NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2604 8.3044 120.3480 54.7536 33.2996 174.8559 2 L 3.8570 8.2481 123.7243 54.6561 41.3591 174.7492 3 T 4.0179 8.5959 121.9421 63.6361 69.0596 173.5331 4 D 4.7048 7.7009 120.7211 51.2245 43.1853 173.8960 5 P 4.2998 0.0000 0.0000 66.0447 31.5536 178.0803 6 I 3.4702 7.9270 117.2717 65.0448 36.9380 177.7568 7 A 3.9591 8.3841 121.0122 55.4656 18.1697 179.0352 8 D 4.1839 7.6196 115.6007 57.3843 41.3025 177.5456 9 M 3.7954 8.0827 118.3962 59.0591 32.1514 177.9594 10 L 3.7950 7.8230 118.3659 58.7056 41.9442 179.8541 11 T 3.7846 8.1458 115.1730 66.7256 68.3533 177.0126 12 R 3.8776 8.4479 120.2428 59.3255 30.2644 178.8694 13 I 3.6391 7.9737 120.0124 64.4630 37.0703 178.4977 14 R 3.7684 8.0863 119.4245 59.5295 29.7709 178.3820 15 N 4.3744 7.9757 114.3956 55.4290 38.6154 177.0855 16 A 4.1932 7.9755 122.9463 55.1013 18.1585 179.0738 17 T 3.7188 7.5402 107.9150 65.5471 68.3013 176.3036 18 R 4.5208 7.6249 120.8431 57.5137 30.1173 177.7370 19 V 4.4836 7.4782 110.3499 60.4459 32.5807 175.2831 20 Y 4.3256 8.7831 115.1366 57.8208 35.8146 171.9704 21 K 4.2720 7.8804 117.0578 56.2141 33.1322 177.6178 22 E 4.2624 8.8030 123.5930 59.3015 30.6273 176.2426 23 S 4.6585 7.6822 110.6974 57.2389 65.7500 173.1942 24 T 4.6473 8.6298 118.1189 60.4872 70.8409 172.1593 25 D 5.4727 8.6106 127.1236 53.2348 42.9169 176.1893 26 V 4.7502 8.7957 114.2017 58.8838 36.7043 172.9106 27 P 3.5271 0.0000 0.0000 62.5513 31.4691 176.3455 28 A 4.3534 8.3015 126.6737 50.8912 19.8424 176.3743 29 S 5.3781 8.8311 121.5932 58.7275 63.5250 178.1443 30 R 3.5400 7.1665 121.5796 58.9250 31.0350 177.7688 31 F 4.4558 8.4324 119.0653 62.0814 39.6967 177.7485 32 K 3.5803 7.7647 116.2805 59.0587 31.7121 178.7696 33 E 3.6129 8.2914 119.9874 58.8491 29.5642 177.7657 34 E 4.1573 8.1810 116.7071 59.8910 29.8238 179.0090 35 I 3.6398 7.5564 119.1104 64.6634 37.1708 178.1981 36 L 3.8326 7.5126 118.9504 58.0424 41.4007 179.5605 37 R 4.1277 8.6684 119.5672 59.6668 29.8334 178.7193 38 I 3.7869 8.2986 119.6702 64.4344 37.2821 178.2259 39 L 3.9994 8.0287 118.9835 57.7821 41.3420 179.1714 40 A 4.5559 8.1045 122.2496 54.2721 18.5161 179.3094 41 R 3.9083 8.0628 116.3973 59.6977 30.0636 178.1465 42 E 4.3244 8.4018 117.6192 59.4659 29.8932 176.5837 43 G 3.6722 7.9968 106.9315 45.6963 0.0000 174.9424 44 F 4.1479 8.5406 118.9961 59.8367 39.1753 175.6340 45 I 4.7336 8.1174 113.0904 58.5244 40.2309 176.1611 46 K 3.7499 8.6212 123.9141 58.8336 32.3358 176.7232 47 G 4.4702 7.2578 103.9591 43.4239 0.0000 170.6990 48 Y 6.1868 7.7035 117.5750 54.8807 41.4932 174.0616 49 E 4.6975 8.7476 116.2133 54.5931 33.6077 174.4679 50 R 4.7463 8.6187 120.3348 56.4851 30.9568 176.1761 51 V 4.6011 9.9099 123.3969 61.3801 35.9341 173.5547 52 D 5.3947 8.7622 124.6632 52.9497 42.2143 176.4183 53 V 3.9459 9.3830 126.0041 61.5534 32.5312 174.9333 54 D 4.2217 9.2053 129.8666 55.3271 38.8405 175.6077 55 G 4.0283 8.0097 104.9627 46.3207 0.0000 173.3727 56 K 4.4254 7.7447 119.6058 54.8024 33.2744 174.2423 57 P 4.9560 0.0000 0.0000 63.4970 32.2059 174.7858 58 Y 4.8722 9.2933 118.0752 57.4502 43.5305 173.1303 59 L 5.4842 9.4019 121.1629 53.2650 44.8794 176.1009 60 R 4.7817 9.3636 124.0240 54.8683 31.6038 175.4422 61 V 4.3938 8.7016 125.9715 62.0468 33.4094 174.5323 62 Y 4.7823 9.3924 126.8105 56.1804 38.3690 175.3112 63 L 4.4117 8.1813 123.7599 55.0072 42.6063 176.7679 64 K 4.9252 8.2072 120.8155 