NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3986 8.3049 120.3476 55.2613 33.4286 174.4414 2 L 4.4181 8.0771 123.0129 51.8764 43.2835 175.7375 3 T 4.0019 8.6614 113.3005 64.1193 70.3500 174.8821 4 D 4.4521 7.6257 122.6211 50.7903 43.5708 173.5958 5 P 4.1214 0.0000 0.0000 65.8289 31.6179 178.4210 6 I 3.3859 7.7192 117.8888 64.6843 36.8239 177.8559 7 A 3.8173 8.0804 121.1110 54.8727 18.2676 178.8703 8 D 4.2589 8.2927 116.3265 57.8477 41.2836 178.8683 9 M 3.8913 9.0116 119.1778 58.7549 32.3595 177.8752 10 L 3.8278 7.6975 119.0238 58.3800 41.7503 179.9792 11 T 3.8112 7.9759 115.3457 66.6767 68.6625 177.0489 12 R 3.9953 8.2781 120.2867 59.5800 30.0280 179.1550 13 I 3.6261 7.8310 119.2904 64.2193 37.0536 177.9142 14 R 3.7349 7.5310 118.0898 59.8665 30.0196 177.7971 15 N 4.3310 8.5744 115.9126 56.1259 38.5895 176.8817 16 A 3.9673 7.8999 122.1055 55.8813 18.6079 179.9108 17 T 4.4037 8.2081 109.5115 64.4863 68.5526 176.9321 18 R 3.7731 7.8623 120.0486 57.8776 30.0912 178.1834 19 V 4.2819 7.2582 109.1139 60.2925 32.3371 175.0966 20 Y 3.1180 6.9637 114.6513 58.4709 35.5898 170.1021 21 K 4.0354 7.9060 118.6060 57.0101 32.6507 176.5418 22 E 4.4268 8.4898 120.8526 58.7031 31.1288 176.5159 23 S 4.6288 7.5856 122.3893 58.4500 61.5840 172.5696 24 T 3.7627 7.6781 108.2463 59.8343 68.1211 169.8465 25 D 5.6577 8.3192 128.9044 52.4151 43.8537 175.6829 26 V 4.5289 8.2154 121.3103 58.9291 34.6417 172.1685 27 P 3.4402 0.0000 0.0000 61.9599 31.5976 175.6339 28 A 4.0763 7.5337 126.7105 52.7245 19.0121 177.1564 29 S 4.4147 8.7253 113.8057 56.3073 65.5822 175.2455 30 R 3.7522 8.4015 123.7401 59.5447 29.7951 178.0197 31 F 4.2473 8.2947 119.2855 61.8254 39.4338 177.4495 32 K 3.6737 8.4236 118.0863 59.5719 31.8311 178.6240 33 E 3.6229 8.3705 119.4247 59.4973 29.3607 178.4868 34 E 3.9838 8.4276 117.3157 59.6909 29.8137 179.4950 35 I 3.9311 8.0880 119.5593 64.4544 37.2882 178.1259 36 L 3.8811 7.7895 119.8036 58.0503 41.3142 179.6211 37 R 4.0756 8.1135 117.8373 59.7866 30.0194 179.0876 38 I 3.7700 7.8549 119.0722 64.1722 37.0375 178.2440 39 L 4.2025 8.0041 119.2066 57.9787 41.5102 179.2078 40 A 4.0336 8.5916 120.5687 55.2613 18.1920 179.3074 41 R 3.8520 7.9486 115.7671 59.8435 30.2714 178.0870 42 E 4.0923 8.6983 114.7577 56.2815 29.4306 176.9223 43 G 3.7871 8.2791 107.4005 46.8312 0.0000 175.0014 44 F 4.8383 8.4542 119.9546 57.7791 39.5780 176.3372 45 I 4.7975 7.3283 112.7030 58.6858 40.3887 176.0842 46 K 4.1146 8.7185 121.0414 57.2956 32.4959 175.9214 47 G 3.9683 7.2535 104.3616 45.7506 0.0000 172.0979 48 Y 5.3792 7.7012 114.7259 56.5607 40.2101 173.2620 49 E 4.6080 8.9388 118.7051 54.4577 33.7485 174.8250 50 R 4.8423 8.5671 119.9815 56.0142 30.8891 176.1866 51 V 4.6816 8.4498 115.8676 59.5890 36.2456 174.0701 52 D 5.5728 8.6519 120.5159 52.7964 43.7271 176.4676 53 V 4.2007 8.9424 121.7644 62.3802 34.4410 174.7298 54 D 4.3575 10.0136 124.2780 55.0156 39.6312 173.9453 55 G 4.0333 8.6423 103.6416 44.9879 0.0000 173.5904 56 K 4.7072 8.4408 119.3663 53.1126 35.3445 173.7298 57 P 4.8114 0.0000 0.0000 63.8797 31.9068 174.9318 58 Y 4.8282 9.1114 121.1277 56.7609 42.4156 174.1387 59 L 4.9492 8.6324 119.0568 53.7608 45.0709 175.8824 60 R 4.4007 9.0451 124.1702 56.0671 31.2798 175.9211 61 V 4.7468 8.1587 123.8424 61.2730 33.7836 174.3127 62 Y 4.5408 9.3637 126.7239 57.2719 39.0395 174.8991 63 L 4.6574 8.8715 125.2781 53.7989 43.1072 176.1411 64 K 4.7052 