NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2971 8.2993 120.1349 56.2511 33.7385 175.2118 2 K 4.3718 7.8018 116.9744 53.9577 34.7247 173.5689 3 P 4.7666 0.0000 0.0000 62.8108 33.2859 176.7051 4 K 4.8605 8.9517 119.3174 54.9454 36.7222 175.6933 5 L 5.1603 8.6723 121.9443 53.2860 44.7944 175.5569 6 L 5.2916 8.6419 120.8682 53.3996 44.7382 174.6115 7 Y 4.8749 9.3983 126.6478 55.9441 41.0515 173.8188 8 C 4.1145 8.5741 128.4909 58.2834 32.4198 173.8684 9 S 3.7956 7.9149 123.6920 61.7485 62.4599 175.3096 10 N 4.1570 7.4243 121.7454 54.6214 36.8498 174.4899 11 G 3.8464 8.4714 113.0551 44.1859 0.0000 171.3139 12 G 3.2440 7.3022 106.7010 46.8350 0.0000 173.0353 13 H 4.8508 7.2292 115.2557 53.2363 31.8215 174.8432 14 F 4.9880 8.5598 122.1128 57.3070 40.2469 174.6597 15 L 4.5932 9.2631 126.9255 55.3529 43.3735 175.6458 16 R 5.0007 9.2001 125.9570 54.8215 33.5615 173.7371 17 I 4.8274 8.1584 127.4617 59.4178 37.8852 175.6796 18 L 4.0804 8.6442 127.7530 53.6282 42.1075 177.2090 19 P 4.4528 0.0000 0.0000 64.8006 31.3271 176.8573 20 D 4.5917 8.0563 116.0369 53.0249 40.1244 177.1939 21 G 4.0403 8.6407 109.9915 45.5090 0.0000 173.5992 22 T 4.2829 8.1360 117.8747 63.3092 68.9128 173.4373 23 V 4.8609 8.3148 126.1113 61.1102 33.6112 174.1568 24 D 4.6279 8.7636 126.3380 52.6436 42.4797 173.8435 25 G 4.5016 8.7607 105.0028 45.1835 0.0000 172.5209 26 T 4.9873 9.1128 117.1660 60.1427 70.5895 174.7749 27 R 4.2345 8.8917 124.8953 56.9815 30.9443 175.9051 28 D 4.7148 8.1883 119.9391 53.3353 41.3393 177.0238 29 R 3.6641 8.6784 125.8557 57.5887 30.4515 177.3364 30 S 4.4013 8.3425 111.8195 58.1625 63.7093 174.1077 31 D 4.2855 7.6229 120.9604 55.2693 41.0422 177.0551 32 Q 3.9190 8.6107 124.0784 57.5920 29.2256 176.1032 33 H 4.7625 9.2280 115.6881 55.6067 29.3056 175.8490 34 I 4.8739 6.9933 111.5325 60.0956 38.4452 175.6318 35 Q 4.2195 7.7920 122.1415 55.9314 29.5391 174.9599 36 L 5.3199 8.9922 124.0071 52.7969 46.0818 175.2725 37 Q 4.8062 9.2243 122.2782 54.3111 32.1285 173.9122 38 L 5.3396 8.6096 125.8926 53.0480 43.8210 175.8413 39 S 4.8786 8.8823 117.9673 56.1891 66.1803 173.1181 40 A 4.5099 8.7856 125.7406 51.7026 18.7059 176.7550 41 E 4.4290 9.4361 122.5115 55.0753 29.7054 175.3367 42 S 5.5148 7.8776 111.1443 55.9676 63.7896 174.5036 43 V 3.6230 8.0907 117.7225 62.5747 31.6678 177.8654 44 G 4.0242 8.9265 112.4979 45.5910 0.0000 172.0230 45 E 5.0497 7.6895 120.3811 55.1295 31.4937 175.7462 46 V 4.7991 9.0834 116.5750 59.9159 36.6137 173.9153 47 Y 5.4210 8.9240 119.4773 56.5747 41.0812 175.2966 48 I 4.5824 8.6165 123.1779 59.6954 39.6781 174.1622 49 K 4.7227 8.6852 129.3596 53.9489 35.1706 175.1086 50 S 4.6223 8.9711 123.0700 58.6164 62.5689 174.9171 51 T 3.8762 8.5395 118.8038 64.5710 68.6623 175.9382 52 E 4.0340 8.3978 122.8786 58.9001 29.8404 177.1923 53 T 4.2947 7.8023 105.6293 60.9364 70.0210 175.5449 54 G 3.8143 8.1095 110.1543 45.1781 0.0000 173.7013 55 Q 4.5147 7.5279 119.0444 56.0298 30.4972 174.5896 56 Y 4.9716 8.7721 118.6677 55.7411 41.1852 175.3833 57 L 4.4758 8.9234 126.6091 55.7896 43.5934 175.5282 58 A 5.0875 8.5050 124.9114 51.2010 23.2738 174.6074 59 M 5.3645 8.7700 119.4768 53.9157 34.9512 175.5336 60 D 5.2985 9.6846 126.2289 51.7926 41.2602 176.8736 61 T 4.3695 8.5331 107.7653 63.5408 68.7522 174.4690 62 D 4.7083 8.8896 122.0472 54.0604 41.4016 177.0682 63 G 3.5978 9.1814 108.5039 45.6453 0.0000 172.8761 64 L 4.8263 7.8412 119.4466 52.6741 43.1860 175.8215 65 L 4.9393 8.4444 123.7529 55.1313 42.4581 175.7518 66 Y 5.0016 8.7891 120.4309 55.8825 42.1820 173.4929 67 G 4.4170 8.7566 107.5187 44.6662 0.0000 173.0372 68 S 5.1502 9.0873 119.7068 56.4486 64.4436 175.2706 69 Q 4.1031 9.1193 125.4904 58.2705 28.9310 176.5706 70 T 4.7073 7.5366 112.7948 60.3655 71.5018 172.0168 71 P 3.5628 0.0000 0.0000 62.6727 31.9917 175.2487 72 N 4.8978 8.0132 