NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 T 4.3297 8.1749 110.9398 61.1977 70.1691 172.7235 4 R 3.8966 8.3413 120.3135 55.9137 30.5271 175.2929 5 T 4.4217 8.0357 119.3391 60.8709 69.8300 172.3427 6 P 4.3609 0.0000 0.0000 62.2831 32.0459 176.1472 7 K 4.3083 8.3565 121.2678 55.2092 32.4225 176.4719 8 L 4.5030 8.4023 126.5386 54.7530 43.4957 176.0574 9 V 4.4677 8.8367 121.8293 61.0402 34.0757 174.0755 10 K 4.6796 8.7563 129.9857 55.0871 34.1595 174.3528 11 H 5.6403 9.2197 127.8044 54.3345 31.8826 172.8965 12 T 5.0556 8.7463 123.5928 61.7123 71.0229 173.1913 13 L 5.3218 9.0380 128.8990 53.3027 44.7264 174.7883 14 L 5.4941 9.2677 126.7605 53.2587 44.3500 175.6773 15 T 5.3761 9.1712 112.4796 59.9546 72.8944 172.4957 16 R 4.8608 8.3228 122.0043 54.6048 33.0756 174.3836 17 F 4.8830 8.7947 124.3252 56.0390 40.6796 175.7499 18 K 3.8591 8.7950 121.9067 57.1002 32.4596 177.7117 19 D 4.4329 9.0797 123.8256 57.5135 40.8712 177.8395 20 E 4.2224 8.0198 114.3626 57.3828 30.3338 176.8064 21 I 4.0881 7.6433 122.2516 61.3591 37.8793 176.5074 22 T 4.3614 8.9534 116.5496 60.7717 71.2447 176.0358 23 R 3.9057 8.5204 119.3594 59.8008 29.2029 178.8361 24 E 3.9386 8.0835 118.5152 59.2356 29.4778 179.0987 25 Q 3.9316 8.0595 118.0281 59.0813 28.7114 179.0682 26 I 3.5842 7.7906 120.7205 64.4119 37.0452 178.2598 27 D 4.3451 8.2358 119.7929 57.3428 40.6285 178.6903 28 N 4.2727 8.2616 116.9981 56.6153 38.5607 177.1624 29 Y 4.3646 8.1359 118.3113 61.1557 37.8291 178.8326 30 I 3.7872 8.2256 121.1530 64.3343 37.1674 178.1284 31 N 4.3347 8.1934 117.4191 56.5376 38.1530 177.2184 32 D 4.3432 8.0497 119.2238 57.2286 41.0741 178.0398 33 Y 3.3001 7.8670 120.0958 60.7807 38.8593 177.7753 34 T 3.1960 7.7832 116.8617 66.7111 68.4865 175.8858 35 N 4.3181 8.0537 118.1652 56.1735 38.8294 176.7793 36 L 3.8877 7.6977 120.7766 57.3512 41.3320 178.7363 37 L 3.8176 7.2819 119.8431 58.2873 41.9983 177.8255 38 D 4.4287 7.8716 116.4372 57.0871 41.3997 176.9606 39 L 4.1234 7.4607 117.6569 55.9944 42.1319 176.7308 40 I 4.4391 7.5712 119.6698 58.4955 37.8001 174.1316 41 P 4.3243 0.0000 0.0000 65.3672 31.3507 178.4801 42 S 4.3366 8.0551 111.0742 60.2515 63.4567 174.0155 43 M 3.5508 7.9346 122.1459 55.2364 32.3989 175.5628 44 K 4.4322 8.3608 125.8087 57.9412 33.8633 176.5653 45 S 4.6624 7.3664 112.1905 57.2862 66.7268 173.2001 46 F 5.3235 8.3931 122.0392 57.0899 42.0925 173.0534 47 N 5.0211 8.5321 122.4301 51.5244 43.2357 173.2567 48 W 5.2544 7.8156 116.6365 55.8968 31.6805 173.4269 49 G 3.7417 8.5806 107.0559 45.9796 0.0000 171.8536 50 T 5.1626 8.0447 109.0145 59.0637 71.8638 173.1737 51 D 4.3580 8.5612 122.4183 55.0556 40.9716 177.1241 52 L 4.0376 8.7896 126.0221 55.7857 41.9839 177.8205 53 G 3.8744 8.5630 106.7105 46.7557 0.0000 174.2265 54 M 4.3538 8.0738 117.7559 54.8798 32.9837 175.7917 55 E 4.6269 7.6966 117.6182 53.7722 32.3891 175.3766 56 S 4.0957 8.4659 114.0505 58.6591 62.7325 175.1728 57 A 4.0876 8.6804 129.8484 55.1039 18.5506 179.0983 58 E 4.2017 8.1113 113.8212 58.9031 29.7196 178.9526 59 L 4.1002 7.7224 119.8208 57.3401 41.9468 178.2708 60 N 4.5891 8.2333 115.3466 53.0358 37.4535 175.1343 61 R 3.5630 8.9808 119.4284 57.4210 28.3409 177.5046 62 G 3.8880 8.4803 105.0400 45.6496 0.0000 174.1875 63 Y 4.3579 7.7479 118.3343 58.1247 38.7036 175.3382 64 T 4.6056 9.1869 114.2136 62.3524 71.6766 174.0093 65 H 5.5429 8.4812 117.7165 53.6571 32.9957 172.5892 66 A 5.2385 8.6088 122.9301 50.1508 22.2997 174.8563 67 F 5.2299 9.5794 121.4178 55.7028 42.4092 174.1386 68 E 5.0736 9.2672 124.1738 54.8025 31.8579 175.1030 69 S 5.1959 9.1087 121.6967 57.0245 65.6379 173.4204 70 T 4.9017 8.2417 121.3275 61.9270 70.8531 173.7566 71 F 5.0556 9.1701 123.3352 55.8759 43.3648 175.4579 72 E 4.3910 8.9108 117.9235 57.1903 30.3001 176.7289 73 S 4.6899 7.3466 112.4579 56.3950 66.3450 176.8397 74 K 3.8126 8.2711 121.9751 59.5784 