8.2253 122.9394 54.9920 35.0056 174.3027 65 Y 4.7555 8.4652 122.5218 56.4131 43.0102 174.4032 66 G 4.3129 8.9112 109.7277 44.6060 0.0000 171.4867 67 P 4.7136 0.0000 0.0000 60.8608 33.2561 174.6230 68 R 4.1320 8.2901 119.0009 57.1285 30.6863 174.8873 69 R 4.7896 8.3215 121.1020 54.5834 34.0208 174.7061 70 Q 4.2931 8.6009 119.0830 55.1028 30.7029 177.9184 71 G 3.7235 8.5161 107.6061 45.9038 0.0000 171.6687 72 P 4.4008 0.0000 0.0000 63.2203 32.7086 174.9283 73 D 4.2749 8.5522 120.2558 54.4386 38.5194 171.6775 74 P 4.4992 0.0000 0.0000 63.2879 32.2001 177.2238 75 R 3.8783 7.4573 118.5107 56.3642 30.3417 174.8437 76 P 4.7675 0.0000 0.0000 61.8615 32.2479 175.9739 77 E 4.2498 8.8540 124.1886 56.3574 30.8250 176.4560 78 Q 4.5448 8.6627 124.5004 55.9520 29.6435 176.1504 79 V 4.0660 8.0888 118.8757 63.8839 32.3356 176.1552 80 I 4.1709 7.1300 120.4699 59.6606 36.4194 174.9025 81 H 4.1131 8.7764 121.4259 58.3922 29.0433 175.0506 82 H 4.1074 8.4395 116.7229 53.7815 31.6754 171.5179 83 I 3.8141 6.2251 126.6658 60.5811 39.6663 172.7336 84 R 4.3610 7.4552 127.2646 54.9581 32.9143 174.3426 85 R 4.2802 8.4884 124.3496 56.5857 30.0525 174.5183 86 I 4.2532 7.7087 119.0226 62.2537 40.4822 175.9544 87 S 4.1252 7.8946 118.2272 58.8607 63.2291 174.3094 88 K 4.6360 8.4043 125.2118 53.8172 36.1702 174.4513 89 P 4.2099 0.0000 0.0000 64.0130 32.0410 176.1169 90 G 3.8453 9.0735 106.5745 45.9560 0.0000 172.2475 91 R 3.7757 7.3777 118.9881 55.7882 30.7175 174.0120 92 R 4.0331 7.2431 119.2590 56.1496 31.4100 177.2594 93 V 4.1060 7.9399 121.6356 61.4564 33.5828 173.3559 94 Y 5.3698 8.3628 125.1632 56.3329 39.9008 175.8090 95 V 4.5906 8.7049 116.1237 59.3693 35.7952 175.8294 96 G 3.8582 8.5666 112.2749 44.6819 0.0000 175.5044 97 V 3.2667 8.2904 119.4012 63.6791 31.3970 177.0646 98 K 4.4169 7.9366 118.0545 56.6187 32.3608 176.3557 99 E 4.6032 8.7697 119.4080 55.9731 30.1557 176.0676 100 I 4.1726 7.7595 121.1049 59.0879 36.9361 173.9184 101 P 4.1627 0.0000 0.0000 63.2903 31.1971 176.5757 102 R 4.2941 8.1390 120.9724 54.3143 29.1944 175.0194 103 V 3.5435 8.1231 124.3087 64.0348 32.6910 176.3914 104 R 3.3355 9.2517 126.9045 58.4676 27.3658 176.0509 105 R 3.7558 9.0216 109.5521 57.0927 29.3955 176.1595 106 G 4.0620 8.8904 107.0797 45.1023 0.0000 175.9194 107 L 4.3328 7.9710 117.9504 55.6945 41.7466 176.6430 108 G 4.4762 7.5671 105.9507 43.5890 0.0000 171.7200 109 I 4.9299 8.4487 113.5006 59.5353 41.0062 174.8079 110 A 4.5303 8.6052 123.6435 51.5209 21.7355 176.1153 111 I 4.2340 8.4230 124.7862 62.0448 38.2869 176.2659 112 L 4.8232 9.1427 127.4559 53.0744 45.5496 175.3753 113 S 4.7604 8.7095 113.5340 57.2282 65.1437 172.8237 114 T 5.1280 8.6887 117.6292 59.4594 71.8934 175.1257 115 S 4.2335 8.7562 114.9122 59.9048 63.3045 174.7661 116 K 4.2381 7.9608 120.3737 56.1472 32.0126 177.0667 117 G 3.7431 8.2164 108.4133 44.0984 0.0000 172.1951 118 V 4.4706 7.9252 118.8688 62.2952 32.0752 175.7806 119 L 5.0625 8.4766 127.4512 54.2478 44.4655 175.7340 120 T 4.5919 8.6829 110.5546 61.3866 70.2696 174.6939 121 D 4.3748 8.7665 122.0818 57.2410 38.9473 179.0005 122 R 3.9815 8.0955 119.4525 59.1095 30.2548 178.0224 123 E 3.9007 8.1269 116.7628 59.8018 29.4047 179.1906 124 A 4.0103 8.7526 120.3349 55.6598 18.6234 179.6961 125 R 3.8678 8.7836 117.3901 59.4163 29.8427 178.6391 126 K 4.0361 8.1193 119.0604 58.7341 32.2065 177.2829 127 L 4.4181 7.5697 116.1857 53.4151 42.1044 