NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5265 8.2893 118.2000 55.1749 32.6671 175.2059 2 T 4.1489 8.4148 110.8097 60.7493 71.1297 174.2024 3 M 4.0988 8.7420 121.2920 58.6028 32.2221 179.7528 4 E 3.9458 8.2123 118.7726 59.5461 29.8823 178.7729 5 Q 4.0147 8.1615 117.9456 58.8104 28.7783 178.5576 6 F 4.1141 8.5707 121.8874 61.4031 39.8192 177.0086 7 L 3.7879 8.2381 118.7276 58.3195 41.4091 179.8450 8 T 3.7854 7.7061 115.8398 66.3164 68.3131 177.0488 9 S 4.0756 7.9763 116.3371 61.2749 62.7967 176.5202 10 L 3.6986 7.2941 122.1415 57.7787 41.3482 179.2522 11 D 4.3443 7.4379 116.9112 57.4625 40.5325 178.7351 12 M 4.0458 7.5809 117.9629 58.2971 32.3526 178.5492 13 I 3.7696 8.0042 120.3297 64.4492 37.3356 178.2041 14 R 4.2421 8.1811 121.0538 59.0017 29.5962 178.6067 15 S 4.5568 7.9855 112.7252 61.1202 63.0502 176.2748 16 G 3.7722 7.9475 107.8450 46.5324 0.0000 174.0386 17 C 5.0045 8.0063 117.0148 58.3619 42.5560 175.7391 18 A 4.2100 8.8637 122.6289 54.9029 17.8175 177.7461 19 P 4.3549 0.0000 0.0000 64.7635 31.4746 177.9978 20 K 4.0480 7.8034 116.0788 56.3221 32.3492 175.9826 21 F 4.8821 7.6350 116.4877 55.2935 42.1938 174.5962 22 K 4.4187 9.2631 123.6536 55.0616 31.5234 175.3586 23 L 4.8046 8.1131 125.4066 52.6163 45.3529 176.4341 24 K 4.3835 8.2950 121.4260 55.4742 33.3504 177.9340 25 T 3.8508 8.6241 121.0761 66.7770 68.2067 176.3556 26 E 3.8767 8.0411 118.9383 59.3012 29.6085 178.9319 27 D 3.9899 7.8503 119.8832 57.1251 40.9028 178.6474 28 L 4.0210 7.7507 119.0206 57.8896 41.6890 179.1179 29 D 4.4521 8.3319 119.0526 57.2951 40.5957 179.1830 30 R 4.0541 7.7635 118.4639 59.1793 30.1354 178.9262 31 L 3.7724 8.0698 118.8010 57.8606 41.6013 179.2625 32 R 4.8730 8.4024 120.3019 58.8382 29.6613 177.7878 33 V 4.3721 7.4304 107.4342 60.8565 31.7915 176.7263 34 G 4.2875 8.8031 107.2333 46.0984 0.0000 173.8861 35 D 4.8211 8.4819 120.5035 53.1064 39.9472 175.4560 36 F 4.5543 8.8489 123.1478 57.2645 39.7787 177.1207 37 N 4.8839 8.3269 119.5843 51.2722 37.4180 174.7270 38 F 4.8774 7.0191 110.9564 54.7147 40.8685 172.6867 39 P 4.1461 0.0000 0.0000 62.3810 31.2624 174.2125 40 P 4.2489 0.0000 0.0000 61.6122 32.5038 176.8002 41 S 4.3310 8.2038 116.2455 57.9101 65.2154 175.0437 42 Q 3.8801 8.4722 122.6864 59.3315 28.6744 178.1983 43 D 4.3488 7.9767 119.4670 57.2878 41.0594 178.1949 44 L 3.9140 7.7297 120.7212 58.4055 42.0096 178.9461 45 M 3.9945 7.7007 118.2684 58.7413 31.8384 178.2405 46 C 4.3337 8.2764 116.6340 59.6913 38.9240 175.4774 47 Y 3.2906 7.5776 122.1518 60.6215 38.4259 178.3163 48 T 4.1761 7.8189 110.6244 64.5073 68.7704 176.4832 49 K 4.0377 8.0442 122.5587 59.4828 32.2790 177.7391 50 C 4.2532 8.4065 118.9536 59.8410 41.8317 175.7787 51 V 3.3787 7.6411 119.5643 66.1987 31.1135 178.2726 52 S 4.2273 8.3136 114.8032 61.3668 62.6184 176.6945 53 L 4.0238 8.3313 122.3429 57.9432 41.1419 179.0117 54 M 3.9801 7.9354 116.8863 58.6810 32.2366 177.8326 55 A 4.1816 7.8955 119.3656 52.4415 18.6720 177.6322 56 G 3.8626 7.7147 105.2418 47.0359 0.0000 174.7082 57 T 4.3092 7.9687 110.1084 61.3835 69.8415 174.2700 58 V 5.2864 7.7711 113.5147 58.5139 35.6386 173.7625 59 N 4.9456 8.1523 118.2509 50.9301 39.4532 175.7023 60 K 4.0186 8.5204 116.5553 58.8954 32.1047 178.1459 61 K 4.2307 8.2881 117.1959 56.0842 32.4027 178.0191 62 G 4.0172 8.4554 107.7782 45.4043 0.0000 173.6105 63 E 4.0687 8.4220 120.9078 55.6760 29.7005 176.1708 64 F 4.7949 8.0952 126.9674 58.0865 40.1872 174.7890 65 N 4.4975 8.1297 127.3790 51.3684 38.0922 174.6727 66 A 3.6139 7.9256 125.7428 54.1232 18.7195 177.2088 67 P 4.1398 0.0000 0.0000 65.5697 31.3850 178.8191 68 K 3.8738 8.1033 117.8579 59.2330 32.1523 