NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3185 8.1627 120.6021 55.3421 33.9112 173.5531 2 L 4.7126 8.2563 128.6345 53.7926 43.3040 173.8119 3 Y 4.7860 9.9602 124.5847 56.4706 42.8500 173.9178 4 H 5.1787 8.9882 118.9444 54.2451 30.9140 173.7122 5 L 4.6260 8.5273 127.6457 53.7186 42.8795 175.7014 6 F 4.9387 9.1510 125.7208 56.4935 40.1394 176.3250 7 V 2.4654 8.3382 121.9575 62.0852 31.8796 175.4465 8 N 4.5457 8.2217 118.0687 52.6656 36.7995 172.9513 9 N 5.0236 7.6010 115.4095 53.7623 42.5951 171.9883 10 Q 5.0838 8.3798 115.5692 55.7357 31.9939 173.8092 11 V 4.5216 8.4789 111.9205 59.3348 35.4395 175.0783 12 K 4.4794 8.6705 126.5049 55.4273 32.8197 176.2744 13 L 4.0178 8.5677 128.7247 54.5939 41.6423 177.5448 14 Q 4.2035 9.8882 125.0117 58.4730 29.3608 176.0460 15 N 5.2096 7.8161 112.4417 50.7888 42.5137 173.5268 16 D 4.7105 8.6209 120.3745 54.7085 41.9486 176.0724 17 F 4.6578 9.7471 126.6991 57.8032 40.4066 174.1628 18 K 5.1486 7.9102 125.5265 54.2785 36.5860 173.3573 19 P 4.5407 0.0000 0.0000 64.9622 31.5642 175.9514 20 E 4.1600 9.3797 121.7577 56.2096 29.1213 175.3893 21 S 4.4457 7.8044 114.9002 58.6108 64.1587 173.7507 22 V 5.0359 9.0018 122.2900 61.1808 34.8839 173.8405 23 A 5.1291 9.7402 129.8193 50.3605 21.5451 175.0235 24 A 4.6546 9.2404 126.3452 50.9743 20.3850 175.3430 25 I 4.5598 8.5765 123.4988 61.1503 38.9764 175.6788 26 R 4.7150 9.0739 125.7253 54.3975 34.2686 174.1906 27 S 4.9632 8.7223 118.9029 56.6822 64.4079 174.4324 28 S 4.5519 8.8195 120.0060 58.1886 63.1904 173.3947 29 A 4.7739 7.2597 121.0604 52.6483 21.4347 176.3476 30 F 5.0232 8.5271 121.0360 56.5734 40.4850 174.4177 31 N 4.5166 8.5997 126.8054 51.6291 37.0579 176.1159 32 S 3.6846 8.2214 119.6489 61.0177 63.3934 175.9038 33 K 4.3659 7.6390 118.9816 56.2736 31.9412 175.9220 34 G 3.9942 7.3908 106.5114 43.7005 0.0000 173.7478 35 G 3.9971 8.0269 109.3952 44.3258 0.0000 173.2573 36 T 4.0514 8.2848 116.9558 64.3700 69.2002 174.0400 37 T 4.6323 9.0928 122.7126 61.6009 72.0783 173.1306 38 V 5.2265 8.9120 125.6864 60.1591 35.1049 174.1272 39 F 5.3862 8.6619 124.3175 55.8240 42.1794 173.4545 40 N 5.7321 9.4108 120.9820 51.5112 42.4996 173.3965 41 F 4.8100 9.2989 121.9398 55.9385 41.0386 174.7232 42 L 5.4232 8.7443 124.4950 52.8720 44.7807 177.1062 43 S 4.9153 9.0438 116.6149 56.3699 64.5182 175.0711 44 A 3.9598 8.6332 123.0489 55.3151 18.0492 178.6819 45 G 3.8764 8.0963 101.8235 45.4164 0.0000 173.1636 46 E 3.8680 8.2479 117.5633 57.1628 27.6798 174.5000 47 N 4.6473 8.2738 116.0727 53.2991 39.5095 174.9926 48 I 4.6568 8.5871 123.9656 60.2025 36.3870 176.4335 49 L 4.2401 8.8698 126.7131 57.0958 42.3577 177.3605 50 L 4.6554 8.0140 120.1296 53.3732 45.4475 174.0837 51 H 5.4102 9.1468 126.0514 53.5832 32.9795 172.4444 52 I 4.3823 8.4890 126.3663 59.5997 39.8165 174.6278 53 S 4.3233 8.9034 124.2315 56.7764 63.5557 173.4034 54 I 4.4724 8.9542 130.7562 60.4724 38.1435 175.5619 55 R 4.4176 8.3882 128.3392 53.7678 30.7860 175.8543 56 P 2.9700 0.0000 0.0000 65.0627 31.4899 179.3136 57 G 3.7580 7.7757 103.5160 47.0622 0.0000 172.9349 58 E 4.4154 7.4811 117.6238 54.4926 31.5050 174.3501 59 N 4.3182 8.7283 116.2328 54.5135 38.2635 173.3289 60 V 5.0495 7.6146 108.0753 60.3117 37.3603 174.5079 61 I 4.8798 9.2054 124.6480 59.5734 39.9827 174.6049 62 V 4.7242 8.7216 127.4639 61.1110 33.9684 174.2165 63 F 5.6899 8.9918 126.1385 55.3414 41.9655 174.0939 64 N 5.3475 8.0783 119.1911 54.3932 42.4893 172.3989 65 S 5.5893 8.7883 116.0173 57.2498 67.6649 173.6873 66 R 4.3689 8.5079 117.4674 55.7075 33.7323 174.3885 67 L 4.5493 8.2047 125.4629 