177.1109 128 G 4.0645 7.6158 105.5681 46.2786 0.0000 173.4550 129 V 4.4742 8.0020 110.5021 60.0282 36.3482 175.0616 130 G 4.2371 8.5958 110.9372 43.7617 0.0000 171.4446 131 G 4.3101 7.3830 103.8403 45.4018 0.0000 170.9372 132 E 4.4080 8.2512 121.4518 56.2442 30.6027 177.1874 133 L 4.1079 9.1234 131.9002 54.8884 40.0390 176.7273 134 I 3.7170 8.5532 121.3710 64.3691 37.3834 176.1794 135 C 5.2269 8.0602 114.6975 56.9812 34.5288 173.4192 136 E 4.8814 8.5677 115.9576 54.5725 29.6936 174.5680 137 V 3.7655 8.0870 127.8786 62.8408 33.4765 175.5945 138 W 4.7974 7.9009 122.9146 57.1312 27.6168 174.1636 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 4.40 0.00 1.99 2.03 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 2.56 0.00 2 L 8.08 4.42 0.00 1.70 1.54 0.90 0.56 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 8.66 4.00 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 1.20 0.00 0.00 4 D 7.63 4.45 0.00 2.70 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 5 P 0.00 4.12 0.00 2.08 1.99 0.00 3.60 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 2.06 2.12 0.00 6 I 7.72 3.39 1.65 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 1.18 0.39 0.65 0.00 0.00 7 A 8.08 3.82 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.29 4.26 0.00 2.72 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 9 M 9.01 3.89 0.00 1.83 1.93 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.47 0.00 10 L 7.70 3.83 0.00 1.79 1.61 0.87 0.66 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 11 T 7.98 3.81 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 12 R 8.28 4.00 0.00 1.88 1.99 0.00 3.23 0.00 0.00 3.16 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.87 0.00 13 I 7.83 3.63 1.96 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.62 0.80 0.00 0.00 14 R 7.53 3.73 0.00 1.83 1.97 0.00 3.16 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 1.52 1.53 0.00 15 N 8.57 4.33 0.00 2.67 2.79 0.00 0.00 6.94 7.11 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 16 A 7.90 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 17 T 8.21 4.40 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 18 R 7.86 3.77 0.00 1.88 1.94 0.00 2.98 0.00 0.00 3.40 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 19 V 7.26 4.28 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 0.81 0.00 0.00 1.00 0.00 0.00 20 Y 6.96 3.12 0.00 3.09 2.68 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 21 K 7.91 4.04 0.00 1.79 1.78 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.63 1.53 7.81 22 E 8.49 4.43 0.00 2.07 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 2.55 2.44 0.00 23 S 7.59 4.63 0.00 3.77 3.37 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 24 T 7.68 3.76 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 1.22 0.00 0.00 25 D 8.32 5.66 0.00 2.41 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 26 V 8.22 4.53 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 0.77 0.00 0.00 0.88 0.00 0.00 27 P 0.00 3.44 0.00 1.83 1.89 0.00 3.71 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.23 0.00 28 A 7.53 4.08 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 S 8.73 4.41 0.00 3.96 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 30 R 8.40 3.75 0.00 1.89 2.02 0.00 3.34 0.00 0.00 3.29 7.