NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 D 4.5939 8.2227 120.1951 53.8898 42.4322 176.9299 7 F 4.0362 9.3896 120.2815 61.2868 39.8692 173.7329 8 Q 3.7475 8.8171 117.5703 58.5956 29.3662 177.8969 9 Q 4.0473 7.7872 118.7595 59.1343 28.7515 178.5016 10 R 3.9503 8.1559 118.2402 59.1807 30.4657 178.6346 11 R 3.9526 7.4016 113.7237 56.9105 28.9470 178.0780 12 A 3.9864 7.7156 123.8248 55.6578 18.4851 179.2343 13 H 4.3925 8.0784 109.1466 57.3817 29.4276 176.2599 14 L 4.1555 8.2543 120.7920 56.9589 42.2435 179.4450 15 A 3.8436 6.9045 121.7164 54.8441 18.4414 177.9089 16 N 4.8918 7.8282 109.1359 52.8237 39.3659 174.9884 17 L 4.3289 7.7943 119.6937 54.2192 42.4462 177.8793 18 S 4.3853 9.0295 118.1730 58.0173 64.9385 175.2233 19 D 4.3531 8.6507 122.5233 57.7572 40.5883 178.7891 20 E 3.9462 8.2083 118.9202 59.5991 29.6728 178.6422 21 E 4.0401 8.1747 118.2969 59.1426 29.3962 179.2019 22 L 4.0059 8.0118 120.6317 57.9326 42.2142 178.4860 23 Q 3.9758 8.3038 119.7439 59.6668 28.9132 178.3236 24 T 4.0508 8.0696 116.5244 66.9888 68.5792 176.2933 25 R 3.9055 8.5024 120.5400 59.3965 30.1640 177.8171 26 F 3.8217 8.6091 120.7972 61.6242 39.2336 177.4041 27 W 4.3634 8.5956 117.9749 59.4590 28.8843 178.5074 28 E 4.0468 8.6794 119.2244 59.7485 28.8939 179.3310 29 M 4.0171 8.0665 118.4463 58.1859 32.1316 178.4940 30 A 3.8497 7.5983 120.4823 55.0977 18.5117 179.3065 31 E 3.9078 8.4518 117.6879 59.5436 29.5800 179.0064 32 K 3.9182 7.8125 117.0407 59.8077 32.1515 179.0282 33 I 3.8894 7.5566 119.0514 64.1235 37.2871 178.2795 34 V 3.9637 7.7363 112.1126 63.0966 31.6922 177.9886 35 D 4.4139 8.0888 119.2729 57.3250 40.7247 177.4130 36 P 4.3060 0.0000 0.0000 65.4553 31.1598 178.7350 37 L 4.0467 7.7200 116.7231 57.4340 41.8676 179.2020 38 L 4.1108 8.1958 119.3546 57.8806 41.7874 178.6378 39 D 4.3668 8.0889 117.9258 57.6240 41.1931 178.3186 40 L 4.0967 8.1718 119.3437 57.9492 41.3975 179.7754 41 G 3.7424 7.8821 104.5011 47.7523 0.0000 175.5981 42 K 4.1840 7.9007 119.4338 58.5668 32.2864 178.4961 43 K 4.5202 7.6611 114.9510 55.3698 32.6170 175.5655 44 N 5.0527 7.1799 114.8946 52.1628 42.7673 172.8107 45 T 4.6911 8.0301 113.2556 60.4063 70.9717 172.4948 46 T 4.7363 7.9223 112.0604 58.4195 73.1069 172.7332 47 P 4.2225 0.0000 0.0000 65.9573 31.2330 179.1928 48 S 4.3536 8.0493 112.2816 61.4253 62.7785 176.4416 49 I 3.7633 7.7417 123.3957 64.1998 36.8395 178.2327 50 E 3.9816 8.2273 119.5205 59.5246 29.3421 179.6037 51 R 3.9912 8.6110 118.6116 58.9718 29.9297 179.2337 52 S 4.2106 7.7813 114.4873 61.0970 63.2804 176.5744 53 V 3.5891 8.0957 122.2200 65.9265 31.1824 178.1149 54 L 4.2007 8.1875 118.5387 57.5585 41.4513 179.5715 55 L 4.3774 8.0402 120.6058 57.5003 41.4064 179.7209 56 R 4.0380 8.1396 116.8012 59.3016 30.0034 178.5732 57 M 4.4048 7.7579 117.2729 56.1808 32.0922 176.0468 58 G 3.6676 6.9823 108.1104 45.4812 0.0000 173.5890 59 F 4.9231 8.1051 118.5227 55.0617 41.5754 175.9355 60 S 4.5211 8.6913 118.8464 57.7869 65.3084 175.5555 61 S 4.2585 8.6045 117.2013 61.6572 62.5242 176.7072 62 L 4.0107 7.8634 121.9641 57.5490 41.4886 178.9429 63 E 3.9765 8.3409 118.2494 59.6285 29.5178 179.4700 64 A 4.0399 8.5469 120.9938 54.7667 18.3567 179.6967 65 K 3.8714 8.0735 117.9386 59.5214 32.1921 178.9543 66 A 3.9919 7.9530 121.0134 55.2707 18.3225 179.5624 67 I 3.8260 8.1414 118.7571 64.7208 37.2002 178.9082 68 V 3.6405 7.8048 118.9751 65.7010 31.3309 177.4323 69 D 4.3744 8.4718 119.3158 57.8474 40.5938 179.6119 70 K 3.7072 7.6789 118.4324 59.2304 31.8927 179.7589 71 T 3.6567 7.6150 116.1721 66.7096 68.3600 176.4401 72 M 3.9648 7.9131 120.3824 58.7517 31.8478 178.4193 73 D 4.3608 7.9913 117.7128 56.5452 40.9098 177.8968 74 R 4.4231 6.9967 116.6140 55.4973 30.6337 175.9697 75 G 3.9510 8.0615 104.1827 46.9647 0.0000 175.7558 76 L 4.4794 7.7945 118.4179 54.8410 41.9972 177.9951 77 M 4.1762 8.1091 119.9129 58.5077 31.7076 178.2310 78 G 3.8265 8.1227 103.6303 46.8011 0.0000 174.6211 79 K 4.4246 8.4190 119.9957 55.3943 32.9949 176.9304 80 G 3.8837 7.9592 108.5925 