NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4581 8.3349 116.8001 59.0114 64.0628 173.2085 2 M 4.1356 8.3762 123.9095 54.7432 31.9680 175.0163 3 Q 4.6049 8.5864 119.5843 55.8294 28.4313 174.3713 4 S 4.7684 7.7414 119.3783 58.6501 70.0800 177.0058 5 L 4.1496 6.9614 120.9715 57.0210 41.3998 179.3674 6 K 3.8177 7.6721 118.7862 59.5172 32.5517 179.6000 7 S 3.2446 7.5823 115.2959 61.4596 62.7394 176.6798 8 T 3.6100 6.8600 110.8080 64.5236 68.0778 176.2892 9 A 3.8238 7.0694 122.6481 54.7716 18.6162 179.2613 10 K 3.7525 7.5423 117.0492 59.7472 31.8756 179.6223 11 W 4.2202 7.1401 117.8123 59.2271 29.1048 177.7577 12 A 4.4234 7.8123 117.8290 52.5365 18.3639 178.8872 13 A 4.1112 7.6821 119.9389 53.6755 19.3908 178.0329 14 S 4.6514 7.2781 111.8131 55.8913 67.2281 175.4029 15 L 3.9196 8.6707 125.4356 58.0049 41.8059 179.0801 16 E 3.9712 8.1936 119.1114 59.2537 29.7080 178.1258 17 N 4.3405 7.9901 116.1681 56.2898 38.4040 176.9799 18 L 3.9452 7.8101 119.7166 58.1724 42.3359 178.2259 19 L 4.1737 7.7268 115.2900 55.0850 41.5830 177.1946 20 E 4.5596 7.6152 118.9148 56.8723 31.2658 176.1348 21 D 4.5546 8.2933 119.9211 53.0533 42.2724 174.2966 22 P 4.2518 0.0000 0.0000 66.5856 31.0893 178.3181 23 E 4.1111 8.4669 118.4711 58.5650 29.2551 179.3309 24 G 2.3814 8.4570 105.8275 47.5701 0.0000 175.9077 25 V 3.6056 7.6724 121.4282 65.7336 31.4662 177.5751 26 K 4.0899 8.3782 119.2221 59.2825 31.7454 179.3982 27 R 3.9963 8.6340 118.7498 59.2803 30.2242 179.1877 28 F 4.3812 8.2262 120.9420 61.0456 39.2484 177.1781 29 R 3.5876 7.8412 117.8958 59.5213 29.8750 178.1386 30 E 3.9013 8.1420 118.3294 59.7783 29.4420 178.8484 31 F 4.0014 8.0973 120.1669 61.4556 39.4356 177.0864 32 L 3.8484 7.9402 117.9363 57.4065 41.5584 179.6294 33 K 3.8433 8.5469 119.9918 59.6582 32.0144 179.0146 34 K 4.0834 7.9636 116.7214 58.3003 32.1257 178.0136 35 E 4.1063 7.6431 117.5838 54.7896 31.1284 174.4029 36 F 3.8314 8.1633 119.6145 59.0738 37.4211 175.2842 37 S 4.3496 8.6728 114.8628 57.8176 65.8160 176.6526 38 E 3.9414 8.1769 124.1537 59.0003 29.2365 178.2904 39 E 4.1760 8.0415 118.6348 59.4662 29.3766 178.3950 40 N 4.3320 8.0445 117.1597 56.7256 39.0074 177.2443 41 V 3.7696 7.6534 119.9194 65.0452 31.4975 178.1301 42 L 3.9796 8.2179 120.0416 56.9329 41.2773 179.1441 43 F 3.3123 7.5736 120.7352 60.7271 39.2732 176.9409 44 W 3.7655 7.9395 127.7053 60.3855 30.4671 177.6800 45 L 4.0697 7.9739 118.4579 57.8802 41.1313 179.5008 46 A 3.9508 8.2203 121.0745 55.3553 18.4174 179.5555 47 C 4.0126 7.8164 113.2374 61.0075 29.5630 175.7614 48 E 3.6983 7.6581 123.3784 58.3822 29.0679 178.2114 49 D 4.2600 8.2063 118.4808 57.1993 41.0516 177.8799 50 F 4.0820 8.5110 120.8045 61.1270 39.3689 176.7456 51 K 3.9936 7.8419 118.6236 59.0016 32.0197 178.7438 52 K 4.1266 7.6453 118.3416 57.8725 32.6838 177.2941 53 M 4.7376 7.6655 114.4116 52.8529 34.2730 174.1561 54 Q 4.7749 7.8283 125.4076 54.9880 31.5936 173.2507 55 D 4.5887 7.7464 123.2779 53.5865 43.5013 176.9140 56 K 3.8664 8.5559 122.0578 59.9163 32.0559 179.4586 57 T 3.8426 7.8355 108.5319 65.1032 68.7187 176.0964 58 Q 3.9999 8.1280 120.9802 58.7682 28.7143 178.5450 59 M 4.0968 8.6012 119.1409 58.9575 32.1838 178.2861 60 Q 4.1254 8.1613 117.9154 59.2422 29.0778 178.7592 61 E 4.1102 8.4570 119.3573 59.0438 29.3509 179.3574 62 K 4.1173 8.6958 118.8134 58.5644 32.2969 179.2345 63 A 3.2134 8.3938 122.1354 54.9139 18.3751 179.8764 64 K 4.2267 8.0308 116.9084 59.8902 32.6351 