NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.6440 0.0000 0.0000 62.3428 33.8759 174.7158 2 F 4.8951 9.3096 120.3743 54.8905 42.2741 169.0117 3 V 4.8017 10.1083 125.4470 61.0361 34.9267 173.6173 4 E 5.1066 9.1378 127.0112 54.3785 33.0413 174.4803 5 L 5.0589 9.1017 126.9520 53.3320 44.5805 174.3586 6 E 5.1287 8.9818 128.0049 54.7435 32.1804 174.5869 7 T 5.2047 8.7683 120.2835 60.7461 71.3842 173.4532 8 N 5.6194 8.2774 120.3658 52.7118 38.2848 175.5039 9 L 4.2412 7.9526 121.3560 54.2758 43.0587 175.3203 10 P 4.6104 0.0000 0.0000 61.8829 32.5034 177.1603 11 A 4.0072 8.8381 123.1131 55.7500 17.9218 180.2675 12 S 4.0620 8.0861 110.5871 61.7501 62.9375 176.0913 13 R 4.2754 7.7621 118.4755 55.6673 30.1743 176.2411 14 I 4.1471 7.3024 121.5183 59.0984 38.1368 173.9351 15 P 4.1038 0.0000 0.0000 62.6777 31.6177 175.6568 16 A 4.1988 8.5336 126.1631 53.8500 18.8633 177.6857 17 G 3.9706 8.9249 109.4775 45.6777 0.0000 174.8191 18 L 4.0137 8.0181 122.5682 58.3481 41.8559 178.7050 19 E 4.0209 8.2398 116.7633 59.5579 29.3104 178.7663 20 N 4.2919 8.1164 116.8003 56.1763 38.7533 177.3183 21 R 3.9887 8.0303 119.3419 59.3878 30.1458 178.9710 22 L 3.4226 8.7186 120.3686 57.8235 42.0382 178.4370 23 C 3.9687 8.4044 118.9551 62.3997 31.5490 175.2956 24 A 4.0514 8.1572 122.0938 55.2939 18.0319 179.1863 25 A 3.8019 8.1334 119.4823 55.6685 18.2355 179.9424 26 T 3.7897 8.0315 113.8252 66.8052 68.6330 176.3924 27 A 4.1363 7.7898 123.8495 54.9069 18.0881 179.8108 28 T 3.7530 7.6251 112.5035 66.9341 68.6886 176.6113 29 I 3.6880 7.8178 120.7359 64.0580 37.2052 177.7394 30 L 4.2633 8.1299 117.3245 53.5867 42.7887 175.6539 31 D 4.3937 7.9980 117.2561 55.5778 40.0390 172.9746 32 K 4.7095 7.3763 116.9363 53.2323 36.3317 174.5200 33 P 4.2118 0.0000 0.0000 62.9324 31.8999 176.8478 34 E 3.8235 8.9775 123.2724 59.4411 29.6057 177.5314 35 D 4.6241 8.0020 114.3153 55.0853 41.2064 176.0386 36 R 4.4510 7.7777 115.0471 56.2675 31.1982 175.2945 37 V 4.0767 7.4231 118.8704 62.0679 32.6089 175.2502 38 S 4.7540 8.6183 124.1607 56.7412 65.0612 173.1832 39 V 4.8960 8.3922 124.0454 61.3819 34.1077 174.6837 40 T 4.7531 9.0492 123.3595 61.8279 72.5055 172.8094 41 I 4.9108 8.4691 125.8492 59.6875 40.3924 175.3873 42 R 4.5362 9.1391 127.6758 54.0653 31.1327 174.1123 43 P 4.6643 0.0000 0.0000 60.8686 33.8463 175.2248 44 G 3.9530 9.0514 106.2453 46.8227 0.0000 173.8228 45 M 4.3590 7.8714 118.7216 53.9072 33.6042 175.4969 46 T 4.5990 8.1585 116.7823 62.5018 69.0752 174.7658 47 L 4.8461 8.3215 125.7955 52.6053 45.1619 175.2635 48 L 5.0454 8.4212 123.2879 53.3596 45.0704 175.3299 49 M 4.6310 9.0185 124.9493 55.0278 35.4033 174.5068 50 N 4.2852 9.2457 123.8993 55.6537 35.9610 173.7339 51 K 3.9050 8.1311 108.4483 57.5271 32.4065 174.7521 52 S 4.6623 7.8875 111.2403 58.1111 65.4711 173.7380 53 T 4.9142 8.2320 115.0142 60.6837 68.9017 174.3639 54 E 4.2436 7.8184 121.6290 55.6406 30.1685 174.9106 55 P 4.4984 0.0000 0.0000 64.0077 31.4309 175.4304 56 C 4.9056 9.1228 115.1108 57.9812 33.6051 172.2249 57 A 4.8913 8.8165 119.9908 51.0126 22.8909 174.7473 58 H 5.1592 9.2532 116.4928 53.7770 32.4315 172.9748 59 L 4.9991 8.6443 123.9873 53.1892 44.8523 174.7819 60 L 5.0433 9.0247 126.6631 52.8993 44.5043 175.5010 61 V 4.7152 8.8184 124.1744 61.2081 34.2458 174.2104 62 S 5.8900 8.9071 124.1188 56.2313 65.9341 173.3019 63 S 4.8695 8.4855 116.8633 57.5453 66.0109 173.2506 64 I 4.6093 7.9982 124.5357 59.8500 