NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9891 8.3544 108.0294 45.7455 0.0000 172.9240 2 I 3.6303 8.2281 124.1784 60.5492 38.8297 174.9457 3 D 4.6266 8.6033 129.4069 53.6687 41.9851 174.6040 4 P 4.5236 0.0000 0.0000 64.8605 31.9380 176.5922 5 N 4.8271 8.7752 117.1404 53.0568 38.9394 176.0725 6 Y 4.7278 7.9755 119.8579 59.6242 37.4788 178.2394 7 R 3.4520 6.1372 117.7222 58.8989 30.4556 177.5784 8 T 3.9421 7.5588 116.5183 66.2243 68.8552 175.0553 9 S 4.6758 7.9420 113.7196 57.8920 64.4237 173.5594 10 R 5.0021 8.6849 121.0246 54.6032 32.6811 175.8148 11 Q 4.4959 8.5806 121.4179 55.0446 31.3005 174.5065 12 V 4.1713 7.9184 119.4879 60.8559 32.8041 176.2405 13 V 4.4473 8.2000 118.5925 59.4002 32.7792 174.1103 14 G 4.1136 7.2230 104.2593 43.3345 0.0000 172.2573 15 E 4.8832 8.1364 122.1028 54.1585 32.7504 174.9801 16 H 4.6577 9.5117 122.8493 55.3365 32.0882 173.4364 17 Q 3.2574 9.9079 127.2589 56.8194 26.2291 175.0915 18 G 3.9736 8.5549 106.0752 45.0580 0.0000 173.5762 19 H 5.0104 7.9671 115.1786 53.1397 31.2823 173.8054 20 K 3.9638 8.3706 119.9308 56.4832 33.1573 175.8219 21 V 4.7189 8.1265 122.3360 61.3361 34.3416 173.7423 22 Y 4.9480 9.4502 126.5350 56.5424 39.8320 176.3339 23 G 4.1211 8.0244 113.2960 44.8845 0.0000 171.1229 24 P 4.8988 0.0000 0.0000 62.4493 32.6258 175.9869 25 V 4.6021 8.1691 120.0127 60.2863 33.9361 175.8637 26 D 4.7994 9.3902 123.6063 52.5715 42.5431 172.4943 27 P 4.7361 0.0000 0.0000 61.6501 31.9768 174.6605 28 P 4.7441 0.0000 0.0000 62.8817 31.7735 177.5979 29 K 4.0166 7.9284 119.1504 58.0115 32.6571 176.9192 30 V 4.5660 8.0059 118.8130 61.1567 33.0406 175.3337 31 L 4.7729 9.5584 125.9926 53.0651 44.3335 178.8109 32 G 3.8798 8.5265 108.0551 45.6255 0.0000 171.9507 33 I 4.6168 8.2704 120.6937 59.7707 39.1996 174.2159 34 H 5.0061 8.7015 122.3449 55.0112 30.4903 174.9619 35 G 4.7214 8.9537 110.2598 47.4563 0.0000 172.4180 36 T 4.6176 8.6557 115.3635 65.2469 70.9808 176.1315 37 I 4.3493 8.2043 121.2074 63.2754 38.6263 175.6645 38 V 4.5955 10.0206 125.0378 61.1292 33.6191 174.3465 39 G 4.3507 9.0029 116.5137 44.5374 0.0000 171.4360 40 V 4.8068 8.2976 125.1269 61.0494 34.5854 174.1420 41 D 4.7611 9.1620 129.1349 53.2726 40.4958 176.6986 42 F 4.8027 8.7234 125.4263 60.3162 39.1195 176.7964 43 D 4.7282 8.6175 118.9221 55.4592 41.0657 176.9091 44 L 4.4739 8.2738 118.7584 55.7591 43.1919 176.9999 45 C 3.9070 8.1739 117.8415 60.2847 31.4982 172.8514 46 I 4.1539 8.3877 124.8345 60.0458 38.4405 174.2334 47 A 3.8757 7.9494 119.4736 54.1279 15.2151 178.6237 48 D 4.3574 8.2648 122.1983 56.7734 41.9018 177.1272 49 G 3.9912 8.3841 105.5664 45.8648 0.0000 175.0277 50 S 4.1113 7.8002 117.9523 61.2545 62.7087 176.2029 51 C 3.9167 7.7792 116.8162 61.5191 28.9463 176.0587 52 I 3.6661 7.1338 120.7263 64.1403 36.7902 178.1570 53 T 3.9735 7.5589 115.3568 65.7272 68.2821 175.8449 54 A 4.5058 7.3493 121.2198 52.2886 19.3589 177.0982 55 C 4.1603 7.6863 119.1508 59.0243 31.7678 172.5684 56 P 4.3760 0.0000 0.0000 64.5094 31.3576 176.6434 57 V 4.3080 6.8207 119.5920 62.8878 32.1023 174.4464 58 N 4.1688 8.4232 110.9198 53.9617 35.8770 175.8973 59 V 3.5335 7.6836 118.9274 65.4788 32.8480 175.9366 60 F 5.7141 8.1497 117.0099 55.4323 40.9274 175.5098 61 Q 4.5462 8.3859 118.2558 54.0674 32.0668 173.8832 62 W 4.9652 8.8204 121.2052 58.1067 29.9946 174.7939 63 Y 4.9782 9.7466 124.4039 56.0075 41.6329 173.7197 64 D 4.8868 8.4527 126.7907 53.6889 42.2062 177.1427 65 T 4.5661 9.3536 113.6401 58.7877 68.3436 171.0856 66 P 4.5704 0.0000 0.0000 64.4783 32.0539 177.8876 67 G 3.9038 9.3486 111.2356 45.3080 0.0000 172.9283 68 H 4.5871 8.0922 120.1689 54.3497 30.4434 174.2556 69 P 4.1906 0.0000 0.0000 65.0569 31.3748 177.0038 70 A 4.3727 7.7890 120.8294 53.6471 19.6605 176.8195 71 S 4.5405 7.4243 106.7891 58.0445 