NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2366 8.3144 119.9992 56.1331 33.9155 174.8775 2 E 3.5654 8.6411 121.2876 54.9507 30.1450 175.3527 3 T 4.3022 8.8367 118.6031 61.1953 72.0385 174.6640 4 A 4.0565 8.6668 123.7743 55.5723 18.2066 180.1107 5 A 4.1594 7.9564 118.2157 55.2780 18.7894 179.2743 6 A 3.8692 8.1486 119.3586 55.3780 18.2167 179.9355 7 K 4.8827 8.5842 119.5765 59.2296 32.3676 178.5550 8 F 4.1602 9.0557 122.1792 61.7984 38.9417 177.0093 9 E 4.1025 9.4508 119.0165 59.4574 28.9998 179.3744 10 R 3.9626 7.8667 117.9632 59.2792 30.2603 178.1258 11 Q 4.1851 8.7493 117.7314 58.2725 29.0723 176.3178 12 H 5.0913 8.6889 113.9115 55.0165 31.7949 173.4569 13 M 4.4027 7.7538 119.2318 56.0327 32.5566 175.9312 14 D 4.7694 9.6529 126.5549 52.5267 41.6619 175.4830 15 S 4.5342 8.4588 114.8696 58.1424 64.1056 175.8622 16 S 4.4318 7.8739 114.8249 59.1876 63.5505 173.7394 17 T 4.6967 7.4625 115.3348 60.2365 69.7528 173.9069 18 S 4.1822 8.9749 123.5904 59.8681 63.1571 173.7994 19 A 3.3215 7.1283 122.0510 51.2726 20.6254 175.3553 20 A 3.9394 8.2333 123.4300 52.4137 18.5682 177.8402 21 S 4.5773 8.5989 115.7880 57.9643 62.9736 173.0789 22 S 4.6059 7.4266 112.2327 57.8428 64.7226 175.2733 23 S 4.3363 8.7032 117.9206 60.0520 62.9604 174.2604 24 N 4.7241 8.5708 119.9237 54.0245 39.7341 175.5941 25 Y 4.0619 7.9994 119.5036 61.7950 38.7055 177.5102 26 C 4.6028 8.5150 116.7708 60.3704 38.6628 175.8620 27 N 4.5669 8.3687 117.3904 56.4964 38.0458 177.1486 28 Q 3.8558 8.0863 119.2797 59.4223 28.7897 179.1570 29 M 3.7911 8.1692 119.7213 58.6035 31.9582 178.5423 30 M 4.0709 8.2741 118.8718 58.3805 32.0769 178.8786 31 K 4.0345 7.7644 119.3977 59.4238 32.3353 179.1274 32 S 4.1020 7.5749 112.5762 61.4834 62.9804 175.5059 33 R 4.1259 8.3231 116.7168 56.0160 29.2599 175.9718 34 N 4.3029 7.8205 113.8853 54.5635 36.7599 174.9186 35 L 4.5154 8.1242 116.7385 55.1919 42.1946 177.8604 36 T 5.6419 7.5852 107.8527 60.6024 69.2804 175.5815 37 K 4.2224 8.4712 125.3678 59.7558 32.4103 177.1592 38 D 4.6922 7.8234 115.6767 53.7991 41.1497 175.6248 39 R 3.5629 7.1509 114.0740 55.1291 31.6016 174.5556 40 C 4.9937 8.7131 116.4639 55.6621 39.5008 173.8268 41 K 4.1103 8.1828 126.4157 56.2242 32.3222 175.1498 42 P 4.7251 0.0000 0.0000 65.1628 32.7960 176.1092 43 V 4.8472 7.2614 118.0060 61.0925 34.9107 173.9930 44 N 4.1203 8.0480 121.9263 53.3016 42.9786 173.0534 45 T 4.7261 8.0887 121.4674 61.6190 71.3386 173.3137 46 F 5.0068 8.7300 124.2371 55.7500 41.9816 174.6574 47 V 4.6252 9.4657 123.7104 61.0516 33.5927 175.4690 48 H 5.7906 8.9667 126.4234 53.9491 26.5775 173.1561 49 E 4.8073 7.8029 117.5470 53.2015 34.5345 176.5701 50 S 4.3077 8.4993 115.1728 58.6430 64.7915 175.1336 51 L 3.9858 8.5665 124.4256 58.3756 41.7788 178.8734 52 A 4.0364 8.1807 120.2097 55.7254 17.9020 179.1533 53 D 4.3703 7.3830 115.5034 56.9989 41.3583 179.0014 54 V 3.7791 7.9317 118.7785 66.2899 31.7936 178.0648 55 Q 4.1237 8.6497 117.7817 58.9526 28.5546 178.9528 56 A 4.0759 7.7408 121.5763 54.5781 18.3296 179.6599 57 V 3.5543 8.1348 117.2838 65.7852 31.3340 177.0243 58 C 4.0159 7.7165 114.9232 58.1918 39.8917 174.1488 59 S 4.5683 7.3174 113.9838 57.9135 63.6878 174.9059 60 Q 4.1515 7.4271 122.7073 56.1828 27.4676 176.9872 61 K 4.2665 7.7724 128.9922 56.4618 33.0146 176.0973 62 N 4.7362 9.0054 127.2110 54.3625 39.1923 174.2353 63 V 4.6029 7.8618 117.6741 59.2408 36.0000 175.2715 64 A 4.1120 8.3762 125.2167 51.9403 19.2498 178.5995 65 C 4.5995 9.9103 119.4000 55.9391 41.1096 174.8750 66 K 3.5473 9.0295 123.4362 59.3855 31.6640 177.1996 67 N 4.6580 8.1578 113.5096 52.3267 37.4996 175.7303 68 