NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0512 8.0549 120.3907 62.1947 32.6461 175.1528 2 L 4.0382 8.4371 127.6817 53.0839 42.2599 176.2254 3 S 4.5589 9.2386 120.6600 57.1581 67.0012 174.9529 4 A 3.9882 8.3833 122.4013 55.1687 17.9109 179.6019 5 A 4.0370 7.7943 120.3315 54.4987 18.6221 179.1826 6 D 4.4811 7.7186 118.8876 56.9184 40.8787 179.3674 7 K 3.9803 7.7961 118.4235 59.5139 32.1780 179.6113 8 S 4.1433 7.9354 113.7692 61.0048 63.0528 176.3690 9 N 4.4079 8.2891 120.6151 56.0457 38.2887 177.4574 10 V 3.4513 7.9738 119.9568 66.0441 31.6225 178.1743 11 K 3.9136 8.2093 118.2674 59.4724 31.9597 179.2398 12 A 4.0552 8.1648 121.0505 55.1201 18.3976 179.2513 13 C 4.1111 8.3169 117.3783 62.4008 31.6858 175.6650 14 W 3.9787 8.7295 130.2886 60.1262 30.0237 178.3373 15 G 3.6423 8.0640 105.3708 47.6092 0.0000 175.5757 16 K 4.1387 7.7807 119.7185 59.1554 32.4463 179.1254 17 I 3.8018 7.5295 120.1220 62.3426 37.1392 178.1977 18 G 3.9083 8.1330 106.9969 46.9909 0.0000 175.1616 19 S 4.3882 8.7658 119.1305 58.7531 63.5396 174.3931 20 H 4.2416 7.7593 118.1387 56.6331 28.1905 176.3305 21 A 3.7440 7.8501 123.0010 55.1794 17.8390 179.8117 22 G 3.8852 7.9752 102.9542 46.8665 0.0000 174.8125 23 E 3.9324 7.9834 120.6434 59.3471 29.6221 178.3869 24 Y 4.4475 7.8969 116.9681 60.7040 38.0026 177.9384 25 G 3.7290 8.5987 107.0087 47.9139 0.0000 175.5791 26 A 3.9680 8.2932 123.3459 54.7784 18.4311 179.2988 27 E 3.8421 8.3041 117.6488 59.3274 29.8160 178.6717 28 A 3.9111 8.5075 121.1479 55.1965 18.3725 179.4994 29 L 3.3565 7.6425 117.1821 57.8366 41.7244 179.3269 30 E 3.9366 7.7944 118.7752 59.5180 29.5383 179.1215 31 R 3.9428 8.1018 118.0089 59.3297 29.5826 179.3153 32 T 4.0524 7.4933 115.1240 66.8555 68.4089 176.9213 33 F 4.6342 8.1702 120.0553 60.4880 38.5940 177.3868 34 C 4.1481 7.7844 117.5779 62.6012 31.6856 175.5504 35 S 4.1264 8.2984 115.3399 59.5444 63.7861 174.6031 36 F 4.6252 7.9711 120.0999 53.6716 39.0216 173.3715 37 P 4.7302 0.0000 0.0000 64.7964 31.3411 177.5686 38 T 4.1534 8.0424 107.8164 64.0829 69.0385 176.3795 39 T 4.4263 8.1334 112.8415 64.4924 68.9957 176.6304 40 K 3.8487 8.1322 121.6821 59.0533 31.7479 178.8287 41 T 3.9487 7.5563 109.1702 64.0512 68.7241 175.3419 42 Y 4.2303 7.7152 117.8980 58.4977 39.5515 175.1730 43 F 4.7934 7.8847 118.1927 55.7209 39.3440 174.6692 44 P 4.3498 0.0000 0.0000 65.6695 31.9189 177.4272 45 H 4.7170 8.5783 112.3279 55.6544 28.8245 174.5419 46 F 4.7871 7.7795 118.8452 55.9407 40.4015 174.9809 47 D 4.5437 9.2884 125.2533 54.1948 41.2911 176.0179 48 L 4.8270 8.3929 126.1600 54.3863 42.8573 176.7271 49 S 4.4131 8.2365 113.9717 57.6457 63.8355 173.0914 50 H 4.3708 8.6031 122.0236 57.9919 29.9608 174.9670 51 G 3.8559 9.0976 114.6990 45.7684 0.0000 173.6492 52 S 3.8285 7.9574 112.8570 57.3807 62.5702 174.5501 53 A 3.9648 8.8008 132.1190 55.4335 18.2603 178.9082 54 Q 3.7505 7.8674 117.6102 59.1211 29.1773 178.3395 55 V 3.9051 7.7031 119.5055 65.7255 31.7148 178.0282 56 K 3.8944 8.2987 118.2286 59.5513 31.4364 179.0155 57 A 4.0315 8.3273 121.1505 55.5898 18.3496 179.2334 58 H 4.4200 8.4747 116.4838 59.1284 29.9770 177.3554 59 G 3.8699 8.7238 108.1930 48.1432 0.0000 175.3193 60 Q 4.0014 8.0265 121.1499 58.9421 28.9901 178.4675 61 K 4.0470 7.7761 118.7531 59.4175 32.1792 179.6105 62 V 3.6119 7.9859 118.3719 65.6712 31.3806 177.7398 63 A 4.2055 8.1661 120.6153 55.7185 18.2798 179.3143 64 D 4.3711 8.8331 117.1662 57.4555 40.7431 178.7695 65 A 4.2364 7.9621 120.7300 54.1811 18.7002 179.5103 66 L 4.0796 8.0030 117.5965 57.9097 41.5398 179.5756 67 T 3.7401 8.2117 115.3615 66.7751 68.6105 175.9566 68 Q 4.1074 8.3269 121.1720 59.2734 28.6946 178.3481 69 A 4.1044 7.7481 121.4757 54.3960 18.6065 179.5699 70 V 3.1104 7.8011 116.1900 65.1324 31.5199 177.0053 71 A 4.5431 7.3018 117.4776 52.0177 19.6885 176.3148 72 H 4.9299 7.9027 115.3151 55.6379 30.0225 175.2443 73 M 4.3600 8.3563 119.1811 57.2824 32.1336 177.1184 74 D 4.6824 7.9432 117.1804 54.9157 42.9637 176.0901 75 D 4.8265 7.7533 117.9677 51.6444 41.3039 175.5683 76 L 4.0266 7.8595 