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.70 0.00 31 F 8.29 4.25 0.00 3.00 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 K 8.42 3.67 0.00 1.97 1.75 0.00 1.71 0.00 0.00 1.48 0.00 0.00 2.84 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.31 1.33 7.81 33 E 8.37 3.62 0.00 2.00 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 0.00 2.41 2.40 0.00 34 E 8.43 3.98 0.00 2.25 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 2.39 2.50 0.00 35 I 8.09 3.93 1.97 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.37 0.89 0.00 0.00 36 L 7.79 3.88 0.00 1.28 1.19 0.37 0.70 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 37 R 8.11 4.08 0.00 2.11 2.08 0.00 3.19 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.85 0.00 38 I 7.85 3.77 2.11 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.77 1.00 0.00 0.00 39 L 8.00 4.20 0.00 1.84 1.84 1.01 1.07 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 40 A 8.59 4.03 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 41 R 7.95 3.85 0.00 1.90 2.22 0.00 3.29 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 42 E 8.70 4.09 0.00 2.00 1.55 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 2.49 2.54 0.00 43 G 8.28 3.79 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 0.00 0.00 0.00 44 F 8.45 4.84 0.00 3.21 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 45 I 7.33 4.80 2.22 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 1.17 0.96 0.00 0.00 46 K 8.72 4.11 0.00 2.07 1.96 0.00 1.80 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.53 1.48 7.81 47 G 7.25 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 48 Y 7.70 5.38 0.00 3.27 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 49 E 8.94 4.61 0.00 2.04 2.05 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 2.47 2.37 0.00 50 R 8.57 4.84 0.00 1.78 2.00 0.00 3.20 0.00 0.00 3.28 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.77 0.00 51 V 8.45 4.68 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 1.04 0.00 0.00 52 D 8.65 5.57 0.00 2.55 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 8.94 4.20 1.68 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 0.72 0.00 0.00 0.77 0.00 0.00 54 D 10.01 4.36 0.00 2.81 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 55 G 8.64 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 8.44 4.71 0.00 2.11 1.73 0.00 1.61 0.00 0.00 1.86 0.00 0.00 3.10 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.40 7.81 57 P 0.00 4.81 0.00 2.05 2.19 0.00 3.62 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.96 0.00 58 Y 9.11 4.83 0.00 2.98 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 59 L 8.63 4.95 0.00 1.69 1.64 0.80 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 60 R 9.05 4.40 0.00 1.81 1.49 0.00 3.11 0.00 0.00 2.99 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.55 0.00 61 V 8.16 4.75 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 0.80 0.00 0.00 1.01 0.00 0.00 62 Y 9.36 4.54 0.00 3.12 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 8.87 4.66 0.00 1.95 1.36 0.98 1.25 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 8.23 4.71 0.00 1.74 1.60 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.33 1.47 7.81 65 Y 8.47 4.76 0.00 3.10 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 66 G 8.91 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 0.00 0.00 0.00 67 P 0.00 4.71 0.00 2.24 2.22 0.00 3.77 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.97 0.00 68 R 8.29 4.13 