G 4.0011 8.2650 108.9656 45.8259 0.0000 174.6727 69 Q 4.0724 7.5629 117.6298 56.4816 29.2662 176.6672 70 T 4.3047 8.2093 113.9987 61.9488 67.9349 175.0002 71 N 4.7813 7.8844 116.1846 54.4933 38.2222 175.4946 72 C 5.1772 7.5430 116.6971 56.8213 43.3291 172.2644 73 Y 5.0420 7.9243 116.9278 56.5932 42.4924 173.6351 74 Q 5.0555 9.5533 126.2381 53.8635 31.6723 174.6617 75 S 4.3637 8.6722 121.9668 58.8257 62.8254 173.7433 76 Y 4.4277 8.2922 123.4352 61.0317 37.8960 177.3307 77 S 4.8344 7.8231 113.5810 57.6862 64.4234 174.3798 78 T 4.5967 8.3849 112.2730 61.7694 70.3511 173.6604 79 M 5.1951 9.0207 121.6170 53.7964 37.1746 174.4657 80 S 5.1113 9.7481 117.3914 57.8508 64.7176 173.2274 81 I 5.1572 9.1122 117.7052 59.4676 41.5679 174.0904 82 T 4.8072 8.7269 120.1846 61.8647 70.8668 172.9268 83 D 4.8039 10.6100 126.8043 53.5769 43.0761 174.2096 84 C 5.5433 9.2582 123.5032 55.2214 41.4290 172.6835 85 R 5.1731 9.1289 125.0932 54.0127 32.2351 174.7676 86 E 4.2826 9.8428 129.0022 57.1483 30.2460 176.1611 87 T 4.6253 8.7000 123.2110 61.5089 71.3995 174.7129 88 G 3.8567 8.4022 112.7616 46.7771 0.0000 172.5646 89 S 4.5124 8.7797 115.5393 58.3495 61.9710 170.0966 90 S 4.2338 7.5856 115.9852 58.0898 62.9508 173.6627 91 K 4.3579 10.2427 126.0693 54.3651 34.0034 174.5392 92 Y 4.2104 8.8418 126.9321 57.7070 38.8298 174.5905 93 P 3.4113 0.0000 0.0000 63.5743 31.7459 176.6604 94 N 4.7110 8.2365 119.2722 51.8185 37.7218 172.0808 95 C 4.4233 7.9657 117.6816 56.1635 42.1326 173.0590 96 A 4.7587 8.0087 124.8798 50.1744 21.6951 174.4502 97 Y 5.5625 9.8178 120.2379 54.9312 41.5082 175.5010 98 K 4.2195 10.2803 125.5253 56.6924 33.5464 175.5859 99 T 4.9894 8.6144 124.5492 62.7489 69.6028 174.1244 100 T 4.6359 9.4772 124.7481 61.6145 71.4570 172.9927 101 Q 4.9962 8.5522 126.6157 54.4564 31.6497 173.9997 102 A 4.5610 8.8477 126.0796 51.4210 23.7421 174.5595 103 N 5.3759 8.6659 116.5104 51.9449 39.9565 174.7912 104 K 4.7975 9.3689 122.7990 54.7765 36.8737 175.6448 105 H 4.9334 8.7750 118.8130 55.9501 29.9530 174.7274 106 I 4.4034 8.6048 115.2998 59.2056 41.1922 174.3271 107 I 5.3494 8.3334 123.9731 58.7709 39.8490 174.7746 108 V 4.6722 8.2410 126.4077 60.9617 34.4315 173.9821 109 A 4.7756 8.9108 128.9853 51.2076 20.2046 175.7464 110 C 5.4571 9.3073 119.9513 54.7322 42.6368 173.2043 111 E 4.5866 7.9682 118.1160 56.9189 33.7533 177.0925 112 G 4.1142 8.7740 110.9048 44.8911 0.0000 172.1866 113 N 5.1227 8.0494 115.9970 50.9568 41.5449 172.3779 114 P 4.0191 0.0000 0.0000 59.4633 33.0230 174.7426 115 Y 4.5133 8.4752 122.4604 57.0650 39.2918 174.5709 116 V 4.4883 7.7290 118.0803 58.4605 36.8211 173.2830 117 P 4.4637 0.0000 0.0000 62.6979 30.8752 176.9910 118 V 4.3905 8.8704 123.5432 61.5120 33.4368 175.2473 119 H 5.1657 7.6629 120.4536 54.6143 33.6940 171.6198 120 F 4.9086 9.2191 127.4622 57.3457 39.4686 174.5477 121 D 4.5737 8.7985 127.1488 55.2855 41.7972 176.1367 122 A 4.2293 5.9941 119.7022 52.0909 21.2269 174.5207 123 S 5.3011 8.5195 113.8791 56.8226 65.4344 174.7609 124 V 4.0174 9.8077 121.7198 62.1815 31.2125 174.5205 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 8.31 4.24 0.00 1.89 1.89 0.00 1.59 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.45 7.81 2 E 8.64 3.57 0.00 2.12 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 2.42 2.38 0.00 3 T 8.84 4.30 4.26 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 0.00 0.00 0.00 1.23 0.00 0.00 4 A 8.67 4.06 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 5 A 7.96 4.16 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 6 A 8.15 3.87 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 K 