NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2738 8.1733 120.1294 56.8303 34.7652 173.9501 2 S 5.0273 8.3553 117.7076 56.5158 64.4094 173.4136 3 F 4.5475 10.0720 125.8634 57.1911 40.2453 175.1690 4 E 4.1861 9.1659 121.1792 55.8503 30.7305 176.9991 5 R 3.4274 9.0913 121.1036 60.8841 29.8951 179.4872 6 C 4.3074 8.0333 115.3320 59.5946 41.0190 175.7352 7 E 3.9012 8.1164 120.7417 59.2718 29.3587 178.4762 8 L 3.4645 8.1169 120.2695 57.7976 42.0618 178.5456 9 A 3.9113 7.9137 120.7367 55.5182 18.2503 179.9529 10 R 3.9294 8.1738 116.4411 59.4584 30.0052 179.4620 11 T 3.8380 7.8712 115.7128 66.6573 68.4377 176.7368 12 L 3.8685 8.3109 121.2411 57.3551 41.5448 179.4930 13 K 3.9050 8.0726 119.6554 59.6979 31.9984 179.1885 14 R 3.9655 7.9888 117.0235 58.7961 29.9777 178.0471 15 L 4.3890 7.3426 116.2198 54.2264 41.7149 177.0595 16 G 3.8740 7.9501 106.9641 46.7714 0.0000 174.9667 17 M 3.9877 7.8635 120.8298 56.1734 32.3826 175.5981 18 D 4.3255 7.9946 117.4604 56.1543 40.5740 175.5769 19 G 3.9467 9.5142 115.4781 45.2629 0.0000 170.9685 20 Y 4.1356 8.2703 121.8993 58.8521 39.0030 176.4921 21 R 3.6151 8.9148 126.7354 57.2668 27.8548 177.1798 22 G 3.8090 8.2170 102.9821 45.7806 0.0000 173.9689 23 I 4.0791 7.5660 122.0240 59.0864 38.0668 175.8958 24 S 4.6047 8.3029 120.3022 57.6726 63.9243 174.8470 25 L 4.2325 8.5539 122.3250 58.6359 41.7112 179.3509 26 A 4.1462 8.1597 120.0983 55.3490 18.2711 179.2509 27 N 4.4573 8.1800 115.0600 56.2426 38.5737 177.7434 28 W 4.2978 8.0212 119.9526 59.9113 29.1097 178.3267 29 M 4.1287 8.5967 119.0609 58.6836 31.4759 177.9087 30 C 3.1860 8.0054 118.5245 59.1367 44.7803 175.3906 31 L 3.9566 8.2131 121.6652 58.2507 41.7906 178.7611 32 A 4.2028 8.3769 120.8156 55.0044 18.2725 179.3056 33 K 2.9520 8.3885 118.3210 59.4913 32.0639 179.0838 34 W 4.1519 7.8265 117.1682 58.9641 29.0719 178.2504 35 E 4.3949 8.2298 118.6741 58.5129 29.3653 177.6303 36 S 4.5019 7.9567 108.9220 56.8400 65.0022 174.4248 37 G 3.4453 8.3900 108.7740 46.9961 0.0000 173.4932 38 Y 3.7111 7.7566 113.6297 58.6679 34.9816 168.2853 39 N 5.3744 7.6273 119.1642 51.9019 40.4597 175.7583 40 T 4.0870 8.9372 116.5117 63.9938 69.1524 175.8881 41 R 4.4413 7.8361 118.7752 55.8005 31.0180 176.1395 42 A 4.2998 7.5670 120.9340 52.6497 19.2469 176.9257 43 T 5.1050 8.3440 111.1346 60.0718 72.4737 173.0405 44 N 4.8762 8.7858 121.6695 52.2700 42.2507 172.3409 45 Y 4.7643 8.7791 128.1318 57.1656 40.1928 174.4523 46 N 4.4901 8.5979 125.0102 51.3168 38.9960 175.4910 47 A 3.5805 8.2674 128.0594 54.8668 18.9468 179.0370 48 G 3.7435 8.1385 104.0387 48.5130 0.0000 174.0524 49 D 4.7292 7.8900 117.6670 51.7144 40.0183 176.3152 50 R 4.0753 7.6024 117.3283 57.7383 28.3654 175.7697 51 S 5.0074 7.2846 110.9602 57.0793 66.5586 172.6973 52 T 5.1471 8.7867 115.4723 62.0280 72.8849 172.9190 53 D 5.3740 8.9550 125.6756 53.3524 42.9318 175.0907 54 Y 5.0081 9.3504 121.2709 57.3656 41.5580 177.7089 55 G 4.4236 8.7987 111.3283 45.6481 0.0000 173.5648 56 I 3.9526 8.3045 116.9464 62.9306 37.8673 177.5121 57 F 4.7447 7.9033 115.3510 56.4092 39.8877 175.1335 58 Q 3.6497 7.9672 119.1895 57.1272 26.7407 174.2591 59 I 4.3266 8.0952 118.6956 61.3753 39.1642 176.6759 60 N 5.4601 9.2074 125.4765 53.0528 39.8539 175.8459 61 S 4.6244 9.2103 120.8384 60.4410 63.3190 175.4993 62 R 3.7466 8.7724 122.2610 58.7136 30.2737 177.8166 63 Y 4.3306 7.7003 114.2044 57.4283 40.7074 176.7965 64 W 4.9355 8.1965 119.0119 57.5959 31.5881 173.9999 65 C 5.6196 8.1021 112.2446 53.7317 46.1397 172.3914 66 N 4.9376 9.0425 119.4768 52.1050 40.0035 174.7924 67 D 4.8342 8.7232 123.6913 52.1686 40.4458 177.1415 68 G 3.9622 8.5198 107.4241 46.1652 0.0000 174.4684 69 K 4.4759 8.1352 116.3052 56.5304 33.2278 175.7816 70 T 4.6611 7.6206 117.0128 60.6013 69.3153 172.3693 71 P 4.1960 