NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2074 8.3144 121.7899 55.6155 33.4355 175.1491 2 E 3.7381 8.7384 126.3218 54.9847 30.0267 175.0891 3 S 4.4330 8.9343 123.0235 57.9800 66.2789 174.5768 4 A 3.9913 8.5837 124.7358 55.3095 18.1388 179.9773 5 A 3.9546 8.0173 118.4655 55.4413 18.4856 179.6034 6 A 3.9963 8.2355 119.3699 55.0888 18.3302 179.7483 7 K 4.1092 8.4273 119.9371 59.0475 32.2442 178.8203 8 F 4.0716 8.4678 120.9580 61.3745 39.4513 176.9518 9 E 4.0062 8.4045 118.2784 59.3495 29.0278 179.3821 10 R 3.8216 8.0404 118.0032 59.6565 30.2920 178.3710 11 Q 3.9975 7.9849 116.6358 58.1132 28.7985 176.5377 12 H 4.6522 7.8537 113.1500 54.8165 30.7875 172.9865 13 M 4.5766 7.6407 119.5593 53.6547 33.5655 176.4012 14 D 4.7147 8.1727 122.8259 52.5349 41.6906 173.9956 15 S 4.2104 8.1448 117.2177 56.8599 63.8545 174.4612 16 G 4.3724 8.0151 115.8255 44.9620 0.0000 172.0516 17 N 4.5543 8.2429 117.5981 55.3222 39.8021 176.3413 18 S 4.7277 7.5941 112.9810 56.1494 63.5013 172.7174 19 P 4.2709 0.0000 0.0000 65.3300 31.6920 178.2811 20 S 4.4954 7.8428 110.5374 57.7686 63.7908 174.1161 21 S 4.2038 7.7927 117.1071 58.5544 62.7832 175.2535 22 S 4.1818 8.7650 121.0629 61.1999 62.8590 176.5467 23 S 4.2318 7.7980 114.7203 60.6854 62.8966 174.6292 24 N 4.7484 8.2921 117.6863 53.4274 39.1310 176.0032 25 Y 4.0236 8.1197 120.9545 61.1903 38.7410 177.5545 26 C 4.2047 8.5228 117.1313 60.0169 39.6449 175.7092 27 N 4.4464 8.2964 117.5330 56.5360 38.1139 177.3057 28 L 3.9799 7.8218 119.9741 58.0414 41.7935 179.5076 29 M 3.6731 7.9212 118.9447 58.4960 31.6481 178.7619 30 M 4.1834 8.1792 119.2610 58.2964 31.9832 178.4999 31 C 4.1759 7.6288 118.8531 62.1464 31.6433 175.0255 32 C 3.9632 8.0750 119.6671 62.4905 31.1585 174.4022 33 R 4.3807 8.3461 116.1257 55.7445 29.5268 176.2394 34 K 3.9008 7.7755 115.7946 58.5501 29.7064 176.3237 35 M 4.6872 8.4677 115.6375 55.3976 32.3468 177.2409 36 T 4.7655 7.7171 106.2793 60.2208 69.6794 172.6019 37 Q 4.5653 8.3302 121.2742 56.5719 29.8059 174.1827 38 G 4.2095 11.0855 114.0019 45.1806 0.0000 173.1278 39 K 3.7302 6.8893 115.9660 55.2096 35.0885 175.0861 40 C 4.9317 8.5790 117.8778 55.7454 40.5397 173.8495 41 K 4.1612 8.6592 127.6537 55.8879 32.3221 174.8796 42 P 4.7253 0.0000 0.0000 64.8806 32.6523 176.5236 43 V 5.0236 7.6239 118.6778 61.1114 34.5896 174.1556 44 N 4.7599 9.4253 125.5649 52.5945 42.7930 172.7830 45 T 4.7484 7.7489 121.8067 61.7050 70.7903 173.5728 46 F 4.7535 8.8961 124.9398 55.6939 41.7063 174.6881 47 V 4.5233 8.3755 122.5095 61.6676 32.9264 174.8673 48 H 4.8761 8.9629 124.0422 55.8756 29.2588 175.3933 49 E 4.3360 8.0606 118.4523 55.1119 30.7235 177.0000 50 S 4.2183 8.4839 115.5129 58.9616 64.6360 175.3240 51 L 3.9791 8.6509 124.8206 58.2196 41.7985 179.2118 52 A 4.0100 7.4221 122.6113 55.3372 18.0955 179.3791 53 D 4.3263 7.9645 115.7705 57.3379 41.2534 178.7673 54 V 3.7573 7.7584 118.4958 65.9655 31.6670 178.2251 55 K 3.9210 8.6196 118.4238 59.4431 31.8846 179.0912 56 A 4.0339 8.1051 120.7459 54.7375 18.1133 179.7270 57 V 3.7373 7.6340 117.1251 66.1574 31.3333 177.0900 58 C 3.6161 7.8547 114.9295 58.0404 39.9011 174.2587 59 S 4.6202 7.4528 114.0294 57.8944 63.7915 174.8091 60 Q 4.5568 7.6677 121.5010 56.1602 27.7442 176.9616 61 K 4.2662 8.6924 129.6353 56.7763 33.0328 176.5452 62 K 4.1822 8.6760 127.9333 56.7051 32.4287 176.9577 63 V 4.5134 7.9776 117.0663 59.6374 35.9797 175.5043 64 T 3.9736 8.3561 119.9727 63.3717 69.2417 175.6699 65 C 4.6299 8.5927 123.3590 56.6373 40.9031 175.0442 66 K 3.7315 9.3277 122.8829 59.5113 31.7066 177.8453 67 N 4.5943 8.1231 113.3318 52.6099 37.4704 175.9087 68 G 3.9256 