55.4148 35.8874 174.4052 65 Y 4.7131 8.4379 120.6761 57.2175 43.0538 173.5777 66 G 4.4511 8.6778 108.3042 44.8744 0.0000 171.7333 67 P 4.8625 0.0000 0.0000 61.3202 33.6714 175.4030 68 R 3.9698 8.4560 120.7737 57.0895 30.3921 176.4425 69 R 4.4764 8.2900 125.5950 55.5675 31.9679 175.5744 70 Q 4.3033 8.5452 118.9754 55.5557 30.6484 178.0853 71 G 3.8411 8.4702 108.8178 44.9018 0.0000 171.7746 72 P 4.3321 0.0000 0.0000 63.0936 32.2296 175.3552 73 D 4.2516 8.3806 116.3186 55.0759 38.7829 170.7648 74 P 4.6282 0.0000 0.0000 62.2738 32.0485 176.7531 75 R 3.6444 8.0982 118.8526 56.5079 29.7605 174.6528 76 P 4.6770 0.0000 0.0000 61.2016 32.9702 175.4152 77 E 4.4509 8.8180 122.0772 55.7739 30.9837 176.0802 78 Q 4.3799 8.7353 124.8735 56.2786 29.3035 176.1152 79 V 4.0646 8.1117 118.2423 62.7620 33.1634 175.6622 80 I 4.7259 7.1977 119.4233 59.8490 37.4165 174.7871 81 H 4.3222 8.9254 121.7063 58.2171 29.2700 175.5326 82 H 4.4829 7.8998 119.0650 54.0085 32.5958 172.6450 83 I 4.2573 7.4856 125.3553 60.2848 39.7076 173.3057 84 R 4.5033 8.8623 130.3663 54.1880 33.6759 174.6350 85 R 4.0208 8.4921 125.8314 57.5442 30.9302 174.6083 86 I 4.5425 8.4780 120.4879 61.9623 39.8562 176.1140 87 S 4.1589 7.2726 119.5865 59.1186 63.5761 174.1720 88 K 4.6864 8.9157 125.1430 53.4962 36.2266 173.9603 89 P 4.3924 0.0000 0.0000 64.5537 31.3400 176.4275 90 G 3.7994 8.5747 109.4402 44.6988 0.0000 173.9170 91 R 5.5229 7.0155 132.7329 56.7706 32.5772 173.8124 92 R 4.1382 7.3068 118.8285 56.1381 31.4422 177.0892 93 V 4.2367 8.9404 120.6484 61.6029 34.1260 173.7121 94 Y 5.2032 8.6123 125.3266 56.3411 40.1027 175.8426 95 V 4.5733 8.8431 115.5135 59.5574 36.1185 175.0079 96 G 4.1829 8.7329 110.2436 45.4373 0.0000 175.6056 97 V 3.6801 8.4334 123.2730 64.6802 31.6686 178.2340 98 K 4.2689 8.0230 117.1230 57.4743 31.9691 177.0281 99 E 4.5799 10.1976 116.7429 55.5758 30.5786 175.8640 100 I 3.7380 7.4786 120.9018 60.6258 37.0663 174.4342 101 P 4.4880 0.0000 0.0000 62.7293 31.8972 175.6256 102 R 4.6286 8.2631 117.8090 54.3928 32.4944 175.7719 103 V 4.2210 8.1058 120.9641 62.7341 33.8387 175.2392 104 R 3.5367 9.0604 120.7920 59.7577 26.9008 176.5719 105 R 3.6222 8.5882 119.0691 56.9572 28.3140 176.5199 106 G 4.3185 8.2981 110.1610 45.7683 0.0000 175.3357 107 L 3.9479 8.0095 119.1907 57.4131 41.7370 177.6170 108 G 4.4896 7.7216 104.4313 44.9897 0.0000 172.7920 109 I 5.1638 9.5049 112.0797 59.0195 41.6317 174.2637 110 A 4.9847 9.0401 125.0080 50.3736 21.7026 175.2232 111 I 4.6759 8.4603 124.5327 60.3781 38.7226 175.0620 112 L 5.1456 9.0175 127.9934 52.9661 44.8567 175.5231 113 S 5.2307 9.5782 118.7781 56.9844 64.1863 173.0164 114 T 5.1626 8.6356 116.9694 59.4670 71.9117 175.2257 115 S 3.8632 9.0535 117.1918 60.6633 62.8847 175.1213 116 K 4.4047 7.8792 120.0142 56.3447 32.3566 176.0903 117 G 3.8914 8.7645 106.5959 44.2550 0.0000 173.4323 118 V 4.3889 8.0882 119.0782 62.6216 32.0828 174.9879 119 L 5.2276 9.3419 127.4221 53.1415 46.4249 175.0455 120 T 4.9657 8.4022 109.9321 60.8833 70.6198 176.4824 121 D 4.3496 9.6408 126.6523 56.1921 40.1911 179.1528 122 R 3.9286 7.9959 119.6936 58.5526 29.8655 178.3577 123 E 3.9352 8.1070 117.8425 59.9058 29.8380 179.5865 124 A 4.0967 8.1887 120.3874 55.2058 18.3878 179.4792 125 R 3.8115 8.1527 116.4991 59.5328 30.3994 178.2376 126 K 4.1697 8.2365 119.3386 58.9293 32.0536 177.8533 127 L 4.3862 7.9168 116.5336 54.0693 41.6186 177.0068 128 G 3.9483 7.6483 