0.0000 0.0000 63.9929 31.6988 176.1990 72 G 3.8966 8.8350 109.8390 46.2628 0.0000 173.2670 73 A 4.2277 7.3904 121.4268 51.4327 19.0745 177.4484 74 V 4.4914 8.1180 112.8630 59.7508 35.5464 176.2870 75 N 4.8956 7.9853 115.3901 51.9362 38.4691 174.3727 76 A 3.9555 8.6773 124.0770 54.8908 19.0811 178.4156 77 C 4.5900 8.4819 111.2434 57.1913 41.1796 173.0344 78 H 4.0804 8.0174 116.4263 56.7162 26.3152 174.3914 79 L 4.8416 8.2859 117.6170 52.7686 46.2482 176.7590 80 S 4.6058 8.3911 115.9324 58.0227 63.2545 175.9352 81 C 3.9676 8.7590 124.7920 59.6397 40.1787 176.3947 82 S 3.9254 7.7548 114.7327 61.2447 61.6835 175.8860 83 A 4.1202 7.9789 122.6668 54.3886 18.1816 177.9266 84 L 4.4588 7.7807 116.4425 55.0608 41.8052 177.5809 85 L 5.0770 7.9124 117.3008 54.5313 42.4287 176.6459 86 Q 4.3954 7.8315 117.5135 55.2455 29.6814 175.9653 87 D 4.3712 8.5785 120.4602 57.2082 41.1135 176.7048 88 N 4.5682 8.0219 118.2311 53.2191 39.0750 174.5260 89 I 4.2533 8.4715 119.1229 61.0241 38.0063 176.9802 90 A 3.9409 8.2552 124.7819 56.0264 18.1945 180.1885 91 D 4.2901 8.0786 116.4352 57.4429 40.9008 178.6671 92 A 4.1114 8.0070 120.8498 55.1288 18.3198 179.7592 93 V 3.3655 8.2258 116.9171 66.0576 31.6199 178.0801 94 A 3.8303 7.9840 120.5375 55.3089 18.0565 178.8454 95 C 4.2314 8.3379 116.7725 59.6320 40.3376 175.6160 96 A 3.9016 8.1472 122.6718 55.0207 17.6092 179.7250 97 K 3.6876 7.7795 116.5109 59.4125 32.3926 179.1775 98 R 4.0703 7.8022 118.9908 59.3427 30.1376 178.5775 99 V 2.4533 7.5772 118.1790 65.7945 30.9184 177.9354 100 V 3.9284 7.7537 109.9048 62.5735 31.3740 177.7172 101 R 4.2871 7.6665 117.1420 56.5203 30.6348 176.1703 102 D 4.7625 7.5252 119.5463 52.5322 42.1535 175.4944 103 P 4.2350 0.0000 0.0000 66.1749 30.9338 178.4869 104 Q 4.0266 8.1382 116.1528 56.7726 29.9831 177.6213 105 G 3.9117 7.7210 106.5040 47.0042 0.0000 176.5731 106 I 3.5489 7.7656 121.4332 63.2819 37.8845 177.6094 107 R 4.2148 7.2614 117.2266 57.6277 29.9787 177.3621 108 A 4.1157 7.5618 120.7333 53.5098 18.6414 177.6457 109 W 4.7796 8.0449 116.7322 55.3476 29.7545 177.4398 110 V 3.7531 8.7456 123.8473 66.0025 30.9292 177.6508 111 A 4.0388 8.2774 120.2533 54.7312 18.1996 179.2327 112 W 3.9764 8.4448 126.8742 60.6567 30.5997 178.3823 113 R 3.7709 8.2861 116.3390 59.3091 29.6370 178.4403 114 N 4.3277 8.2592 115.2467 56.0327 38.7546 177.0470 115 R 3.9701 7.9334 116.2830 56.2092 31.1145 176.4095 116 C 4.5202 7.7393 115.4622 57.6563 42.7238 174.4385 117 Q 3.2493 6.5391 119.3772 57.1719 28.7101 175.3238 118 N 4.1993 8.6298 121.0902 54.3916 36.2999 173.9431 119 R 4.5485 7.3266 114.0824 53.9439 33.6582 175.3948 120 D 4.4988 8.5667 119.3721 54.5108 40.7642 176.1139 121 V 4.6353 8.2681 119.1171 61.1119 32.7173 177.9339 122 R 4.0196 8.0268 121.1669 59.4269 29.8316 178.7488 123 Q 3.9988 8.2494 115.1887 59.3919 28.3251 178.5530 124 Y 3.9302 7.9690 115.3634 60.0055 38.2012 176.7372 125 V 4.4079 7.9211 111.0225 60.7064 32.8990 175.4823 126 Q 4.1601 7.5627 120.3995 57.1538 28.8112 176.8458 127 G 3.9330 8.8578 109.8661 46.2678 0.0000 174.6534 128 C 4.4519 8.0536 115.9033 56.5862 40.6917 174.0626 129 G 3.8272 8.1628 107.1619 46.8009 0.0000 174.0690 130 V 4.0077 7.8797 118.0124 61.0785 32.0544 175.8814 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 K 8.17 4.27 0.00 1.63 2.01 0.00 1.08 0.00 0.00 1.39 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.24 1.17 7.81 2 S 8.36 5.03 0.00 3.83 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 3 F 10.07 4.55 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 4 E 9.17 4.19 0.00 1.94 1.88 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 2.32 2.40 0.00 5 R 9.09 3.43 0.00 2.00 1.94 0.00 3.39 0.00 0.00 3.46 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.85 0.00 6 C 8.03 4.31 0.00 3.01 3.12 