178.7710 65 E 3.8668 8.0016 120.5477 59.2723 29.5984 178.8445 66 I 3.8464 7.9153 114.5944 63.4941 37.4926 177.5327 67 Y 4.3273 7.9859 120.7976 60.9948 38.5271 177.8123 68 M 3.7390 8.2384 118.2315 58.1354 32.4100 177.7896 69 T 3.8861 7.8171 110.0609 63.8942 69.2676 176.5244 70 F 4.6405 7.8851 119.7820 57.5998 39.7143 176.4756 71 L 4.2015 7.9999 115.3017 51.4009 43.4131 180.4637 72 S 2.7900 5.8100 122.2039 58.5744 63.4494 171.3416 73 S 4.7024 8.3150 112.5362 60.2026 63.3219 174.4939 74 K 4.3075 7.3596 117.7826 57.3684 35.1387 177.9446 75 A 3.7938 8.5879 118.1662 52.8738 16.0572 177.1624 76 S 3.7495 8.2760 109.3264 59.7849 61.4855 172.4115 77 S 4.4850 7.7181 122.5890 55.6238 66.0436 174.0437 78 Q 4.0225 7.4953 126.3793 53.5003 30.1202 173.4468 79 V 3.9474 7.9989 122.8327 61.1320 32.4498 177.2280 80 N 4.7220 8.4257 121.0239 52.6944 34.9292 174.0990 81 V 4.2930 7.1979 117.6514 60.6958 35.8763 173.7145 82 E 4.0036 8.9018 121.9990 58.0053 29.3155 175.1496 83 G 4.1230 8.8571 118.4479 47.4229 0.0000 174.0345 84 Q 3.7646 7.7938 119.4427 58.7602 29.3230 178.3394 85 S 4.7576 7.8948 111.7499 58.1627 63.6910 174.0595 86 R 4.4028 7.8460 120.4096 55.2878 30.9980 173.3075 87 L 3.4292 8.2874 119.4086 51.0225 40.6816 172.8493 88 N 4.5221 7.7393 119.1953 52.7143 39.6284 175.5879 89 E 4.0411 8.7811 119.3659 59.6918 29.1811 179.8350 90 K 4.4094 8.0434 118.6730 58.5684 32.3609 178.0721 91 I 4.0444 7.8611 118.0340 62.5827 37.9680 177.0127 92 L 4.2792 7.5418 118.0228 56.1703 41.8065 177.9709 93 E 4.3355 8.0662 118.4765 57.0681 30.6969 176.1662 94 E 5.0170 7.9258 117.1630 54.3047 29.9239 173.2545 95 P 4.6962 0.0000 0.0000 63.1080 33.4177 175.7571 96 H 5.0511 8.3851 115.7717 52.6142 33.0340 172.6050 97 P 4.6288 0.0000 0.0000 66.5602 30.9467 178.8681 98 L 4.9325 8.2516 120.0742 56.0032 41.4883 179.0382 99 M 4.0800 8.0292 117.5060 58.0709 31.1204 178.3451 100 F 4.2176 8.6005 118.7600 59.8826 39.2386 177.7021 101 Q 4.2962 7.9785 117.7131 58.0784 28.4699 178.6948 102 K 3.9463 7.6475 120.8489 59.6352 32.3631 178.8922 103 L 4.2382 7.9673 118.5962 57.3685 41.2834 179.2091 104 Q 4.0426 8.5977 120.4139 59.3666 29.1857 177.6379 105 D 4.5581 8.4266 119.2550 57.2645 41.1910 177.9368 106 Q 4.0237 8.1464 119.6854 59.4450 29.2389 178.2693 107 I 3.9253 8.6569 119.7842 63.7142 37.9958 177.6209 108 F 4.1294 8.9470 122.4991 61.1220 39.3421 176.6107 109 N 4.2931 8.3950 116.4512 56.7977 38.9125 176.6810 110 L 4.0895 8.1616 121.7390 58.1709 42.0080 178.6487 111 M 4.0336 8.4274 118.6886 58.4084 32.0969 177.8739 112 K 3.8526 7.7109 119.7276 60.1097 32.2031 177.5101 113 Y 4.0733 7.8685 119.1016 61.0315 38.6519 177.6037 114 D 4.1828 9.1718 118.7525 57.6542 41.6579 178.7720 115 S 4.3768 8.5132 115.8595 61.6833 62.8062 176.5532 116 Y 3.8895 8.0399 119.7582 61.1744 37.5064 178.4245 117 S 4.3541 7.7677 113.5490 60.3885 63.0641 176.3478 118 R 4.3668 7.8457 121.5182 58.6134 29.9423 178.4460 119 F 2.6594 8.5303 121.1350 60.6604 39.4729 176.3511 120 L 4.2881 8.2357 117.9765 54.9335 41.8142 177.5800 121 K 4.1029 7.9967 121.0238 58.7189 32.6235 177.6953 122 S 4.5520 7.4622 114.2411 55.7695 62.2969 171.7416 123 D 3.6962 7.5695 120.0259 53.7542 40.7576 177.1982 124 L 4.4798 7.5652 123.1959 55.1357 41.3622 178.9845 125 F 4.4084 7.7318 119.0210 59.2789 39.1619 175.3900 126 L 4.7889 7.3327 121.1786 52.8268 41.8421 177.6953 127 K 4.6194 8.3812 120.2035 58.4129 32.4004 178.4631 128 H 4.1602 8.2325 114.4207 56.9775 29.2061 