0.00 1.81 1.87 0.00 3.14 0.00 0.00 3.20 7.23 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 8.32 4.79 0.00 1.69 1.82 0.00 3.23 0.00 0.00 3.26 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.72 0.00 70 Q 8.60 4.29 0.00 1.93 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 5.96 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 71 G 8.52 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 72 P 0.00 4.40 0.00 2.19 2.05 0.00 3.90 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 1.97 1.95 0.00 73 D 8.55 4.27 0.00 2.83 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 74 P 0.00 4.50 0.00 2.20 2.24 0.00 3.74 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 1.99 1.93 0.00 75 R 7.46 3.88 0.00 1.93 1.89 0.00 3.49 0.00 0.00 3.29 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.50 0.00 76 P 0.00 4.77 0.00 2.06 2.30 0.00 2.84 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 1.72 1.77 0.00 77 E 8.85 4.25 0.00 2.13 1.90 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 2.45 2.43 0.00 78 Q 8.66 4.54 0.00 1.92 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.72 0.00 0.00 0.00 0.00 0.00 2.40 2.21 0.00 79 V 8.09 4.07 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 1.00 0.00 0.00 80 I 7.13 4.17 1.68 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 1.06 0.68 0.66 0.00 0.00 81 H 8.78 4.11 0.00 3.06 3.40 0.00 5.86 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 82 H 8.44 4.11 0.00 1.40 1.69 0.00 6.04 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 6.23 3.81 1.55 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.51 0.66 0.00 0.00 84 R 7.46 4.36 0.00 1.49 1.60 0.00 3.37 0.00 0.00 3.30 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.47 0.00 85 R 8.49 4.28 0.00 1.77 1.79 0.00 3.30 0.00 0.00 3.17 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.57 0.00 86 I 7.71 4.25 2.20 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 1.19 0.48 0.89 0.00 0.00 87 S 7.89 4.13 0.00 3.72 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 K 8.40 4.64 0.00 1.69 1.59 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.34 1.43 7.81 89 P 0.00 4.21 0.00 2.16 2.05 0.00 3.88 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 90 G 9.07 3.85 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 0.00 0.00 0.00 91 R 7.38 3.78 0.00 1.89 2.00 0.00 3.31 0.00 0.00 3.32 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.31 0.00 92 R 7.24 4.03 0.00 1.75 1.28 0.00 3.37 0.00 0.00 3.16 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.52 0.00 93 V 7.94 4.11 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 0.90 0.00 0.00 0.91 0.00 0.00 94 Y 8.36 5.37 0.00 2.87 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 95 V 8.70 4.59 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 0.77 0.00 0.00 1.04 0.00 0.00 96 G 8.57 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 97 V 8.29 3.27 2.05 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 0.77 0.00 0.00 1.01 0.00 0.00 98 K 7.94 4.42 0.00 1.77 1.89 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.39 1.45 7.81 99 E 8.77 4.60 0.00 2.10 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 0.00 2.23 2.25 0.00 100 I 7.76 4.17 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 1.50 0.71 0.94 0.00 0.00 101 P 0.00 4.16 0.00 2.20 2.11 0.00 3.77 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 2.03 2.02 0.00 