NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 R 4.2379 8.2549 117.2407 55.2130 31.4258 175.9648 13 K 4.1800 7.4819 114.7916 54.2408 34.3737 173.4291 14 Q 4.0350 8.2574 116.5601 55.5322 26.2419 172.6027 15 V 3.8317 8.0770 121.5515 62.8133 32.4256 178.0273 16 S 4.3454 9.0542 115.5643 59.0143 62.9679 168.5579 17 D 5.3082 7.5399 116.2542 53.6760 40.6361 174.5330 18 G 4.0003 8.0868 113.8843 45.0559 0.0000 170.6995 19 V 3.9203 8.6108 117.7797 60.7711 33.0245 175.1918 20 A 4.7659 8.5248 128.0258 50.8417 19.9870 175.5543 21 H 4.9680 9.2348 120.1391 55.9319 30.4173 175.1108 22 I 5.0079 8.2706 114.1099 59.5969 41.2204 173.3580 23 H 4.9119 9.4231 126.3198 54.6694 31.9395 172.4506 24 A 5.0404 9.6036 131.2661 49.8680 18.3717 175.6447 25 S 4.6595 8.9314 116.1927 56.9112 64.7938 176.3874 26 F 4.0144 8.8680 121.2226 60.5921 38.7567 176.2622 27 N 4.6918 7.5483 115.3516 54.1321 39.2886 173.7605 28 N 4.5074 7.9393 115.2868 53.5349 42.2206 172.7560 29 T 5.7759 8.9624 116.6906 62.1080 72.8722 173.5072 30 I 4.5910 8.5524 119.9441 59.3265 40.8095 174.6073 31 V 4.9331 9.1237 123.6904 61.6609 34.8660 174.4168 32 T 5.2268 9.1175 123.6777 62.1618 73.0497 172.7808 33 I 4.7154 8.7193 127.2421 60.3743 38.9278 174.9231 34 T 4.5832 8.9687 124.5192 61.4432 71.6394 174.0121 35 D 3.7022 9.7880 125.7904 57.2210 39.6972 180.9627 36 R 2.9082 8.5890 121.3063 56.3454 32.7300 176.1451 37 Q 3.8315 8.6741 127.1744 57.7889 29.8780 174.5194 38 G 3.2090 8.1595 104.3872 45.4272 0.0000 173.4164 39 N 4.3502 8.4608 122.6444 51.9416 41.2625 174.4486 40 A 4.4155 8.5703 125.8845 52.0632 19.1016 176.1707 41 L 4.6509 8.4028 118.8710 55.8520 44.4438 177.1017 42 G 4.4586 7.3552 103.1486 45.2129 0.0000 170.9233 43 W 5.0119 7.6882 115.7882 56.0996 30.6660 172.6247 44 A 4.1674 9.1002 121.3391 52.6251 22.9353 175.0028 45 T 4.7352 7.8726 111.9173 59.6946 70.4624 173.9677 46 A 4.3166 8.4180 125.3212 55.3981 17.8731 180.3026 47 G 3.6869 7.8821 103.5062 47.4712 0.0000 175.7234 48 G 3.7587 8.3303 107.4992 47.3135 0.0000 175.8963 49 S 4.0663 7.8665 116.3426 59.0684 63.9441 174.0645 50 G 3.5470 7.6577 107.5215 46.3389 0.0000 173.3812 51 F 5.1227 7.7123 110.0959 57.0233 40.3980 178.8459 52 R 3.9712 8.0604 119.9386 56.3276 29.8808 175.1699 53 G 3.8071 8.8736 113.9557 47.1724 0.0000 175.9720 54 S 4.2817 9.5716 123.9051 61.1595 62.7114 174.1772 55 R 4.3253 7.9216 118.0476 55.9991 29.4062 176.1079 56 K 4.5613 8.6695 118.6616 56.7360 34.1490 177.3184 57 S 4.6262 7.7016 112.4453 58.4039 62.8672 173.7820 58 T 4.5977 7.1233 110.7666 59.6246 71.0079 173.6574 59 P 4.3978 0.0000 0.0000 66.2814 31.1915 177.8175 60 F 4.3575 8.4517 120.2065 61.2160 37.6312 176.5070 61 A 4.0833 7.6275 119.0903 55.4920 17.5196 179.5233 62 A 4.2600 7.9799 119.0296 55.2030 18.3519 179.2560 63 Q 3.9645 8.6736 118.5821 59.6206 28.6665 178.8883 64 V 3.5642 7.8639 112.5994 64.1597 31.4462 178.0472 65 A 4.1777 7.4545 117.7706 54.3698 19.3089 179.0321 66 A 3.9572 8.9856 118.4690 54.8177 18.6177 178.6388 67 E 4.4573 8.3336 115.3272 57.8839 30.8371 178.2301 68 R 3.8667 7.5341 119.0901 59.5296 30.1382 177.9695 69 C 3.9822 8.3539 114.0511 61.5318 29.1871 175.8174 70 A 4.0382 7.9305 122.8298 55.1145 17.8266 178.9941 71 D 3.8035 7.9725 114.9872 56.7231 41.2449 177.3631 72 A 4.9611 7.6089 119.9819 51.3380 19.5652 177.4059 73 V 4.3901 7.3336 110.6714 62.1089 34.7202 177.5797 74 K 3.8112 9.1635 121.8696 59.8164 31.7379 177.8863 75 E 4.1665 8.3493 116.1411 58.6769 29.3283 178.3817 76 Y 3.8964 9.0114 120.0268 60.3560 38.3760 176.0548 77 G 4.3628 8.4458 109.5382 46.4908 0.0000 172.9912 78 I 4.9199 7.5841 109.7011 59.1932 41.2081 175.2871 79 K 4.9992 8.6162 119.3647 56.3371 35.1020 175.9356 80 N 5.3600 8.4020 118.9029 52.2352 41.3689 173.8369 81 L 4.8431 8.3105 123.5086 53.2332 43.8845 175.7074 82 E 4.6682 8.3358 120.3547 53.8794 30.9314 174.1828 83 V 3.8704 8.2586 123.9769 63.3032 32.4897 174.2670 84 M 4.8628 8.6050 128.1068 53.0406 32.9844 173.0965 85 V 4.0052 8.1816 115.4926 60.9339 33.2751 175.1260 86 K 4.2336 9.0511 126.3542 59.0165 34.7045 174.6171 87 G 4.8709 9.1113 115.8782 44.1253 0.0000 172.3210 88 P 4.4211 0.0000 0.0000 61.8970 32.7760 175.7671 89 G 3.2757 7.9982 106.5257 45.7835 0.0000 169.8018 90 P 4.3939 0.0000 0.0000 63.0758 32.4847 177.7924 91 G 4.1144 8.7158 105.1069 46.7735 0.0000 175.8807 