65.4061 175.6772 72 E 4.9484 8.1818 119.4599 56.1525 30.5569 175.5787 73 K 4.7525 7.6634 119.3849 54.7933 35.8774 174.8956 74 K 4.7777 9.5827 122.9127 54.9271 37.2929 175.5841 75 A 4.6943 8.6254 124.2136 51.4132 18.8668 176.1730 76 D 5.2512 8.7563 122.5397 52.6390 43.1981 175.0327 77 P 4.4762 0.0000 0.0000 62.0292 28.9812 176.3005 78 I 3.9818 7.5656 118.1315 63.5750 38.9313 174.8972 79 N 5.0540 7.5834 117.0424 53.1748 39.6243 175.9095 80 E 3.7219 8.2323 120.2044 58.7392 30.0536 178.1462 81 Q 4.0341 7.9353 115.9610 58.1261 28.9557 176.6405 82 A 4.1500 8.2213 120.0925 52.9388 19.1026 177.3512 83 C 3.9665 7.2956 117.4300 59.4042 31.8728 173.2677 84 I 3.6140 7.7348 119.1032 59.8496 37.5590 175.1412 85 F 3.9768 7.3214 117.0678 59.3300 35.9872 177.2380 86 C 4.1257 7.9491 115.8890 59.7420 29.9475 175.0047 87 M 3.3906 7.8948 115.5388 55.8968 29.8709 178.1612 88 A 4.0193 7.6900 122.5985 55.2953 18.4505 179.8391 89 C 4.0241 8.1160 112.4709 61.7512 29.4202 176.0349 90 V 3.5800 7.1064 119.9235 65.4427 31.1472 177.0408 91 N 4.6116 7.7988 113.5700 54.3109 38.7924 176.0900 92 V 4.1163 7.5167 112.3760 61.5268 33.2978 175.8706 93 C 4.2214 7.8558 121.7881 58.4093 31.7165 172.3363 94 P 4.4099 0.0000 0.0000 64.6392 31.2877 177.2413 95 V 4.1765 7.6316 116.3186 60.2704 32.2969 175.2203 96 A 3.6573 7.6339 121.5689 53.7828 16.2815 178.3368 97 A 4.5734 7.6564 120.9403 52.4885 20.8014 178.1698 98 I 5.0146 7.6233 116.0404 59.3053 40.1583 174.7490 99 D 4.9102 9.1850 125.5879 52.5508 44.2707 174.2970 100 V 5.0395 8.6048 125.0234 59.9567 34.4185 175.0952 101 K 4.5199 9.4652 124.1245 54.4944 35.5766 173.7303 102 P 3.9803 0.0000 0.0000 60.9420 32.3223 174.2202 103 P 4.4201 0.0000 0.0000 63.3053 31.0763 176.2633 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 G 8.35 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 0.00 0.00 0.00 2 I 8.23 3.63 1.96 0.00 0.00 0.59 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 0.75 0.98 0.00 0.00 3 D 8.60 4.63 0.00 2.89 2.62 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 4 P 0.00 4.52 0.00 2.23 2.19 0.00 3.82 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 5 N 8.78 4.83 0.00 2.88 2.80 0.00 0.00 6.58 7.81 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 6 Y 7.98 4.73 0.00 3.03 3.27 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 7 R 6.14 3.45 0.00 1.38 1.71 0.00 2.91 0.00 0.00 3.00 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.50 0.00 8 T 7.56 3.94 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 1.19 0.00 0.00 9 S 7.94 4.68 0.00 4.04 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 10 R 8.68 5.00 0.00 2.03 2.09 0.00 3.31 0.00 0.00 3.41 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.67 0.00 11 Q 8.58 4.50 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.97 0.00 0.00 0.00 0.00 0.00 2.43 2.30 0.00 12 V 7.92 4.17 1.93 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 0.86 0.00 0.00 0.55 0.00 0.00 13 V 8.20 4.45 2.06 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 0.75 0.00 0.00 0.92 0.00 0.00 14 G 7.22 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 15 E 8.14 4.88 0.00 1.83 1.73 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 2.11 2.20 0.00 16 H 9.51 4.66 0.00 2.99 2.81 0.00 5.80 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 Q 9.91 3.26 0.00 1.80 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.30 0.00 0.00 0.00 0.00 0.00 2.24 2.26 0.00 18 G 8.55 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 19 H 7.97 5.01 0.00 3.21 3.36 0.00 5.27 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 K 8.37 3.96 0.00 1.68 1.27 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.76 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.49 1.48 7.81 21 V 8.13 4.72 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 