 0.0000 175.2557 15 K 4.3058 7.7494 121.2948 58.1768 32.3814 177.1669 16 E 4.7828 7.8087 114.1514 53.5934 32.4420 173.0072 17 P 4.4224 0.0000 0.0000 62.1959 32.2409 177.5243 18 G 3.7774 7.1361 108.3581 45.3626 0.0000 170.1719 19 L 4.9964 7.9243 121.4248 53.2554 44.8965 177.0822 20 Q 4.6316 8.8727 123.9596 52.9302 32.5712 174.4217 21 I 4.8557 7.5447 122.5319 59.2301 41.1389 174.3687 22 W 5.4346 9.4882 125.4006 54.9100 33.4787 174.1382 23 R 4.7251 9.2293 122.4160 54.2740 32.5482 175.0613 24 V 4.3034 8.4525 126.3449 62.9316 32.5269 175.4099 25 E 4.3159 9.1785 127.0162 55.1942 32.4643 175.6280 26 K 3.4197 9.4478 125.4451 57.6412 29.3726 175.2381 27 F 4.0517 7.6404 110.4746 58.0942 37.0756 174.8531 28 D 5.0753 8.0226 119.5406 52.2798 44.0901 174.1553 29 L 4.5696 8.0715 124.9108 53.4810 43.1373 175.3747 30 V 4.6807 8.6189 127.6830 60.0137 33.9756 173.1219 31 P 4.7571 0.0000 0.0000 63.2632 31.7979 175.8521 32 V 4.1537 8.5008 123.6347 61.3171 32.6631 174.1160 33 P 4.2980 0.0000 0.0000 63.0098 31.7997 177.5780 34 T 2.7115 8.3819 113.2439 63.9734 68.6957 175.5723 35 C 4.2135 7.8562 115.3716 59.6063 30.3228 173.8404 36 L 4.4798 7.9521 120.4224 54.3656 41.7852 175.7441 37 Y 4.2676 7.6112 118.4660 59.7281 38.3317 177.3152 38 G 3.3998 8.4912 112.5910 44.9112 0.0000 172.3633 39 D 4.8562 6.9618 118.9789 52.8141 41.1958 175.5342 40 F 4.2073 8.4554 124.2155 55.0303 41.4984 175.5478 41 F 5.1402 9.3106 123.5929 57.9891 39.2352 176.5126 42 T 4.4137 9.7358 114.5655 63.5967 69.9283 175.8590 43 G 4.1876 8.5852 109.7135 46.4261 0.0000 172.6218 44 D 5.6668 8.7340 119.9174 52.2651 45.6527 174.2139 45 A 5.7260 8.4712 119.5794 50.8721 22.6156 174.7359 46 Y 5.4521 9.6480 116.7491 56.4794 43.2843 174.4201 47 V 5.2495 9.4516 120.6501 61.4630 35.0621 174.3077 48 I 5.2070 9.5307 128.0702 59.5279 40.8670 173.9036 49 L 5.2848 9.1822 129.3179 53.1974 44.7073 174.6362 50 K 4.6632 9.1798 128.2435 55.0588 34.2030 174.6491 51 T 5.1390 8.7548 124.9796 61.9437 70.7880 173.5991 52 V 4.3690 8.4271 126.9698 60.6044 34.3199 174.5002 53 Q 4.3000 8.6885 129.2453 56.3429 29.6249 175.0816 54 L 4.5328 8.5081 126.5967 53.0666 43.3221 177.7019 55 R 3.9155 8.9042 122.8863 59.7045 29.9820 177.2244 56 N 4.4142 7.9760 113.1888 54.0737 37.6280 174.3713 57 G 4.0276 8.5247 107.1622 45.3992 0.0000 173.4312 58 N 4.7427 8.4784 118.2160 52.8341 40.8872 173.6888 59 L 5.0241 8.0727 120.5178 52.7435 44.3411 176.1233 60 Q 4.2422 8.6510 124.5129 55.2878 31.0379 173.9009 61 Y 5.4391 8.3561 122.0745 56.3795 42.0527 173.9220 62 D 5.4909 9.3468 123.2390 52.6356 44.4591 174.6084 63 L 5.3345 9.2418 124.3567 53.4641 44.2468 175.2545 64 H 5.5420 9.8679 121.2421 54.0944 32.4599 171.9915 65 Y 5.3556 8.7369 121.7905 55.1505 40.2435 174.2335 66 W 4.9339 9.5144 135.0000 55.4795 33.2369 174.5234 67 L 4.7254 7.8516 127.3684 52.4254 43.7766 176.3363 68 G 3.4540 8.4160 112.2776 45.7080 0.0000 173.3664 69 N 4.2578 9.2424 122.0794 55.9522 39.0449 175.6358 70 E 4.6078 8.3074 115.6737 55.8447 29.8218 175.8156 71 C 5.1355 7.9734 114.0245 57.5951 30.5497 174.2522 72 S 4.5174 8.8336 117.5128 57.7345 65.0686 175.2628 73 Q 4.0388 8.6365 122.5896 59.2658 28.7645 177.7594 74 D 4.0785 7.7337 119.8074 56.1848 39.0869 178.4657 75 E 3.8351 7.7902 119.7111 59.1481 29.6767 179.1828 76 S 4.2830 7.9973 114.1282 61.2467 63.1461 176.5554 77 G 3.5653 8.3082 109.4708 47.5167 0.0000 175.4213 78 A 3.6504 8.0469 123.6715 54.4693 18.3641 179.4252 79 A 4.1467 8.4200 119.4642 55.3468 18.5126 179.7038 80 A 2.8957 7.7687 119.0526 55.0450 18.3380 180.0294 81 I 3.5307 7.5820 118.1870 64.5941 