NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.1820 8.1749 117.3698 64.0087 70.8095 176.0870 3 T 3.0449 6.7916 115.5200 62.7132 63.8977 171.2223 4 F 4.4448 7.2576 120.2662 56.2134 40.3756 174.5819 5 R 4.4223 8.0937 119.0170 54.8697 33.0551 173.4909 6 F 5.1237 8.0646 119.1280 55.6023 42.0168 174.9604 7 C 4.1561 8.1274 117.2462 57.0183 31.8731 172.8877 8 R 4.4728 8.4891 119.7990 57.1932 30.8773 179.1702 9 D 4.0522 8.3845 115.4184 55.0189 42.3875 173.5580 10 C 4.4861 8.2979 117.1017 61.1258 30.5613 175.7838 11 N 4.4525 6.9443 118.1688 56.5676 37.4504 173.5789 12 N 4.7030 7.9024 128.5513 52.8409 39.6244 174.4627 13 M 4.2078 8.4200 127.2297 54.9776 34.0482 174.9749 14 L 5.6042 7.5450 119.4864 52.2811 44.7839 175.8712 15 Y 4.6540 9.0151 122.4997 56.2491 39.6524 173.9159 16 P 5.3421 0.0000 0.0000 63.1217 33.3086 175.0825 17 R 4.7376 8.9229 118.2860 55.3177 35.1935 173.4717 18 E 4.7081 8.6412 121.2758 54.7903 32.1009 175.4745 19 D 4.5760 8.5325 126.3839 52.7523 40.7013 176.8954 20 K 3.8166 8.7963 124.0172 59.3767 32.3005 178.6305 21 E 4.0605 8.1777 117.0691 58.2687 29.6816 176.7508 22 N 4.8032 8.1622 113.3631 52.0210 39.7950 173.7273 23 N 4.0923 7.8733 116.8331 52.2980 35.9314 173.1213 24 R 4.3806 7.1770 115.9183 55.5106 32.7078 173.1354 25 L 4.7772 7.8466 121.8258 53.6520 44.4079 175.0317 26 L 5.0312 8.2692 124.4688 53.2211 46.0564 176.4776 27 F 5.4959 8.7263 123.0340 57.2646 41.5454 174.0949 28 E 5.1887 8.3134 115.1389 56.7124 33.0781 174.0241 29 C 5.1879 8.8360 118.0351 58.3810 34.5734 174.2923 30 R 4.5814 8.5291 122.8454 56.4247 30.4466 176.4139 31 T 4.5098 8.0918 112.9677 65.1506 71.6050 174.2064 32 C 4.8321 7.5277 116.7555 58.0846 28.3040 175.3848 33 S 4.6096 8.6482 111.1313 57.5157 65.7512 172.9683 34 Y 4.3002 7.8814 121.4492 57.9357 39.1931 175.5015 35 V 5.0751 8.2600 122.4062 61.9755 34.7683 172.6851 36 E 5.1342 9.2677 124.8424 54.1496 33.2208 174.9909 37 E 4.4810 8.9355 118.9895 56.0534 30.8282 176.2288 38 A 3.6972 8.4029 123.6170 52.1604 18.1571 178.2229 39 G 3.7370 9.0975 112.7306 48.4406 0.0000 173.4480 40 S 4.6328 7.5865 111.5001 56.1269 65.2288 171.5821 41 P 4.4480 0.0000 0.0000 63.0111 31.1852 176.1053 42 L 4.4125 7.3773 121.5433 54.0565 41.1646 175.9644 43 V 4.0840 8.3806 126.6502 65.0930 32.0940 175.6905 44 Y 5.0198 7.6062 117.6366 56.0821 41.7301 173.5309 45 R 4.2583 7.5801 124.2891 54.8469 33.5291 173.5630 46 H 4.2548 8.5456 122.9387 56.9482 31.1541 172.0363 47 E 3.4599 7.9464 124.7312 56.2325 27.8396 173.1007 48 L 4.1944 7.8257 125.4713 56.7070 42.7124 178.3800 49 I 4.0145 7.1965 127.8008 61.0632 35.6939 176.2531 50 T 4.2804 7.8324 121.3406 63.4465 69.0075 174.7825 51 N 4.9583 8.3712 116.2656 52.9466 41.5183 173.9339 52 I 4.3215 7.7094 113.2622 60.5841 38.3966 175.1214 53 G 3.8322 9.3148 112.7887 45.2153 0.0000 174.9279 54 E 3.7551 7.3716 119.4274 59.6938 30.1497 178.1303 55 T 4.4989 7.3032 113.5702 62.2003 69.9071 173.4509 56 A 3.8226 7.8235 124.9465 52.7789 19.6265 179.5350 57 G 3.6148 7.8780 102.3816 47.0830 0.0000 175.2515 58 V 4.5014 7.7081 131.8870 60.4118 31.8247 175.5214 59 V 3.6424 7.6129 121.2395 63.3442 32.3197 175.9784 60 Q 4.2941 8.6924 122.5827 57.3343 28.6240 176.1636 61 D 4.8263 7.7565 115.3854 54.3543 42.1557 177.4141 62 I 3.8430 7.9985 119.4576 62.4447 37.8424 176.1586 63 G 3.9263 7.8742 108.1563 47.5077 0.0000 175.4112 64 S 4.2337 8.5502 112.7906 58.7086 63.3240 173.4701 65 D 4.6317 7.4236 122.1878 52.5149 