0.95 0.00 0.00 0.64 0.00 0.00 22 Y 9.45 4.95 0.00 2.96 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 23 G 8.02 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 0.00 0.00 0.00 24 P 0.00 4.90 0.00 2.12 2.09 0.00 3.76 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 2.02 1.99 0.00 25 V 8.17 4.60 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 0.75 0.00 0.00 0.97 0.00 0.00 26 D 9.39 4.80 0.00 2.76 2.55 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 27 P 0.00 4.74 0.00 2.11 2.02 0.00 3.75 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 2.06 2.13 0.00 28 P 0.00 4.74 0.00 2.17 2.33 0.00 3.69 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.97 0.00 29 K 7.93 4.02 0.00 1.78 1.89 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.35 7.81 30 V 8.01 4.57 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 1.11 0.00 0.00 0.97 0.00 0.00 31 L 9.56 4.77 0.00 1.74 1.90 1.05 1.27 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 32 G 8.53 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 33 I 8.27 4.62 1.74 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.82 0.22 0.00 0.00 34 H 8.70 5.01 0.00 2.23 2.88 0.00 5.59 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 G 8.95 4.72 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 0.00 0.00 0.00 36 T 8.66 4.62 4.35 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 1.30 0.00 0.00 37 I 8.20 4.35 2.01 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 1.30 1.66 1.17 0.00 0.00 38 V 10.02 4.60 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 0.91 0.00 0.00 0.89 0.00 0.00 39 G 9.00 4.35 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 0.00 40 V 8.30 4.81 2.27 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 1.38 0.00 0.00 1.34 0.00 0.00 41 D 9.16 4.76 0.00 2.65 2.57 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 0.00 0.00 0.00 0.00 42 F 8.72 4.80 0.00 3.17 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 43 D 8.62 4.73 0.00 2.88 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 44 L 8.27 4.47 0.00 1.72 1.72 0.93 0.91 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 45 C 8.17 3.91 0.00 3.01 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 46 I 8.39 4.15 1.89 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 1.35 1.04 0.93 0.00 0.00 47 A 7.95 3.88 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 48 D 8.26 4.36 0.00 2.67 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 49 G 8.38 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 0.00 0.00 0.00 50 S 7.80 4.11 0.00 3.82 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 51 C 7.78 3.92 0.00 2.28 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 52 I 7.13 3.67 1.43 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 -0.12 0.60 0.00 0.00 53 T 7.56 3.97 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 1.20 0.00 0.00 54 A 7.35 4.51 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 55 C 7.69 4.16 0.00 3.34 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 56 P 0.00 4.38 0.00 2.19 2.15 0.00 3.76 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 57 V 6.82 4.31 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 0.81 0.00 0.00 0.86 0.00 0.00 58 N 8.42 4.17 0.00 2.81 2.80 0.00 0.00 7.09 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 59 V 7.68 3.53 1.61 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 -0.04 0.00 0.00 0.71 0.00 0.00 60 F 8.15 5.71 0.00 2.80 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 61 Q 8.39 4.55 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.01 0.00 0.00 0.00 0.00 0.00 2.36 2.49 0.00 62 W 8.82 4.97 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 63 Y 9.75 4.98 0.00 2.96 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 