54.0645 42.7073 177.7048 68 K 3.7690 8.7790 123.3449 59.5541 32.1129 178.5892 69 N 4.9306 7.9326 113.7460 53.0374 39.0597 173.6022 70 G 4.0531 7.8244 105.9015 43.4945 0.0000 172.4672 71 A 4.4272 7.9827 121.3764 50.0574 20.4307 177.1164 72 W 4.3904 8.4172 120.0500 57.2659 29.7773 177.2003 73 G 4.3202 8.5865 112.2063 44.8261 0.0000 171.2218 74 P 4.6490 0.0000 0.0000 63.1618 31.8355 176.2066 75 E 4.6396 8.8134 121.8285 56.1437 31.1661 176.2087 76 E 4.8232 9.2594 121.9724 54.8793 32.3642 175.0534 77 R 5.5522 8.7858 120.6688 54.3907 32.7407 175.0221 78 I 4.9919 8.7920 112.7007 58.2950 41.5214 172.6918 79 P 4.7382 0.0000 0.0000 63.7783 31.2601 175.6819 80 Y 4.3294 8.6032 123.9347 60.5386 39.5177 176.1826 81 A 3.8389 8.2601 121.7276 53.3982 18.9563 176.6622 82 E 4.0717 8.5052 116.7461 57.7339 27.4266 176.0256 83 K 4.2523 7.2998 116.1489 56.9801 34.2385 176.6699 84 F 5.1468 7.5002 115.2161 55.4751 40.8861 175.0981 85 R 4.4424 8.7772 125.2680 53.5875 30.6350 174.1198 86 P 4.4707 0.0000 0.0000 62.1032 32.1114 174.5249 87 P 4.7376 0.0000 0.0000 63.5088 32.2372 174.9063 88 N 5.9711 7.8064 115.7713 50.0215 37.7497 172.1724 89 P 4.8994 0.0000 0.0000 63.0096 33.3734 176.5528 90 S 4.9734 8.5738 113.2594 57.1278 66.8107 173.3175 91 I 4.7380 8.7660 120.8011 59.9981 41.2780 174.4291 92 T 4.9324 8.9989 123.9258 61.6359 71.4230 173.1588 93 V 4.7544 8.7809 126.8725 61.0563 34.2657 174.1407 94 I 4.9941 8.7967 128.8802 59.5022 40.4974 174.1705 95 D 4.7783 8.8016 127.3756 53.3938 41.8869 175.9138 96 H 4.7913 8.8382 124.1066 55.5382 28.4253 175.7534 97 G 3.8690 8.5575 113.8468 45.8297 0.0000 174.9186 98 D 4.4770 7.5797 118.6694 53.7788 40.7720 175.9463 99 R 4.8203 7.2726 115.0821 55.6417 32.7107 173.4490 100 F 5.2746 9.2841 118.8845 56.0263 41.8350 174.6550 101 Q 4.6066 9.2773 123.6054 54.2968 31.4870 174.1151 102 I 4.7333 8.7316 127.4555 59.4476 40.2896 174.6064 103 R 4.4887 8.7237 126.2827 54.4966 32.8461 175.5280 104 F 4.9339 8.1087 123.2428 56.7107 40.8580 175.1919 105 D 4.2587 8.2361 121.0238 57.2720 40.8633 175.2810 106 Y 4.7662 7.0179 114.3135 56.4710 41.8262 175.0393 107 G 3.9643 8.7696 111.5058 44.7731 0.0000 172.9942 108 T 4.2453 8.0774 109.3130 60.9300 69.7127 174.1237 109 S 4.4286 8.3082 117.3666 58.5067 63.9010 173.9116 110 I 4.4700 8.5131 122.9082 59.8278 39.5085 174.2694 111 Y 4.9693 8.5543 123.3647 56.2637 40.3832 174.4494 112 Y 4.6340 9.0180 125.0594 55.5024 41.4938 174.4081 113 N 4.6153 8.5151 124.6861 53.0310 39.4647 175.4487 114 K 4.2969 8.5626 123.3155 56.7427 32.6547 177.2630 115 R 4.4089 8.8463 121.7515 56.4019 31.6664 176.3141 116 I 4.4989 7.7365 117.7756 59.4729 39.5528 176.6463 117 K 4.4231 8.5112 128.7417 55.0759 30.5269 176.0500 118 E 4.8146 7.5278 117.9765 54.4590 33.9489 175.5394 119 N 4.9461 8.5774 117.9033 52.9908 40.6961 173.8306 120 A 4.9343 9.1114 122.7739 51.5410 20.0746 177.9267 121 A 4.6858 9.5156 123.1146 52.4088 21.3819 176.1531 122 A 4.8885 7.6619 115.4133 50.8798 23.3715 175.0708 123 I 4.4842 8.2322 119.2060 59.3736 40.4327 175.0486 124 A 5.2476 9.1196 128.8261 50.4642 22.4156 174.7263 125 Y 5.1379 9.0059 120.2956 56.1606 42.4218 173.9407 126 N 5.3918 9.3791 123.1570 51.1606 43.3817 173.4721 127 A 4.4910 8.2384 123.6058 52.0606 22.1532 176.7337 128 E 3.9559 9.0241 122.2454 58.9769 30.1770 177.3980 129 N 4.7892 7.4399 116.8533 50.2728 38.8188 172.0134 130 S 4.0928 8.0136 113.8991 58.5003 63.2718 174.1324 131 L 3.8437 8.4013 128.4907 56.6827 42.8347 175.6342 132 F 5.9944 7.7843 115.9655 55.3806 42.7361 174.7741 133 S 4.5530 9.3588 115.2486 58.6479 63.9756 173.9491 134 S 4.7578 