102 R 8.14 4.29 0.00 1.78 1.89 0.00 3.23 0.00 0.00 3.15 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.59 0.00 103 V 8.12 3.54 2.30 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 1.14 0.00 0.00 1.07 0.00 0.00 104 R 9.25 3.34 0.00 1.64 1.59 0.00 2.97 0.00 0.00 2.64 7.27 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 9.02 3.76 0.00 1.75 1.86 0.00 3.19 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.62 0.00 106 G 8.89 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 0.00 0.00 0.00 107 L 7.97 4.33 0.00 1.58 1.73 0.88 0.67 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 0.00 108 G 7.57 4.48 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 0.00 109 I 8.45 4.93 2.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.92 1.11 0.00 0.00 110 A 8.61 4.53 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 0.00 111 I 8.42 4.23 1.91 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.18 0.99 0.00 0.00 112 L 9.14 4.82 0.00 1.61 1.62 0.96 0.70 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 0.00 113 S 8.71 4.76 0.00 3.86 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 0.00 114 T 8.69 5.13 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 1.25 0.00 0.00 115 S 8.76 4.23 0.00 3.98 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 0.00 116 K 7.96 4.24 0.00 1.79 1.86 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.41 1.37 7.81 117 G 8.22 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 0.00 118 V 7.93 4.47 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 0.99 0.00 0.00 0.89 0.00 0.00 119 L 8.48 5.06 0.00 1.69 1.90 0.95 0.57 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 0.00 120 T 8.68 4.59 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 121 D 8.77 4.37 0.00 2.94 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 0.00 122 R 8.10 3.98 0.00 1.89 2.07 0.00 3.16 0.00 0.00 3.35 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.78 0.00 123 E 8.13 3.90 0.00 2.36 2.01 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 2.35 2.37 0.00 124 A 8.75 4.01 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 0.00 0.00 125 R 8.78 3.87 0.00 2.02 2.07 0.00 3.11 0.00 0.00 3.10 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 126 K 8.12 4.04 0.00 1.88 2.05 0.00 1.84 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.48 7.81 127 L 7.57 4.42 0.00 1.71 1.66 0.93 0.79 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 0.00 128 G 7.62 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 0.00 0.00 0.00 129 V 8.00 4.47 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 0.74 0.00 0.00 0.94 0.00 0.00 130 G 8.60 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 7.38 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 0.00 0.00 0.00 132 E 8.25 4.41 0.00 2.30 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 2.35 2.03 0.00 133 L 9.12 4.11 0.00 1.74 1.55 0.94 0.93 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 0.00 134 I 8.55 3.72 2.18 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.71 0.88 0.00 0.00 135 C 8.06 5.23 0.00 2.91 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.57 4.88 0.00 2.06 2.01 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 2.40 2.38 0.00 137 V 8.09 3.77 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 -0.08 0.00 0.00 0.76 0.00 0.00 138 W 7.90 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