37.4473 176.8993 65 G 4.0355 8.6554 118.4738 46.0800 0.0000 173.1617 66 V 4.5478 7.3158 111.3550 62.9299 35.4950 174.2367 67 V 4.4534 7.7168 112.2802 61.9666 32.5441 176.0236 68 G 4.0577 8.3322 107.0527 45.5760 0.0000 174.8498 69 T 4.5838 7.3249 110.2828 58.8342 72.9288 174.2721 70 A 3.8639 8.7665 125.6889 55.8920 17.6738 179.0784 71 E 3.8217 8.2654 116.5063 60.2456 29.4077 179.3945 72 Q 4.0903 7.9611 116.0016 59.2965 28.9714 178.1398 73 N 3.7415 8.1355 118.4846 55.6246 38.3425 177.3299 74 R 3.8640 7.7421 120.1128 59.6914 30.2743 178.7212 75 T 3.8296 7.2530 115.8564 66.8629 68.4260 176.2613 76 H 4.1758 8.2308 118.2713 59.0216 28.7690 177.4037 77 S 4.6451 9.0525 114.9684 61.8326 62.1105 175.9934 78 A 4.1210 8.1179 123.0358 55.5111 18.0619 179.7552 79 S 4.0830 7.9561 112.7453 61.8723 62.9615 176.9457 80 F 4.4295 8.5729 120.7265 60.7016 38.6022 177.6947 81 F 3.9534 9.3261 117.7774 60.5704 38.3670 177.4310 82 K 3.9483 8.5731 119.3614 59.6717 31.8005 178.3845 83 F 4.1319 8.5590 120.7604 61.2622 39.4270 177.0248 84 L 3.9207 8.8500 118.9727 58.0108 41.5304 179.3762 85 T 3.9542 8.1272 109.9338 65.4839 68.1760 175.2259 86 E 3.8222 7.6196 120.3180 58.5752 29.6663 177.4669 87 E 3.8901 7.9838 119.0401 59.6369 29.6948 179.0912 88 L 4.0156 8.2649 116.0379 55.1975 42.5467 176.8676 89 S 3.7740 7.8347 113.9179 59.4387 60.0219 170.9197 90 L 4.8574 7.2410 118.0018 53.0538 46.1768 176.6180 91 D 4.8554 8.2681 119.9225 53.0174 42.6641 177.6265 92 Q 4.2884 8.9026 120.1222 59.5848 28.7036 179.2332 93 D 4.6119 8.1619 114.5040 55.1949 39.7778 176.5910 94 R 4.6852 8.3460 119.3268 55.9294 31.5357 175.2941 95 I 5.0154 7.8435 119.0419 59.6112 40.9187 175.0226 96 V 4.6270 8.3544 124.9712 61.1809 34.9540 174.1748 97 I 4.8619 8.4581 126.3250 59.5665 40.5930 175.1027 98 R 4.3994 8.3371 122.7338 54.4929 34.1012 174.0466 99 F 5.1755 8.4918 122.1387 55.6753 41.4951 175.1774 100 F 4.8447 9.5201 122.2371 54.8509 41.7597 172.7509 101 P 5.0856 0.0000 0.0000 62.7269 32.3464 175.3420 102 L 5.0796 8.9715 121.3352 53.0425 46.4033 174.9560 103 E 4.6459 8.3434 117.4201 54.9051 33.1427 177.5197 104 A 3.5641 8.7726 127.3795 55.0651 18.8759 179.5068 105 W 4.2884 7.8832 111.8409 58.7172 28.3721 176.6846 106 Q 4.1322 7.6864 116.6054 55.6268 28.5069 175.0981 107 I 4.2639 7.4862 121.3373 59.7162 38.4071 174.6116 108 G 4.8522 8.5911 114.9512 43.8080 0.0000 172.6689 109 K 4.6252 8.1354 122.4744 55.6023 36.3634 176.0527 110 K 3.9798 9.7601 118.7855 57.7067 29.6572 175.6837 111 G 3.9795 9.0872 101.4794 46.2693 0.0000 173.9283 112 T 4.4409 7.8358 113.9950 61.2729 69.9257 172.6113 113 V 5.0315 8.4210 111.4474 59.5974 35.6204 176.0901 114 M 3.9960 8.9274 121.8848 59.2251 32.0372 179.3371 115 T 3.7334 7.8203 113.3396 66.3467 68.5294 174.5333 116 F 4.9369 7.9552 117.5565 57.0939 39.4058 175.7994 117 L 4.4288 8.3538 127.2570 55.0281 42.1267 176.4675 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 P 0.00 4.64 0.00 2.04 2.05 0.00 3.45 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 1.97 2.10 0.00 2 F 9.31 4.90 0.00 2.99 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 3 V 10.11 4.80 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 0.90 0.00 0.00 0.90 0.00 0.00 4 E 9.14 5.11 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 2.20 2.23 0.00 5 L 9.10 5.06 0.00 1.67 1.50 0.95 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.98 5.13 0.00 2.04 1.75 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 