123.3843 57.4389 42.0095 177.4025 77 P 4.2786 0.0000 0.0000 65.1692 31.2324 177.9013 78 T 4.1098 7.5429 110.8206 64.5815 67.6046 176.2145 79 A 4.1048 7.9168 121.1190 54.3706 18.6504 177.7558 80 M 4.4775 7.7734 116.0427 55.4205 32.4794 178.2506 81 S 4.0393 8.1773 116.3217 61.7272 63.0435 175.9550 82 A 4.1536 7.9851 124.6280 54.7173 18.0349 179.4711 83 L 4.1316 7.8970 116.7299 57.6776 41.8484 179.7765 84 S 4.0735 8.1568 115.6280 61.6415 62.7127 176.3717 85 D 4.4089 7.8289 121.4478 57.2235 40.5975 178.4765 86 L 3.9465 7.8059 120.4106 58.6514 42.0564 178.6468 87 H 4.3734 8.2419 115.2159 58.0645 28.7123 177.4467 88 A 4.2365 7.9016 121.4727 53.8578 18.6203 177.1928 89 Y 4.6368 8.0718 115.7285 59.1184 41.0012 176.7815 90 K 3.7588 8.2504 119.0351 58.7459 32.4745 177.2838 91 L 4.3110 7.9291 116.4171 54.1478 43.0139 176.5466 92 R 3.7464 8.0264 116.6142 56.9680 27.5536 177.0402 93 V 3.2902 7.9224 116.7083 62.2156 32.2775 175.0444 94 D 4.5457 8.5944 127.6745 53.6200 41.7503 175.1310 95 P 4.4151 0.0000 0.0000 66.0653 31.8740 178.9850 96 V 3.3670 7.6954 110.3190 64.2778 31.1823 178.2141 97 N 4.1329 7.8217 116.1076 56.1403 38.1910 177.4423 98 F 3.8456 7.9510 119.4691 60.3192 38.9116 177.7370 99 K 3.9785 7.9187 117.6875 59.3739 31.8379 179.2886 100 F 3.8896 7.4397 117.6026 60.2769 38.7122 177.5321 101 L 3.8947 7.9575 121.3751 57.7490 41.9904 178.8617 102 S 3.8247 8.2461 115.4941 61.9509 62.8122 176.2795 103 H 4.2800 8.4455 120.6183 59.7725 29.6522 177.1835 104 C 4.1856 8.1491 118.2341 62.5122 27.7867 176.0059 105 L 3.9357 8.1716 121.3079 57.6583 41.0582 179.5351 106 L 4.2134 7.9190 118.7945 57.8240 41.5679 179.5899 107 V 3.3794 7.6315 118.1198 66.3747 31.4259 178.1699 108 T 3.7205 7.7129 115.3096 66.5837 68.2128 176.6560 109 L 3.8183 7.6351 120.3090 57.3109 41.4857 179.1877 110 A 3.2228 7.3617 120.3169 55.0949 18.2270 179.1858 111 C 4.0482 7.8891 114.4167 62.8731 28.2319 175.3291 112 H 4.4408 7.5762 115.5162 56.3980 30.2338 175.3762 113 H 4.9793 8.2875 117.1156 53.6014 29.0884 172.4353 114 P 4.3262 0.0000 0.0000 65.7542 32.0009 179.3728 115 A 4.0574 8.0946 120.6966 54.9345 18.4082 178.4506 116 E 4.1092 7.8628 112.9966 58.7995 30.2358 177.4973 117 F 4.5880 7.5783 123.2349 57.3795 38.4826 175.6600 118 T 4.1313 7.2809 113.5077 60.9777 71.2879 172.8761 119 P 4.1150 0.0000 0.0000 66.0078 31.2757 178.8168 120 A 3.9451 7.8320 118.8646 55.0443 18.3898 179.7396 121 V 3.4762 7.3924 115.7819 65.9896 31.5428 177.4123 122 H 3.5338 7.9839 118.3024 59.3827 29.4720 176.9238 123 A 3.9407 7.7666 122.0042 55.3219 18.0565 179.8186 124 S 4.2422 7.9647 115.0076 60.9615 62.8112 176.9743 125 L 3.6880 7.9409 121.7318 57.6431 41.4327 178.7086 126 D 4.4804 8.1805 117.9432 57.6994 41.0320 178.4147 127 K 3.9051 8.2327 118.8379 59.5252 32.1371 179.1326 128 F 4.1729 7.9618 120.4475 61.4840 39.4391 177.3611 129 F 4.3381 8.2428 117.8525 60.6101 38.6392 177.7065 130 S 4.1161 8.3315 112.7250 61.2711 61.7052 176.0921 131 A 3.9250 7.7600 123.6332 54.8577 17.9354 179.7894 132 V 3.4264 7.3639 116.9010 65.6309 31.1617 177.9902 133 S 4.1227 7.9374 113.0182 60.3263 63.0280 176.4996 134 T 3.7219 7.6596 119.4701 66.3806 68.2809 176.3692 135 V 3.5916 7.2761 119.5265 65.8777 31.4359 177.7745 136 L 4.1462 7.3263 116.1090 56.0984 41.6197 178.0804 137 T 4.1120 6.5903 107.2458 61.1881 69.5482 175.8716 138 S 3.8674 7.3860 118.3706 61.4031 62.7546 175.8453 139 K 4.2959 7.3875 118.1605 56.4329 31.5310 175.8492 140 Y 4.3997 7.0723 118.8041 57.1394 38.4584 175.5795 141 R 4.2568 8.8880 124.1695 56.6045 30.9342 175.4247 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 V 8.05 4.05 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 0.98 0.00 0.00 0.92 0.00 0.00 2 L 8.44 4.04 0.00 1.76 1.59 1.01 0.71 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 3 S 9.24 4.56 0.00 4.04 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 4 A 8.38 3.99 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 5 A 7.79 4.04 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 6 D 7.72 4.48 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 