40.9176 174.1159 66 P 4.4134 0.0000 0.0000 65.9013 31.5310 177.8919 67 T 3.9097 7.9754 107.9171 63.8066 68.5993 174.2234 68 L 4.2329 7.5708 121.4819 53.5033 42.7558 174.5483 69 P 4.7269 0.0000 0.0000 62.4587 33.1575 174.9234 70 R 6.0300 8.9408 119.2250 53.8379 32.9314 175.0233 71 S 4.8507 8.6356 115.1681 56.3180 67.1024 173.5526 72 D 4.8210 8.4666 118.4113 53.2596 39.8505 176.8203 73 R 4.2826 7.7900 120.2256 56.1383 31.4562 174.5941 74 E 5.6016 8.4031 115.6013 53.4055 30.2288 174.9122 75 C 2.8001 8.1851 117.4373 54.0650 42.2809 172.7572 76 P 4.1205 0.0000 0.0000 64.8731 30.9423 176.3068 77 K 4.2644 6.8877 113.0119 57.3438 34.8950 175.7114 78 C 3.8778 8.1147 113.4734 57.3757 41.5785 174.0729 79 H 3.8308 7.7166 114.2954 56.4779 26.9681 174.4538 80 S 4.5201 7.6788 116.6256 57.9196 64.5199 173.9803 81 R 5.1786 8.1498 117.4942 55.4523 31.0203 176.5759 82 E 4.6437 8.4828 118.9274 54.7240 32.5508 174.7134 83 N 6.1265 9.0929 120.7586 50.2780 43.2983 174.5443 84 V 5.4591 8.6144 120.6145 59.1190 33.7874 174.7158 85 F 5.0795 9.5105 121.7614 55.3659 40.2784 174.2692 86 F 4.5603 7.4300 110.8726 56.9306 41.0044 172.7240 87 Q 4.6308 8.5582 116.5679 53.7490 32.6146 174.6000 88 S 3.6054 8.4200 112.9348 59.3084 62.2303 174.3259 89 Q 3.8257 8.0604 125.2342 56.6893 28.7385 176.0090 90 Q 4.0727 7.3206 120.2920 55.2961 28.2447 176.6477 91 R 4.2368 8.1553 126.9519 55.9029 27.5696 175.9568 92 R 4.6758 7.4910 116.8706 53.9509 33.8147 176.0157 93 K 4.1235 8.4491 120.9045 59.5057 32.3522 179.4743 94 D 4.5044 8.0006 116.6850 55.6133 39.4767 176.7737 95 T 3.9165 6.9895 115.8303 64.0407 69.0119 173.5143 96 S 4.6883 8.3244 118.1123 57.8698 64.9006 173.6393 97 M 4.6322 8.2000 118.5431 54.9631 32.2115 176.7099 98 V 4.2152 7.7486 117.1136 62.1335 33.4366 174.3679 99 L 5.3022 8.2634 123.6836 52.6956 44.3793 175.2927 100 F 5.0103 8.9608 120.7766 56.0143 41.4937 174.9136 101 F 4.8082 9.1671 123.0158 55.7938 42.1519 175.0649 102 V 5.4961 7.7020 117.2072 60.2927 34.8463 173.9870 103 C 4.9054 8.9605 128.4481 59.5481 32.2211 173.7683 104 L 4.2811 8.6800 125.4189 55.4158 41.7544 177.3522 105 S 4.8473 8.7315 114.3143 55.8462 63.0519 173.7369 106 C 5.8228 8.8145 126.7951 58.4003 27.2939 174.7973 107 S 4.0406 7.5246 114.8480 59.4571 59.8108 168.3111 108 H 4.8948 8.1027 118.3744 54.8626 32.2888 173.8940 109 I 5.4267 7.8899 123.7897 58.9090 35.9887 174.5471 110 F 4.6500 8.4613 119.8595 56.4311 40.3067 176.6917 111 T 4.6945 8.2794 118.0079 62.0930 71.0102 174.0461 112 S 4.6432 8.2554 114.9514 58.4672 63.0850 175.5624 113 D 4.7326 8.0635 119.7025 53.6923 37.8247 177.0056 114 Q 4.1168 8.2352 119.8846 57.4979 29.2150 177.7993 115 K 4.1876 7.8956 116.3455 56.3198 32.8189 176.3218 116 N 4.3114 8.5952 115.2482 54.1940 36.1966 174.4196 117 K 4.1693 8.1568 122.3723 56.8212 32.1857 177.2176 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 2 T 8.17 4.18 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 1.32 0.00 0.00 3 T 6.79 3.04 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 1.05 0.00 0.00 4 F 7.26 4.44 0.00 2.78 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 5 R 8.09 4.42 0.00 1.68 1.72 0.00 3.19 0.00 0.00 3.52 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.53 0.00 6 F 8.06 5.12 0.00 3.07 2.92 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 0.00 0.00 0.00 7 C 8.13 4.16 0.00 2.09 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 8 R 8.49 4.47 0.00 2.07 2.02 0.00 3.32 0.00 0.00 3.44 7.