116.7672 51.6511 40.0025 174.5463 73 E 4.0059 8.6615 115.1820 59.2168 29.5997 177.5909 74 E 4.1236 8.1692 117.7471 57.5985 29.8472 177.1763 75 C 5.3931 7.7682 115.0415 58.8011 29.4431 173.3106 76 L 4.3216 7.3114 123.3709 54.2828 43.1518 175.2572 77 F 5.3040 8.8602 123.9962 55.5497 43.4325 174.0427 78 L 4.8005 9.3658 123.5348 54.4100 42.6465 175.4064 79 E 4.7923 9.1080 126.4096 55.0112 30.9519 175.4938 80 R 4.6835 8.4694 124.9006 54.2473 34.5036 174.0173 81 L 4.8702 8.5885 125.7462 54.3822 43.0937 175.9245 82 E 4.5186 9.2300 126.2970 55.0300 32.3077 176.3884 83 E 3.9411 9.0864 118.2847 60.0315 29.3512 178.4776 84 N 4.8160 8.6916 113.2836 53.4673 38.6957 175.4645 85 H 3.9490 8.1939 112.7895 56.5399 27.1619 174.8136 86 Y 4.4804 7.6516 117.3435 58.2124 39.4036 174.1567 87 N 5.4924 9.4068 119.2408 52.0461 41.2252 174.4475 88 T 5.0561 8.5499 112.4635 60.1573 72.7142 172.5512 89 Y 5.2860 8.6564 119.0091 56.4731 41.6481 174.3414 90 I 4.9391 8.7405 125.1274 58.9370 40.4465 175.0705 91 S 3.8507 9.0531 121.3526 58.9189 62.8755 175.0417 92 K 3.8297 8.6544 128.9493 59.3937 32.3627 178.5100 93 K 3.7293 7.9811 117.8391 59.3734 32.0850 177.5849 94 H 4.5698 7.7106 114.5779 55.3576 29.6598 176.8587 95 A 4.0750 7.5428 127.1259 54.6862 17.9446 180.1018 96 E 3.8817 7.9431 116.0263 58.6441 29.8906 177.5155 97 K 4.0755 7.6435 116.3793 56.0013 32.7538 175.8242 98 N 3.8122 7.5255 115.1127 53.8544 35.9485 174.8598 99 W 5.0246 7.7728 118.3356 55.9690 30.6678 176.9814 100 F 5.3716 8.9302 124.1444 55.5178 40.8530 176.2966 101 V 3.8071 8.7009 121.9151 63.5988 32.2658 175.2119 102 G 4.9383 8.7720 113.1227 44.9670 0.0000 171.3180 103 L 5.2141 8.2317 121.6996 52.2395 44.1983 176.6973 104 K 3.8382 8.8003 124.1437 56.2341 32.9797 178.0238 105 K 3.8608 8.6375 122.1931 59.5414 32.1319 177.2233 106 N 4.5017 8.0008 113.2842 53.1847 37.6449 175.6348 107 G 3.5575 8.2603 108.4065 45.1296 0.0000 172.9917 108 S 4.9890 7.6381 114.2618 56.2183 65.6258 173.3669 109 C 4.5682 8.5748 121.9307 59.8368 31.8800 173.1050 110 K 4.2955 8.6974 127.3085 56.0408 32.9528 176.5657 111 R 4.3351 8.5005 124.5369 55.2274 31.4478 177.6936 112 G 3.6383 8.8247 112.6031 48.2920 0.0000 174.1796 113 P 3.9163 0.0000 0.0000 64.2809 31.3213 177.3311 114 R 4.4816 7.7602 115.7051 55.8302 30.2741 176.3378 115 T 4.7119 7.3674 108.2458 61.0417 70.0479 173.5717 116 H 4.9344 8.4962 120.8074 54.5345 33.0340 172.2290 117 Y 4.0344 8.1512 122.0881 60.1772 38.0901 176.7950 118 G 4.0835 8.9386 111.9233 45.5354 0.0000 173.9887 119 Q 4.0752 7.8174 119.6209 55.2659 29.4466 177.3402 120 K 3.6766 8.5608 123.0203 59.0608 32.8124 178.4680 121 A 3.9405 7.9684 121.8432 54.7515 18.1971 178.3687 122 I 4.5059 6.9285 105.8369 60.3676 38.2113 175.2859 123 L 4.5178 7.3479 123.1861 53.5357 43.0684 175.4363 124 F 5.3006 9.1580 122.8470 55.5365 42.6673 173.9748 125 L 5.1164 9.2079 125.2543 52.8074 44.0861 173.6162 126 P 5.1698 0.0000 0.0000 62.6546 32.0549 175.7144 127 L 5.0857 9.1110 124.4768 51.9692 45.7060 174.5223 128 P 4.8386 0.0000 0.0000 62.9263 32.3831 176.0228 129 V 4.5086 7.7069 119.5618 60.5578 33.3077 175.8372 130 S 4.2605 8.7479 115.0039 59.5029 62.6030 173.9650 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 K 8.30 4.30 0.00 1.74 1.90 0.00 1.59 0.00 0.00 1.71 0.00 0.00 3.10 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.56 7.81 2 K 7.80 4.37 0.00 1.92 1.78 0.00 1.57 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.32 1.52 7.81 3 P 0.00 4.77 0.00 1.92 2.00 0.00 3.60 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.08 0.00 4 K 8.95 4.86 0.00 1.65 1.66 0.00 1.67 0.00 0.00 1.69 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.41 7.81 5 L 8.67 5.16 0.00 1.77 1.72 0.39 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.64 5.29 0.00 1.59 1.68 0.44 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 