NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4101 8.3349 115.4123 57.8832 64.3414 172.7743 2 L 4.2926 8.2286 121.9048 52.3348 42.4117 176.4869 3 S 4.5659 9.7434 120.9127 57.4591 66.7651 174.6975 4 D 4.3421 8.4638 120.7290 57.1533 40.4276 178.9288 5 K 3.9358 7.9610 119.8501 59.5197 32.2327 178.4142 6 D 4.5431 8.0364 120.4137 56.8266 40.7244 178.9012 7 K 3.8679 8.2106 118.7148 59.4842 31.9825 179.2894 8 A 3.9406 8.1529 120.7327 54.9693 18.2445 179.5356 9 A 3.8955 8.0517 119.3205 55.2941 18.4283 180.1233 10 V 3.4061 7.9215 116.9009 66.1044 31.5469 178.4376 11 R 3.9113 8.0971 117.7373 59.1822 29.7615 178.9571 12 A 3.9598 8.3027 120.8589 54.9804 18.3236 179.4345 13 L 3.8415 8.0534 118.9278 58.1519 42.2412 179.0162 14 W 4.0691 8.5931 128.7151 60.3950 30.3279 177.6980 15 S 4.0306 7.9497 112.5432 61.2507 61.8191 176.1306 16 K 3.9877 7.4074 120.2665 58.8758 32.2178 178.7340 17 I 3.3690 7.4281 112.1352 61.4185 37.9215 177.7079 18 G 2.4317 7.3370 108.9184 47.4714 0.0000 175.5518 19 K 3.9740 7.6671 119.1700 59.0815 32.5299 178.1764 20 S 4.7485 7.8438 115.8533 58.2257 63.2154 175.8659 21 S 4.2051 7.8179 120.7356 61.9156 62.4700 176.0118 22 D 4.3652 8.1778 121.6986 57.1054 40.5912 178.5567 23 A 4.0261 7.9945 120.5043 55.2293 18.3843 179.5134 24 I 3.7942 8.1844 118.6343 64.5042 37.2280 178.9414 25 G 3.6523 8.4804 106.8501 47.6992 0.0000 175.2292 26 N 4.3145 8.2967 119.6747 56.4622 39.0488 176.4211 27 D 4.3134 8.3690 119.3126 57.2179 41.3552 177.9443 28 A 4.0313 8.4063 121.6109 55.4456 18.4575 179.7403 29 L 4.0937 8.0851 117.3699 57.8992 41.2104 179.9655 30 S 4.1946 8.2705 115.3599 61.5411 62.7630 176.9386 31 R 3.9794 8.2042 120.8024 59.3430 29.7677 178.4677 32 M 4.2487 8.2220 118.2904 59.0356 32.0448 178.4251 33 I 3.8877 7.9493 112.5885 63.3423 37.5164 178.2597 34 V 3.7184 7.3059 119.2490 65.9198 31.6865 177.8863 35 V 3.6875 8.2528 116.9777 64.5180 32.9144 175.6170 36 Y 4.7157 8.2588 116.7843 54.4513 38.0573 174.1088 37 P 4.6474 0.0000 0.0000 64.8694 31.3715 178.4391 38 Q 4.0901 8.2009 117.3681 59.1429 28.4531 178.0901 39 T 4.1049 8.2565 111.5077 64.0395 68.7355 176.4264 40 K 4.2653 8.0998 121.5088 58.9290 31.7789 178.8793 41 I 3.5227 7.3409 113.8375 63.9045 37.0493 177.3489 42 Y 3.9577 7.0420 116.5122 58.9681 37.8170 176.0915 43 F 4.2178 7.3080 118.8668 56.7111 39.5266 177.4417 44 S 4.1591 7.5380 118.0913 61.0530 62.6807 174.8859 45 H 4.5824 8.0745 114.7674 56.2859 28.9803 175.4830 46 W 4.7612 7.8456 120.8985 55.4107 29.7080 174.6697 47 P 4.4545 0.0000 0.0000 65.8534 30.8498 175.8310 48 D 4.6730 7.6136 115.1746 52.6105 41.5726 175.4336 49 V 4.6086 8.2161 119.4276 60.8948 31.8731 174.0233 50 T 4.7775 7.8951 114.0558 58.1326 71.9274 172.4292 51 P 4.2312 0.0000 0.0000 64.3122 31.7674 176.3985 52 G 3.9460 8.7564 109.6557 46.4455 0.0000 174.4982 53 S 4.4286 7.5435 115.1304 56.7723 65.2867 173.0818 54 P 4.1408 0.0000 0.0000 65.9952 30.9097 178.6742 55 N 3.7123 7.6982 114.4275 56.1491 38.2330 177.4044 56 I 3.7655 7.2196 121.2314 64.2072 37.2173 178.7044 57 K 3.9430 8.3662 119.5467 59.3410 31.9440 179.2829 58 A 3.9491 8.0202 121.0872 55.5249 18.2880 179.2468 59 H 4.3280 8.6445 117.1885 59.1529 29.8753 177.7253 60 G 3.6560 8.4026 108.2010 47.7509 0.0000 175.8872 61 K 4.0782 8.0887 120.8347 58.9380 32.0207 179.6796 62 K 3.9564 7.9368 118.7123 59.4477 32.0089 179.5193 63 V 3.5780 7.8731 118.4137 66.4886 31.4563 178.0776 64 M 4.2771 8.3886 118.2267 57.9971 31.7332 179.0283 65 G 3.7225 8.2317 106.6452 47.5141 0.0000 176.1757 66 G 3.5780 8.0686 108.1046 47.6303 0.0000 175.9558 67 I 3.5542 7.8384 122.1899 63.9127 37.1737 178.2963 68 A 3.3239 8.0157 121.8637 54.9074 18.1220 179.4185 69 L 3.8498 7.9317 118.5256 58.2547 41.9365 179.0405 70 A 3.9371 7.8056 119.8161 55.1012 18.3902 179.4763 71 V 3.5331 7.8353 116.8479 66.2578 31.3190 178.5524 72 S 4.1872 7.8104 113.6588 60.6566 62.8657 175.7570 73 K 4.5371 8.0933 120.1813 56.3265 32.4509 178.2922 74 I 3.8200 7.3348 122.2759 64.3458 37.8011 176.5003 75 D 4.5160 8.0350 118.2343 56.8001 41.1497 176.2933 76 D 4.6971 8.1131 118.5753 51.7147 42.3540 175.1226 77 L 3.9203 8.1977 124.4721 