8.3928 114.7955 56.1515 64.6087 171.8716 135 P 4.6509 0.0000 0.0000 62.1642 33.4182 175.2517 136 V 4.4993 8.2708 111.7930 59.9458 34.9173 175.6420 137 T 4.5190 8.6484 120.8441 63.2150 70.0804 174.1258 138 V 4.7493 8.7643 125.2900 61.4054 34.8465 173.7731 139 D 5.3039 8.9628 129.0686 52.8821 42.5858 175.6759 140 V 5.0051 8.8742 125.0307 61.6392 33.0473 174.6455 141 H 5.0468 9.8055 125.5965 54.1483 31.2258 175.8858 142 G 3.7234 8.8857 109.6617 47.1575 0.0000 173.5728 143 L 4.7805 7.3378 116.9122 54.5978 42.8892 174.6444 144 L 3.8416 8.4188 122.2752 54.9669 42.2742 175.3744 145 P 4.6478 0.0000 0.0000 60.7889 32.7490 173.8146 146 P 4.3155 0.0000 0.0000 62.8353 31.6484 175.9782 147 L 4.6618 8.1373 121.8915 52.1424 43.4942 174.9764 148 P 4.5135 0.0000 0.0000 61.6463 32.0308 175.6013 149 P 4.1244 0.0000 0.0000 65.2933 31.4591 176.2236 150 A 4.0874 7.4015 126.2000 52.9070 19.7053 175.7003 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 M 8.16 4.32 0.00 2.26 2.00 0.00 0.00 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 2.38 0.00 2 L 8.26 4.71 0.00 1.78 1.39 0.89 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 3 Y 9.96 4.79 0.00 2.87 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 4 H 8.99 5.18 0.00 3.14 3.14 0.00 5.70 0.00 0.00 0.00 0.00 6.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 L 8.53 4.63 0.00 1.83 1.58 1.18 1.03 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 6 F 9.15 4.94 0.00 2.98 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 7 V 8.34 2.47 1.52 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 0.54 0.00 0.00 0.21 0.00 0.00 8 N 8.22 4.55 0.00 2.74 2.85 0.00 0.00 6.67 7.62 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 9 N 7.60 5.02 0.00 2.92 2.92 0.00 0.00 6.59 7.12 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 10 Q 8.38 5.08 0.00 2.17 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.46 0.00 0.00 0.00 0.00 0.00 2.25 2.40 0.00 11 V 8.48 4.52 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 0.88 0.00 0.00 0.62 0.00 0.00 12 K 8.67 4.48 0.00 1.76 1.75 0.00 1.86 0.00 0.00 1.72 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.57 7.81 13 L 8.57 4.02 0.00 1.67 1.75 0.96 0.51 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 14 Q 9.89 4.20 0.00 2.11 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.69 0.00 0.00 0.00 0.00 0.00 2.41 2.44 0.00 15 N 7.82 5.21 0.00 2.76 2.71 0.00 0.00 6.92 8.06 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 16 D 8.62 4.71 0.00 2.60 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 17 F 9.75 4.66 0.00 3.22 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 18 K 7.91 5.15 0.00 1.77 1.96 0.00 1.56 0.00 0.00 1.82 0.00 0.00 2.80 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.54 1.36 7.81 19 P 0.00 4.54 0.00 1.99 1.98 0.00 3.62 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.15 0.00 20 E 9.38 4.16 0.00 2.06 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 2.12 2.34 0.00 21 S 7.80 4.45 0.00 2.77 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 22 V 9.00 5.04 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 0.98 0.00 0.00 0.96 0.00 0.00 23 A 9.74 5.13 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 24 A 9.24 4.65 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 25 I 8.58 4.56 1.63 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.44 0.27 0.00 0.00 26 R 9.07 4.71 0.00 1.58 1.69 0.00 3.06 0.00 0.00 3.05 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.47 0.00 27 S 8.72 4.96 0.00 3.65 3.70 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 