92 R 4.0403 7.9165 118.5143 59.2267 30.3760 177.0805 93 E 4.5930 8.1413 111.8356 56.6919 34.4921 177.1475 94 S 4.0827 8.3687 111.7142 61.7725 62.2003 176.0221 95 T 4.1162 7.8180 114.8471 65.7498 67.3901 175.6093 96 I 3.5342 8.0097 119.5571 65.1495 36.9283 177.6640 97 R 3.9069 8.2417 117.9363 59.8036 30.0847 178.8731 98 A 4.0469 7.6149 119.2521 55.3834 18.4458 179.2703 99 L 4.2125 7.8875 116.2616 57.9452 41.9607 178.6614 100 N 4.7103 8.3615 115.8842 57.0156 38.6418 178.2501 101 A 4.4797 8.1093 119.1082 52.1807 18.6824 177.5380 102 A 4.4761 8.7861 122.7761 52.4549 20.4925 177.7231 103 G 4.0235 8.1278 104.9526 45.3912 0.0000 173.5734 104 F 5.1056 7.8742 116.3135 55.3487 42.2699 176.4108 105 R 4.4802 8.8057 122.6931 54.0736 28.1417 174.8511 106 I 4.1858 7.8648 119.7137 61.5137 38.4469 175.2184 107 T 4.7026 8.7082 122.6765 62.7557 70.9072 172.9988 108 N 4.8621 8.0750 120.8966 51.6575 41.8619 173.7014 109 I 5.2125 8.4526 126.5771 58.9519 37.3763 173.7170 110 T 4.4962 8.3181 113.5287 59.4054 71.8541 175.1338 111 D 5.1257 8.3108 125.0738 53.0609 39.0149 176.7744 112 V 3.7125 8.2700 113.9656 63.5352 32.7433 176.3924 113 T 3.9721 7.5264 117.4075 63.0726 68.6283 172.5052 114 P 4.5072 0.0000 0.0000 62.6939 32.2027 176.0648 115 I 4.5638 7.7967 119.2628 59.1310 40.7729 173.2125 116 P 4.5169 0.0000 0.0000 62.5579 32.2232 177.3206 117 H 4.5379 8.6544 122.6117 55.9984 28.0929 175.3729 118 N 4.1688 8.1355 115.7919 53.9839 35.3136 173.3204 119 G 3.9134 8.1447 106.8577 46.8596 0.0000 171.2664 120 C 4.4550 7.7807 116.2788 57.7367 29.9384 173.2775 121 R 4.3978 8.1155 121.5682 53.6719 30.0107 173.9572 122 P 4.4282 0.0000 0.0000 61.6927 31.9560 173.9510 123 P 4.4866 0.0000 0.0000 62.5669 31.8069 176.8361 124 K 4.3999 8.4756 115.1479 56.1329 32.8669 178.4317 125 K 3.6756 7.4595 123.5704 57.4400 32.2146 178.2424 126 R 4.7275 8.4893 114.8436 55.1418 34.1581 173.7114 127 R 4.3965 8.3829 114.6209 58.1117 32.4340 176.5080 128 V 3.7799 7.9952 113.5037 61.9791 31.5225 175.9840 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 12 R 8.25 4.24 0.00 1.72 1.94 0.00 2.61 0.00 0.00 2.98 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.62 0.00 13 K 7.48 4.18 0.00 2.08 2.02 0.00 1.57 0.00 0.00 1.51 0.00 0.00 3.05 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.46 1.62 7.81 14 Q 8.26 4.03 0.00 2.20 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.04 0.00 0.00 0.00 0.00 0.00 2.29 2.38 0.00 15 V 8.08 3.83 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 1.10 0.00 0.00 0.92 0.00 0.00 16 S 9.05 4.35 0.00 4.15 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 D 7.54 5.31 0.00 2.68 2.64 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 18 G 8.09 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 19 V 8.61 3.92 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 0.81 0.00 0.00 1.05 0.00 0.00 20 A 8.52 4.77 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 21 H 9.23 4.97 0.00 3.09 3.19 0.00 5.57 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 22 I 8.27 5.01 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.02 0.92 0.00 0.00 23 H 9.42 4.91 0.00 3.19 3.21 0.00 5.76 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 24 A 9.60 5.04 1.33 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 0.00 0.00 0.00 25 S 8.93 4.66 0.00 4.00 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 26 F 8.87 4.01 0.00 3.10 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 0.00 27 N 7.55 4.69 0.00 2.90 2.91 0.00 0.00 6.79 7.88 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 28 N 7.94 4.51 0.00 2.71 2.66 0.00 0.00 6.78 6.81 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 29 T 8.96 5.78 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 1.26 0.00 0.00 30 I 8.55 4.59 1.91 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.86 0.97 0.00 0.00 31 V 9.12 4.93 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 1.04 0.00 0.00 0.98 0.00 0.00 32 T 9.12 5.23 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 1.36 0.00 0.00 33 I 8.72 4.72 1.79 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.96 0.73 0.00 0.00 34 T 8.97 4.58 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 1.24 0.00 0.00 35 D 9.79 3.70 0.00 2.57 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 36 R 8.59 2.91 0.00 2.00 2.01 0.00 3.30 0.00 0.00 3.31 7.