46.0650 0.0000 174.3561 81 A 4.2191 9.2750 127.1248 55.0362 18.3775 179.8484 82 G 3.6184 8.1176 104.0761 48.0429 0.0000 175.1571 83 H 4.2497 8.1497 120.0072 59.2446 29.9542 176.8997 84 I 3.5996 7.6836 121.4230 64.5322 37.0114 178.2300 85 V 3.4841 7.6177 118.4755 66.5063 31.3417 176.8577 86 Y 4.1126 8.2486 121.2491 61.6904 38.4767 179.0066 87 K 3.9183 8.9800 124.2499 60.0490 31.9854 181.2588 88 I 3.6789 7.8590 121.0243 63.8346 36.7743 178.5152 89 A 3.8315 7.8039 121.6637 55.0952 18.2489 179.9033 90 K 3.7458 7.6920 116.9124 59.4954 31.8588 179.1973 91 E 3.7827 7.8787 117.6919 59.7321 29.4413 178.4464 92 K 3.9840 7.5910 114.1275 55.9079 32.3947 176.5872 93 N 4.0315 7.6664 117.0487 54.7696 37.4963 172.3004 94 I 4.6704 7.7243 109.7628 57.9787 41.4829 175.9102 95 S 4.3357 8.8239 115.8575 57.7877 64.7130 175.1543 96 V 3.6148 8.3847 122.2233 66.6398 31.0963 178.3581 97 R 3.8762 7.9061 117.5701 59.3013 29.9256 178.1813 98 E 3.9774 8.1173 118.3678 59.2844 29.4190 178.6609 99 A 4.1086 8.4427 121.4596 55.5690 17.6298 180.0044 100 G 3.4036 8.6234 103.7054 47.8004 0.0000 175.7429 101 L 4.3516 8.4103 121.5807 57.4709 41.6535 179.3053 102 A 4.0816 8.4025 120.8780 55.2697 18.2821 179.2844 103 L 3.9565 8.3962 119.0364 57.4090 41.5657 180.0795 104 S 4.2223 9.2134 112.4455 61.2704 62.7778 175.4072 105 E 4.4885 8.1690 119.4946 55.9555 29.5700 176.6912 106 G 4.2818 8.3979 108.2695 45.3870 0.0000 173.4748 107 K 4.3187 8.2340 118.5682 55.7018 34.2949 176.7056 108 Y 4.1592 8.3558 118.1553 58.9802 35.1429 171.3532 109 W 4.2674 8.0306 122.6191 59.7647 28.9489 178.0567 110 D 4.4788 8.2523 117.7106 57.6528 40.5428 178.1309 111 D 4.4982 8.2106 118.6087 57.2243 40.6140 178.5788 112 A 4.0079 7.6418 120.1845 55.1486 18.5277 179.5079 113 I 3.8355 8.1774 117.7419 63.9643 37.1782 176.6466 114 Q 4.2947 7.6326 124.1561 56.2398 29.0788 174.9646 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 6 D 8.22 4.59 0.00 2.81 2.53 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 0.00 7 F 9.39 4.04 0.00 3.26 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 Q 8.82 3.75 0.00 2.04 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.84 0.00 0.00 0.00 0.00 0.00 2.46 2.43 0.00 9 Q 7.79 4.05 0.00 2.14 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.86 0.00 0.00 0.00 0.00 0.00 2.43 2.53 0.00 10 R 8.16 3.95 0.00 1.85 1.98 0.00 3.26 0.00 0.00 3.34 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.92 0.00 11 R 7.40 3.95 0.00 1.63 1.43 0.00 2.21 0.00 0.00 2.96 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.36 0.00 12 A 7.72 3.99 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 13 H 8.08 4.39 0.00 3.28 3.41 0.00 5.52 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.25 4.16 0.00 1.69 1.68 0.90 0.56 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 15 A 6.90 3.84 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 16 N 7.83 4.89 0.00 2.69 2.82 0.00 0.00 6.93 7.85 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 17 L 7.79 4.33 0.00 1.72 1.61 0.94 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 18 S 9.03 4.39 0.00 4.05 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 19 D 8.65 4.35 0.00 2.71 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 20 E 8.21 3.95 0.00 2.09 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 0.00 2.40 2.51 0.00 21 E 8.17 4.04 0.00 2.26 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 0.00 2.36 2.34 0.00 22 L 8.01 4.01 0.00 1.89 1.86 0.95 0.72 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 23 Q 8.30 3.98 0.00 2.20 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.51 0.00 0.00 0.00 0.00 0.00 2.76 2.60 0.00 24 T 8.07 4.05 4.53 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 1.29 0.00 0.00 25 R 8.50 3.91 0.00 1.87 2.12 0.00 3.16 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 26 F 8.61 3.82 0.00 3.13 3.02 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 27 W 8.60 4.36 0.00 3.59 3.28 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 28 E 8.68 4.05 0.00 