105.7688 46.4338 0.0000 173.8235 129 V 4.5455 7.6025 111.0430 59.7233 35.7919 173.9504 130 G 4.2379 7.5970 108.3171 45.6347 0.0000 174.0875 131 G 4.2094 7.2716 109.1479 46.1482 0.0000 173.6909 132 E 4.2102 8.8851 127.7269 55.6890 30.8513 175.6197 133 L 4.2202 8.7910 130.6042 54.8398 42.2148 177.1894 134 I 4.0164 8.9831 128.5227 63.3596 37.5950 175.8126 135 C 5.0822 7.6854 114.6512 56.6449 33.9668 171.3259 136 E 4.9601 9.2391 121.0573 54.4841 31.6558 174.8951 137 V 4.6878 8.9174 126.2335 60.3859 35.9650 175.3669 138 W 4.4688 8.5019 121.9767 57.7428 28.7466 174.2448 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 8.30 4.26 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.53 0.00 2 L 8.25 3.86 0.00 1.72 1.60 0.90 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 3 T 8.60 4.02 4.33 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 1.20 0.00 0.00 4 D 7.70 4.70 0.00 2.64 2.46 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 5 P 0.00 4.30 0.00 2.20 2.05 0.00 3.69 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.16 0.00 6 I 7.93 3.47 1.84 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.24 0.76 0.00 0.00 7 A 8.38 3.96 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 8 D 7.62 4.18 0.00 2.97 2.83 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.08 3.80 0.00 2.16 2.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.52 0.00 10 L 7.82 3.79 0.00 1.80 1.60 0.78 0.36 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 11 T 8.15 3.78 4.36 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 1.17 0.00 0.00 12 R 8.45 3.88 0.00 1.94 1.94 0.00 3.15 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.79 0.00 13 I 7.97 3.64 1.92 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 1.34 1.29 0.82 0.00 0.00 14 R 8.09 3.77 0.00 1.75 1.99 0.00 3.02 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 15 N 7.98 4.37 0.00 2.91 2.84 0.00 0.00 7.05 6.67 0.00 0.00 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 A 7.98 4.19 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 17 T 7.54 3.72 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 18 R 7.62 4.52 0.00 1.92 2.05 0.00 3.22 0.00 0.00 3.17 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 19 V 7.48 4.48 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 0.75 0.00 0.00 1.09 0.00 0.00 20 Y 8.78 4.33 0.00 2.98 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 21 K 7.88 4.27 0.00 1.88 1.76 0.00 1.77 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.57 1.38 7.81 22 E 8.80 4.26 0.00 2.07 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 2.51 2.41 0.00 23 S 7.68 4.66 0.00 3.30 3.38 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 24 T 8.63 4.65 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 1.17 0.00 0.00 25 D 8.61 5.47 0.00 2.39 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 0.00 0.00 0.00 26 V 8.80 4.75 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 0.68 0.00 0.00 0.93 0.00 0.00 27 P 0.00 3.53 0.00 1.77 1.68 0.00 3.67 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 2.00 2.12 0.00 28 A 8.30 4.35 1.16 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 0.00 0.00 29 S 8.83 5.38 0.00 4.12 4.02 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 30 R 7.17 3.54 0.00 1.92 1.95 0.00 3.34 0.00 0.00 3.30 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.64 0.00 31 F 8.43 4.46 0.00 2.98 