NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 L 4.4928 8.0385 120.6275 54.4714 43.6521 178.7094 23 A 3.8112 8.1299 122.7828 55.1121 18.4200 177.8296 24 D 4.3706 9.2233 118.7513 57.2538 41.1842 177.5228 25 S 4.1695 8.6849 116.1627 61.6043 62.8853 176.7114 26 K 3.9203 8.2274 120.9010 59.6880 31.8638 179.2942 27 A 4.0769 8.0656 121.0631 54.8854 18.2787 180.0784 28 V 3.7025 8.2621 118.2994 64.7943 31.6481 178.5372 29 L 4.2260 8.4687 120.0916 57.8538 41.5141 179.1103 30 N 4.2936 8.2958 116.8951 56.3980 38.8149 176.4912 31 Q 4.2163 8.2448 120.8783 59.4406 29.0780 178.2100 32 A 4.2201 8.2580 121.5320 55.4414 18.4316 179.4348 33 V 3.6199 8.0822 116.2680 66.3118 31.5386 177.8422 34 A 4.2695 8.4646 120.0787 55.7586 18.2971 179.4510 35 D 4.3859 8.7755 117.5673 57.2496 40.8662 179.0210 36 L 4.0781 8.8260 120.1402 58.0405 41.5376 179.6316 37 S 3.8817 7.8865 115.0021 61.5670 62.4974 177.0518 38 V 3.6319 7.6772 120.1666 65.7120 31.2787 177.9131 39 A 3.9996 8.5484 120.9634 55.4015 18.1061 179.1248 40 H 4.0454 8.6400 117.1604 59.3608 29.9713 177.3963 41 S 4.0599 7.8732 115.0069 61.4774 62.2290 176.2846 42 I 3.6807 8.0159 122.6482 64.4190 36.8875 178.4129 43 L 3.9644 8.2611 120.2581 57.9935 41.4036 179.1031 44 H 3.7094 8.1917 118.4000 58.9814 29.5962 177.0980 45 Q 4.1923 7.9569 121.3834 59.2213 28.7672 178.3497 46 V 3.6267 7.8612 119.2512 66.2193 31.3125 177.2666 47 H 4.1331 7.9988 116.6879 59.3359 29.7449 176.9732 48 W 4.6863 8.0658 119.0866 59.7837 29.1986 177.5284 49 Y 4.3076 8.6126 114.8790 57.3151 37.7547 175.3202 50 M 4.4031 7.5753 121.0092 56.0343 32.8812 175.5766 51 R 4.6358 8.8520 123.4524 55.6635 34.5946 173.7455 52 G 3.9719 8.9978 106.5284 43.7165 0.0000 173.3900 53 R 4.1849 8.3861 118.5196 57.8316 30.3808 177.6350 54 G 4.2253 9.3609 110.6703 45.1860 0.0000 174.7700 55 F 4.0783 8.5984 122.2851 61.9512 39.0594 176.7861 56 M 4.2579 8.2500 115.5535 58.2886 32.0310 177.3015 57 I 3.7450 7.5353 118.1726 63.2267 38.6159 177.4272 58 W 4.1344 8.1750 119.5265 59.0353 28.7387 178.3418 59 H 3.9493 8.1523 118.5523 58.6505 29.4483 175.3913 60 P 4.2629 0.0000 0.0000 65.3078 31.2865 178.1185 61 K 3.5535 7.4218 119.5166 59.4258 31.9426 178.4857 62 M 4.0167 7.7951 118.7444 58.4263 31.8303 178.3029 63 D 4.1907 7.6213 119.0276 57.3039 40.9797 178.6655 64 E 3.8868 7.8730 118.3875 59.6877 29.4711 178.9171 65 Y 4.4591 7.5821 116.4529 61.4282 37.9860 178.3197 66 M 4.0567 8.5544 119.9833 58.7211 32.0813 178.6963 67 E 3.9496 8.2658 118.3876 59.3355 29.7010 179.1343 68 E 3.6609 8.2297 119.2547 59.1427 29.6800 178.7603 69 I 3.7418 8.0663 120.2420 64.7107 37.2276 178.0598 70 D 4.3992 8.6581 120.0224 57.1562 40.5570 179.0957 71 G 3.4894 8.0032 106.1664 48.0052 0.0000 175.1963 72 Y 4.3121 7.2510 119.4516 60.6093 37.8567 178.1963 73 L 3.9714 8.0864 121.3404 58.6554 42.1095 178.7579 74 D 4.2704 8.1143 117.4575 57.2173 41.2377 177.7213 75 E 3.9061 8.2988 119.8952 59.5253 29.6285 178.7938 76 M 3.8930 8.5637 118.9841 58.4077 32.0655 178.6169 77 S 4.1084 8.2611 113.4518 61.6107 62.5494 176.1445 78 E 4.0260 8.3131 121.1922 59.1263 29.0781 179.3022 79 R 3.8387 7.9852 119.0520 59.0455 30.0398 178.0849 80 L 3.8972 7.9823 120.2439 58.3811 42.0645 178.9572 81 I 3.8237 7.6966 119.4370 64.9664 36.8562 178.5458 82 T 3.9062 7.7828 115.0322 66.4231 68.3497 175.8417 83 L 4.3466 7.9177 118.2222 55.0066 41.7947 177.6429 84 G 3.8424 8.1425 107.7694 45.3502 0.0000 173.9174 85 G 3.8098 7.9083 109.1884 43.8151 0.0000 173.7081 86 A 4.4258 7.9581 121.1210 49.5103 20.3383 174.1613 87 P 4.5431 0.0000 0.0000 62.5623 32.4787 176.6140 88 F 4.6558 8.4395 119.7653 58.7708 39.2062 176.4703 89 S 4.8342 8.6271 120.9379 56.4796 63.3937 174.4821 90 T 4.5459 6.7477 