2.19 2.35 0.00 7 T 8.77 5.20 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 8 N 8.28 5.62 0.00 2.81 3.02 0.00 0.00 6.97 7.67 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 9 L 7.95 4.24 0.00 1.64 1.62 0.91 0.89 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 10 P 0.00 4.61 0.00 2.17 1.95 0.00 3.61 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 2.10 2.07 0.00 11 A 8.84 4.01 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 12 S 8.09 4.06 0.00 4.03 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 13 R 7.76 4.28 0.00 1.96 2.00 0.00 3.14 0.00 0.00 3.22 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 14 I 7.30 4.15 2.04 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 1.29 0.68 0.92 0.00 0.00 15 P 0.00 4.10 0.00 2.15 1.99 0.00 3.60 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.08 0.00 16 A 8.53 4.20 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 17 G 8.92 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 0.00 0.00 0.00 18 L 8.02 4.01 0.00 1.95 1.74 1.09 0.76 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 19 E 8.24 4.02 0.00 2.21 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 2.38 2.36 0.00 20 N 8.12 4.29 0.00 2.93 2.92 0.00 0.00 7.12 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 21 R 8.03 3.99 0.00 2.26 2.33 0.00 3.29 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.87 0.00 22 L 8.72 3.42 0.00 1.90 1.87 0.74 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 23 C 8.40 3.97 0.00 3.05 3.16 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 24 A 8.16 4.05 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 25 A 8.13 3.80 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 T 8.03 3.79 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 1.28 0.00 0.00 27 A 7.79 4.14 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 28 T 7.63 3.75 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 1.16 0.00 0.00 29 I 7.82 3.69 1.34 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.34 0.49 0.00 0.00 30 L 8.13 4.26 0.00 1.66 1.71 1.03 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 31 D 8.00 4.39 0.00 2.80 2.71 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 0.00 0.00 0.00 0.00 32 K 7.38 4.71 0.00 1.75 1.60 0.00 1.73 0.00 0.00 1.86 0.00 0.00 3.01 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.57 1.32 7.81 33 P 0.00 4.21 0.00 2.18 2.18 0.00 3.68 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 2.04 1.94 0.00 34 E 8.98 3.82 0.00 1.99 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 0.00 2.36 2.28 0.00 35 D 8.00 4.62 0.00 2.65 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 7.78 4.45 0.00 1.74 1.79 0.00 3.34 0.00 0.00 3.12 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.62 0.00 37 V 7.42 4.08 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 0.68 0.00 0.00 0.94 0.00 0.00 38 S 8.62 4.75 0.00 3.53 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 39 V 8.39 4.90 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 0.82 0.00 0.00 0.96 0.00 0.00 40 T 9.05 4.75 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 41 I 8.47 4.91 1.88 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 1.35 0.62 0.97 0.00 0.00 42 R 9.14 4.54 0.00 1.70 1.85 0.00 3.26 0.00 0.00 3.19 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.52 0.00 43 P 0.00 4.66 0.00 2.21 2.06 0.00 3.91 