7 Y 9.40 4.87 0.00 3.18 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 8 C 8.57 4.11 0.00 2.48 2.48 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 0.00 0.00 0.00 0.00 9 S 7.91 3.80 0.00 3.63 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 10 N 7.42 4.16 0.00 2.56 2.69 0.00 0.00 7.05 7.98 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 11 G 8.47 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 0.00 0.00 0.00 12 G 7.30 3.24 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 0.00 13 H 7.23 4.85 0.00 2.99 3.16 0.00 5.82 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 F 8.56 4.99 0.00 3.18 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 15 L 9.26 4.59 0.00 1.83 1.52 0.95 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 16 R 9.20 5.00 0.00 1.94 2.06 0.00 3.34 0.00 0.00 3.27 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.69 0.00 17 I 8.16 4.83 1.85 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 1.18 0.70 0.90 0.00 0.00 18 L 8.64 4.08 0.00 1.88 1.58 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.45 0.00 1.99 2.09 0.00 3.52 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.86 0.00 20 D 8.06 4.59 0.00 2.78 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 21 G 8.64 4.04 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 0.00 0.00 0.00 22 T 8.14 4.28 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 23 V 8.31 4.86 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 0.87 0.00 0.00 0.91 0.00 0.00 24 D 8.76 4.63 0.00 2.90 2.75 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 25 G 8.76 4.50 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 26 T 9.11 4.99 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 1.40 0.00 0.00 27 R 8.89 4.23 0.00 1.88 1.98 0.00 3.20 0.00 0.00 3.06 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.51 0.00 28 D 8.19 4.71 0.00 2.77 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 29 R 8.68 3.66 0.00 1.74 1.71 0.00 3.60 0.00 0.00 3.41 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.49 0.00 30 S 8.34 4.40 0.00 3.92 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 31 D 7.62 4.29 0.00 2.88 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 32 Q 8.61 3.92 0.00 1.86 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.65 0.00 0.00 0.00 0.00 0.00 2.29 2.25 0.00 33 H 9.23 4.76 0.00 3.33 3.50 0.00 5.79 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 I 6.99 4.87 2.01 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.61 1.07 0.00 0.00 35 Q 7.79 4.22 0.00 1.98 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.84 0.00 0.00 0.00 0.00 0.00 2.37 2.32 0.00 36 L 8.99 5.32 0.00 1.62 1.43 0.81 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 37 Q 9.22 4.81 0.00 1.99 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.78 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 38 L 8.61 5.34 0.00 1.56 1.62 0.89 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 39 S 8.88 4.88 0.00 3.99 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.79 4.51 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 41 E 9.44 4.43 0.00 1.68 1.96 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 2.23 1.79 0.00 42 S 7.88 5.51 0.00 4.04 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 43 V 8.09 3.62 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 0.83 0.00 0.00 0.93 0.00 0.00 44 G 8.93 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 E 7.69 5.05 0.00 1.83 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.23 0.00 46 V 9.08 4.80 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 1.13 0.00 0.00 47 Y 8.92 5.42 0.00 3.02 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.62 4.58 1.64 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.65 0.64 0.00 0.00 49 K 8.69 4.72 0.00 1.50 1.40 0.00 1.25 