31.7383 179.7137 75 S 4.2325 8.1442 114.2212 61.3615 62.9758 176.5977 76 G 3.6463 8.2053 109.2923 47.5284 0.0000 175.4543 77 L 2.4781 7.4493 122.4069 57.2551 41.9524 178.7850 78 Q 3.8414 8.2655 120.0033 59.0225 28.7563 177.6916 79 E 3.8807 8.0522 119.3968 59.4571 29.9543 177.8237 80 Y 4.2985 7.7555 118.9371 60.9895 38.6584 178.2831 81 L 3.8196 8.0197 118.5533 57.3755 41.7869 178.3835 82 D 4.5950 7.9367 116.4267 53.6457 41.7207 177.0346 83 S 4.2783 7.3322 115.4655 57.6643 64.0244 175.3056 84 A 3.9516 8.6068 123.9512 55.1564 18.1399 180.0059 85 A 3.9087 7.9179 118.8667 55.2252 18.4740 179.4209 86 L 3.7904 7.7968 118.5317 58.1276 42.0007 178.8038 87 A 3.9252 7.8497 120.4336 55.3194 18.5403 179.4724 88 A 3.9391 8.2593 119.3682 55.2215 18.4403 179.6140 89 F 4.0688 8.2642 118.9224 61.4831 39.4901 177.2561 90 A 3.7672 8.4424 120.6950 54.8776 17.8365 179.1600 91 E 3.9289 7.7055 116.7227 59.7112 29.6386 179.3719 92 G 3.8195 7.1631 101.7590 46.8373 0.0000 175.4665 93 F 3.5069 7.5945 122.7200 60.6139 39.4727 177.5237 94 L 3.6330 7.6412 118.5686 57.1850 41.2146 177.5401 95 P 4.3255 0.0000 0.0000 64.4638 31.5157 177.6129 96 T 4.1589 7.5313 108.2365 61.2948 69.1485 173.8585 97 L 4.5629 6.8110 122.7495 53.4025 42.9188 176.5779 98 S 4.4299 8.4650 118.4250 59.9314 64.3814 174.5616 99 Q 4.6195 7.7045 118.0642 53.9641 32.9751 174.5326 100 R 5.1219 8.5807 122.1292 55.0321 33.2725 173.6917 101 L 4.8746 9.2233 128.2239 53.2090 45.4129 175.0754 102 V 4.9973 8.4739 124.9705 61.1690 34.6121 174.3940 103 I 4.7153 8.8084 127.0911 59.7467 41.8234 173.0675 104 D 5.6912 8.8150 128.8125 53.0728 43.7638 174.7233 105 Y 5.0155 7.9639 118.5634 55.7914 41.6225 174.0104 106 F 4.5550 8.5849 119.5998 57.8291 39.9002 176.0352 107 L 4.5009 8.5914 123.5465 53.9051 40.4118 176.7171 108 Y 4.5587 8.1426 119.6333 58.1314 37.9994 175.7220 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 3 T 8.17 4.33 4.25 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 0.00 0.00 1.21 0.00 0.00 4 R 8.34 3.90 0.00 1.92 1.91 0.00 3.18 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 5 T 8.04 4.42 4.25 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 0.00 0.00 1.22 0.00 0.00 6 P 0.00 4.36 0.00 2.22 2.09 0.00 3.77 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 2.01 1.97 0.00 7 K 8.36 4.31 0.00 1.64 1.66 0.00 1.90 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.00 1.50 7.81 8 L 8.40 4.50 0.00 1.66 1.57 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 9 V 8.84 4.47 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 0.67 0.00 0.00 0.52 0.00 0.00 10 K 8.76 4.68 0.00 1.47 0.74 0.00 1.46 0.00 0.00 1.62 0.00 0.00 2.80 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.00 0.94 7.81 11 H 9.22 5.64 0.00 3.25 3.44 0.00 5.64 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 T 8.75 5.06 4.58 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 1.30 0.00 0.00 13 L 9.04 5.32 0.00 1.98 1.92 1.10 0.66 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 14 L 9.27 5.49 0.00 0.96 1.29 0.57 0.38 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 15 T 9.17 5.38 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 1.39 0.00 0.00 16 R 8.32 4.86 0.00 1.82 1.66 0.00 3.18 0.00 0.00 3.06 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.61 0.00 17 F 8.79 4.88 0.00 2.98 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 18 K 8.79 3.86 0.00 1.72 1.97 0.00 1.75 0.00 0.00 1.77 0.00 0.00 2.75 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.43 1.47 7.81 19 D 9.08 4.43 0.00 2.67 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 20 E 8.02 4.22 0.00 2.08 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 2.28 2.28 0.00 21 I 7.64 4.09 2.01 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.08 0.92 0.00 0.00 22 T 8.95 4.36 4.40 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 23 R 8.52 3.91 0.00 