175.3812 129 K 4.2859 7.9222 116.5485 57.7198 34.0919 176.4776 130 R 4.1625 8.1993 122.6888 55.5392 29.6349 175.8889 131 T 4.2351 8.4095 123.2826 63.7048 66.8948 172.9738 132 E 4.2794 8.2589 123.1247 57.3507 30.7926 174.7912 133 E 3.9037 7.7391 117.9762 57.1558 29.5414 174.0005 134 E 4.1485 7.7830 119.6630 56.4852 30.6179 176.8206 135 E 4.4906 8.3046 120.5599 55.4263 31.2016 176.9012 136 E 3.9607 8.8334 120.1311 58.5306 29.9413 181.5757 137 D 4.0778 7.7524 113.5391 54.2626 42.9693 173.1063 138 L 4.3744 6.4652 121.8657 54.9151 42.2230 176.5027 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 S 8.33 4.46 0.00 3.92 3.94 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 2 M 8.38 4.14 0.00 1.98 2.08 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 2.58 2.57 0.00 3 Q 8.59 4.60 0.00 2.16 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.84 0.00 0.00 0.00 0.00 0.00 2.66 2.50 0.00 4 S 7.74 4.77 0.00 3.83 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 5 L 6.96 4.15 0.00 1.63 1.47 0.88 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 6 K 7.67 3.82 0.00 1.64 1.69 0.00 1.60 0.00 0.00 1.73 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.43 7.81 7 S 7.58 3.24 0.00 3.38 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 8 T 6.86 3.61 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 1.07 0.00 0.00 9 A 7.07 3.82 1.14 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 0.00 0.00 10 K 7.54 3.75 0.00 1.04 1.50 0.00 1.21 0.00 0.00 1.44 0.00 0.00 2.75 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.23 1.30 7.81 11 W 7.14 4.22 0.00 3.17 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 12 A 7.81 4.42 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 13 A 7.68 4.11 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 14 S 7.28 4.65 0.00 3.87 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 15 L 8.67 3.92 0.00 1.68 1.38 0.54 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 16 E 8.19 3.97 0.00 2.21 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 0.00 2.44 2.49 0.00 17 N 7.99 4.34 0.00 3.07 2.89 0.00 0.00 7.03 7.79 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 18 L 7.81 3.95 0.00 1.40 1.55 -0.40 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 19 L 7.73 4.17 0.00 1.35 1.21 -0.56 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 20 E 7.62 4.56 0.00 2.13 2.17 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 2.28 2.33 0.00 21 D 8.29 4.55 0.00 2.93 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 22 P 0.00 4.25 0.00 2.35 2.36 0.00 3.84 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.13 0.00 23 E 8.47 4.11 0.00 2.49 2.32 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 2.50 2.46 0.00 24 G 8.46 2.38 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 0.00 25 V 7.67 3.61 2.21 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 1.18 0.00 0.00 1.04 0.00 0.00 26 K 8.38 4.09 0.00 1.94 1.76 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.68 1.65 7.81 27 R 8.63 4.00 0.00 1.63 2.04 0.00 3.34 0.00 0.00 3.27 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.76 0.00 28 F 8.23 4.38 0.00 2.48 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 29 R 7.84 3.59 0.00 2.06 2.08 0.00 3.31 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 30 E 8.14 3.90 0.00 2.08 2.02 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 2.52 2.51 0.00 31 F 8.10 4.00 0.00 3.10 