37.1316 178.5988 82 F 4.4814 8.3644 118.8889 60.9872 38.5754 177.9491 83 T 3.8498 7.8980 115.3446 66.5901 68.1822 176.7469 84 V 3.5636 7.5812 119.8950 66.1616 31.4859 178.0758 85 Q 4.1160 8.4163 117.9649 59.0324 28.6061 178.8033 86 L 3.1868 8.1942 120.3798 57.3854 41.4554 178.9852 87 D 4.2771 8.1984 118.0456 57.5877 41.2267 177.9895 88 D 4.3812 8.3894 119.5927 57.6917 40.5966 178.2807 89 Y 4.1636 8.0601 119.1304 60.3446 39.0040 176.9139 90 L 4.3694 8.0057 118.9132 54.4328 42.0433 176.7660 91 N 3.9184 8.8235 114.0599 54.4842 36.3871 176.0019 92 G 4.0322 8.5315 106.3625 45.8416 0.0000 175.8085 93 R 4.1027 7.8938 117.7579 58.1397 30.4156 176.9347 94 A 4.6427 7.8234 119.6425 51.8066 19.4753 177.1321 95 V 4.1446 8.6513 121.3897 61.8208 32.9202 175.1761 96 Q 5.0496 8.6331 127.0073 55.7367 30.3588 175.0873 97 H 4.8573 9.2071 118.9011 54.2231 33.4840 172.3101 98 R 3.1672 8.4243 123.5311 54.9130 31.0560 175.0153 99 E 4.3961 8.8409 126.6215 54.5284 32.0530 175.0747 100 V 4.0372 7.9819 124.9064 60.6445 33.6734 174.9110 101 Q 4.0639 7.3272 128.2766 58.1497 29.0455 177.4354 102 G 3.9034 9.8696 113.4083 45.6722 0.0000 173.8650 103 F 4.7880 8.2991 116.3235 56.9494 40.8833 174.8235 104 E 4.3221 8.3364 120.1812 56.2414 30.0845 177.7407 105 S 4.3760 9.2978 117.2440 58.2138 65.0880 175.4787 106 A 4.0255 8.5298 124.8299 55.5478 17.9148 180.2945 107 T 3.6528 7.7410 113.0488 66.7126 68.8888 175.9865 108 F 3.0530 7.7470 121.8325 61.0683 39.5468 177.2171 109 L 4.1798 8.1515 118.5885 57.5073 41.1792 179.4026 110 G 3.7286 8.0159 104.8150 46.9712 0.0000 174.6786 111 Y 4.5054 7.4226 117.8660 58.6483 38.6374 175.7062 112 F 4.6364 7.6155 119.3275 54.9819 38.7700 176.0355 113 K 4.0374 8.5472 125.7003 58.7555 32.1415 178.2970 114 S 4.4983 8.1779 110.9121 57.4451 63.2164 171.2395 115 G 3.8761 8.4215 115.5515 45.4700 0.0000 173.8619 116 L 4.0475 8.1222 126.3363 55.0020 43.1307 175.8558 117 K 4.4319 8.9539 124.3004 54.8486 35.9069 174.3548 118 Y 5.5754 8.3465 123.7151 56.4917 39.9088 175.1204 119 K 4.8075 9.0313 121.7171 54.9017 36.2279 176.1014 120 K 4.5768 8.2541 121.4165 56.8313 33.3710 177.4899 121 G 3.7288 8.3353 107.5759 45.1572 0.0000 172.4699 122 G 3.5008 7.4114 105.5106 43.6280 0.0000 172.7956 123 V 3.6893 7.8977 120.0291 60.8090 32.1327 176.1707 124 A 4.1323 8.1229 124.6086 51.5384 19.0279 177.4433 125 S 3.9837 8.4781 114.5249 58.8139 62.7176 174.8705 126 G 3.4985 8.5691 114.5518 45.9910 0.0000 173.9175 127 F 4.7772 7.7331 124.0345 57.9694 38.8131 174.9885 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 8.29 4.39 0.00 2.14 2.15 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 2.46 2.55 0.00 2 G 8.52 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 3 S 8.35 4.65 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 4 V 7.45 4.09 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 0.86 0.00 0.00 0.95 0.00 0.00 5 V 8.56 3.57 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 0.77 0.00 0.00 6 E 8.36 4.54 0.00 1.91 1.89 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 2.22 2.43 0.00 7 H 7.76 3.84 0.00 2.70 2.60 0.00 5.69 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 P 0.00 4.34 0.00 2.23 2.11 0.00 3.29 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.07 0.00 9 E 8.46 4.33 0.00 1.82 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 2.57 2.51 0.00 10 F 8.10 3.82 0.00 2.55 1.64 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 11 L 7.46 4.19 0.00 1.93 1.83 0.96 1.03 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 12 K 7.84 4.33 0.00 2.09 1.99 0.00 1.79 0.00 