109.4984 60.0290 73.0158 173.2592 91 L 4.0992 8.3730 122.4797 57.8665 41.6872 179.7277 92 K 3.8437 7.8504 119.0030 59.6280 32.2933 178.5428 93 E 3.6669 7.7503 118.5159 59.1570 29.1511 179.3055 94 F 4.4141 7.4446 117.7531 60.8609 38.8181 177.7453 95 S 4.1203 8.1285 111.3239 61.0072 62.2757 175.2601 96 E 4.2699 7.9528 119.3775 57.3760 29.7585 177.2536 97 N 4.5847 7.5833 114.6006 52.7760 39.6703 175.3197 98 S 4.5037 7.1789 115.5623 58.0779 63.0015 174.0370 99 Q 4.1575 8.6305 125.4543 57.2640 29.0127 176.6806 100 L 3.9997 7.1797 117.8735 53.9289 42.3249 176.1272 101 K 4.5242 8.2101 121.8663 54.5703 34.7789 175.1749 102 E 4.6396 8.5778 124.7036 54.7980 31.5381 175.5865 103 V 4.4511 7.7552 114.1046 58.8428 34.6978 175.7389 104 L 3.9199 8.3481 121.3524 54.7785 41.9473 177.8879 105 G 2.4839 8.1173 111.1611 45.6365 0.0000 172.5637 106 D 4.4612 7.3229 122.0734 52.8057 43.8066 174.8721 107 Y 4.9574 8.7074 123.8786 60.0446 38.2320 176.5747 108 N 4.6252 8.5011 116.2691 54.3491 39.1813 175.7424 109 V 3.6875 7.8912 117.2780 63.6315 32.0720 176.1732 110 T 4.3237 8.3696 116.6475 60.9673 70.9535 175.9086 111 I 3.6585 8.2867 122.7351 64.9021 37.1768 178.1698 112 E 3.8101 8.2004 118.4941 59.7651 29.2823 179.3322 113 E 3.9309 8.4001 118.4346 59.3430 29.4352 179.4508 114 Q 3.9225 8.0794 118.0706 59.0303 28.7445 178.8549 115 L 3.6504 7.9015 119.8529 57.6485 41.4581 179.5296 116 A 3.8625 7.8391 120.7155 54.9145 18.2895 179.5840 117 R 3.7236 7.9934 117.3154 59.6029 30.0988 178.9272 118 V 3.2677 7.7120 118.0206 65.6659 31.3212 178.0362 119 V 3.5016 7.8456 120.7237 66.5982 31.2910 178.3160 120 E 4.0917 8.2731 118.1459 61.2499 29.5234 180.8441 121 V 3.8373 7.7483 119.5184 66.0998 31.4332 178.2091 122 F 4.3742 8.6875 117.6857 60.6447 38.8128 177.7755 123 R 3.9162 8.9527 118.8733 59.3961 29.8734 178.3014 124 Y 3.8912 8.2686 119.2749 60.7754 38.8181 178.2148 125 L 3.4378 8.1195 119.5332 57.6007 41.5806 179.4803 126 A 3.8626 7.9637 120.5440 54.9074 18.2248 179.6384 127 A 3.7314 7.6136 119.1013 55.0894 18.4973 179.3075 128 L 3.5423 7.6386 119.1628 58.5403 41.9650 179.3943 129 F 4.4269 8.0434 117.7972 60.3815 38.7199 177.3669 130 Q 3.8933 8.2802 119.5368 59.1147 28.7853 178.1227 131 K 3.8454 8.0955 120.8046 59.6619 32.1005 178.8122 132 G 2.4015 7.5203 105.5949 47.1557 0.0000 175.2482 133 F 4.0616 8.3829 123.6303 61.1706 39.3700 176.8861 134 D 4.3872 8.5437 118.5954 57.5249 40.7975 178.8257 135 V 3.5584 7.9894 119.2001 66.2276 31.5535 178.1841 136 S 4.3379 8.0156 115.1075 60.4264 63.0265 175.8753 137 D 4.1831 8.0445 121.9593 57.0677 40.7191 177.6718 138 E 3.8862 7.9285 118.3598 59.5810 29.7471 178.4313 139 E 4.1963 7.8645 115.4524 56.9281 29.5942 177.8710 140 G 3.8215 7.5021 106.3486 46.5684 0.0000 174.9394 141 D 4.6103 7.6213 121.4948 52.4572 38.8475 176.5454 142 S 4.0657 8.0053 119.4846 60.7031 63.4254 176.6241 143 V 3.5145 7.6655 121.2973 66.3576 31.3827 178.0082 144 T 3.7417 7.9930 114.8450 66.3191 68.2562 175.7750 145 N 4.2723 8.0036 120.4529 56.1313 38.9259 176.3212 146 D 4.3586 8.1366 119.0868 57.3690 41.4262 177.9533 147 I 3.5198 7.5128 120.1755 64.6892 37.0263 178.4238 148 F 3.9438 7.8926 118.2567 60.2566 38.6548 177.3877 149 N 4.3194 8.3033 116.8581 56.6965 38.6421 177.1131 150 V 3.5360 8.2333 119.8448 65.9517 31.6191 177.8983 151 A 3.4672 7.4565 121.5042 54.0130 17.9095 179.3288 152 K 3.9920 8.1511 118.3471 59.7539 32.3115 178.5259 153 A 3.9675 8.0343 120.9171 55.4815 18.2731 179.6507 154 S 4.0605 7.8290 111.2775 61.5337 62.4908 176.3177 155 I 3.5778 7.8812 122.5476 64.2939 36.7455 178.2120 156 E 4.0028 8.4164 119.5378 59.2963 29.4354 179.0650 157 K 4.1394 8.0444 119.5185 60.2585 32.2223 178.4156 158 H 4.4405 8.3018 116.1919 58.9513 