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.39 0.00 9 D 8.38 4.05 0.00 2.92 2.76 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 10 C 8.30 4.49 0.00 3.11 3.06 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 11 N 6.94 4.45 0.00 2.87 2.77 0.00 0.00 6.93 7.67 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 12 N 7.90 4.70 0.00 2.66 2.34 0.00 0.00 7.04 7.66 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 13 M 8.42 4.21 0.00 1.76 1.70 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.89 0.00 14 L 7.54 5.60 0.00 1.31 1.46 0.88 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 15 Y 9.02 4.65 0.00 2.90 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 16 P 0.00 5.34 0.00 2.20 2.62 0.00 3.92 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 2.13 2.23 0.00 17 R 8.92 4.74 0.00 1.77 1.82 0.00 3.10 0.00 0.00 3.10 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 18 E 8.64 4.71 0.00 1.95 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 2.27 2.26 0.00 19 D 8.53 4.58 0.00 2.78 2.54 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 0.00 20 K 8.80 3.82 0.00 1.78 1.87 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.45 7.81 21 E 8.18 4.06 0.00 1.92 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 2.29 2.33 0.00 22 N 8.16 4.80 0.00 2.98 2.79 0.00 0.00 7.03 7.62 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 23 N 7.87 4.09 0.00 2.85 2.83 0.00 0.00 6.80 7.79 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 24 R 7.18 4.38 0.00 1.79 1.95 0.00 2.93 0.00 0.00 3.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.44 0.00 25 L 7.85 4.78 0.00 1.67 1.38 0.85 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 26 L 8.27 5.03 0.00 1.59 1.50 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 27 F 8.73 5.50 0.00 3.10 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 28 E 8.31 5.19 0.00 2.17 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 2.40 2.29 0.00 29 C 8.84 5.19 0.00 2.88 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 30 R 8.53 4.58 0.00 1.47 1.65 0.00 2.21 0.00 0.00 2.68 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.14 0.00 31 T 8.09 4.51 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 1.21 0.00 0.00 32 C 7.53 4.83 0.00 3.13 2.50 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 33 S 8.65 4.61 0.00 3.85 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 34 Y 7.88 4.30 0.00 2.97 2.81 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 35 V 8.26 5.08 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 0.95 0.00 0.00 1.08 0.00 0.00 36 E 9.27 5.13 0.00 2.31 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 37 E 8.94 4.48 0.00 1.99 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 2.32 2.35 0.00 38 A 8.40 3.70 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 G 9.10 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 40 S 7.59 4.63 0.00 3.83 3.76 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 41 P 0.00 4.45 0.00 2.24 2.14 0.00 3.83 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 42 L 7.38 4.41 0.00 1.66 1.71 0.95 0.92 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 43 V 8.38 4.08 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.06 0.00 0.00 44 Y 7.61 5.02 0.00 2.86 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.58 4.26 0.00 1.61 1.54 0.00 3.20 0.00 0.00 3.08 