178.4686 69 A 3.9761 8.3972 121.6082 55.3466 18.0353 179.4766 70 L 3.9343 7.8150 115.6257 58.1341 41.8270 179.5000 71 A 4.1067 7.9004 119.1743 54.9001 18.5344 179.0168 72 Q 4.2353 8.3574 116.0644 57.4169 29.0825 177.9581 73 L 3.9915 7.7655 120.7820 57.7588 41.5139 177.6607 74 P 4.4105 0.0000 0.0000 65.4036 31.2704 177.2472 75 H 4.8138 8.0284 112.3479 55.7078 29.0039 175.2345 76 L 4.6020 8.1414 120.8495 55.6718 43.2945 177.0079 77 V 4.2454 7.4014 108.6517 58.3712 35.0546 173.4408 78 P 4.6955 0.0000 0.0000 61.4134 32.1425 175.4709 79 P 4.4332 0.0000 0.0000 65.7606 30.8283 178.6900 80 E 4.1457 8.1726 115.9189 58.3981 29.6281 177.7432 81 M 4.6284 8.0828 116.9373 54.6417 33.0798 177.2440 82 M 3.9942 7.5985 119.4134 58.5391 32.2191 178.2034 83 E 3.9645 8.2020 121.1452 60.2354 29.9066 179.1474 84 M 4.1854 8.0111 119.8911 59.7252 31.4103 180.4357 85 S 4.4043 7.9736 115.1950 61.6615 63.0910 176.6667 86 R 3.9432 8.2247 121.0741 59.3918 29.7770 179.0935 87 K 3.8506 8.3854 118.2961 59.7533 32.1136 179.5880 88 S 3.6087 8.0028 115.3335 61.1267 61.9934 176.8570 89 V 3.8364 8.0210 121.2585 66.2057 31.1079 178.0320 90 E 4.0041 7.9042 116.5655 59.4623 29.4564 179.0946 91 A 4.1273 8.0774 119.4623 54.1184 18.2592 177.8856 92 C 4.8899 7.7986 113.0116 56.4299 41.2001 175.6722 93 R 4.3316 8.0174 119.2180 58.6611 29.4135 177.4830 94 D 4.9396 7.9443 116.2803 53.2072 42.1974 183.3436 95 T 4.8424 7.9301 107.0335 64.7762 68.9685 175.7240 96 H 4.5897 8.4069 119.1007 57.9356 28.9907 177.5014 97 K 4.2755 8.1680 121.3026 56.3003 32.1285 183.5125 98 Q 4.0445 7.8423 115.1179 57.9864 28.9838 175.7784 99 F 5.1635 7.5452 114.2985 55.5880 41.8458 175.0701 100 K 4.4086 8.6691 121.4672 57.7170 33.7267 177.6059 101 E 4.2656 8.0481 119.6515 55.3521 31.1918 177.1186 102 S 4.4536 8.6009 123.1038 61.4656 63.1627 177.4986 103 C 4.3016 8.4715 120.0086 59.3592 41.2162 175.4120 104 E 3.7888 8.5213 120.8800 59.3196 29.1992 178.8821 105 R 3.9433 8.2403 118.3223 59.4557 30.1846 179.2706 106 V 3.4869 7.5736 117.4398 66.0912 31.5816 177.1850 107 Y 3.9783 7.8481 120.5953 60.2736 38.4644 178.3918 108 Q 3.7227 8.0433 118.7036 58.8629 28.5997 178.8017 109 T 3.6616 7.6648 116.6152 66.4197 68.4846 176.3666 110 A 3.3976 7.7799 122.9344 54.8739 18.2443 179.4960 111 K 2.5920 7.3245 118.2853 59.2748 31.8674 178.0667 112 C 4.0212 7.7070 117.8158 59.5250 38.2830 175.0801 113 F 3.6448 8.1077 119.7387 60.5459 38.2563 177.8582 114 S 3.4038 6.6430 111.9519 61.0276 62.6032 175.8193 115 E 4.1230 7.3486 120.1091 57.5796 29.4831 177.4146 116 N 4.6194 7.2850 113.8847 51.8156 39.4271 174.4655 117 A 4.3378 7.1581 123.7665 51.1448 20.0053 178.6183 118 A 4.2270 8.3106 126.6212 52.2368 17.7261 178.5330 119 G 4.0232 8.4695 106.8053 46.5956 0.0000 174.0282 120 Q 4.6806 8.0202 115.3126 55.4365 29.0314 174.5393 121 F 4.9853 8.3070 120.3284 58.2232 40.6808 174.6870 122 M 5.3596 7.7554 123.6847 52.1298 36.0214 174.2026 123 W 4.6231 8.5826 131.6175 54.5089 34.0869 173.7136 124 P 4.2467 0.0000 0.0000 63.0227 30.7080 176.0967 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 8.29 4.53 0.00 2.19 2.33 0.00 0.00 0.00 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.58 0.00 2 T 8.41 4.15 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 1.23 0.00 0.00 3 M 8.74 4.10 0.00 2.10 2.20 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.68 0.00 4 E 8.21 3.95 0.00 2.05 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 2.39 2.43 0.00 5 Q 8.16 4.01 0.00 2.43 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.58 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 6 F 8.57 4.11 0.00 3.11 3.25 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 