8.1068 107.8104 45.5657 0.0000 174.2978 69 Q 4.2708 8.2427 119.2042 56.1450 29.2740 176.0433 70 T 4.7523 8.1700 108.4045 61.8255 69.3303 173.7468 71 N 5.0637 8.0468 116.2834 54.0089 39.0492 174.2459 72 C 5.3753 8.0613 115.9700 57.0402 44.0866 172.2417 73 Y 5.1790 8.8357 117.8700 56.6119 42.3575 173.8303 74 Q 5.1720 9.5948 126.0125 54.1410 31.3622 174.9196 75 S 4.5239 8.8016 121.7418 58.4641 63.1180 174.8420 76 K 4.1322 9.5768 123.4766 58.8112 32.0776 177.2444 77 S 5.0538 7.6401 112.5412 56.2749 65.9760 174.3740 78 T 4.0896 8.2389 111.3776 62.2127 69.7270 173.4919 79 M 5.0293 8.8650 121.5403 53.4458 36.8127 175.0713 80 R 4.6005 9.5133 121.9583 56.1986 31.2613 175.8432 81 I 5.1235 8.9360 117.2088 59.4000 42.0238 174.1659 82 T 5.0725 9.0976 119.3132 61.8666 71.6202 172.6465 83 D 4.9371 9.3730 127.1503 53.2038 43.0722 174.1672 84 C 5.6357 9.2402 124.1755 55.3652 39.0337 173.2610 85 R 5.3748 8.8122 121.9824 54.1325 34.3921 174.6573 86 E 4.1581 9.1344 123.4757 57.0346 30.7973 177.4702 87 T 4.3189 8.5945 113.9995 60.6778 69.9144 176.0233 88 G 3.6790 8.5161 110.6236 48.1268 0.0000 174.7565 89 S 4.4199 7.3974 113.4051 59.0743 63.5762 174.7108 90 S 4.0001 7.3711 115.5206 58.2257 62.5264 173.5860 91 K 4.3539 8.7353 128.6578 54.9701 34.3002 174.4285 92 Y 4.2734 8.7856 127.7859 57.8878 38.9305 174.1361 93 P 3.0618 0.0000 0.0000 62.7527 32.0382 176.8423 94 N 4.6221 7.8527 119.6886 52.2467 37.0178 172.3914 95 C 4.6192 8.0831 117.6708 56.3880 42.8744 173.1361 96 A 5.0649 8.7201 125.7162 50.3407 21.9866 174.4170 97 Y 5.1383 9.3081 119.0926 55.9422 41.9575 175.1003 98 K 4.3764 9.3986 125.0414 56.1343 33.7250 175.4409 99 T 4.9450 8.6096 124.4970 62.8167 69.9900 174.2817 100 T 4.6058 8.7887 122.9703 61.8131 72.0784 173.0113 101 Q 4.8644 8.7656 126.0326 55.2009 29.8244 175.6391 102 V 4.6143 8.7352 116.3257 59.7737 37.0276 174.1075 103 E 5.1349 8.7342 120.9853 54.8663 31.3081 175.8151 104 K 4.7671 8.7217 122.9118 54.7315 37.4155 175.6970 105 H 4.7680 9.0328 119.5230 55.9791 29.9261 174.7214 106 I 4.8506 8.6619 115.3389 59.3126 40.6557 174.3646 107 I 4.8772 8.3107 124.6935 59.7039 39.9514 175.0627 108 V 4.7765 8.5706 119.4167 59.2537 35.9026 174.6564 109 A 4.8843 8.7395 125.1475 51.6105 20.2150 175.7006 110 C 5.4539 9.2698 119.7817 55.3221 43.6367 173.6553 111 G 4.0345 9.2195 109.3857 46.2871 0.0000 172.9882 112 G 4.0975 9.0441 107.9789 44.5592 0.0000 172.3525 113 K 4.6994 8.1258 117.0302 53.5767 34.7067 175.0364 114 P 4.3258 0.0000 0.0000 62.4056 31.8627 175.9482 115 S 4.6890 8.3036 114.7306 57.9382 62.6393 173.4022 116 V 4.6228 8.5676 119.8428 58.4265 36.2909 173.4152 117 P 4.7914 0.0000 0.0000 63.4672 31.0567 176.8930 118 V 4.5030 9.1860 116.1824 61.3591 34.1489 175.2893 119 H 4.8824 8.0145 119.3568 54.6709 33.5411 171.6679 120 F 4.5754 8.5043 127.3376 57.3957 39.5560 174.4826 121 D 4.6628 8.5104 126.9451 56.2511 41.8413 175.9797 122 A 4.7227 6.8492 117.0506 51.2013 22.5061 174.7305 123 S 5.2601 8.8760 113.6412 56.6710 66.0394 174.6006 124 V 4.1511 8.7606 114.8652 61.7083 32.5440 175.3822 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 4.21 0.00 1.74 1.79 0.00 1.78 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 1.33 1.44 7.81 2 E 8.74 3.74 0.00 2.12 1.85 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 2.40 2.37 0.00 3 S 8.93 4.43 0.00 4.10 3.99 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 4 A 8.58 3.99 1.36 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 0.00 0.00 5 A 8.02 3.95 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 8.24 4.