56.8536 41.7122 178.3200 78 K 3.8207 7.8869 118.2422 59.9167 32.5926 178.5578 79 T 4.1095 8.0005 115.4663 66.6584 68.2103 177.0364 80 G 3.7382 8.1277 106.4905 47.0545 0.0000 174.6528 81 L 4.5938 7.8885 119.2966 54.5630 42.0309 178.0120 82 M 3.9714 7.7652 120.9828 58.9935 31.9534 178.4374 83 E 3.9948 8.1874 117.5193 59.6387 29.6436 179.4216 84 L 4.0911 7.8886 118.3400 57.7350 41.6523 179.3561 85 S 4.3767 8.3269 114.6725 60.8901 62.4030 175.7375 86 E 4.1533 8.4075 121.9947 59.4597 29.3369 178.6877 87 Q 4.0565 8.2393 117.8972 59.6560 28.9008 178.8356 88 H 4.3152 8.7865 116.6720 58.2214 28.4660 177.9315 89 A 3.2144 8.2265 122.4477 55.0330 18.6106 178.6126 90 Y 4.1552 8.0376 113.1133 59.4499 38.5180 177.1525 91 K 4.2311 7.8990 119.3241 58.6571 33.0406 177.4960 92 L 4.0637 7.8781 117.1514 55.9027 42.3245 177.5165 93 R 3.4212 7.6422 115.4379 56.9264 27.7740 177.1757 94 V 3.3404 7.2937 116.0564 61.4154 32.4781 174.8404 95 D 4.4039 8.8773 127.9488 53.9913 41.6434 175.3338 96 P 3.8295 0.0000 0.0000 65.4887 31.0975 178.5850 97 S 4.1298 8.2262 113.2045 61.5675 62.5505 176.3419 98 N 4.2751 8.1071 119.8438 55.6950 38.1157 177.4116 99 F 4.4618 7.5494 119.6852 60.4162 38.9342 177.7632 100 K 3.9867 8.0192 117.7165 59.3832 31.9448 179.2139 101 I 3.3284 7.3399 120.1292 64.2720 36.9497 178.1983 102 L 3.9732 8.1055 121.3095 58.2676 41.9156 178.6674 103 N 4.3399 8.4576 116.6291 56.6270 38.4792 176.8239 104 H 4.2385 8.2862 119.5578 59.5612 29.9734 177.1526 105 C 4.2008 8.1542 118.5257 62.7904 27.9196 176.1888 106 I 3.7461 8.1942 121.8905 64.3076 36.7007 178.4376 107 L 3.7600 7.9762 119.8370 57.5952 41.4650 179.6851 108 V 3.4966 7.6531 118.1261 65.9414 31.4494 178.1191 109 V 3.5524 7.7771 117.8088 66.2723 31.4085 177.9958 110 I 3.7737 7.6756 119.3806 64.4246 36.5941 178.4303 111 S 4.1795 7.5223 113.4776 61.4625 62.2998 176.0070 112 T 4.0018 7.7637 111.7080 64.9066 68.6141 176.0397 113 M 3.9592 7.9754 120.3537 56.0914 33.7259 176.7119 114 F 4.9921 8.5042 116.7759 54.9921 39.6825 173.5985 115 P 4.3848 0.0000 0.0000 65.9300 31.6941 178.8811 116 K 4.2103 8.1118 117.1004 58.9757 32.2528 178.1007 117 E 4.1726 8.3026 117.3009 58.7777 30.1823 177.3494 118 F 4.6237 8.2497 123.0936 57.1806 37.8400 174.8025 119 T 4.2365 7.2761 116.0183 60.2559 71.5688 173.7181 120 P 4.0805 0.0000 0.0000 65.5820 31.2286 178.9019 121 E 3.8791 8.0226 116.8124 59.3282 29.3964 179.0450 122 A 3.9766 7.8057 120.7373 55.1675 18.2972 179.1548 123 H 3.7982 7.9068 117.1886 59.2692 29.9592 177.8256 124 V 3.5970 7.8994 121.1952 65.0370 30.9829 178.4872 125 S 4.2612 7.9131 115.4802 61.1904 62.7123 176.4506 126 L 4.1204 8.3151 123.3355 58.0732 41.8404 178.4879 127 D 4.4361 8.6215 118.3972 57.4042 41.2484 178.4084 128 K 4.0187 8.2585 119.0033 59.2775 31.9357 179.1109 129 F 4.1821 8.5840 121.1377 61.5004 39.3172 177.2740 130 L 3.6431 8.5360 118.9002 57.7299 41.3272 179.7847 131 S 4.1601 8.2134 115.4663 61.3980 62.7295 176.9021 132 G 3.4675 7.9294 108.5396 47.5611 0.0000 176.0038 133 V 3.2154 7.4993 120.5463 65.5937 31.4501 177.9629 134 A 3.3877 7.9040 120.8130 54.9388 17.9333 179.4110 135 L 3.7899 7.6832 117.7345 58.0706 42.5667 178.7341 136 A 4.0165 7.9288 120.8784 55.0242 17.8683 179.6321 137 L 3.8038 7.8930 117.3805 57.1185 41.5437 178.5779 138 A 3.1233 7.2585 118.7614 51.8281 18.4851 178.3734 139 E 3.8607 7.4209 118.1739 59.2652 29.7418 177.9408 140 R 4.5130 7.9858 113.9878 56.6880 30.5674 177.2596 141 Y 4.1293 8.3734 117.8339 60.6371 38.0477 176.3473 142 R 4.1803 7.7697 118.8481 56.5567 29.2476 174.4662 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 4.41 0.00 3.99 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 2 L 8.23 4.29 0.00 1.77 1.69 1.11 0.70 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 3 S 9.74 4.57 0.00 4.05 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 4 D 8.46 4.34 0.00 2.70 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 K 7.96 3.94 0.00 1.81 1.80 0.00 1.72 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.52 7.81 6 D 8.04 4.54 0.00 2.99 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 7 K 8.21 3.87 0.00 