28.5360 177.8497 159 I 3.8264 8.1253 121.7625 64.0338 36.9727 177.9794 160 W 4.4473 8.4936 129.2562 61.0952 30.5119 177.9145 161 M 3.2841 7.7396 117.9196 58.1363 31.3607 178.8666 162 L 4.0183 8.5044 119.4621 57.8689 41.6870 179.6331 163 Q 3.9596 8.5357 118.2206 58.7373 28.6577 178.4292 164 A 4.1258 8.5163 122.1897 55.3859 18.1971 179.2076 165 E 4.0025 8.0826 116.3240 59.3206 29.7519 178.1481 166 L 4.3922 7.5621 116.0427 54.2936 41.6996 177.3627 167 G 3.9277 7.9965 106.6843 46.1032 0.0000 173.5421 168 Q 4.6556 8.0537 117.0928 53.1551 31.8992 175.2646 169 A 4.4265 8.2563 122.3725 51.2436 19.2875 176.3066 170 P 4.4033 0.0000 0.0000 64.2582 31.7064 177.6366 171 K 3.8457 8.1257 114.9627 56.9286 29.5500 175.0512 172 L 4.1718 8.0470 121.9674 55.3328 41.4847 177.7104 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 22 L 8.04 4.49 0.00 1.72 1.74 0.91 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 23 A 8.13 3.81 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 24 D 9.22 4.37 0.00 2.87 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 25 S 8.68 4.17 0.00 4.06 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 26 K 8.23 3.92 0.00 1.98 1.85 0.00 1.65 0.00 0.00 1.63 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.67 7.81 27 A 8.07 4.08 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 28 V 8.26 3.70 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 0.92 0.00 0.00 0.78 0.00 0.00 29 L 8.47 4.23 0.00 1.91 1.80 0.92 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 30 N 8.30 4.29 0.00 2.76 2.56 0.00 0.00 6.85 7.16 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 31 Q 8.24 4.22 0.00 2.50 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.51 0.00 0.00 0.00 0.00 0.00 2.49 2.78 0.00 32 A 8.26 4.22 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 0.00 0.00 0.00 0.00 0.00 0.00 33 V 8.08 3.62 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 1.34 0.00 0.00 1.03 0.00 0.00 34 A 8.46 4.27 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 0.00 0.00 0.00 0.00 0.00 35 D 8.78 4.39 0.00 2.86 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 L 8.83 4.08 0.00 1.77 1.80 1.18 1.34 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 37 S 7.89 3.88 0.00 3.36 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 38 V 7.68 3.63 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 1.07 0.00 0.00 1.02 0.00 0.00 39 A 8.55 4.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.64 4.05 0.00 3.26 3.45 0.00 5.60 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 S 7.87 4.06 0.00 3.91 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 42 I 8.02 3.68 1.96 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.90 0.86 0.00 0.00 43 L 8.26 3.96 0.00 1.70 1.68 1.15 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 44 H 8.19 3.71 0.00 2.98 2.68 0.00 5.59 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 7.96 4.19 0.00 2.23 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.57 0.00 0.00 0.00 0.00 0.00 2.34 2.31 0.00 46 V 7.86 3.63 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 0.95 0.00 0.00 1.03 0.00 0.00 47 H 8.00 4.13 0.00 3.11 3.25 0.00 6.00 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 W 8.07 4.69 0.00 3.71 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 49 Y 8.61 4.31 0.00 3.20 3.05 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 50 M 7.58 4.40 0.00 2.32 2.43 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.79 0.00 51 R 8.85 4.64 0.00 2.00 1.79 0.00 3.30 0.00 0.00 3.17 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.98 0.00 52 G 9.00 3.97 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 0.00 0.00 0.00 53 R 8.39 4.18 0.00 