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 K 8.43 4.11 0.00 2.00 2.04 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.31 7.81 8 F 8.47 4.07 0.00 3.19 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 9 E 8.40 4.01 0.00 2.26 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 2.49 2.68 0.00 10 R 8.04 3.82 0.00 1.76 2.06 0.00 3.23 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 11 Q 7.98 4.00 0.00 1.68 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.48 0.00 0.00 0.00 0.00 0.00 2.27 2.46 0.00 12 H 7.85 4.65 0.00 1.87 2.74 0.00 5.62 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.64 4.58 0.00 2.04 2.13 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.66 0.00 14 D 8.17 4.71 0.00 2.52 2.49 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 0.00 15 S 8.14 4.21 0.00 3.90 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 16 G 8.02 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 0.00 0.00 0.00 0.00 17 N 8.24 4.55 0.00 2.73 2.89 0.00 0.00 6.70 7.57 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 18 S 7.59 4.73 0.00 3.82 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.27 0.00 2.17 2.18 0.00 3.75 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 20 S 7.84 4.50 0.00 4.00 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 21 S 7.79 4.20 0.00 3.96 3.87 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 22 S 8.76 4.18 0.00 4.02 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 S 7.80 4.23 0.00 4.02 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 N 8.29 4.75 0.00 2.98 2.89 0.00 0.00 6.44 7.90 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 25 Y 8.12 4.02 0.00 3.10 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 26 C 8.52 4.20 0.00 3.16 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 27 N 8.30 4.45 0.00 2.94 2.94 0.00 0.00 7.14 6.74 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 L 7.82 3.98 0.00 1.64 1.55 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 29 M 7.92 3.67 0.00 0.76 1.23 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.43 0.00 30 M 8.18 4.18 0.00 1.77 1.92 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 2.42 0.00 31 C 7.63 4.18 0.00 3.11 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 32 C 8.07 3.96 0.00 2.84 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 33 R 8.35 4.38 0.00 1.99 2.02 0.00 3.54 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.87 0.00 34 K 7.78 3.90 0.00 1.96 1.96 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.56 7.81 35 M 8.47 4.69 0.00 2.03 2.01 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.42 0.00 36 T 7.72 4.77 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 1.42 0.00 0.00 37 Q 8.33 4.57 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.68 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 38 G 11.09 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 0.00 0.00 0.00 0.00 39 K 6.89 3.73 0.00 1.67 1.60 0.00 1.43 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.35 1.33 7.81 40 C 8.58 4.93 0.00 3.12 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 41 K 8.66 4.16 0.00 1.84 1.80 0.00 1.78 0.00 0.00 1.68 0.00 0.00 3.23 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.60 1.40 7.81 42 P 0.00 4.73 0.00 2.19 2.32 0.00 3.90 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.83 0.00 43 V 7.62 5.02 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.97 0.00 0.00 44 N 9.43 4.76 0.00 2.60 2.24 0.00 0.00 6.71 6.92 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 45 T 7.75 4.75 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 0.78 0.00 0.00 46 F 8.90 4.75 0.00 2.99 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 