1.93 1.84 0.00 1.67 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.47 1.66 7.81 8 A 8.15 3.94 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 9 A 8.05 3.90 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 10 V 7.92 3.41 1.76 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 0.14 0.00 0.00 0.75 0.00 0.00 11 R 8.10 3.91 0.00 2.05 1.96 0.00 3.16 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.70 0.00 12 A 8.30 3.96 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 13 L 8.05 3.84 0.00 1.87 1.86 0.97 1.02 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 14 W 8.59 4.07 0.00 3.38 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 S 7.95 4.03 0.00 4.00 4.08 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 16 K 7.41 3.99 0.00 1.63 1.67 0.00 1.69 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.53 7.81 17 I 7.43 3.37 1.03 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.59 -0.13 0.00 0.00 18 G 7.34 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 K 7.67 3.97 0.00 1.86 1.87 0.00 1.55 0.00 0.00 1.66 0.00 0.00 3.29 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.29 1.53 7.81 20 S 7.84 4.75 0.00 4.15 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 21 S 7.82 4.21 0.00 4.30 4.29 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 22 D 8.18 4.37 0.00 2.80 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 A 7.99 4.03 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 24 I 8.18 3.79 2.13 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.92 1.02 0.00 0.00 25 G 8.48 3.65 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 0.00 0.00 0.00 26 N 8.30 4.31 0.00 2.83 2.99 0.00 0.00 6.88 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 27 D 8.37 4.31 0.00 2.87 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 28 A 8.41 4.03 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.09 4.09 0.00 1.85 1.78 1.09 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 30 S 8.27 4.19 0.00 4.08 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 31 R 8.20 3.98 0.00 2.13 2.07 0.00 3.18 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 2.00 0.00 32 M 8.22 4.25 0.00 2.35 2.25 0.00 0.00 0.00 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.70 0.00 33 I 7.95 3.89 1.96 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.77 1.05 0.00 0.00 34 V 7.31 3.72 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.99 0.00 0.00 35 V 8.25 3.69 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 0.28 0.00 0.00 0.96 0.00 0.00 36 Y 8.26 4.72 0.00 3.22 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 37 P 0.00 4.65 0.00 2.28 2.35 0.00 3.93 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.90 0.00 38 Q 8.20 4.09 0.00 2.27 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.95 0.00 0.00 0.00 0.00 0.00 2.49 2.41 0.00 39 T 8.26 4.10 4.41 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 1.38 0.00 0.00 40 K 8.10 4.27 0.00 2.03 1.95 0.00 1.93 0.00 0.00 1.97 0.00 0.00 3.03 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.56 1.56 7.81 41 I 7.34 3.52 1.55 0.00 0.00 -0.44 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 0.13 0.82 0.00 0.00 42 Y 7.04 3.96 0.00 2.05 2.28 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 43 F 7.31 4.22 0.00 2.52 1.45 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 44 S 7.54 4.16 0.00 3.93 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 45 H 8.07 4.58 0.00 3.40 3.48 0.00 5.52 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 46 W 7.85 4.76 0.00 3.53 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.45 0.00 2.20 2.22 0.00 3.84 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 1.99 1.93 0.00 48 D 7.61 4.67 0.00 2.83 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 49 V 8.22 4.61 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 0.96 0.00 0.00 1.07 0.00 0.00 50 T 7.90 4.78 4.27 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 1.25 0.00 0.00 51 P 0.00 4.23 0.00 2.08 2.07 0.00 3.85 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 2.06 2.13 0.00 52 G 8.76 