0.00 0.00 0.00 0.00 28 S 8.82 4.55 0.00 4.03 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 29 A 7.26 4.77 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 30 F 8.53 5.02 0.00 2.98 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 31 N 8.60 4.52 0.00 2.69 2.62 0.00 0.00 6.77 6.79 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 32 S 8.22 3.68 0.00 3.79 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 33 K 7.64 4.37 0.00 1.66 1.73 0.00 1.68 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.32 1.32 7.81 34 G 7.39 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 35 G 8.03 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 36 T 8.28 4.05 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 1.14 0.00 0.00 37 T 9.09 4.63 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 1.23 0.00 0.00 38 V 8.91 5.23 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 1.23 0.00 0.00 0.86 0.00 0.00 39 F 8.66 5.39 0.00 3.13 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 40 N 9.41 5.73 0.00 2.65 2.79 0.00 0.00 6.49 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 41 F 9.30 4.81 0.00 2.84 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 42 L 8.74 5.42 0.00 1.59 1.58 0.93 0.82 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 43 S 9.04 4.92 0.00 4.08 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 44 A 8.63 3.96 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 45 G 8.10 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 46 E 8.25 3.87 0.00 2.12 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 0.00 2.25 2.27 0.00 47 N 8.27 4.65 0.00 2.91 2.78 0.00 0.00 7.03 8.20 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 48 I 8.59 4.66 2.00 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 1.30 0.95 1.21 0.00 0.00 49 L 8.87 4.24 0.00 1.79 2.05 1.25 0.94 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 50 L 8.01 4.66 0.00 1.11 1.08 0.48 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 51 H 9.15 5.41 0.00 3.57 3.31 0.00 5.81 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 I 8.49 4.38 2.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.12 0.91 0.00 0.00 53 S 8.90 4.32 0.00 3.60 3.54 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 54 I 8.95 4.47 1.97 0.00 0.00 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 1.46 0.85 1.13 0.00 0.00 55 R 8.39 4.42 0.00 1.73 1.72 0.00 3.04 0.00 0.00 3.14 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.62 0.00 56 P 0.00 2.97 0.00 1.85 1.61 0.00 3.30 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.49 0.00 57 G 7.78 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 58 E 7.48 4.42 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.95 0.00 67 L 8.20 4.55 0.00 1.69 1.53 0.92 1.01 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 68 K 8.78 3.77 0.00 1.81 1.85 0.00 1.91 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.43 7.81 69 N 7.93 4.93 0.00 2.66 2.73 0.00 0.00 6.61 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 70 G 7.82 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 0.00 0.00 0.00 71 A 7.98 4.43 1.24 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 0.00 0.00 0.00 72 W 8.42 4.39 0.00 3.23 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 73 G 8.59 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 0.00 0.00 0.00 74 P 0.00 4.65 0.00 2.16 2.14 0.00 3.88 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 2.08 2.07 0.00 75 E 8.81 4.64 0.00 1.94 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 2.30 2.38 0.00 76 E 9.26 