1.87 1.96 0.00 3.38 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.62 0.00 54 G 9.36 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 F 8.60 4.08 0.00 3.40 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 56 M 8.25 4.26 0.00 2.08 2.22 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.72 0.00 57 I 7.54 3.75 1.66 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.35 0.54 0.00 0.00 58 W 8.17 4.13 0.00 3.54 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 0.00 59 H 8.15 3.95 0.00 1.71 2.56 0.00 5.95 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 P 0.00 4.26 0.00 2.17 2.22 0.00 3.66 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 2.06 1.97 0.00 61 K 7.42 3.55 0.00 1.50 1.77 0.00 0.91 0.00 0.00 1.08 0.00 0.00 2.60 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.01 0.74 7.81 62 M 7.80 4.02 0.00 2.04 2.22 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 3.01 0.00 63 D 7.62 4.19 0.00 2.70 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 64 E 7.87 3.89 0.00 1.86 1.91 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 2.29 2.23 0.00 65 Y 7.58 4.46 0.00 3.25 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 66 M 8.55 4.06 0.00 1.89 2.13 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.31 0.00 67 E 8.27 3.95 0.00 2.17 1.95 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 2.29 2.42 0.00 68 E 8.23 3.66 0.00 2.06 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 1.75 2.17 0.00 69 I 8.07 3.74 2.11 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 1.93 0.83 1.03 0.00 0.00 70 D 8.66 4.40 0.00 2.76 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 71 G 8.00 3.49 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 0.00 72 Y 7.25 4.31 0.00 3.21 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 73 L 8.09 3.97 0.00 1.87 1.83 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 74 D 8.11 4.27 0.00 2.87 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 E 8.30 3.91 0.00 2.19 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 2.23 2.31 0.00 76 M 8.56 3.89 0.00 2.00 2.20 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.01 0.00 77 S 8.26 4.11 0.00 3.94 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 78 E 8.31 4.03 0.00 2.24 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 2.32 2.31 0.00 79 R 7.99 3.84 0.00 1.94 1.99 0.00 3.12 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 80 L 7.98 3.90 0.00 1.78 1.89 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 81 I 7.70 3.82 2.01 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 1.52 0.74 0.91 0.00 0.00 82 T 7.78 3.91 4.37 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 1.19 0.00 0.00 83 L 7.92 4.35 0.00 1.74 1.69 0.96 1.09 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 84 G 8.14 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 0.00 0.00 0.00 85 G 7.91 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 A 7.96 4.43 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 P 0.00 4.54 0.00 2.26 2.06 0.00 3.78 0.00 0.00 3.63 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 88 F 8.44 4.66 0.00 3.37 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 89 S 8.63 4.83 0.00 4.02 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 90 T 6.75 4.55 4.10 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 1.18 0.00 0.00 91 L 8.37 4.10 0.00 1.73 1.83 1.01 1.09 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 92 K 7.85 3.84 0.00 1.76 1.71 0.00 1.68 0.00 0.00 1.77 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.55 1.49 7.81 93 E 7.75 3.67 0.00 1.85 1.48 0.00 0.00 0.00 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 94 F 7.44 4.41 0.00 