0.00 1.78 0.00 0.00 3.43 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.76 7.81 13 A 7.53 4.40 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 G 9.68 4.79 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 0.00 0.00 0.00 15 K 7.75 4.31 0.00 1.66 1.95 0.00 1.79 0.00 0.00 1.83 0.00 0.00 3.13 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.66 1.60 7.81 16 E 7.81 4.78 0.00 2.03 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.36 0.00 17 P 0.00 4.42 0.00 2.04 2.02 0.00 3.79 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.15 0.00 18 G 7.14 3.78 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 0.00 0.00 0.00 19 L 7.92 5.00 0.00 1.37 1.47 0.40 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 20 Q 8.87 4.63 0.00 1.69 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.54 0.00 0.00 0.00 0.00 0.00 2.11 2.06 0.00 21 I 7.54 4.86 0.97 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 -0.07 0.94 0.00 0.00 22 W 9.49 5.43 0.00 3.36 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 23 R 9.23 4.73 0.00 1.66 1.83 0.00 3.18 0.00 0.00 2.97 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.83 0.00 24 V 8.45 4.30 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 0.83 0.00 0.00 1.19 0.00 0.00 25 E 9.18 4.32 0.00 2.01 1.79 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 2.18 2.42 0.00 26 K 9.45 3.42 0.00 1.83 1.79 0.00 1.86 0.00 0.00 1.69 0.00 0.00 2.92 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.25 1.38 7.81 27 F 7.64 4.05 0.00 3.21 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 28 D 8.02 5.08 0.00 2.83 2.63 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 29 L 8.07 4.57 0.00 0.27 0.83 0.60 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 30 V 8.62 4.68 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 0.92 0.00 0.00 0.98 0.00 0.00 31 P 0.00 4.76 0.00 2.17 2.16 0.00 3.95 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.30 0.00 32 V 8.50 4.15 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 0.88 0.00 0.00 1.15 0.00 0.00 33 P 0.00 4.30 0.00 2.21 1.97 0.00 3.73 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.12 0.00 34 T 8.38 2.71 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 0.79 0.00 0.00 35 C 7.86 4.21 0.00 3.03 3.01 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 36 L 7.95 4.48 0.00 1.87 1.65 0.87 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 37 Y 7.61 4.27 0.00 2.89 2.85 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 38 G 8.49 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 0.00 0.00 0.00 0.00 39 D 6.96 4.86 0.00 2.53 2.32 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 40 F 8.46 4.21 0.00 2.36 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 9.31 5.14 0.00 3.44 3.27 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 42 T 9.74 4.41 4.43 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 0.00 0.00 0.00 1.41 0.00 0.00 43 G 8.59 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 D 8.73 5.67 0.00 3.19 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 45 A 8.47 5.73 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 46 Y 9.65 5.45 0.00 3.32 3.27 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 47 V 9.45 5.25 2.42 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 1.30 0.00 0.00 1.18 0.00 0.00 48 I 9.53 5.21 2.43 0.00 0.00 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 1.69 0.83 1.11 0.00 0.00 49 L 9.18 5.28 0.00 2.07 1.72 1.12 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 50 K 9.18 4.66 0.00 1.15 1.56 0.00 1.34 