47 V 8.38 4.52 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 0.86 0.00 0.00 1.02 0.00 0.00 48 H 8.96 4.88 0.00 3.17 3.29 0.00 5.70 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.06 4.34 0.00 1.99 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 2.34 2.26 0.00 50 S 8.48 4.22 0.00 4.05 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 51 L 8.65 3.98 0.00 1.79 1.73 0.94 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 52 A 7.42 4.01 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 53 D 7.96 4.33 0.00 2.83 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 54 V 7.76 3.76 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.98 0.00 0.00 55 K 8.62 3.92 0.00 1.97 1.82 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.57 7.81 56 A 8.11 4.03 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.63 3.74 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 1.14 0.00 0.00 1.09 0.00 0.00 58 C 7.85 3.62 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 59 S 7.45 4.62 0.00 3.89 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 60 Q 7.67 4.56 0.00 2.21 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.94 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 61 K 8.69 4.27 0.00 1.82 1.89 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.79 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.41 1.41 7.81 62 K 8.68 4.18 0.00 1.57 1.49 0.00 1.74 0.00 0.00 1.61 0.00 0.00 3.01 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.95 1.48 7.81 63 V 7.98 4.51 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 0.62 0.00 0.00 0.85 0.00 0.00 64 T 8.36 3.97 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 1.19 0.00 0.00 65 C 8.59 4.63 0.00 3.13 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 66 K 9.33 3.73 0.00 1.70 1.89 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.54 7.81 67 N 8.12 4.59 0.00 2.81 2.90 0.00 0.00 6.19 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 8.11 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 69 Q 8.24 4.27 0.00 2.20 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.86 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 70 T 8.17 4.75 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 1.22 0.00 0.00 71 N 8.05 5.06 0.00 2.95 3.01 0.00 0.00 6.06 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 8.06 5.38 0.00 3.05 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 73 Y 8.84 5.18 0.00 2.88 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 74 Q 9.59 5.17 0.00 2.01 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.99 0.00 0.00 0.00 0.00 0.00 2.28 2.26 0.00 75 S 8.80 4.52 0.00 3.93 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 K 9.58 4.13 0.00 1.76 1.94 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.44 7.81 77 S 7.64 5.05 0.00 3.72 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 T 8.24 4.09 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 1.00 0.00 0.00 79 M 8.87 5.03 0.00 1.94 1.98 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 80 R 9.51 4.60 0.00 1.84 1.90 0.00 3.06 0.00 0.00 3.21 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.58 0.00 81 I 8.94 5.12 1.96 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.88 1.04 0.00 0.00 82 T 9.10 5.07 4.44 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 1.35 0.00 0.00 83 D 9.37 4.94 0.00 2.69 2.67 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 84 C 9.24 5.64 0.00 2.90 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 85 R 8.81 5.37 0.00 1.76 1.83 0.00 3.19 0.00 0.00 3.21 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.75 0.00 