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 32 L 7.94 3.85 0.00 1.46 1.56 0.69 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.55 3.84 0.00 1.90 1.93 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.61 7.81 34 K 7.96 4.08 0.00 1.60 1.76 0.00 1.72 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.59 7.81 35 E 7.64 4.11 0.00 1.48 1.64 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 2.18 2.14 0.00 36 F 8.16 3.83 0.00 3.08 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 37 S 8.67 4.35 0.00 3.74 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 38 E 8.18 3.94 0.00 2.00 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 2.41 2.39 0.00 39 E 8.04 4.18 0.00 2.03 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 0.00 2.31 2.45 0.00 40 N 8.04 4.33 0.00 2.85 3.04 0.00 0.00 7.05 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 41 V 7.65 3.77 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 0.75 0.00 0.00 1.07 0.00 0.00 42 L 8.22 3.98 0.00 1.60 1.63 1.09 1.04 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 43 F 7.57 3.31 0.00 2.78 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 44 W 7.94 3.77 0.00 3.45 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 45 L 7.97 4.07 0.00 1.89 1.78 1.01 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 46 A 8.22 3.95 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 47 C 7.82 4.01 0.00 2.82 2.51 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 48 E 7.66 3.70 0.00 1.16 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 1.72 1.94 0.00 49 D 8.21 4.26 0.00 2.87 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 50 F 8.51 4.08 0.00 2.93 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.84 3.99 0.00 1.98 1.89 0.00 2.05 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.54 7.81 52 K 7.65 4.13 0.00 1.87 1.80 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.41 1.66 7.81 53 M 7.67 4.74 0.00 1.97 1.93 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.49 0.00 54 Q 7.83 4.77 0.00 1.83 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.10 0.00 0.00 0.00 0.00 0.00 2.03 2.16 0.00 55 D 7.75 4.59 0.00 2.81 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.56 3.87 0.00 1.79 1.83 0.00 1.71 0.00 0.00 1.85 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.44 7.81 57 T 7.84 3.84 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 58 Q 8.13 4.00 0.00 2.23 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.91 0.00 0.00 0.00 0.00 0.00 2.46 2.38 0.00 59 M 8.60 4.10 0.00 2.11 2.00 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 1.63 2.54 0.00 60 Q 8.16 4.13 0.00 2.36 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.58 0.00 0.00 0.00 0.00 0.00 2.42 2.67 0.00 61 E 8.46 4.11 0.00 2.15 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 2.62 2.52 0.00 62 K 8.70 4.12 0.00 2.25 1.97 0.00 1.77 0.00 0.00 1.79 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.75 1.96 7.81 63 A 8.39 3.21 1.74 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 64 K 8.03 4.23 0.00 2.10 2.19 0.00 1.38 0.00 0.00 1.78 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.65 1.49 7.81 65 E 8.00 3.87 0.00 2.28 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 2.20 2.26 0.00 66 I 7.92 3.85 2.20 0.00 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.44 0.93 0.00 0.00 67 Y 7.99 4.33 0.00 3.39 3.33 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 68 M 8.24 3.74 0.00 