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 7 E 8.12 3.90 0.00 2.07 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 0.00 2.59 2.43 0.00 8 L 8.12 3.46 0.00 1.28 1.32 -0.13 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.91 3.91 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 10 R 8.17 3.93 0.00 1.86 1.99 0.00 3.14 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.78 0.00 11 T 7.87 3.84 4.18 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 1.17 0.00 0.00 12 L 8.31 3.87 0.00 1.68 1.56 0.92 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.07 3.91 0.00 1.93 1.92 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.44 1.50 7.81 14 R 7.99 3.97 0.00 1.94 1.97 0.00 3.21 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.85 0.00 15 L 7.34 4.39 0.00 1.58 1.56 0.87 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.95 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 17 M 7.86 3.99 0.00 1.33 1.98 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.21 0.00 18 D 7.99 4.33 0.00 2.69 2.69 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 19 G 9.51 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 20 Y 8.27 4.14 0.00 3.41 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 21 R 8.91 3.62 0.00 1.90 1.84 0.00 3.39 0.00 0.00 3.02 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 1.47 0.00 22 G 8.22 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 23 I 7.57 4.08 1.68 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.67 -0.33 0.00 0.00 24 S 8.30 4.60 0.00 4.06 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 25 L 8.55 4.23 0.00 2.11 1.82 0.99 1.36 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 26 A 8.16 4.15 1.51 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 0.00 0.00 27 N 8.18 4.46 0.00 2.80 2.79 0.00 0.00 6.97 7.72 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 28 W 8.02 4.30 0.00 3.53 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 29 M 8.60 4.13 0.00 2.15 2.35 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.94 0.00 30 C 8.01 3.19 0.00 2.52 3.14 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 31 L 8.21 3.96 0.00 1.85 1.88 0.54 -0.47 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 32 A 8.38 4.20 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.39 2.95 0.00 1.79 1.74 0.00 0.63 0.00 0.00 0.61 0.00 0.00 2.82 0.00 0.00 2.48 0.00 0.00 0.00 0.00 1.33 0.55 7.81 34 W 7.83 4.15 0.00 3.37 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 35 E 8.23 4.39 0.00 2.05 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 0.00 2.57 2.55 0.00 36 S 7.96 4.50 0.00 4.06 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 37 G 8.39 3.45 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 0.00 0.00 0.00 38 Y 7.76 3.71 0.00 3.28 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 39 N 7.63 5.37 0.00 2.75 2.77 0.00 0.00 7.01 7.07 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 40 T 8.94 4.09 4.45 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 1.43 0.00 0.00 41 R 7.84 4.44 0.00 1.84 2.03 0.00 3.23 0.00 0.00 3.23 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 42 A 7.57 4.30 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 43 T 8.34 5.11 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 1.23 0.00 0.00 44 N 8.79 4.88 0.00 2.85 2.86 0.00 0.00 6.87 7.47 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 45 Y 8.78 4.76 0.00 2.96 2.88 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 46 N 8.60 4.49 0.00 2.64 2.61 0.00 0.00 6.51 7.35 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 47 A 8.27 3.58 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 48 G 8.14 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 49 D 7.89 4.73 0.00 2.76 2.83 