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 1.93 1.96 0.00 44 G 9.05 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 45 M 7.87 4.36 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.63 0.00 46 T 8.16 4.60 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 L 8.32 4.85 0.00 1.71 1.53 0.97 0.59 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 48 L 8.42 5.05 0.00 1.55 1.50 0.93 0.88 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 49 M 9.02 4.63 0.00 1.97 1.83 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.50 0.00 50 N 9.25 4.29 0.00 2.91 2.87 0.00 0.00 7.29 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 51 K 8.13 3.90 0.00 1.96 1.92 0.00 1.52 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.41 7.81 52 S 7.89 4.66 0.00 3.85 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 53 T 8.23 4.91 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 1.27 0.00 0.00 54 E 7.82 4.24 0.00 2.01 1.94 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 2.35 2.28 0.00 55 P 0.00 4.50 0.00 2.03 2.01 0.00 3.71 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 56 C 9.12 4.91 0.00 3.05 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 57 A 8.82 4.89 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 58 H 9.25 5.16 0.00 3.07 3.14 0.00 5.75 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 L 8.64 5.00 0.00 1.47 1.12 0.78 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 60 L 9.02 5.04 0.00 1.60 1.67 0.97 nan 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 61 V 8.82 4.72 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 1.16 0.00 0.00 0.26 0.00 0.00 62 S 8.91 5.89 0.00 3.97 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 63 S 8.49 4.87 0.00 3.95 3.73 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 64 I 8.00 4.61 1.88 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.72 0.92 0.00 0.00 65 G 8.66 4.04 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 0.00 0.00 0.00 66 V 7.32 4.55 2.12 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 0.86 0.00 0.00 0.99 0.00 0.00 67 V 7.72 4.45 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 0.92 0.00 0.00 1.05 0.00 0.00 68 G 8.33 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 0.00 0.00 0.00 69 T 7.32 4.58 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 1.19 0.00 0.00 70 A 8.77 3.86 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 71 E 8.27 3.82 0.00 1.93 1.92 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 2.37 2.30 0.00 72 Q 7.96 4.09 0.00 2.11 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.79 0.00 0.00 0.00 0.00 0.00 2.25 2.38 0.00 73 N 8.14 3.74 0.00 2.55 2.24 0.00 0.00 6.59 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 74 R 7.74 3.86 0.00 1.96 2.04 0.00 3.07 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 75 T 7.25 3.83 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 1.17 0.00 0.00 76 H 8.23 4.18 0.00 3.40 3.70 0.00 5.65 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 77 S 9.05 4.65 0.00 4.35 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 0.00 78 A 8.12 4.12 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 79 S 7.96 4.08 0.00 3.78 3.77 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 80 F 8.57 4.43 0.00 3.19 2.99 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 81 F 9.33 3.95 0.00 3.51 3.20 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 82 K 8.57 3.95 0.00 