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 53 S 7.54 4.43 0.00 3.96 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 0.00 54 P 0.00 4.14 0.00 2.05 2.07 0.00 3.52 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 55 N 7.70 3.71 0.00 2.04 1.42 0.00 0.00 7.13 7.21 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 56 I 7.22 3.77 2.08 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 1.65 1.23 0.94 0.00 0.00 57 K 8.37 3.94 0.00 1.87 1.83 0.00 1.64 0.00 0.00 1.63 0.00 0.00 3.07 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.57 1.58 7.81 58 A 8.02 3.95 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 59 H 8.64 4.33 0.00 3.59 3.47 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 60 G 8.40 3.66 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 0.00 0.00 0.00 61 K 8.09 4.08 0.00 2.05 1.90 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.66 1.71 7.81 62 K 7.94 3.96 0.00 1.95 1.87 0.00 1.80 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.50 1.71 7.81 63 V 7.87 3.58 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 1.03 0.00 0.00 64 M 8.39 4.28 0.00 2.31 2.28 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.01 2.94 0.00 65 G 8.23 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 66 G 8.07 3.58 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 0.00 67 I 7.84 3.55 1.82 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.81 0.59 0.00 0.00 68 A 8.02 3.32 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 69 L 7.93 3.85 0.00 1.84 1.85 0.91 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 70 A 7.81 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 71 V 7.84 3.53 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 0.86 0.00 0.00 0.19 0.00 0.00 72 S 7.81 4.19 0.00 4.04 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 73 K 8.09 4.54 0.00 1.78 1.77 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.54 7.81 74 I 7.33 3.82 2.13 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.01 0.95 0.00 0.00 75 D 8.03 4.52 0.00 2.71 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 76 D 8.11 4.70 0.00 2.62 2.47 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 0.00 77 L 8.20 3.92 0.00 1.64 1.57 0.76 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 78 K 7.89 3.82 0.00 1.70 1.81 0.00 1.94 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.50 7.81 79 T 8.00 4.11 4.28 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 1.20 0.00 0.00 80 G 8.13 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 81 L 7.89 4.59 0.00 1.62 1.55 0.71 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 82 M 7.77 3.97 0.00 2.10 2.20 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 2.83 2.62 0.00 83 E 8.19 3.99 0.00 2.02 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 2.41 2.42 0.00 84 L 7.89 4.09 0.00 1.89 1.70 0.93 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 85 S 8.33 4.38 0.00 3.98 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 86 E 8.41 4.15 0.00 2.19 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 2.42 0.00 87 Q 8.24 4.06 0.00 2.48 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.43 2.60 0.00 88 H 8.79 4.32 0.00 3.54 3.78 0.00 5.80 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 89 A 8.23 3.21 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 90 Y 8.04 4.16 0.00 2.94 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 91 K 7.90 4.23 0.00 1.75 2.01 0.00 1.79 0.00 0.00 1.89 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.38 1.46 7.81 92 L 7.88 4.06 0.00 1.63 1.62 0.72 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 93 R 7.64 3.42 0.00 1.87 1.83 0.00 3.07 0.00 0.00 3.01 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.43 0.00 94 V 7.29 3.34 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 -0.13 0.00 0.00 0.51 0.00 0.00 95 D 8.88 4.40 0.00 2.76 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 P 0.00 3.83 0.00 2.18 2.11 0.00 3.70 0.00 0.00 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.13 0.00 97 S 8.23 4.13 0.00 4.03 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 N 8.11 