8.58 4.88 0.00 1.98 2.04 0.00 1.74 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.55 7.81 8 F 9.06 4.16 0.00 3.24 3.26 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 0.00 0.00 0.00 0.00 9 E 9.45 4.10 0.00 2.32 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 2.43 2.50 0.00 10 R 7.87 3.96 0.00 1.84 2.33 0.00 3.38 0.00 0.00 3.24 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 11 Q 8.75 4.19 0.00 1.66 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.50 0.00 0.00 0.00 0.00 0.00 2.36 2.55 0.00 12 H 8.69 5.09 0.00 2.32 3.00 0.00 5.64 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 13 M 7.75 4.40 0.00 2.03 2.20 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.65 0.00 14 D 9.65 4.77 0.00 2.58 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 S 8.46 4.53 0.00 4.03 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 S 7.87 4.43 0.00 3.98 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 17 T 7.46 4.70 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 1.62 0.00 0.00 18 S 8.97 4.18 0.00 3.89 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 19 A 7.13 3.32 1.11 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 20 A 8.23 3.94 0.66 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 0.00 0.00 21 S 8.60 4.58 0.00 3.87 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 22 S 7.43 4.61 0.00 3.88 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 23 S 8.70 4.34 0.00 4.05 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 24 N 8.57 4.72 0.00 2.82 3.17 0.00 0.00 6.66 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 25 Y 8.00 4.06 0.00 3.15 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 26 C 8.52 4.60 0.00 3.25 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 N 8.37 4.57 0.00 2.87 2.91 0.00 0.00 7.04 7.74 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 28 Q 8.09 3.86 0.00 2.28 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.82 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 29 M 8.17 3.79 0.00 1.31 1.97 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.85 0.00 30 M 8.27 4.07 0.00 2.06 2.50 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 2.71 0.00 31 K 7.76 4.03 0.00 1.72 1.99 0.00 1.64 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.45 7.81 32 S 7.57 4.10 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 33 R 8.32 4.13 0.00 1.98 2.15 0.00 4.05 0.00 0.00 3.09 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.70 0.00 34 N 7.82 4.30 0.00 2.88 2.91 0.00 0.00 6.84 7.91 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 35 L 8.12 4.52 0.00 1.75 1.64 1.02 0.40 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 36 T 7.59 5.64 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 1.49 0.00 0.00 37 K 8.47 4.22 0.00 1.79 1.92 0.00 1.77 0.00 0.00 1.78 0.00 0.00 3.08 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.47 1.49 7.81 38 D 7.82 4.69 0.00 2.67 2.69 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 39 R 7.15 3.56 0.00 1.88 1.75 0.00 3.10 0.00 0.00 3.32 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.58 0.00 40 C 8.71 4.99 0.00 3.10 3.21 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 41 K 8.18 4.11 0.00 2.10 1.71 0.00 1.74 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.37 7.81 42 P 0.00 4.73 0.00 2.21 2.52 0.00 3.72 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.99 0.00 43 V 7.26 4.85 2.07 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 0.76 0.00 0.00 0.95 0.00 0.00 44 N 8.05 4.12 0.00 2.49 2.14 0.00 0.00 6.92 7.35 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 45 T 8.09 