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 37 Q 8.67 3.83 0.00 2.04 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.67 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 38 G 8.16 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 0.00 0.00 0.00 39 N 8.46 4.35 0.00 2.89 2.73 0.00 0.00 6.91 7.54 0.00 0.00 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 8.57 4.42 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 41 L 8.40 4.65 0.00 1.40 1.04 0.39 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 42 G 7.36 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 7.69 5.01 0.00 3.60 3.03 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 44 A 9.10 4.17 1.10 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 45 T 7.87 4.74 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 1.46 0.00 0.00 46 A 8.42 4.32 1.43 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 0.00 0.00 47 G 7.88 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 0.00 0.00 0.00 48 G 8.33 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 0.00 0.00 0.00 49 S 7.87 4.07 0.00 3.67 3.51 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 50 G 7.66 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.71 5.12 0.00 2.98 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 52 R 8.06 3.97 0.00 2.03 1.99 0.00 3.42 0.00 0.00 3.27 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 53 G 8.87 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 54 S 9.57 4.28 0.00 3.88 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 55 R 7.92 4.33 0.00 1.80 2.26 0.00 3.15 0.00 0.00 2.49 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.48 0.00 56 K 8.67 4.56 0.00 1.83 2.19 0.00 1.72 0.00 0.00 1.85 0.00 0.00 3.23 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.38 1.47 7.81 57 S 7.70 4.63 0.00 4.29 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 58 T 7.12 4.60 4.29 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 1.30 0.00 0.00 59 P 0.00 4.40 0.00 2.34 2.38 0.00 3.77 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.06 0.00 60 F 8.45 4.36 0.00 2.98 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 61 A 7.63 4.08 1.53 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 0.00 0.00 62 A 7.98 4.26 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.67 3.96 0.00 2.23 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.60 0.00 0.00 0.00 0.00 0.00 2.56 2.57 0.00 64 V 7.86 3.56 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 0.95 0.00 0.00 0.85 0.00 0.00 65 A 7.45 4.18 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 66 A 8.99 3.96 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 67 E 8.33 4.46 0.00 2.26 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 0.00 2.50 2.32 0.00 68 R 7.53 3.87 0.00 2.16 2.06 0.00 3.01 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 69 C 8.35 3.98 0.00 3.22 3.31 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 70 A 7.93 4.04 1.62 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 71 D 7.97 3.80 0.00 2.73 2.92 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 72 A 7.61 4.96 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 73 V 7.33 4.39 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 0.96 0.00 0.00 1.03 0.00 0.00 74 K 9.16 3.81 0.00 2.13 1.95 0.00 1.67 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.48 1.61 7.81 75 E 8.35 4.17 0.00 2.22 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 2.46 2.46 0.00 76 Y 9.01 3.90 0.00 3.28 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 77 G 8.45 4.36 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 0.00 78 I 7.58 4.92 2.04 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.02 0.99 0.00 0.00 79 K 8.62 5.00 0.00 1.68 1.88 0.00 1.75 0.00 0.00 1.62 0.00 0.00 2.77 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.40 1.56 7.81 80 N 8.40 5.36 0.00 2.62 2.73 0.00 0.00 7.00 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 81 L 8.31 4.84 0.00 1.46 1.39 -0.04 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 82 E 8.34 4.67 0.00 1.82 1.78 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 2.23 2.28 0.00 83 V 8.26 3.87 2.28 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 0.88 0.00 0.00 0.91 0.00 0.00 