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.46 0.00 46 H 8.55 4.25 0.00 2.92 3.21 0.00 6.13 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 47 E 7.95 3.46 0.00 2.02 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 2.15 2.26 0.00 48 L 7.83 4.19 0.00 1.65 1.60 0.95 0.92 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 49 I 7.20 4.01 1.86 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 1.41 0.46 0.91 0.00 0.00 50 T 7.83 4.28 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 1.28 0.00 0.00 51 N 8.37 4.96 0.00 2.77 2.77 0.00 0.00 6.51 7.32 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 52 I 7.71 4.32 1.85 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.54 0.94 0.00 0.00 53 G 9.31 3.83 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 0.00 0.00 0.00 54 E 7.37 3.76 0.00 1.96 2.31 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 2.41 2.49 0.00 55 T 7.30 4.50 4.39 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 1.49 0.00 0.00 56 A 7.82 3.82 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 57 G 7.88 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 V 7.71 4.50 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 0.95 0.00 0.00 1.14 0.00 0.00 59 V 7.61 3.64 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 1.11 0.00 0.00 0.95 0.00 0.00 60 Q 8.69 4.29 0.00 2.05 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 61 D 7.76 4.83 0.00 2.73 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 62 I 8.00 3.84 2.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.82 0.97 0.00 0.00 63 G 7.87 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 64 S 8.55 4.23 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 65 D 7.42 4.63 0.00 2.67 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 66 P 0.00 4.41 0.00 2.21 2.17 0.00 3.84 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 1.98 1.95 0.00 67 T 7.98 3.91 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 1.20 0.00 0.00 68 L 7.57 4.23 0.00 1.82 1.57 0.98 0.82 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 69 P 0.00 4.73 0.00 1.82 1.89 0.00 3.44 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 1.00 0.00 70 R 8.94 6.03 0.00 1.76 1.93 0.00 3.42 0.00 0.00 4.01 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.42 0.00 71 S 8.64 4.85 0.00 3.79 3.53 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.47 4.82 0.00 2.79 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 R 7.79 4.28 0.00 1.87 1.86 0.00 2.62 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.58 0.00 74 E 8.40 5.60 0.00 1.97 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 2.09 2.10 0.00 75 C 8.19 2.80 0.00 2.70 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 76 P 0.00 4.12 0.00 1.90 2.04 0.00 3.22 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.91 0.00 77 K 6.89 4.26 0.00 1.61 1.61 0.00 1.49 0.00 0.00 1.59 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.21 1.14 7.81 78 C 8.11 3.88 0.00 3.21 3.32 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 79 H 7.72 3.83 0.00 3.22 3.29 0.00 5.65 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 S 7.68 4.52 0.00 3.80 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 81 R 8.15 5.18 0.00 1.65 1.88 0.00 3.20 0.00 0.00 3.88 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.45 0.00 82 E 8.48 4.64 0.00 1.90 1.89 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 2.31 2.33 0.00 83 N 9.09 6.13 0.00 