1.96 2.08 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.43 0.00 69 T 7.82 3.89 3.47 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 0.00 0.00 0.00 1.00 0.00 0.00 70 F 7.89 4.64 0.00 3.14 2.93 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 71 L 8.00 4.20 0.00 1.72 1.46 1.03 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 72 S 5.81 2.79 0.00 3.73 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 73 S 8.32 4.70 0.00 3.86 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 74 K 7.36 4.31 0.00 1.71 1.72 0.00 1.80 0.00 0.00 1.81 0.00 0.00 2.88 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.39 7.81 75 A 8.59 3.79 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 76 S 8.28 3.75 0.00 4.21 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 77 S 7.72 4.49 0.00 3.92 4.14 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 78 Q 7.50 4.02 0.00 2.45 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 7.24 0.00 0.00 0.00 0.00 0.00 2.26 2.36 0.00 79 V 8.00 3.95 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 0.81 0.00 0.00 0.96 0.00 0.00 80 N 8.43 4.72 0.00 2.86 2.92 0.00 0.00 5.91 7.71 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 81 V 7.20 4.29 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 1.00 0.00 0.00 82 E 8.90 4.00 0.00 1.95 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 2.32 2.33 0.00 83 G 8.86 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 84 Q 7.79 3.76 0.00 2.02 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 7.47 0.00 0.00 0.00 0.00 0.00 2.36 2.52 0.00 85 S 7.89 4.76 0.00 3.88 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 86 R 7.85 4.40 0.00 1.77 1.86 0.00 3.44 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.59 0.00 87 L 8.29 3.43 0.00 1.27 0.88 0.84 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 88 N 7.74 4.52 0.00 2.91 2.85 0.00 0.00 7.21 8.70 0.00 0.00 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 E 8.78 4.04 0.00 2.05 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 0.00 2.53 2.54 0.00 90 K 8.04 4.41 0.00 1.71 1.88 0.00 1.79 0.00 0.00 2.23 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.38 7.81 91 I 7.86 4.04 1.78 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 1.43 1.33 0.82 0.00 0.00 92 L 7.54 4.28 0.00 1.88 1.77 1.08 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 93 E 8.07 4.34 0.00 2.14 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 0.00 2.41 2.65 0.00 94 E 7.93 5.02 0.00 2.05 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 2.20 2.25 0.00 95 P 0.00 4.70 0.00 2.44 2.20 0.00 3.83 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.19 0.00 96 H 8.39 5.05 0.00 3.18 3.20 0.00 5.63 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 P 0.00 4.63 0.00 2.20 1.99 0.00 3.78 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.98 0.00 98 L 8.25 4.93 0.00 1.73 1.78 0.91 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 99 M 8.03 4.08 0.00 2.28 2.21 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 100 F 8.60 4.22 0.00 3.31 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 0.00 101 Q 7.98 4.30 0.00 2.33 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 7.02 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 102 K 7.65 3.95 0.00 1.96 1.95 0.00 1.62 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.49 7.81 103 L 7.97 4.24 0.00 2.16 2.07 1.00 0.86 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 