7 K 7.80 3.98 0.00 1.92 1.80 0.00 1.63 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.58 7.81 8 S 7.94 4.14 0.00 4.05 4.09 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 9 N 8.29 4.41 0.00 2.99 2.86 0.00 0.00 6.50 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 10 V 7.97 3.45 1.79 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 -0.04 0.00 0.00 0.69 0.00 0.00 11 K 8.21 3.91 0.00 1.79 1.84 0.00 1.67 0.00 0.00 1.61 0.00 0.00 3.04 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.64 7.81 12 A 8.16 4.06 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 13 C 8.32 4.11 0.00 3.13 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 14 W 8.73 3.98 0.00 3.65 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 15 G 8.06 3.64 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 0.00 0.00 0.00 0.00 0.00 0.00 16 K 7.78 4.14 0.00 1.88 1.85 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.63 1.85 7.81 17 I 7.53 3.80 1.47 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.94 0.41 0.00 0.00 18 G 8.13 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 19 S 8.77 4.39 0.00 3.86 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 20 H 7.76 4.24 0.00 2.56 2.19 0.00 5.64 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 21 A 7.85 3.74 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 22 G 7.98 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 0.00 0.00 0.00 23 E 7.98 3.93 0.00 1.98 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 0.00 2.48 2.44 0.00 24 Y 7.90 4.45 0.00 3.06 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 25 G 8.60 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 0.00 0.00 0.00 26 A 8.29 3.97 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 27 E 8.30 3.84 0.00 2.22 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 2.29 2.35 0.00 28 A 8.51 3.91 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 29 L 7.64 3.36 0.00 1.61 0.95 0.95 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 30 E 7.79 3.94 0.00 2.08 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 0.00 2.34 2.44 0.00 31 R 8.10 3.94 0.00 2.00 1.94 0.00 3.12 0.00 0.00 3.11 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.80 0.00 32 T 7.49 4.05 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 1.29 0.00 0.00 33 F 8.17 4.63 0.00 2.99 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 34 C 7.78 4.15 0.00 3.21 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 35 S 8.30 4.13 0.00 3.20 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 36 F 7.97 4.63 0.00 3.08 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 37 P 0.00 4.73 0.00 2.17 2.13 0.00 3.84 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.99 0.00 38 T 8.04 4.15 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 1.29 0.00 0.00 39 T 8.13 4.43 4.63 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 1.71 0.00 0.00 40 K 8.13 3.85 0.00 1.96 1.80 0.00 1.55 0.00 0.00 1.70 0.00 0.00 3.16 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.09 1.69 7.81 41 T 7.56 3.95 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 1.18 0.00 0.00 42 Y 7.72 4.23 0.00 3.18 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 43 F 7.88 4.79 0.00 2.51 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 0.00 0.00 0.00 44 P 0.00 4.35 0.00 2.20 2.17 0.00 3.89 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.93 0.00 45 H 8.58 4.72 0.00 3.39 3.49 0.00 5.51 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 46 F 7.78 4.79 0.00 3.17 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 47 D 9.29 4.54 0.00 2.53 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 48 L 8.39 4.83 0.00 1.59 1.55 0.56 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.24 4.41 0.00 4.04 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 50 H 8.60 4.37 0.00 3.20 3.29 0.00 5.89 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 51 G 9.10 3.86 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 0.00 0.00 0.00 52 S 7.96 3.83 0.00 4.06 