0.00 0.00 1.13 0.00 0.00 2.63 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.93 0.21 7.81 50 S 8.97 4.62 0.00 3.84 3.66 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.54 3.88 4.20 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 1.13 0.00 0.00 52 E 8.40 4.03 0.00 1.92 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 2.32 2.40 0.00 53 T 7.80 4.29 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 54 G 8.11 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 0.00 0.00 0.00 55 Q 7.53 4.51 0.00 1.95 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.70 0.00 0.00 0.00 0.00 0.00 2.47 2.35 0.00 56 Y 8.77 4.97 0.00 2.88 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 57 L 8.92 4.48 0.00 1.63 1.48 0.81 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 58 A 8.50 5.09 0.57 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 59 M 8.77 5.36 0.00 2.14 2.23 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.70 0.00 60 D 9.68 5.30 0.00 3.01 2.96 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 61 T 8.53 4.37 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 1.36 0.00 0.00 62 D 8.89 4.71 0.00 2.80 2.72 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 63 G 9.18 3.60 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 64 L 7.84 4.83 0.00 2.18 1.66 0.92 0.63 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 65 L 8.44 4.94 0.00 1.58 1.63 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 8.79 5.00 0.00 3.08 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 67 G 8.76 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 0.00 0.00 0.00 0.00 68 S 9.09 5.15 0.00 4.08 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 69 Q 9.12 4.10 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.52 0.00 0.00 0.00 0.00 0.00 2.43 2.37 0.00 70 T 7.54 4.71 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 1.14 0.00 0.00 71 P 0.00 3.56 0.00 1.70 0.53 0.00 3.54 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.50 0.00 72 N 8.01 4.90 0.00 2.87 2.92 0.00 0.00 5.97 7.66 0.00 0.00 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 8.66 4.01 0.00 2.04 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 2.26 2.29 0.00 74 E 8.17 4.12 0.00 2.17 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 0.00 2.43 2.38 0.00 75 C 7.77 5.39 0.00 3.34 3.30 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 76 L 7.31 4.32 0.00 1.58 1.30 0.06 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 77 F 8.86 5.30 0.00 3.06 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 78 L 9.37 4.80 0.00 1.59 1.62 0.89 0.78 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 79 E 9.11 4.79 0.00 2.13 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 2.19 1.98 0.00 80 R 8.47 4.68 0.00 1.79 1.80 0.00 3.35 0.00 0.00 3.10 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.76 0.00 81 L 8.59 4.87 0.00 1.62 1.51 0.84 0.81 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 82 E 9.23 4.52 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.59 0.00 83 E 9.09 3.94 0.00 2.04 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 0.00 2.35 2.40 0.00 84 N 8.69 4.82 0.00 2.97 3.02 0.00 0.00 7.17 9.01 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 85 H 8.19 3.95 0.00 3.22 3.35 0.00 5.85 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 Y 7.65 4.48 0.00 3.09 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 87 N 9.41 5.49 0.00 2.77 2.42 0.00 0.00 6.90 6.80 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 88 T 8.55 5.06 4.49 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 1.15 0.00 0.00 89 Y 8.66 5.29 0.00 2.92 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 90 I 8.74 4.94 1.79 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.22 0.53 0.72 0.00 0.00 91 S 9.05 3.85 0.00 4.06 