7 L 8.24 3.79 0.00 1.86 1.69 0.97 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 8 T 7.71 3.79 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 1.17 0.00 0.00 9 S 7.98 4.08 0.00 3.96 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 0.00 10 L 7.29 3.70 0.00 1.61 1.56 0.67 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 11 D 7.44 4.34 0.00 2.84 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 12 M 7.58 4.05 0.00 1.94 2.07 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.55 0.00 13 I 8.00 3.77 1.70 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.96 0.71 0.00 0.00 14 R 8.18 4.24 0.00 2.25 2.14 0.00 3.15 0.00 0.00 3.30 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 15 S 7.99 4.56 0.00 4.11 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 16 G 7.95 3.77 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 0.00 0.00 0.00 17 C 8.01 5.00 0.00 3.11 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 18 A 8.86 4.21 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 19 P 0.00 4.35 0.00 2.03 2.13 0.00 3.69 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 2.19 2.20 0.00 20 K 7.80 4.05 0.00 1.16 1.04 0.00 1.61 0.00 0.00 1.53 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.27 1.37 7.81 21 F 7.63 4.88 0.00 3.07 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 22 K 9.26 4.42 0.00 1.73 1.88 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.40 7.81 23 L 8.11 4.80 0.00 1.54 1.37 0.66 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.29 4.38 0.00 1.91 1.67 0.00 1.64 0.00 0.00 1.79 0.00 0.00 3.14 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.43 7.81 25 T 8.62 3.85 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 1.24 0.00 0.00 26 E 8.04 3.88 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.25 0.00 27 D 7.85 3.99 0.00 2.88 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 28 L 7.75 4.02 0.00 1.77 1.67 0.72 0.51 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 29 D 8.33 4.45 0.00 2.78 2.70 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 30 R 7.76 4.05 0.00 1.78 2.24 0.00 2.88 0.00 0.00 2.92 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 31 L 8.07 3.77 0.00 1.94 1.68 0.85 -0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 32 R 8.40 4.87 0.00 2.03 2.26 0.00 3.16 0.00 0.00 3.35 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 33 V 7.43 4.37 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 0.91 0.00 0.00 1.11 0.00 0.00 34 G 8.80 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 0.00 0.00 0.00 35 D 8.48 4.82 0.00 2.75 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 F 8.85 4.55 0.00 2.84 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 37 N 8.33 4.88 0.00 3.02 2.89 0.00 0.00 6.67 7.55 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 38 F 7.02 4.88 0.00 3.09 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 39 P 0.00 4.15 0.00 2.19 2.11 0.00 3.94 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 2.07 2.00 0.00 40 P 0.00 4.25 0.00 1.45 1.19 0.00 3.51 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.63 0.00 41 S 8.20 4.33 0.00 4.04 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 42 Q 8.47 3.88 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.95 0.00 0.00 0.00 0.00 0.00 2.44 2.52 0.00 43 D 7.98 4.35 0.00 2.82 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 44 L 7.73 3.91 0.00 1.71 1.65 0.89 0.99 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 45 M 7.70 3.99 0.00 2.17 2.07 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 1.67 0.00 46 C 8.28 4.33 0.00 2.90 3.24 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 