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 53 A 8.80 3.96 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 54 Q 7.87 3.75 0.00 1.92 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.87 0.00 0.00 0.00 0.00 0.00 1.66 2.09 0.00 55 V 7.70 3.91 2.29 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 1.00 0.00 0.00 1.22 0.00 0.00 56 K 8.30 3.89 0.00 2.03 1.86 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.66 7.81 57 A 8.33 4.03 1.40 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 0.00 0.00 58 H 8.47 4.42 0.00 3.82 3.58 0.00 5.81 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 59 G 8.72 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 60 Q 8.03 4.00 0.00 2.23 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 61 K 7.78 4.05 0.00 2.04 1.86 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.67 7.81 62 V 7.99 3.61 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 1.03 0.00 0.00 0.93 0.00 0.00 63 A 8.17 4.21 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 0.00 0.00 0.00 0.00 0.00 0.00 64 D 8.83 4.37 0.00 2.86 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 65 A 7.96 4.24 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 66 L 8.00 4.08 0.00 2.21 1.84 1.12 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 67 T 8.21 3.74 4.54 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 1.37 0.00 0.00 68 Q 8.33 4.11 0.00 2.32 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 69 A 7.75 4.10 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 70 V 7.80 3.11 1.87 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 0.61 0.00 0.00 -0.34 0.00 0.00 71 A 7.30 4.54 1.27 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 0.00 0.00 72 H 7.90 4.93 0.00 3.13 3.24 0.00 5.62 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 M 8.36 4.36 0.00 2.04 2.10 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.74 0.00 74 D 7.94 4.68 0.00 2.65 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 75 D 7.75 4.83 0.00 2.64 2.49 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 76 L 7.86 4.03 0.00 1.69 1.65 0.83 1.16 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 77 P 0.00 4.28 0.00 1.98 2.07 0.00 3.77 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.09 0.00 78 T 7.54 4.11 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 1.26 0.00 0.00 79 A 7.92 4.10 1.20 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 0.00 0.00 80 M 7.77 4.48 0.00 2.02 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 2.47 2.72 0.00 81 S 8.18 4.04 0.00 4.02 4.09 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 82 A 7.99 4.15 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 83 L 7.90 4.13 0.00 1.92 1.77 0.95 0.98 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 84 S 8.16 4.07 0.00 3.97 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 85 D 7.83 4.41 0.00 2.75 2.81 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 86 L 7.81 3.95 0.00 1.93 1.83 0.93 1.41 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 87 H 8.24 4.37 0.00 3.54 3.62 0.00 5.86 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 88 A 7.90 4.24 1.33 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 0.00 0.00 89 Y 8.07 4.64 0.00 3.00 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 90 K 8.25 3.76 0.00 1.68 1.93 0.00 1.78 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.36 7.81 91 L 7.93 4.31 0.00 1.65 1.64 0.68 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 92 R 8.03 3.75 0.00 1.95 2.02 0.00 3.45 0.00 0.00 3.54 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.55 0.00 93 V 7.92 3.29 2.24 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 0.16 0.00 0.00 0.57 0.00 0.00 94 D 8.59 4.55 0.00 2.80 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.42 0.00 2.23 2.14 0.00 3.68 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.42 0.00 96 V 7.70 3.37 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 0.90 0.00 0.00 0.86 0.00 0.00 97 N 7.82 4.13 0.00 2.59 2.79 0.00 0.00 7.00 9.04 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 