2.29 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 2.39 2.45 0.00 29 M 8.07 4.02 0.00 1.94 1.90 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 2.54 2.93 0.00 30 A 7.60 3.85 1.25 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 0.00 0.00 0.00 31 E 8.45 3.91 0.00 2.34 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 2.35 2.42 0.00 32 K 7.81 3.92 0.00 1.88 1.87 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.72 7.81 33 I 7.56 3.89 1.99 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 1.49 0.59 0.89 0.00 0.00 34 V 7.74 3.96 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 0.84 0.00 0.00 1.04 0.00 0.00 35 D 8.09 4.41 0.00 2.85 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 36 P 0.00 4.31 0.00 2.15 2.09 0.00 3.64 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 2.11 2.17 0.00 37 L 7.72 4.05 0.00 1.77 1.74 0.92 0.97 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 38 L 8.20 4.11 0.00 1.84 1.71 0.93 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 39 D 8.09 4.37 0.00 2.90 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 40 L 8.17 4.10 0.00 1.94 1.72 0.92 0.92 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 41 G 7.88 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 42 K 7.90 4.18 0.00 1.92 1.88 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.53 7.81 43 K 7.66 4.52 0.00 1.75 1.83 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.45 7.81 44 N 7.18 5.05 0.00 2.90 2.66 0.00 0.00 6.58 7.42 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 45 T 8.03 4.69 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 46 T 7.92 4.74 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 1.21 0.00 0.00 47 P 0.00 4.22 0.00 2.18 2.14 0.00 3.60 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 48 S 8.05 4.35 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 49 I 7.74 3.76 2.01 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.70 0.92 0.00 0.00 50 E 8.23 3.98 0.00 2.17 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 0.00 2.55 2.51 0.00 51 R 8.61 3.99 0.00 1.96 2.01 0.00 3.13 0.00 0.00 3.23 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.84 0.00 52 S 7.78 4.21 0.00 4.02 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 0.00 53 V 8.10 3.59 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 1.05 0.00 0.00 0.98 0.00 0.00 54 L 8.19 4.20 0.00 1.76 1.68 0.84 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 55 L 8.04 4.38 0.00 1.93 1.76 0.96 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 56 R 8.14 4.04 0.00 2.03 2.03 0.00 3.17 0.00 0.00 3.24 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 57 M 7.76 4.40 0.00 2.22 2.57 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 2.94 2.64 0.00 58 G 6.98 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 0.00 0.00 0.00 59 F 8.11 4.92 0.00 3.24 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 60 S 8.69 4.52 0.00 4.13 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 61 S 8.60 4.26 0.00 4.09 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 0.00 62 L 7.86 4.01 0.00 1.75 1.78 0.94 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 63 E 8.34 3.98 0.00 2.38 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 0.00 2.46 2.43 0.00 64 A 8.55 4.04 1.41 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 0.00 0.00 0.00 65 K 8.07 3.87 0.00 1.89 1.97 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.45 7.81 66 A 7.95 3.99 1.42 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 67 I 8.14 3.83 1.81 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.59 0.99 0.00 0.00 68 V 7.80 3.64 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 1.03 0.00 0.00 0.96 0.00 0.00 69 D 8.47 4.37 0.00 2.87 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 70 K 7.68 3.71 0.00 1.50 0.74 0.00 2.04 0.00 0.00 1.66 0.00 0.00 3.08 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.24 1.61 7.81 71 T 7.61 3.66 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 1.31 0.00 0.00 