0.00 104 Q 8.60 4.04 0.00 2.13 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.96 6.70 0.00 0.00 0.00 0.00 0.00 2.31 1.91 0.00 105 D 8.43 4.56 0.00 2.92 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 0.00 106 Q 8.15 4.02 0.00 2.39 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.66 0.00 0.00 0.00 0.00 0.00 2.43 2.59 0.00 107 I 8.66 3.93 2.31 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.01 1.44 0.00 0.00 108 F 8.95 4.13 0.00 3.59 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 0.00 109 N 8.39 4.29 0.00 3.05 3.10 0.00 0.00 6.89 6.28 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 0.00 110 L 8.16 4.09 0.00 1.94 1.90 1.03 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 0.00 111 M 8.43 4.03 0.00 1.96 2.25 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.50 0.00 112 K 7.71 3.85 0.00 1.53 1.78 0.00 1.47 0.00 0.00 1.41 0.00 0.00 2.59 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.98 0.71 7.81 113 Y 7.87 4.07 0.00 3.10 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 0.00 114 D 9.17 4.18 0.00 2.96 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 0.00 115 S 8.51 4.38 0.00 4.21 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 0.00 116 Y 8.04 3.89 0.00 3.12 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.77 4.35 0.00 3.80 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 0.00 118 R 7.85 4.37 0.00 2.31 2.44 0.00 3.28 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 1.72 1.95 0.00 119 F 8.53 2.66 0.00 2.91 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 0.00 120 L 8.24 4.29 0.00 1.75 1.70 1.14 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 121 K 8.00 4.10 0.00 2.00 2.09 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.31 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.45 1.41 7.81 122 S 7.46 4.55 0.00 4.27 3.85 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 0.00 123 D 7.57 3.70 0.00 2.30 1.54 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 0.00 0.00 0.00 0.00 124 L 7.57 4.48 0.00 1.58 1.70 1.02 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 125 F 7.73 4.41 0.00 2.89 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 0.00 126 L 7.33 4.79 0.00 1.69 1.56 0.95 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 127 K 8.38 4.62 0.00 1.90 1.91 0.00 1.98 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.58 1.47 7.81 128 H 8.23 4.16 0.00 3.11 3.34 0.00 5.67 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 K 7.92 4.29 0.00 1.83 1.81 0.00 1.90 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.38 7.81 130 R 8.20 4.16 0.00 1.91 2.12 0.00 3.36 0.00 0.00 3.24 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.85 0.00 131 T 8.41 4.24 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 1.22 0.00 0.00 132 E 8.26 4.28 0.00 1.96 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 0.00 2.25 2.24 0.00 133 E 7.74 3.90 0.00 2.14 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 2.19 2.31 0.00 134 E 7.78 4.15 0.00 2.01 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 2.29 0.00 135 E 8.30 4.49 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 2.29 2.40 0.00 136 E 8.83 3.96 0.00 2.04 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 2.41 2.31 0.00 137 D 7.75 4.08 0.00 2.69 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 L 6.47 4.37 0.00 1.62 1.50 0.92 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00