4.73 3.10 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 1.02 0.00 0.00 46 F 8.73 5.01 0.00 3.04 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 9.47 4.63 2.16 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 1.10 0.00 0.00 0.88 0.00 0.00 48 H 8.97 5.79 0.00 3.05 3.58 0.00 5.62 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.80 4.81 0.00 1.95 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 50 S 8.50 4.31 0.00 4.07 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 51 L 8.57 3.99 0.00 1.83 1.74 1.05 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.18 4.04 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 53 D 7.38 4.37 0.00 2.58 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 54 V 7.93 3.78 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 1.13 0.00 0.00 55 Q 8.65 4.12 0.00 2.22 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.35 2.56 0.00 56 A 7.74 4.08 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 57 V 8.13 3.55 2.19 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 1.11 0.00 0.00 1.02 0.00 0.00 58 C 7.72 4.02 0.00 3.06 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 59 S 7.32 4.57 0.00 3.89 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 60 Q 7.43 4.15 0.00 1.88 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.96 0.00 0.00 0.00 0.00 0.00 1.17 2.14 0.00 61 K 7.77 4.27 0.00 1.87 1.68 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.41 1.42 7.81 62 N 9.01 4.74 0.00 2.88 2.73 0.00 0.00 7.01 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 63 V 7.86 4.60 1.97 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 0.73 0.00 0.00 0.82 0.00 0.00 64 A 8.38 4.11 1.18 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 0.00 0.00 0.00 0.00 0.00 65 C 9.91 4.60 0.00 3.05 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 66 K 9.03 3.55 0.00 2.08 1.86 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.44 1.37 7.81 67 N 8.16 4.66 0.00 2.84 2.89 0.00 0.00 6.17 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 68 G 8.26 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 69 Q 7.56 4.07 0.00 2.38 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.64 0.00 0.00 0.00 0.00 0.00 2.37 2.29 0.00 70 T 8.21 4.30 4.18 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 0.00 0.00 1.17 0.00 0.00 71 N 7.88 4.78 0.00 3.02 3.06 0.00 0.00 6.21 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 72 C 7.54 5.18 0.00 2.88 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 73 Y 7.92 5.04 0.00 2.83 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 74 Q 9.55 5.06 0.00 1.95 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.98 0.00 0.00 0.00 0.00 0.00 2.20 2.27 0.00 75 S 8.67 4.36 0.00 3.93 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 76 Y 8.29 4.43 0.00 3.06 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 77 S 7.82 4.83 0.00 3.81 3.82 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 0.00 0.00 0.00 0.00 78 T 8.38 4.60 4.35 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 1.37 0.00 0.00 79 M 9.02 5.20 0.00 2.15 2.03 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 2.58 2.52 0.00 80 S 9.75 5.11 0.00 3.81 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 81 I 9.11 5.16 2.02 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.69 1.01 0.00 0.00 82 T 8.73 4.81 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 1.00 0.00 0.00 83 D 10.61 4.80 0.00 2.84 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 C 9.26 5.54 0.00 2.65 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 85 R 9.13 5.17 0.00 1.89 1.81 