4.82 0.00 2.30 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 2.33 2.41 0.00 77 R 8.79 5.55 0.00 1.91 1.95 0.00 3.02 0.00 0.00 3.31 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 78 I 8.79 4.99 2.00 0.00 0.00 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 1.77 1.02 1.13 0.00 0.00 79 P 0.00 4.74 0.00 2.12 2.14 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 2.01 2.00 0.00 80 Y 8.60 4.33 0.00 3.05 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 81 A 8.26 3.84 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 82 E 8.51 4.07 0.00 2.03 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 2.08 2.23 0.00 83 K 7.30 4.25 0.00 0.99 0.74 0.00 1.53 0.00 0.00 1.56 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.31 1.00 7.81 84 F 7.50 5.15 0.00 2.73 2.70 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 0.00 0.00 0.00 0.00 85 R 8.78 4.44 0.00 1.07 1.53 0.00 3.18 0.00 0.00 3.26 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 86 P 0.00 4.47 0.00 2.34 2.18 0.00 3.78 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.01 0.00 87 P 0.00 4.74 0.00 2.30 2.38 0.00 3.65 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.01 0.00 88 N 7.81 5.97 0.00 2.56 2.74 0.00 0.00 7.30 8.02 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 89 P 0.00 4.90 0.00 2.01 2.13 0.00 3.92 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 2.50 0.00 90 S 8.57 4.97 0.00 3.97 3.72 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 91 I 8.77 4.74 1.60 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.75 0.81 0.00 0.00 92 T 9.00 4.93 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 1.16 0.00 0.00 93 V 8.78 4.75 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 0.42 0.00 0.00 0.73 0.00 0.00 94 I 8.80 4.99 1.79 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 1.10 0.48 0.66 0.00 0.00 95 D 8.80 4.78 0.00 2.58 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 96 H 8.84 4.79 0.00 3.34 3.24 0.00 5.75 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 G 8.56 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 98 D 7.58 4.48 0.00 2.79 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 99 R 7.27 4.82 0.00 2.00 2.02 0.00 3.04 0.00 0.00 3.31 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.80 0.00 100 F 9.28 5.27 0.00 3.10 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 0.00 101 Q 9.28 4.61 0.00 2.06 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.75 0.00 0.00 0.00 0.00 0.00 1.99 1.62 0.00 102 I 8.73 4.73 1.64 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.34 0.50 0.00 0.00 103 R 8.72 4.49 0.00 1.45 1.63 0.00 3.16 0.00 0.00 3.10 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.60 0.00 104 F 8.11 4.93 0.00 2.80 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 0.00 105 D 8.24 4.26 0.00 2.32 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 0.00 0.00 0.00 106 Y 7.02 4.77 0.00 3.05 2.73 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 0.00 107 G 8.77 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 0.00 108 T 8.08 4.25 4.31 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 1.25 0.00 0.00 109 S 8.31 4.43 0.00 3.57 3.35 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 0.00 110 I 8.51 4.47 1.64 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 1.43 0.89 0.37 0.00 0.00 111 Y 8.55 4.97 0.00 2.80 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 0.00 112 Y 9.02 4.63 0.00 2.87 2.89 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 0.00 113 N 8.52 4.62 0.00 2.45 2.64 0.00 0.00 7.21 