4.28 0.00 2.40 2.72 0.00 0.00 6.91 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 99 F 7.55 4.46 0.00 3.14 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 0.00 100 K 8.02 3.99 0.00 1.91 1.85 0.00 1.66 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.54 1.54 7.81 101 I 7.34 3.33 1.79 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.83 -0.02 0.00 0.00 102 L 8.11 3.97 0.00 1.79 1.73 0.99 0.97 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 0.00 103 N 8.46 4.34 0.00 2.98 2.89 0.00 0.00 6.66 8.89 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 0.00 104 H 8.29 4.24 0.00 3.29 3.51 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 0.00 105 C 8.15 4.20 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 0.00 106 I 8.19 3.75 2.05 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.99 0.97 0.00 0.00 107 L 7.98 3.76 0.00 1.85 1.73 1.14 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 108 V 7.65 3.50 2.20 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 0.99 0.00 0.00 0.88 0.00 0.00 109 V 7.78 3.55 2.22 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 1.06 0.00 0.00 0.97 0.00 0.00 110 I 7.68 3.77 1.40 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.46 0.69 0.00 0.00 111 S 7.52 4.18 0.00 3.91 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 0.00 112 T 7.76 4.00 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 1.28 0.00 0.00 113 M 7.98 3.96 0.00 1.27 1.98 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.40 0.00 114 F 8.50 4.99 0.00 3.10 3.16 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.38 0.00 2.22 2.24 0.00 3.82 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 116 K 8.11 4.21 0.00 1.84 1.96 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.48 1.50 7.81 117 E 8.30 4.17 0.00 2.09 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 2.31 2.40 0.00 118 F 8.25 4.62 0.00 3.11 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 0.00 119 T 7.28 4.24 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 1.25 0.00 0.00 120 P 0.00 4.08 0.00 2.12 2.08 0.00 3.55 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.13 0.00 121 E 8.02 3.88 0.00 2.01 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 2.37 2.40 0.00 122 A 7.81 3.98 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 0.00 123 H 7.91 3.80 0.00 2.38 3.18 0.00 5.62 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 V 7.90 3.60 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 0.84 0.00 0.00 0.92 0.00 0.00 125 S 7.91 4.26 0.00 3.90 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 0.00 126 L 8.32 4.12 0.00 2.03 1.93 1.06 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 127 D 8.62 4.44 0.00 3.12 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 0.00 128 K 8.26 4.02 0.00 2.08 1.89 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.65 7.81 129 F 8.58 4.18 0.00 3.10 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 0.00 130 L 8.54 3.64 0.00 1.71 1.81 1.01 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 131 S 8.21 4.16 0.00 4.01 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 0.00 132 G 7.93 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 0.00 0.00 0.00 0.00 133 V 7.50 3.22 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.06 0.00 0.00 134 A 7.90 3.39 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 0.00 135 L 7.68 3.79 0.00 1.64 1.74 0.86 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 136 A 7.93 4.02 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 0.00 137 L 7.89 3.80 0.00 0.99 1.14 -0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 138 A 7.26 3.12 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.42 3.86 0.00 1.99 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 2.33 2.46 0.00 140 R 7.99 4.51 0.00 2.08 2.26 0.00 3.48 0.00 0.00 3.30 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.88 0.00 141 Y 8.37 4.13 0.00 3.04 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 0.00 142 R 7.77 4.18 0.00 1.88 1.85 0.00 3.09 0.00 0.00 3.31 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 0.00