3.25 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 95 S 8.13 4.12 0.00 4.09 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 96 E 7.95 4.27 0.00 1.94 1.91 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 2.25 2.39 0.00 97 N 7.58 4.58 0.00 2.27 2.70 0.00 0.00 6.93 7.29 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 98 S 7.18 4.50 0.00 3.99 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 99 Q 8.63 4.16 0.00 1.72 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.68 0.00 0.00 0.00 0.00 0.00 2.48 2.74 0.00 100 L 7.18 4.00 0.00 1.45 1.44 0.88 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.21 4.52 0.00 1.58 1.57 0.00 1.60 0.00 0.00 1.67 0.00 0.00 3.03 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.25 1.42 7.81 102 E 8.58 4.64 0.00 1.96 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.28 0.00 103 V 7.76 4.45 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 0.70 0.00 0.00 0.85 0.00 0.00 104 L 8.35 3.92 0.00 1.54 1.51 0.90 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 105 G 8.12 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.32 4.46 0.00 2.45 2.41 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 0.00 107 Y 8.71 4.96 0.00 3.11 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 0.00 108 N 8.50 4.63 0.00 2.90 2.92 0.00 0.00 6.87 6.98 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 0.00 109 V 7.89 3.69 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 0.84 0.00 0.00 0.98 0.00 0.00 110 T 8.37 4.32 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 0.00 111 I 8.29 3.66 1.87 0.00 0.00 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 1.87 1.22 0.81 0.00 0.00 112 E 8.20 3.81 0.00 1.96 1.95 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 2.36 2.40 0.00 113 E 8.40 3.93 0.00 2.13 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 2.30 2.32 0.00 114 Q 8.08 3.92 0.00 2.13 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.61 2.59 0.00 115 L 7.90 3.65 0.00 1.50 1.29 -0.15 0.11 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 0.00 116 A 7.84 3.86 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 0.00 117 R 7.99 3.72 0.00 1.88 2.13 0.00 3.04 0.00 0.00 3.03 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.57 0.00 118 V 7.71 3.27 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 -0.08 0.00 0.00 0.81 0.00 0.00 119 V 7.85 3.50 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 0.92 0.00 0.00 0.85 0.00 0.00 120 E 8.27 4.09 0.00 2.00 1.95 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 2.25 2.20 0.00 121 V 7.75 3.84 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 1.10 0.00 0.00 0.96 0.00 0.00 122 F 8.69 4.37 0.00 3.22 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 0.00 123 R 8.95 3.92 0.00 1.96 2.01 0.00 3.15 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.91 0.00 124 Y 8.27 3.89 0.00 3.09 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 L 8.12 3.44 0.00 1.61 0.93 0.99 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 126 A 7.96 3.86 1.28 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 0.00 0.00 127 A 7.61 3.73 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 0.00 128 L 7.64 3.54 0.00 0.97 1.32 0.88 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 129 F 8.04 4.43 0.00 3.13 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 Q 8.28 3.89 0.00 2.08 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.74 0.00 0.00 0.00 0.00 0.00 2.29 2.51 0.00 131 K 8.10 3.85 0.00 1.86 1.77 0.00 1.61 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.41 7.81 132 G 7.52 2.40 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 0.00 133 F 8.38 4.06 