47 Y 7.58 3.29 0.00 2.55 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 48 T 7.82 4.18 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 49 K 8.04 4.04 0.00 1.89 2.05 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.50 1.50 7.81 50 C 8.41 4.25 0.00 3.35 3.36 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 51 V 7.64 3.38 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 0.16 0.00 0.00 0.38 0.00 0.00 52 S 8.31 4.23 0.00 4.15 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 53 L 8.33 4.02 0.00 1.90 1.74 0.98 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 54 M 7.94 3.98 0.00 2.05 2.18 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.52 0.00 55 A 7.90 4.18 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 G 7.71 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 57 T 7.97 4.31 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 58 V 7.77 5.29 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 1.22 0.00 0.00 1.00 0.00 0.00 59 N 8.15 4.95 0.00 2.95 2.97 0.00 0.00 5.93 7.20 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 60 K 8.52 4.02 0.00 1.79 1.95 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.47 1.49 7.81 61 K 8.29 4.23 0.00 1.98 1.87 0.00 1.74 0.00 0.00 1.85 0.00 0.00 2.94 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.52 1.45 7.81 62 G 8.46 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 0.00 0.00 0.00 63 E 8.42 4.07 0.00 2.28 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 2.45 2.32 0.00 64 F 8.10 4.79 0.00 2.76 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 65 N 8.13 4.50 0.00 2.59 2.46 0.00 0.00 6.78 8.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 A 7.93 3.61 1.35 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 0.00 0.00 0.00 67 P 0.00 4.14 0.00 2.12 2.08 0.00 3.69 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 2.08 2.12 0.00 68 K 8.10 3.87 0.00 1.80 1.78 0.00 1.62 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.43 7.81 69 A 8.40 3.98 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 70 L 7.81 3.93 0.00 1.83 1.76 1.00 0.72 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 71 A 7.90 4.11 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 72 Q 8.36 4.24 0.00 2.23 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.65 0.00 0.00 0.00 0.00 0.00 2.53 2.54 0.00 73 L 7.77 3.99 0.00 1.85 1.77 1.01 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.41 0.00 1.81 2.06 0.00 3.66 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 1.96 2.15 0.00 75 H 8.03 4.81 0.00 3.23 3.32 0.00 5.63 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 L 8.14 4.60 0.00 1.72 1.74 0.97 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 77 V 7.40 4.25 1.78 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 0.73 0.00 0.00 0.89 0.00 0.00 78 P 0.00 4.70 0.00 2.31 2.22 0.00 3.01 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.73 0.00 79 P 0.00 4.43 0.00 2.16 2.14 0.00 3.57 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 80 E 8.17 4.15 0.00 1.86 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 2.30 2.45 0.00 81 M 8.08 4.63 0.00 1.82 1.76 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 82 M 7.60 3.99 0.00 2.06 2.23 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.83 0.00 83 E 8.20 3.96 0.00 2.06 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 2.36 2.42 0.00 84 M 8.01 4.19 0.00 2.06 2.06 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.20 0.00 85 S 7.97 4.40 0.00 4.06 4.12 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 86 R 8.22 3.94 0.00 2.07 1.99 0.00 3.14 