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 50 R 7.60 4.08 0.00 2.07 2.15 0.00 3.11 0.00 0.00 3.27 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.57 0.00 51 S 7.28 5.01 0.00 4.00 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 52 T 8.79 5.15 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 0.64 0.00 0.00 53 D 8.96 5.37 0.00 2.74 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Y 9.35 5.01 0.00 2.90 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 55 G 8.80 4.42 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 0.00 56 I 8.30 3.95 1.68 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 1.86 -0.02 0.00 0.00 57 F 7.90 4.74 0.00 3.21 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 58 Q 7.97 3.65 0.00 2.54 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.85 6.84 0.00 0.00 0.00 0.00 0.00 2.51 2.69 0.00 59 I 8.10 4.33 2.13 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.99 1.13 0.00 0.00 60 N 9.21 5.46 0.00 3.11 3.07 0.00 0.00 6.96 7.63 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 61 S 9.21 4.62 0.00 4.05 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 0.00 62 R 8.77 3.75 0.00 1.53 1.31 0.00 2.64 0.00 0.00 2.85 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.97 0.00 63 Y 7.70 4.33 0.00 1.57 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 0.00 0.00 0.00 64 W 8.20 4.94 0.00 3.52 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 65 C 8.10 5.62 0.00 3.10 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 66 N 9.04 4.94 0.00 2.83 2.69 0.00 0.00 7.04 8.91 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 67 D 8.72 4.83 0.00 2.84 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 68 G 8.52 3.96 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 0.00 0.00 0.00 69 K 8.14 4.48 0.00 1.88 1.89 0.00 1.60 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.62 1.44 7.81 70 T 7.62 4.66 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 71 P 0.00 4.20 0.00 2.02 2.00 0.00 3.83 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 72 G 8.84 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 73 A 7.39 4.23 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 74 V 8.12 4.49 1.99 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 0.65 0.00 0.00 0.87 0.00 0.00 75 N 7.99 4.90 0.00 2.68 2.55 0.00 0.00 6.78 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 76 A 8.68 3.96 1.22 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 0.00 0.00 77 C 8.48 4.59 0.00 3.33 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 78 H 8.02 4.08 0.00 3.30 3.38 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.29 4.84 0.00 1.68 1.50 0.96 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.39 4.61 0.00 3.83 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 81 C 8.76 3.97 0.00 2.26 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 82 S 7.75 3.93 0.00 3.83 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 83 A 7.98 4.12 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 84 L 7.78 4.46 0.00 1.92 1.82 1.05 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.91 5.08 0.00 1.78 1.70 1.12 0.89 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 86 Q 7.83 4.40 0.00 2.21 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.37 7.08 0.00 0.00 0.00 0.00 0.00 2.36 2.49 0.00 87 D 8.58 4.37 0.00 2.62 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 88 N 8.02 4.57 0.00 2.69 2.75 0.00 0.00 6.95 7.94 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 89 I 8.47 4.25 1.79 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.92 1.02 0.00 0.00 90 A 8.26 3.94 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 91 D 8.08 4.29 0.00 2.75 2.74 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 92 A 8.01 4.11 