86 E 9.13 4.16 0.00 1.88 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 1.77 2.07 0.00 87 T 8.59 4.32 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 1.22 0.00 0.00 88 G 8.52 3.68 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 0.00 0.00 0.00 89 S 7.40 4.42 0.00 3.89 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 90 S 7.37 4.00 0.00 3.80 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 K 8.74 4.35 0.00 1.80 1.59 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.85 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.36 1.39 7.81 92 Y 8.79 4.27 0.00 2.95 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 93 P 0.00 3.06 0.00 1.76 1.14 0.00 3.66 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.74 0.00 94 N 7.85 4.62 0.00 2.91 2.75 0.00 0.00 7.01 7.32 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 95 C 8.08 4.62 0.00 3.10 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 96 A 8.72 5.06 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 97 Y 9.31 5.14 0.00 2.97 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 98 K 9.40 4.38 0.00 1.81 1.75 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.60 7.81 99 T 8.61 4.94 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 1.30 0.00 0.00 100 T 8.79 4.61 4.27 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 1.23 0.00 0.00 101 Q 8.77 4.86 0.00 1.90 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.82 0.00 0.00 0.00 0.00 0.00 2.21 2.31 0.00 102 V 8.74 4.61 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 0.74 0.00 0.00 0.96 0.00 0.00 103 E 8.73 5.13 0.00 1.81 1.85 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 2.20 2.30 0.00 104 K 8.72 4.77 0.00 1.74 1.82 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.44 7.81 105 H 9.03 4.77 0.00 3.11 3.23 0.00 5.58 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.66 4.85 1.79 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 1.27 1.08 1.13 0.00 0.00 107 I 8.31 4.88 1.78 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.75 0.82 0.00 0.00 108 V 8.57 4.78 2.15 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 0.56 0.00 0.00 0.94 0.00 0.00 109 A 8.74 4.88 1.28 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 0.00 0.00 0.00 0.00 0.00 0.00 110 C 9.27 5.45 0.00 2.91 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 0.00 111 G 9.22 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 0.00 112 G 9.04 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 K 8.13 4.70 0.00 1.69 1.70 0.00 1.76 0.00 0.00 1.76 0.00 0.00 2.86 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.33 1.40 7.81 114 P 0.00 4.33 0.00 2.16 2.04 0.00 3.76 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 115 S 8.30 4.69 0.00 3.89 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 0.00 116 V 8.57 4.62 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.98 0.00 0.00 117 P 0.00 4.79 0.00 1.96 2.02 0.00 3.62 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 2.04 2.11 0.00 118 V 9.19 4.50 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 1.01 0.00 0.00 119 H 8.01 4.88 0.00 3.16 3.09 0.00 5.65 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 8.50 4.58 0.00 3.03 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 0.00 121 D 8.51 4.66 0.00 2.62 2.60 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 0.00 122 A 6.85 4.72 1.17 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 0.00 0.00 123 S 8.88 5.26 0.00 3.98 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 0.00 124 V 8.76 4.15 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 0.78 0.00 0.00 0.94 0.00 0.00