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 0.00 114 K 8.56 4.30 0.00 1.71 1.77 0.00 1.70 0.00 0.00 1.58 0.00 0.00 2.13 0.00 0.00 2.44 0.00 0.00 0.00 0.00 1.22 1.24 7.81 115 R 8.85 4.41 0.00 1.97 2.06 0.00 3.41 0.00 0.00 3.34 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.76 0.00 116 I 7.74 4.50 2.02 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.74 1.02 0.00 0.00 117 K 8.51 4.42 0.00 1.77 1.79 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.41 7.81 118 E 7.53 4.81 0.00 1.98 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 0.00 2.25 2.37 0.00 119 N 8.58 4.95 0.00 2.84 2.95 0.00 0.00 6.76 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 0.00 120 A 9.11 4.93 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 9.52 4.69 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 0.00 122 A 7.66 4.89 1.21 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 0.00 123 I 8.23 4.48 1.47 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.21 0.44 0.34 0.00 0.00 124 A 9.12 5.25 1.23 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 0.00 0.00 0.00 125 Y 9.01 5.14 0.00 2.93 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 0.00 126 N 9.38 5.39 0.00 2.50 2.53 0.00 0.00 6.33 8.05 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 0.00 127 A 8.24 4.49 1.01 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 0.00 0.00 128 E 9.02 3.96 0.00 1.88 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 2.25 2.22 0.00 129 N 7.44 4.79 0.00 2.65 2.53 0.00 0.00 6.74 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 0.00 130 S 8.01 4.09 0.00 3.68 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 0.00 131 L 8.40 3.84 0.00 1.33 0.69 0.48 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 132 F 7.78 5.99 0.00 3.15 2.91 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 0.00 133 S 9.36 4.55 0.00 3.87 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 0.00 134 S 8.39 4.76 0.00 3.89 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 0.00 135 P 0.00 4.65 0.00 1.78 0.49 0.00 3.49 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.26 0.00 136 V 8.27 4.50 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 0.66 0.00 0.00 0.78 0.00 0.00 137 T 8.65 4.52 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 0.00 138 V 8.76 4.75 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 0.94 0.00 0.00 0.85 0.00 0.00 139 D 8.96 5.30 0.00 2.67 2.54 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 0.00 140 V 8.87 5.01 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 1.09 0.00 0.00 1.01 0.00 0.00 141 H 9.81 5.05 0.00 3.07 3.34 0.00 5.66 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 0.00 142 G 8.89 3.72 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 0.00 143 L 7.34 4.78 0.00 1.71 1.59 0.92 0.76 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 0.00 144 L 8.42 3.84 0.00 1.58 1.61 0.87 0.94 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 0.00 145 P 0.00 4.65 0.00 2.22 2.08 0.00 3.71 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.80 0.00 146 P 0.00 4.32 0.00 2.06 2.03 0.00 3.66 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 2.03 2.11 0.00 147 L 8.14 4.66 0.00 1.61 1.56 0.91 1.05 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 0.00 148 P 0.00 4.51 0.00 2.21 2.17 0.00 3.69 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 2.06 1.94 0.00 149 P 0.00 4.12 0.00 2.19 2.23 0.00 3.80 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 1.98 1.96 0.00 150 A 7.40 4.09 1.24 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 0.00 0.00 0.00