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 92 K 8.65 3.83 0.00 1.71 1.60 0.00 1.75 0.00 0.00 1.45 0.00 0.00 2.79 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.33 1.29 7.81 93 K 7.98 3.73 0.00 1.61 1.57 0.00 1.72 0.00 0.00 1.48 0.00 0.00 3.01 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.17 1.55 7.81 94 H 7.71 4.57 0.00 3.11 2.44 0.00 5.69 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 A 7.54 4.08 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 96 E 7.94 3.88 0.00 1.81 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.35 0.00 97 K 7.64 4.08 0.00 0.87 1.36 0.00 1.51 0.00 0.00 1.46 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.20 0.98 7.81 98 N 7.53 3.81 0.00 2.96 2.86 0.00 0.00 6.93 7.79 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 99 W 7.77 5.02 0.00 3.26 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 0.00 100 F 8.93 5.37 0.00 2.93 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 0.00 101 V 8.70 3.81 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 0.63 0.00 0.00 0.67 0.00 0.00 102 G 8.77 4.94 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 0.00 0.00 0.00 103 L 8.23 5.21 0.00 1.39 1.49 1.02 0.93 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 0.00 104 K 8.80 3.84 0.00 1.86 1.72 0.00 1.64 0.00 0.00 1.54 0.00 0.00 2.78 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.38 7.81 105 K 8.64 3.86 0.00 1.66 1.81 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.38 1.37 7.81 106 N 8.00 4.50 0.00 2.83 2.89 0.00 0.00 6.21 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 0.00 107 G 8.26 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 S 7.64 4.99 0.00 3.85 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 0.00 109 C 8.57 4.57 0.00 3.02 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 0.00 110 K 8.70 4.30 0.00 1.78 1.68 0.00 1.80 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.41 1.38 7.81 111 R 8.50 4.34 0.00 1.72 1.55 0.00 3.12 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.55 0.00 112 G 8.82 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 0.00 113 P 0.00 3.92 0.00 1.76 1.97 0.00 2.83 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.90 0.00 114 R 7.76 4.48 0.00 1.68 1.89 0.00 3.29 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.62 0.00 115 T 7.37 4.71 4.39 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 1.33 0.00 0.00 116 H 8.50 4.93 0.00 3.19 3.15 0.00 5.70 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 Y 8.15 4.03 0.00 2.94 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 0.00 118 G 8.94 4.08 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 0.00 0.00 0.00 119 Q 7.82 4.08 0.00 2.07 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.74 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 120 K 8.56 3.68 0.00 1.65 1.63 0.00 1.63 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.28 1.25 7.81 121 A 7.97 3.94 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 0.00 122 I 6.93 4.51 1.46 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.24 0.61 0.00 0.00 123 L 7.35 4.52 0.00 1.16 1.21 0.52 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 124 F 9.16 5.30 0.00 3.26 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 0.00 125 L 9.21 5.12 0.00 2.18 1.86 0.79 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 126 P 0.00 5.17 0.00 2.06 2.08 0.00 3.77 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.29 0.00 127 L 9.11 5.09 0.00 1.76 1.59 0.94 0.99 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 0.00 128 P 0.00 4.84 0.00 2.06 2.06 0.00 3.72 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 129 V 7.71 4.51 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 0.75 0.00 0.00 0.86 0.00 0.00 130 S 8.75 4.26 0.00 3.85 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