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 32 K 7.76 3.58 0.00 1.98 1.74 0.00 1.61 0.00 0.00 1.49 0.00 0.00 2.88 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.34 1.44 7.81 33 E 8.29 3.61 0.00 1.94 2.16 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 2.35 2.26 0.00 34 E 8.18 4.16 0.00 2.19 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 0.00 2.54 2.51 0.00 35 I 7.56 3.64 1.53 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.06 0.68 0.00 0.00 36 L 7.51 3.83 0.00 1.17 1.20 0.61 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 37 R 8.67 4.13 0.00 1.90 2.25 0.00 3.13 0.00 0.00 3.21 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.78 0.00 38 I 8.30 3.79 1.99 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.32 0.87 0.00 0.00 39 L 8.03 4.00 0.00 1.81 1.78 0.61 0.64 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 40 A 8.10 4.56 1.50 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 0.00 0.00 41 R 8.06 3.91 0.00 1.88 2.28 0.00 3.31 0.00 0.00 3.26 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.75 0.00 42 E 8.40 4.32 0.00 2.42 2.35 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 2.65 2.65 0.00 43 G 8.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.54 4.15 0.00 3.16 3.11 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 45 I 8.12 4.73 2.11 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 1.42 1.10 0.96 0.00 0.00 46 K 8.62 3.75 0.00 2.15 2.00 0.00 1.74 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.55 1.68 7.81 47 G 7.26 4.47 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 48 Y 7.70 6.19 0.00 3.16 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.75 4.70 0.00 2.02 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.48 0.00 50 R 8.62 4.75 0.00 1.79 1.99 0.00 3.22 0.00 0.00 3.21 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.78 0.00 51 V 9.91 4.60 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 1.00 0.00 0.00 1.05 0.00 0.00 52 D 8.76 5.39 0.00 2.61 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 53 V 9.38 3.95 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 0.46 0.00 0.00 0.46 0.00 0.00 54 D 9.21 4.22 0.00 2.97 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 55 G 8.01 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 0.00 0.00 0.00 0.00 56 K 7.74 4.43 0.00 2.33 1.81 0.00 1.59 0.00 0.00 1.88 0.00 0.00 3.10 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.47 1.43 7.81 57 P 0.00 4.96 0.00 2.06 2.05 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 1.83 1.94 0.00 58 Y 9.29 4.87 0.00 3.06 2.77 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 0.00 0.00 0.00 0.00 59 L 9.40 5.48 0.00 1.65 1.59 0.80 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 60 R 9.36 4.78 0.00 1.97 1.75 0.00 2.96 0.00 0.00 3.04 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.73 0.00 61 V 8.70 4.39 2.16 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 0.98 0.00 0.00 0.92 0.00 0.00 62 Y 9.39 4.78 0.00 3.22 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 63 L 8.18 4.41 0.00 2.00 1.76 0.90 0.92 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 64 K 8.21 4.93 0.00 1.83 1.72 0.00 1.88 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.33 1.50 7.81 65 Y 8.44 4.71 0.00 2.97 2.96 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 66 G 8.68 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 0.00 0.00 0.00 0.00 67 P 0.00 4.86 0.00 2.14 2.22 0.00 3.76 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 2.07 1.98 0.00 68 R 8.46 3.97 0.00 1.82 1.87 0.00 3.19 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 69 R 8.29 4.48 0.00 1.64 1.87 0.00 3.23 0.00 0.00 3.