0.00 3.18 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.66 0.00 86 E 9.84 4.28 0.00 2.31 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 2.28 2.69 0.00 87 T 8.70 4.63 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 1.20 0.00 0.00 88 G 8.40 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.78 4.51 0.00 4.01 4.06 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 S 7.59 4.23 0.00 4.09 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 K 10.24 4.36 0.00 1.67 1.58 0.00 1.70 0.00 0.00 1.58 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.33 1.49 7.81 92 Y 8.84 4.21 0.00 3.07 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 P 0.00 3.41 0.00 1.87 1.45 0.00 3.71 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.79 0.00 94 N 8.24 4.71 0.00 2.62 2.68 0.00 0.00 6.96 7.72 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 95 C 7.97 4.42 0.00 2.80 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 96 A 8.01 4.76 1.09 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 97 Y 9.82 5.56 0.00 2.71 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 98 K 10.28 4.22 0.00 1.90 1.86 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.47 1.46 7.81 99 T 8.61 4.99 4.30 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 1.19 0.00 0.00 100 T 9.48 4.64 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 101 Q 8.55 5.00 0.00 1.88 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.73 0.00 0.00 0.00 0.00 0.00 2.14 2.32 0.00 102 A 8.85 4.56 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 0.00 103 N 8.67 5.38 0.00 2.59 2.80 0.00 0.00 6.66 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 K 9.37 4.80 0.00 1.67 1.71 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.44 7.81 105 H 8.78 4.93 0.00 3.01 3.18 0.00 5.59 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.60 4.40 2.16 0.00 0.00 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 1.35 0.81 1.21 0.00 0.00 107 I 8.33 5.35 1.66 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.98 0.77 0.00 0.00 108 V 8.24 4.67 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 0.63 0.00 0.00 0.90 0.00 0.00 109 A 8.91 4.78 1.11 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 0.00 110 C 9.31 5.46 0.00 1.94 1.52 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.97 4.59 0.00 1.77 1.73 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 2.29 2.29 0.00 112 G 8.77 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 0.00 113 N 8.05 5.12 0.00 2.70 2.70 0.00 0.00 6.86 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 0.00 114 P 0.00 4.02 0.00 2.25 2.03 0.00 3.83 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 2.00 2.03 0.00 115 Y 8.48 4.51 0.00 2.94 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 V 7.73 4.49 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 0.66 0.00 0.00 0.85 0.00 0.00 117 P 0.00 4.46 0.00 0.49 1.15 0.00 3.45 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 1.87 1.86 0.00 118 V 8.87 4.39 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 0.68 0.00 0.00 0.87 0.00 0.00 119 H 7.66 5.17 0.00 3.23 3.10 0.00 5.85 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 0.00 120 F 9.22 4.91 0.00 2.86 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 D 8.80 4.57 0.00 2.29 2.43 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 0.00 122 A 5.99 4.23 1.16 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 0.00 0.00 123 S 8.52 5.30 0.00 4.08 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 0.00 124 V 9.81 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 0.70 0.00 0.00 0.92 0.00 0.00