2.07 2.26 0.00 2.99 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.74 0.00 24 E 8.08 3.94 0.00 2.06 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 2.39 2.46 0.00 25 Q 8.06 3.93 0.00 2.32 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 26 I 7.79 3.58 1.79 0.00 0.00 0.52 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 0.26 0.51 0.00 0.00 27 D 8.24 4.35 0.00 2.85 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 28 N 8.26 4.27 0.00 2.67 2.64 0.00 0.00 7.02 7.10 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 29 Y 8.14 4.36 0.00 3.43 3.22 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 30 I 8.23 3.79 1.72 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.91 0.12 0.00 0.00 31 N 8.19 4.33 0.00 2.91 2.87 0.00 0.00 7.04 8.24 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 32 D 8.05 4.34 0.00 3.08 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 33 Y 7.87 3.30 0.00 2.73 2.66 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 34 T 7.78 3.20 4.38 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 1.33 0.00 0.00 35 N 8.05 4.32 0.00 2.89 2.89 0.00 0.00 7.25 6.18 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 36 L 7.70 3.89 0.00 1.62 1.69 0.68 0.53 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 37 L 7.28 3.82 0.00 1.73 1.65 0.94 1.16 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 38 D 7.87 4.43 0.00 2.65 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 39 L 7.46 4.12 0.00 1.71 1.70 0.89 0.75 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 40 I 7.57 4.44 2.03 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.47 1.21 0.00 0.00 41 P 0.00 4.32 0.00 2.07 2.14 0.00 3.72 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.10 0.00 42 S 8.06 4.34 0.00 4.18 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 43 M 7.93 3.55 0.00 1.86 1.83 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 2.23 0.00 44 K 8.36 4.43 0.00 1.47 1.75 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.08 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.46 7.81 45 S 7.37 4.66 0.00 3.79 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 46 F 8.39 5.32 0.00 2.85 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 N 8.53 5.02 0.00 2.40 2.38 0.00 0.00 6.11 7.29 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 48 W 7.82 5.25 0.00 3.14 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 49 G 8.58 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 0.00 0.00 0.00 50 T 8.04 5.16 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 1.29 0.00 0.00 51 D 8.56 4.36 0.00 2.76 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 52 L 8.79 4.04 0.00 1.66 1.69 0.88 0.94 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 53 G 8.56 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 0.00 0.00 0.00 54 M 8.07 4.35 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.53 0.00 55 E 7.70 4.63 0.00 1.94 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 2.22 2.21 0.00 56 S 8.47 4.10 0.00 3.85 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 57 A 8.68 4.09 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 58 E 8.11 4.20 0.00 2.19 2.23 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 2.37 2.35 0.00 59 L 7.72 4.10 0.00 1.77 1.79 0.93 1.06 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 60 N 8.23 4.59 0.00 3.14 3.12 0.00 0.00 6.37 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 61 R 8.98 3.56 0.00 2.24 2.14 0.00 3.41 0.00 0.00 3.49 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.80 0.00 62 G 8.48 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 63 Y 7.75 4.36 0.00 3.18 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 64 T 9.19 4.61 4.40 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 1.31 0.00 0.00 65 H 8.48 5.54 0.00 3.35 3.03 0.00 5.56 