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 70 Q 8.55 4.30 0.00 1.93 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.05 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 71 G 8.47 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 72 P 0.00 4.33 0.00 2.19 2.06 0.00 3.92 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 1.99 1.95 0.00 73 D 8.38 4.25 0.00 2.77 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 4.63 0.00 2.20 2.29 0.00 3.70 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 1.96 1.93 0.00 75 R 8.10 3.64 0.00 1.92 1.60 0.00 3.15 0.00 0.00 3.15 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.60 0.00 76 P 0.00 4.68 0.00 2.32 2.34 0.00 3.05 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 77 E 8.82 4.45 0.00 2.13 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 2.41 2.45 0.00 78 Q 8.74 4.38 0.00 1.79 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.64 0.00 0.00 0.00 0.00 0.00 2.28 2.14 0.00 79 V 8.11 4.06 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 0.67 0.00 0.00 0.92 0.00 0.00 80 I 7.20 4.73 1.79 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.96 0.81 0.00 0.00 81 H 8.93 4.32 0.00 3.30 3.46 0.00 5.83 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.90 4.48 0.00 1.40 1.31 0.00 5.80 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 7.49 4.26 1.60 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.44 0.71 0.00 0.00 84 R 8.86 4.50 0.00 1.47 1.42 0.00 3.27 0.00 0.00 3.07 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.64 0.00 85 R 8.49 4.02 0.00 1.79 1.77 0.00 3.19 0.00 0.00 3.18 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.58 0.00 86 I 8.48 4.54 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 1.08 0.83 0.88 0.00 0.00 87 S 7.27 4.16 0.00 3.90 3.68 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 0.00 0.00 0.00 0.00 88 K 8.92 4.69 0.00 1.75 1.59 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.31 1.54 7.81 89 P 0.00 4.39 0.00 2.17 2.07 0.00 3.77 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.05 0.00 90 G 8.57 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 0.00 0.00 0.00 91 R 7.02 5.52 0.00 1.95 1.88 0.00 3.25 0.00 0.00 3.17 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.46 0.00 92 R 7.31 4.14 0.00 1.90 1.60 0.00 3.39 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.48 0.00 93 V 8.94 4.24 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 1.03 0.00 0.00 0.92 0.00 0.00 94 Y 8.61 5.20 0.00 2.88 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 V 8.84 4.57 2.11 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 0.80 0.00 0.00 1.03 0.00 0.00 96 G 8.73 4.18 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 0.00 97 V 8.43 3.68 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 0.76 0.00 0.00 0.94 0.00 0.00 98 K 8.02 4.27 0.00 1.78 1.91 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.45 1.47 7.81 99 E 10.20 4.58 0.00 2.03 1.93 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 2.23 2.25 0.00 100 I 7.48 3.74 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.58 0.93 0.00 0.00 101 P 0.00 4.49 0.00 2.19 2.07 0.00 3.74 