98 F 7.95 3.85 0.00 3.16 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 99 K 7.92 3.98 0.00 1.69 1.79 0.00 1.54 0.00 0.00 1.79 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.47 7.81 100 F 7.44 3.89 0.00 3.00 2.34 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 0.00 101 L 7.96 3.89 0.00 1.62 1.50 0.77 0.88 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 0.00 102 S 8.25 3.82 0.00 4.00 4.09 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 0.00 103 H 8.45 4.28 0.00 3.40 3.60 0.00 5.78 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 0.00 104 C 8.15 4.19 0.00 3.12 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 0.00 105 L 8.17 3.94 0.00 1.41 1.34 0.27 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 106 L 7.92 4.21 0.00 2.08 1.91 1.26 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 107 V 7.63 3.38 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 1.02 0.00 0.00 0.82 0.00 0.00 108 T 7.71 3.72 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 1.08 0.00 0.00 109 L 7.64 3.82 0.00 1.77 1.74 1.29 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 110 A 7.36 3.22 0.45 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 0.00 111 C 7.89 4.05 0.00 2.86 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 0.00 112 H 7.58 4.44 0.00 2.70 3.03 0.00 5.59 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 H 8.29 4.98 0.00 3.23 3.23 0.00 5.62 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 P 0.00 4.33 0.00 2.22 2.28 0.00 3.75 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.93 0.00 115 A 8.09 4.06 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 0.00 116 E 7.86 4.11 0.00 2.29 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 2.43 2.44 0.00 117 F 7.58 4.59 0.00 3.08 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 0.00 118 T 7.28 4.13 4.22 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 1.22 0.00 0.00 119 P 0.00 4.12 0.00 2.14 2.13 0.00 3.57 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 2.11 2.17 0.00 120 A 7.83 3.95 1.27 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 0.00 0.00 121 V 7.39 3.48 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 0.99 0.00 0.00 0.91 0.00 0.00 122 H 7.98 3.53 0.00 2.31 3.19 0.00 5.66 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 0.00 123 A 7.77 3.94 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 0.00 124 S 7.96 4.24 0.00 3.84 4.01 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 0.00 125 L 7.94 3.69 0.00 1.96 1.56 1.21 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 126 D 8.18 4.48 0.00 2.92 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 0.00 127 K 8.23 3.91 0.00 2.06 1.87 0.00 1.89 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.47 7.81 128 F 7.96 4.17 0.00 3.03 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 0.00 129 F 8.24 4.34 0.00 3.13 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 0.00 130 S 8.33 4.12 0.00 4.02 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 0.00 131 A 7.76 3.93 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 0.00 132 V 7.36 3.43 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 0.94 0.00 0.00 0.23 0.00 0.00 133 S 7.94 4.12 0.00 3.82 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 0.00 134 T 7.66 3.72 4.30 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 1.10 0.00 0.00 135 V 7.28 3.59 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 1.00 0.00 0.00 0.93 0.00 0.00 136 L 7.33 4.15 0.00 1.27 1.60 0.93 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 137 T 6.59 4.11 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 0.45 0.00 0.00 138 S 7.39 3.87 0.00 3.85 4.09 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 0.00 139 K 7.39 4.30 0.00 1.86 1.84 0.00 1.88 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.35 7.81 140 Y 7.07 4.40 0.00 2.93 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 0.00 141 R 8.89 4.26 0.00 2.03 2.06 0.00 3.27 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.65 0.00