2.01 2.13 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.52 7.81 83 F 8.56 4.13 0.00 3.25 3.38 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 84 L 8.85 3.92 0.00 1.65 1.66 0.79 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 85 T 8.13 3.95 4.34 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 1.42 0.00 0.00 86 E 7.62 3.82 0.00 1.98 2.12 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 2.25 2.24 0.00 87 E 7.98 3.89 0.00 1.74 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 1.47 1.47 0.00 88 L 8.26 4.02 0.00 1.66 1.69 0.90 0.93 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 89 S 7.83 3.77 0.00 4.02 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 L 7.24 4.86 0.00 1.57 1.51 0.90 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 91 D 8.27 4.86 0.00 2.88 2.61 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 0.00 0.00 0.00 0.00 92 Q 8.90 4.29 0.00 2.14 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.95 0.00 0.00 0.00 0.00 0.00 2.57 2.42 0.00 93 D 8.16 4.61 0.00 2.81 2.82 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 94 R 8.35 4.69 0.00 1.84 2.09 0.00 3.24 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.73 0.00 95 I 7.84 5.02 1.82 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 0.99 0.56 0.31 0.00 0.00 96 V 8.35 4.63 1.96 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 1.02 0.00 0.00 0.92 0.00 0.00 97 I 8.46 4.86 1.75 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.48 0.04 0.00 0.00 98 R 8.34 4.40 0.00 1.69 1.42 0.00 3.34 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.56 0.00 99 F 8.49 5.18 0.00 2.78 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 0.00 100 F 9.52 4.84 0.00 2.94 2.97 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 0.00 101 P 0.00 5.09 0.00 2.12 2.09 0.00 3.77 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 2.05 2.03 0.00 102 L 8.97 5.08 0.00 1.54 1.45 0.84 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 103 E 8.34 4.65 0.00 1.16 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 2.19 2.22 0.00 104 A 8.77 3.56 1.29 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 0.00 0.00 0.00 105 W 7.88 4.29 0.00 3.57 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 0.00 106 Q 7.69 4.13 0.00 1.64 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.70 0.00 0.00 0.00 0.00 0.00 1.16 1.73 0.00 107 I 7.49 4.26 1.88 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 1.25 0.69 1.06 0.00 0.00 108 G 8.59 4.85 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 0.00 0.00 0.00 0.00 109 K 8.14 4.63 0.00 1.80 1.67 0.00 1.83 0.00 0.00 1.83 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.49 7.81 110 K 9.76 3.98 0.00 1.86 1.85 0.00 1.86 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.38 1.44 7.81 111 G 9.09 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 0.00 0.00 0.00 112 T 7.84 4.44 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 1.37 0.00 0.00 113 V 8.42 5.03 2.40 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 0.98 0.00 0.00 1.13 0.00 0.00 114 M 8.93 4.00 0.00 2.02 2.21 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 2.64 2.84 0.00 115 T 7.82 3.73 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 0.26 0.00 0.00 116 F 7.96 4.94 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 0.00 117 L 8.35 4.43 0.00 1.70 1.54 0.97 0.80 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