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 102 R 8.26 4.63 0.00 1.79 1.86 0.00 3.17 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 103 V 8.11 4.22 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 1.26 0.00 0.00 1.05 0.00 0.00 104 R 9.06 3.54 0.00 1.65 1.62 0.00 3.00 0.00 0.00 2.80 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 105 R 8.59 3.62 0.00 1.76 2.03 0.00 3.22 0.00 0.00 3.16 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.63 0.00 106 G 8.30 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 0.00 107 L 8.01 3.95 0.00 1.61 1.76 0.86 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 108 G 7.72 4.49 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 0.00 109 I 9.50 5.16 1.92 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.70 1.11 0.00 0.00 110 A 9.04 4.98 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 I 8.46 4.68 1.78 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.52 0.88 0.00 0.00 112 L 9.02 5.15 0.00 1.57 1.58 0.95 0.48 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 0.00 113 S 9.58 5.23 0.00 4.09 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 0.00 114 T 8.64 5.16 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 1.27 0.00 0.00 115 S 9.05 3.86 0.00 3.99 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 0.00 116 K 7.88 4.40 0.00 1.79 1.84 0.00 1.68 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.38 1.35 7.81 117 G 8.76 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 0.00 118 V 8.09 4.39 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 0.87 0.00 0.00 1.27 0.00 0.00 119 L 9.34 5.23 0.00 1.57 1.54 0.95 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 120 T 8.40 4.97 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 1.33 0.00 0.00 121 D 9.64 4.35 0.00 2.82 2.94 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 0.00 122 R 8.00 3.93 0.00 1.90 2.00 0.00 3.20 0.00 0.00 3.36 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.75 0.00 123 E 8.11 3.94 0.00 2.22 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 2.38 2.40 0.00 124 A 8.19 4.10 1.43 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 0.00 125 R 8.15 3.81 0.00 2.02 2.02 0.00 3.27 0.00 0.00 3.16 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 126 K 8.24 4.17 0.00 1.89 2.05 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.48 7.81 127 L 7.92 4.39 0.00 1.79 1.69 0.93 0.89 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 0.00 128 G 7.65 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 0.00 129 V 7.60 4.55 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 0.84 0.00 0.00 0.95 0.00 0.00 130 G 7.60 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 0.00 0.00 0.00 0.00 131 G 7.27 4.21 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 0.00 132 E 8.89 4.21 0.00 2.17 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 0.00 2.17 1.74 0.00 133 L 8.79 4.22 0.00 1.79 1.50 0.91 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 134 I 8.98 4.02 1.92 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.71 0.81 0.00 0.00 135 C 7.69 5.08 0.00 2.77 2.82 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 0.00 136 E 9.24 4.96 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 2.42 2.33 0.00 137 V 8.92 4.69 1.56 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 -0.04 0.00 0.00 0.58 0.00 0.00 138 W 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