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.23 3.37 2.18 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 0.78 0.00 0.00 0.89 0.00 0.00 94 A 7.98 3.83 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 95 C 8.34 4.23 0.00 3.07 3.29 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 96 A 8.15 3.90 0.74 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 97 K 7.78 3.69 0.00 1.59 1.39 0.00 1.30 0.00 0.00 0.91 0.00 0.00 2.32 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.30 0.85 7.81 98 R 7.80 4.07 0.00 1.99 2.16 0.00 3.29 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.98 0.00 99 V 7.58 2.45 1.81 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 -0.35 0.00 0.00 -0.48 0.00 0.00 100 V 7.75 3.93 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 1.17 0.00 0.00 1.46 0.00 0.00 101 R 7.67 4.29 0.00 2.08 2.04 0.00 3.24 0.00 0.00 3.42 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 2.15 0.00 102 D 7.53 4.76 0.00 3.10 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 0.00 103 P 0.00 4.23 0.00 2.01 2.12 0.00 3.68 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.13 0.00 104 Q 8.14 4.03 0.00 2.03 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.81 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 105 G 7.72 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 0.00 106 I 7.77 3.55 1.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.59 0.00 0.00 107 R 7.26 4.21 0.00 2.02 2.03 0.00 3.23 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.49 0.00 108 A 7.56 4.12 0.74 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 0.00 109 W 8.04 4.78 0.00 3.53 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 V 8.75 3.75 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 1.19 0.00 0.00 1.01 0.00 0.00 111 A 8.28 4.04 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 0.00 112 W 8.44 3.98 0.00 3.48 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 0.00 113 R 8.29 3.77 0.00 2.07 2.01 0.00 3.35 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.04 0.00 114 N 8.26 4.33 0.00 2.66 2.69 0.00 0.00 7.01 7.56 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 0.00 115 R 7.93 3.97 0.00 1.12 0.74 0.00 2.21 0.00 0.00 2.32 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.93 0.00 116 C 7.74 4.52 0.00 1.59 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 0.00 117 Q 6.54 3.25 0.00 0.93 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.89 0.00 0.00 0.00 0.00 0.00 2.15 2.24 0.00 118 N 8.63 4.20 0.00 2.78 2.80 0.00 0.00 6.85 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 0.00 119 R 7.33 4.55 0.00 1.78 1.74 0.00 3.23 0.00 0.00 3.05 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.51 0.00 120 D 8.57 4.50 0.00 2.64 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 0.00 121 V 8.27 4.64 2.36 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 0.80 0.00 0.00 1.04 0.00 0.00 122 R 8.03 4.02 0.00 2.05 2.03 0.00 3.17 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 123 Q 8.25 4.00 0.00 2.03 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.13 6.91 0.00 0.00 0.00 0.00 0.00 2.21 1.55 0.00 124 Y 7.97 3.93 0.00 3.23 3.17 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 0.00 0.00 0.00 125 V 7.92 4.41 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 1.03 0.00 0.00 1.07 0.00 0.00 126 Q 7.56 4.16 0.00 1.97 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.01 0.00 0.00 0.00 0.00 0.00 2.55 2.46 0.00 127 G 8.86 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 0.00 0.00 0.00 128 C 8.05 4.45 0.00 3.06 3.15 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 0.00 129 G 8.16 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 0.00 130 V 7.88 4.01 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 0.79 0.00 0.00 0.96 0.00 0.00