0.00 0.00 0.64 0.00 0.00 2.69 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.80 1.23 7.81 51 T 8.75 5.14 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 1.30 0.00 0.00 52 V 8.43 4.37 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 0.99 0.00 0.00 0.91 0.00 0.00 53 Q 8.69 4.30 0.00 2.06 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.58 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 54 L 8.51 4.53 0.00 1.95 1.52 0.90 0.66 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 55 R 8.90 3.92 0.00 1.75 2.00 0.00 3.23 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 56 N 7.98 4.41 0.00 2.84 2.92 0.00 0.00 6.31 7.00 0.00 0.00 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 G 8.52 4.03 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 0.00 0.00 0.00 58 N 8.48 4.74 0.00 2.77 2.68 0.00 0.00 6.94 6.68 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 59 L 8.07 5.02 0.00 1.07 1.21 1.06 0.83 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 60 Q 8.65 4.24 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.76 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 61 Y 8.36 5.44 0.00 3.04 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 62 D 9.35 5.49 0.00 2.85 2.83 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 63 L 9.24 5.33 0.00 1.69 1.75 0.96 0.84 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 64 H 9.87 5.54 0.00 3.34 3.09 0.00 5.58 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 Y 8.74 5.36 0.00 3.22 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 66 W 9.51 4.93 0.00 3.12 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 L 7.85 4.73 0.00 1.25 1.38 0.91 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 68 G 8.42 3.45 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 0.00 69 N 9.24 4.26 0.00 2.57 2.82 0.00 0.00 7.06 7.63 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 70 E 8.31 4.61 0.00 1.97 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 2.27 0.00 71 C 7.97 5.14 0.00 3.30 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 72 S 8.83 4.52 0.00 4.17 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 0.00 73 Q 8.64 4.04 0.00 2.25 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.95 6.93 0.00 0.00 0.00 0.00 0.00 2.61 2.50 0.00 74 D 7.73 4.08 0.00 1.92 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 75 E 7.79 3.84 0.00 2.13 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 2.24 2.14 0.00 76 S 8.00 4.28 0.00 4.12 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 77 G 8.31 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 78 A 8.05 3.65 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 A 8.42 4.15 1.58 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 0.00 0.00 80 A 7.77 2.90 1.12 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 81 I 7.58 3.53 1.58 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.64 0.79 0.00 0.00 82 F 8.36 4.48 0.00 3.07 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 83 T 7.90 3.85 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 84 V 7.58 3.56 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 1.12 0.00 0.00 0.89 0.00 0.00 85 Q 8.42 4.12 0.00 2.59 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.47 2.64 0.00 86 L 8.19 3.19 0.00 1.58 1.30 0.37 -0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 87 D 8.20 4.28 0.00 2.84 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 88 D 8.39 4.38 0.00 2.98 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 89 Y 8.06 4.16 0.00 3.22 