64 D 8.45 4.89 0.00 2.42 2.42 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 65 T 9.35 4.57 4.15 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 0.87 0.00 0.00 66 P 0.00 4.57 0.00 2.16 2.06 0.00 3.25 0.00 0.00 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.87 0.00 67 G 9.35 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 0.00 0.00 0.00 68 H 8.09 4.59 0.00 3.17 3.50 0.00 5.72 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.19 0.00 2.16 2.11 0.00 3.13 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.84 0.00 70 A 7.79 4.37 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 71 S 7.42 4.54 0.00 3.85 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 72 E 8.18 4.95 0.00 1.79 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 2.28 2.00 0.00 73 K 7.66 4.75 0.00 1.41 1.23 0.00 1.18 0.00 0.00 1.24 0.00 0.00 2.88 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.45 1.39 7.81 74 K 9.58 4.78 0.00 1.08 0.85 0.00 1.27 0.00 0.00 1.45 0.00 0.00 2.72 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.14 1.26 7.81 75 A 8.63 4.69 1.03 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 76 D 8.76 5.25 0.00 2.93 2.65 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 77 P 0.00 4.48 0.00 1.91 1.93 0.00 3.69 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 1.63 2.12 0.00 78 I 7.57 3.98 1.88 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 1.41 0.81 0.92 0.00 0.00 79 N 7.58 5.05 0.00 2.86 2.63 0.00 0.00 6.50 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 80 E 8.23 3.72 0.00 1.89 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 2.37 2.34 0.00 81 Q 7.94 4.03 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.78 0.00 0.00 0.00 0.00 0.00 2.35 2.29 0.00 82 A 8.22 4.15 1.19 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 0.00 0.00 0.00 83 C 7.30 3.97 0.00 2.72 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 84 I 7.73 3.61 1.72 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.03 0.76 0.00 0.00 85 F 7.32 3.98 0.00 3.27 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 86 C 7.95 4.13 0.00 3.12 3.19 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 0.00 87 M 7.89 3.39 0.00 2.37 2.32 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.91 0.00 88 A 7.69 4.02 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 89 C 8.12 4.02 0.00 3.11 3.30 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 90 V 7.11 3.58 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 0.93 0.00 0.00 1.00 0.00 0.00 91 N 7.80 4.61 0.00 2.72 2.85 0.00 0.00 6.96 7.36 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 92 V 7.52 4.12 2.05 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 0.72 0.00 0.00 0.99 0.00 0.00 93 C 7.86 4.22 0.00 2.89 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 94 P 0.00 4.41 0.00 2.22 2.16 0.00 3.74 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 1.99 2.28 0.00 95 V 7.63 4.18 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 96 A 7.63 3.66 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 97 A 7.66 4.57 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 98 I 7.62 5.01 1.90 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 1.22 0.66 1.11 0.00 0.00 99 D 9.18 4.91 0.00 2.78 2.52 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 0.00 0.00 0.00 0.00 0.00 100 V 8.60 5.04 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 0.87 0.00 0.00 1.16 0.00 0.00 101 K 9.47 4.52 0.00 1.73 1.62 0.00 1.61 0.00 0.00 1.58 0.00 0.00 2.76 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.26 1.34 7.81 102 P 0.00 3.98 0.00 1.74 1.20 0.00 3.57 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.22 0.00 103 P 0.00 4.42 0.00 2.19 2.09 0.00 3.59 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.08 0.00