2.84 2.94 0.00 0.00 6.34 7.56 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 84 V 8.61 5.46 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.94 0.00 0.00 85 F 9.51 5.08 0.00 2.50 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 0.00 0.00 0.00 86 F 7.43 4.56 0.00 2.79 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 87 Q 8.56 4.63 0.00 1.92 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.10 6.85 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 88 S 8.42 3.61 0.00 3.68 3.69 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 89 Q 8.06 3.83 0.00 2.06 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.95 0.00 0.00 0.00 0.00 0.00 1.69 1.86 0.00 90 Q 7.32 4.07 0.00 1.90 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 7.42 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 91 R 8.16 4.24 0.00 1.79 1.84 0.00 3.30 0.00 0.00 3.06 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.50 0.00 92 R 7.49 4.68 0.00 1.68 1.74 0.00 3.24 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.53 0.00 93 K 8.45 4.12 0.00 1.85 1.82 0.00 1.72 0.00 0.00 1.86 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.41 7.81 94 D 8.00 4.50 0.00 2.78 2.81 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 95 T 6.99 3.92 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 1.19 0.00 0.00 96 S 8.32 4.69 0.00 4.02 3.90 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 97 M 8.20 4.63 0.00 2.05 2.13 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.50 0.00 98 V 7.75 4.22 2.27 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 1.01 0.00 0.00 1.05 0.00 0.00 99 L 8.26 5.30 0.00 1.25 1.42 0.93 1.38 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 0.00 100 F 8.96 5.01 0.00 3.09 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 0.00 101 F 9.17 4.81 0.00 1.51 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 V 7.70 5.50 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 1.15 0.00 0.00 0.88 0.00 0.00 103 C 8.96 4.91 0.00 3.15 2.87 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 0.00 104 L 8.68 4.28 0.00 1.75 1.73 0.99 0.67 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 0.00 105 S 8.73 4.85 0.00 3.82 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 0.00 106 C 8.81 5.82 0.00 3.19 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 0.00 107 S 7.52 4.04 0.00 4.05 4.19 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 0.00 108 H 8.10 4.89 0.00 3.27 3.24 0.00 5.82 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 I 7.89 5.43 1.89 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 1.11 1.92 1.06 0.00 0.00 110 F 8.46 4.65 0.00 3.13 3.07 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 0.00 0.00 0.00 0.00 111 T 8.28 4.69 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 1.06 0.00 0.00 112 S 8.26 4.64 0.00 4.34 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 0.00 113 D 8.06 4.73 0.00 2.72 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 0.00 114 Q 8.24 4.12 0.00 2.05 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.99 0.00 0.00 0.00 0.00 0.00 2.37 2.61 0.00 115 K 7.90 4.19 0.00 1.74 1.86 0.00 1.87 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.46 7.81 116 N 8.60 4.31 0.00 2.84 2.94 0.00 0.00 7.03 8.02 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 0.00 117 K 8.16 4.17 0.00 1.75 1.73 0.00 1.79 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.43 7.81