72 M 7.91 3.96 0.00 2.02 2.22 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.56 0.00 73 D 7.99 4.36 0.00 2.46 2.56 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 74 R 7.00 4.42 0.00 1.54 1.84 0.00 2.59 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.28 0.00 75 G 8.06 3.95 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 0.00 0.00 0.00 76 L 7.79 4.48 0.00 2.00 1.82 1.04 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 77 M 8.11 4.18 0.00 2.03 2.14 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.56 0.00 78 G 8.12 3.83 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 0.00 0.00 0.00 79 K 8.42 4.42 0.00 1.88 1.92 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.62 7.81 80 G 7.96 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 81 A 9.28 4.22 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 82 G 8.12 3.62 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 0.00 0.00 0.00 83 H 8.15 4.25 0.00 3.25 3.54 0.00 5.71 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 84 I 7.68 3.60 2.06 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.92 0.72 0.00 0.00 85 V 7.62 3.48 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 1.13 0.00 0.00 0.86 0.00 0.00 86 Y 8.25 4.11 0.00 3.25 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 87 K 8.98 3.92 0.00 1.75 1.81 0.00 1.87 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.38 1.36 7.81 88 I 7.86 3.68 1.96 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.75 0.67 0.00 0.00 89 A 7.80 3.83 1.26 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 0.00 0.00 90 K 7.69 3.75 0.00 1.59 1.71 0.00 1.19 0.00 0.00 1.04 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.21 0.94 7.81 91 E 7.88 3.78 0.00 1.78 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 2.49 2.35 0.00 92 K 7.59 3.98 0.00 1.44 1.57 0.00 1.64 0.00 0.00 1.37 0.00 0.00 2.67 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.68 0.65 7.81 93 N 7.67 4.03 0.00 2.76 2.76 0.00 0.00 6.86 8.09 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 94 I 7.72 4.67 2.00 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 1.33 0.78 0.94 0.00 0.00 95 S 8.82 4.34 0.00 4.06 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 96 V 8.38 3.61 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 1.25 0.00 0.00 1.02 0.00 0.00 97 R 7.91 3.88 0.00 1.77 1.86 0.00 2.89 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 98 E 8.12 3.98 0.00 2.03 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 0.00 2.35 2.34 0.00 99 A 8.44 4.11 1.41 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 0.00 0.00 0.00 100 G 8.62 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 0.00 101 L 8.41 4.35 0.00 2.04 1.81 1.11 0.77 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 0.00 102 A 8.40 4.08 1.48 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 0.00 0.00 103 L 8.40 3.96 0.00 1.77 1.55 0.55 -0.69 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 S 9.21 4.22 0.00 4.07 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 0.00 105 E 8.17 4.49 0.00 2.06 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 0.00 2.32 2.41 0.00 106 G 8.40 4.28 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 0.00 107 K 8.23 4.32 0.00 1.38 0.81 0.00 1.38 0.00 0.00 1.50 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.18 1.23 7.81 108 Y 8.36 4.16 0.00 2.94 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 0.00 109 W 8.03 4.27 0.00 3.44 3.25 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 0.00 110 D 8.25 4.48 0.00 2.72 2.79 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 0.00 111 D 8.21 4.50 0.00 2.86 2.68 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 0.00 112 A 7.64 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 0.00 113 I 8.18 3.84 2.10 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.88 0.96 0.00 0.00 114 Q 7.63 4.29 0.00 2.38 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.74 6.55 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00