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 A 8.61 5.24 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 67 F 9.58 5.23 0.00 3.30 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 68 E 9.27 5.07 0.00 1.82 1.77 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 2.23 2.21 0.00 69 S 9.11 5.20 0.00 3.84 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 70 T 8.24 4.90 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 1.12 0.00 0.00 71 F 9.17 5.06 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 72 E 8.91 4.39 0.00 2.01 2.04 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 2.28 2.30 0.00 73 S 7.35 4.69 0.00 4.04 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 74 K 8.27 3.81 0.00 1.81 1.83 0.00 1.73 0.00 0.00 1.93 0.00 0.00 3.06 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.25 1.41 7.81 75 S 8.14 4.23 0.00 4.05 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 76 G 8.21 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 0.00 0.00 0.00 77 L 7.45 2.48 0.00 1.14 1.48 0.29 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 78 Q 8.27 3.84 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.54 0.00 0.00 0.00 0.00 0.00 2.32 2.53 0.00 79 E 8.05 3.88 0.00 2.12 2.17 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 2.37 2.34 0.00 80 Y 7.76 4.30 0.00 3.18 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 81 L 8.02 3.82 0.00 1.71 1.66 0.88 1.00 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 82 D 7.94 4.59 0.00 2.66 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 83 S 7.33 4.28 0.00 3.99 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 84 A 8.61 3.95 1.32 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 0.00 0.00 85 A 7.92 3.91 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 86 L 7.80 3.79 0.00 1.33 1.42 0.82 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 87 A 7.85 3.93 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 88 A 8.26 3.94 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 89 F 8.26 4.07 0.00 3.01 3.23 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 90 A 8.44 3.77 1.32 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 0.00 0.00 91 E 7.71 3.93 0.00 2.04 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 2.50 0.00 92 G 7.16 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 0.00 0.00 0.00 93 F 7.59 3.51 0.00 1.75 2.22 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 94 L 7.64 3.63 0.00 1.67 1.55 0.86 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 95 P 0.00 4.33 0.00 1.91 2.03 0.00 3.50 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.04 0.00 96 T 7.53 4.16 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 1.00 0.00 0.00 97 L 6.81 4.56 0.00 1.41 1.50 0.54 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 98 S 8.46 4.43 0.00 3.80 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 99 Q 7.70 4.62 0.00 1.54 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.88 0.00 0.00 0.00 0.00 0.00 2.10 2.08 0.00 100 R 8.58 5.12 0.00 1.72 1.76 0.00 3.22 0.00 0.00 3.13 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.68 0.00 101 L 9.22 4.87 0.00 1.56 1.04 0.72 0.40 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 0.00 102 V 8.47 5.00 2.14 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 0.91 0.00 0.00 1.01 0.00 0.00 103 I 8.81 4.72 1.91 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 1.38 1.29 1.00 0.00 0.00 104 D 8.81 5.69 0.00 2.61 2.45 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 0.00 105 Y 7.96 5.02 0.00 3.06 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 0.00 106 F 8.58 4.56 0.00 1.95 2.14 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 0.00 107 L 8.59 4.50 0.00 1.55 1.69 0.89 1.22 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 0.00 108 Y 8.14 4.56 0.00 3.06 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