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 90 L 8.01 4.37 0.00 1.82 1.45 0.34 0.32 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 91 N 8.82 3.92 0.00 2.90 2.91 0.00 0.00 6.90 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 92 G 8.53 4.03 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 0.00 0.00 0.00 93 R 7.89 4.10 0.00 2.20 2.18 0.00 3.23 0.00 0.00 3.36 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.82 0.00 94 A 7.82 4.64 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 95 V 8.65 4.14 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 0.96 0.00 0.00 0.99 0.00 0.00 96 Q 8.63 5.05 0.00 2.05 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.46 0.00 0.00 0.00 0.00 0.00 2.40 2.53 0.00 97 H 9.21 4.86 0.00 2.88 3.06 0.00 5.60 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 R 8.42 3.17 0.00 1.50 1.60 0.00 3.29 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.17 0.00 99 E 8.84 4.40 0.00 1.46 1.49 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 1.82 1.47 0.00 100 V 7.98 4.04 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 0.93 0.00 0.00 0.75 0.00 0.00 101 Q 7.33 4.06 0.00 1.41 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.32 0.00 0.00 0.00 0.00 0.00 1.96 1.20 0.00 102 G 9.87 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 0.00 103 F 8.30 4.79 0.00 2.91 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 0.00 104 E 8.34 4.32 0.00 2.14 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 2.65 2.47 0.00 105 S 9.30 4.38 0.00 4.02 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 0.00 106 A 8.53 4.03 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 0.00 107 T 7.74 3.65 4.17 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 1.18 0.00 0.00 108 F 7.75 3.05 0.00 3.11 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 0.00 109 L 8.15 4.18 0.00 1.89 1.72 1.03 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 110 G 8.02 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 0.00 111 Y 7.42 4.51 0.00 1.75 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 0.00 0.00 0.00 112 F 7.62 4.64 0.00 3.10 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 0.00 113 K 8.55 4.04 0.00 1.73 1.87 0.00 1.69 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.40 7.81 114 S 8.18 4.50 0.00 3.95 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 0.00 115 G 8.42 3.88 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 0.00 0.00 0.00 116 L 8.12 4.05 0.00 1.33 1.34 0.49 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 117 K 8.95 4.43 0.00 1.62 1.58 0.00 1.59 0.00 0.00 1.56 0.00 0.00 2.78 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.24 1.29 7.81 118 Y 8.35 5.58 0.00 2.91 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 0.00 119 K 9.03 4.81 0.00 1.75 1.77 0.00 0.74 0.00 0.00 1.31 0.00 0.00 2.36 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.15 0.88 7.81 120 K 8.25 4.58 0.00 1.78 1.89 0.00 1.87 0.00 0.00 0.61 0.00 0.00 2.87 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.54 1.31 7.81 121 G 8.34 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 0.00 122 G 7.41 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.90 3.69 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 0.70 0.00 0.00 0.87 0.00 0.00 124 A 8.12 4.13 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 0.00 125 S 8.48 3.98 0.00 3.82 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 0.00 126 G 8.57 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.73 4.78 0.00 3.07 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