84 M 8.61 4.86 0.00 2.17 1.83 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.53 0.00 85 V 8.18 4.01 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 0.73 0.00 0.00 0.95 0.00 0.00 86 K 9.05 4.23 0.00 1.84 1.84 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.83 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.50 7.81 87 G 9.11 4.87 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 88 P 0.00 4.42 0.00 1.73 1.85 0.00 3.90 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.81 0.00 89 G 8.00 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 0.00 0.00 0.00 90 P 0.00 4.39 0.00 2.24 2.26 0.00 3.71 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 91 G 8.72 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 92 R 7.92 4.04 0.00 1.90 2.01 0.00 3.26 0.00 0.00 3.19 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.72 0.00 93 E 8.14 4.59 0.00 2.02 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 2.22 2.22 0.00 94 S 8.37 4.08 0.00 3.90 3.97 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 0.00 0.00 0.00 0.00 95 T 7.82 4.12 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 1.27 0.00 0.00 96 I 8.01 3.53 1.89 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.51 0.92 0.00 0.00 97 R 8.24 3.91 0.00 1.85 2.04 0.00 3.15 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.86 0.00 98 A 7.61 4.05 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.89 4.21 0.00 1.91 1.81 1.04 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 100 N 8.36 4.71 0.00 2.89 2.89 0.00 0.00 6.91 8.15 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 0.00 101 A 8.11 4.48 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 0.00 102 A 8.79 4.48 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 0.00 103 G 8.13 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 0.00 104 F 7.87 5.11 0.00 2.95 2.94 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 0.00 105 R 8.81 4.48 0.00 1.97 1.92 0.00 3.21 0.00 0.00 3.38 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 106 I 7.86 4.19 1.91 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 1.37 1.82 0.95 0.00 0.00 107 T 8.71 4.70 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 1.22 0.00 0.00 108 N 8.07 4.86 0.00 2.77 2.59 0.00 0.00 6.92 7.82 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 0.00 109 I 8.45 5.21 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 1.00 0.91 0.00 0.00 110 T 8.32 4.50 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 1.20 0.00 0.00 111 D 8.31 5.13 0.00 2.82 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 0.00 112 V 8.27 3.71 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 1.04 0.00 0.00 113 T 7.53 3.97 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 1.24 0.00 0.00 114 P 0.00 4.51 0.00 2.17 2.05 0.00 3.74 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 115 I 7.80 4.56 1.90 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 1.48 0.58 0.95 0.00 0.00 116 P 0.00 4.52 0.00 2.19 2.06 0.00 3.78 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 117 H 8.65 4.54 0.00 3.12 3.35 0.00 6.04 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 N 8.14 4.17 0.00 2.88 2.87 0.00 0.00 6.93 7.65 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 0.00 119 G 8.14 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 0.00 0.00 0.00 120 C 7.78 4.45 0.00 2.97 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 0.00 121 R 8.12 4.40 0.00 1.74 1.84 0.00 3.25 0.00 0.00 3.28 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 122 P 0.00 4.43 0.00 2.22 2.07 0.00 3.83 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 123 P 0.00 4.49 0.00 2.24 2.24 0.00 3.70 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.99 0.00 124 K 8.48 4.40 0.00 1.76 1.87 0.00 1.90 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.44 1.42 7.81 125 K 7.46 3.68 0.00 1.82 0.81 0.00 1.65 0.00 0.00 1.67 0.00 0.00 3.05 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.32 1.40 7.81 126 R 8.49 4.73 0.00 1.74 1.76 0.00 3.16 0.00 0.00 3.17 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00 127 R 8.38 4.40 0.00 1.73 1.90 0.00 3.24 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.59 0.00 128 V 8.00 3.78 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 0.64 0.00 0.00 0.91 0.00 0.00