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 0.00 134 D 8.54 4.39 0.00 2.83 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 0.00 135 V 7.99 3.56 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 1.04 0.00 0.00 0.90 0.00 0.00 136 S 8.02 4.34 0.00 4.26 4.16 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 0.00 137 D 8.04 4.18 0.00 2.46 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 0.00 138 E 7.93 3.89 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 2.31 2.50 0.00 139 E 7.86 4.20 0.00 1.98 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 2.33 2.30 0.00 140 G 7.50 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 0.00 0.00 0.00 141 D 7.62 4.61 0.00 2.82 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 0.00 142 S 8.01 4.07 0.00 4.04 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 0.00 143 V 7.67 3.51 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 1.01 0.00 0.00 0.90 0.00 0.00 144 T 7.99 3.74 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 145 N 8.00 4.27 0.00 2.67 2.86 0.00 0.00 6.55 8.56 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 0.00 146 D 8.14 4.36 0.00 2.76 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 0.00 147 I 7.51 3.52 1.59 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.02 0.52 0.00 0.00 148 F 7.89 3.94 0.00 3.38 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 0.00 149 N 8.30 4.32 0.00 3.31 3.03 0.00 0.00 6.82 7.77 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 0.00 150 V 8.23 3.54 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 0.98 0.00 0.00 1.06 0.00 0.00 151 A 7.46 3.47 -0.12 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 0.00 152 K 8.15 3.99 0.00 2.07 2.00 0.00 1.63 0.00 0.00 1.54 0.00 0.00 3.03 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.53 7.81 153 A 8.03 3.97 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 0.00 154 S 7.83 4.06 0.00 3.96 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 0.00 155 I 7.88 3.58 1.86 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.84 0.59 0.00 0.00 156 E 8.42 4.00 0.00 2.22 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 2.35 2.47 0.00 157 K 8.04 4.14 0.00 2.07 2.05 0.00 1.73 0.00 0.00 1.80 0.00 0.00 3.07 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.66 1.90 7.81 158 H 8.30 4.44 0.00 3.51 3.47 0.00 5.68 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 I 8.13 3.83 2.14 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.05 1.00 0.00 0.00 160 W 8.49 4.45 0.00 3.40 3.52 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 0.00 161 M 7.74 3.28 0.00 1.98 2.17 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 1.15 0.00 162 L 8.50 4.02 0.00 1.68 1.58 0.71 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 163 Q 8.54 3.96 0.00 2.35 2.47 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 2.48 2.57 0.00 164 A 8.52 4.13 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 0.00 165 E 8.08 4.00 0.00 2.21 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 0.00 2.32 2.43 0.00 166 L 7.56 4.39 0.00 1.79 1.63 0.80 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 0.00 167 G 8.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 Q 8.05 4.66 0.00 2.10 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.89 0.00 0.00 0.00 0.00 0.00 2.28 2.41 0.00 169 A 8.26 4.43 1.28 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 0.00 0.00 170 P 0.00 4.40 0.00 2.12 2.27 0.00 3.89 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 2.08 2.36 0.00 171 K 8.13 3.85 0.00 1.90 1.88 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.66 7.81 172 L 8.05 4.17 0.00 1.63 1.59 0.93 0.94 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