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 1.68 1.83 0.00 87 K 8.39 3.85 0.00 1.92 1.77 0.00 1.63 0.00 0.00 1.60 0.00 0.00 3.19 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.59 7.81 88 S 8.00 3.61 0.00 3.40 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 89 V 8.02 3.84 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 1.44 0.00 0.00 90 E 7.90 4.00 0.00 2.10 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 2.50 2.47 0.00 91 A 8.08 4.13 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 92 C 7.80 4.89 0.00 2.92 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 93 R 8.02 4.33 0.00 2.19 2.54 0.00 3.08 0.00 0.00 3.31 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.66 0.00 94 D 7.94 4.94 0.00 2.58 2.65 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 95 T 7.93 4.84 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 1.21 0.00 0.00 96 H 8.41 4.59 0.00 3.43 3.66 0.00 5.45 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 8.17 4.28 0.00 1.75 1.76 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.28 7.81 98 Q 7.84 4.04 0.00 1.87 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.68 0.00 0.00 0.00 0.00 0.00 2.18 2.22 0.00 99 F 7.55 5.16 0.00 3.09 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 0.00 100 K 8.67 4.41 0.00 1.78 1.88 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.42 7.81 101 E 8.05 4.27 0.00 2.05 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 2.41 2.33 0.00 102 S 8.60 4.45 0.00 4.17 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 0.00 103 C 8.47 4.30 0.00 3.30 3.21 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 0.00 104 E 8.52 3.79 0.00 2.04 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 2.36 1.94 0.00 105 R 8.24 3.94 0.00 2.13 2.19 0.00 3.34 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 2.12 1.94 0.00 106 V 7.57 3.49 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 1.09 0.00 0.00 1.09 0.00 0.00 107 Y 7.85 3.98 0.00 3.02 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 0.00 108 Q 8.04 3.72 0.00 1.76 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 1.94 1.16 0.00 109 T 7.66 3.66 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 0.57 0.00 0.00 110 A 7.78 3.40 0.47 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 0.00 111 K 7.32 2.59 0.00 1.02 1.46 0.00 1.56 0.00 0.00 1.45 0.00 0.00 2.92 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.29 1.23 7.81 112 C 7.71 4.02 0.00 2.93 3.18 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 0.00 113 F 8.11 3.64 0.00 2.64 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 0.00 0.00 0.00 114 S 6.64 3.40 0.00 4.08 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 0.00 115 E 7.35 4.12 0.00 1.91 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 2.28 0.00 116 N 7.28 4.62 0.00 2.39 2.62 0.00 0.00 6.92 6.65 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 0.00 117 A 7.16 4.34 1.35 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 0.00 0.00 0.00 118 A 8.31 4.23 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 0.00 119 G 8.47 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 0.00 0.00 0.00 120 Q 8.02 4.68 0.00 2.18 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.73 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 121 F 8.31 4.99 0.00 3.11 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 0.00 122 M 7.76 5.36 0.00 1.95 2.02 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.43 0.00 123 W 8.58 4.62 0.00 3.69 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 P 0.00 4.25 0.00 1.70 1.84 0.00 2.20 0.00 0.00 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.63 0.00