NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.5486 8.3349 116.7905 58.6909 64.1119 173.2770 2 D 4.6150 8.3879 120.6933 52.7695 42.7700 170.7624 3 V 4.0378 8.3583 121.4789 62.0814 33.4220 175.2881 4 L 4.0852 8.8595 128.5320 54.4301 42.4830 177.3163 5 E 4.5883 8.1910 124.3091 55.2389 27.4308 175.6711 6 L 4.5024 7.8508 119.6632 55.2106 43.3766 178.2003 7 T 4.7984 8.2800 109.3423 60.0012 71.7196 174.2299 8 D 4.5685 8.9572 122.4787 57.2522 41.2651 177.5147 9 D 4.5315 7.5611 117.8713 56.5595 41.5091 176.2830 10 N 5.0237 7.9405 112.1907 51.9066 39.8921 175.6561 11 F 4.0017 9.0473 122.7763 61.6334 39.3027 176.7972 12 E 4.2919 8.4873 117.1795 58.0609 29.3392 177.3573 13 S 4.6059 7.9864 112.4283 58.6159 64.8514 175.5056 14 R 4.1880 7.8232 120.2278 57.7432 30.7731 178.6369 15 I 3.5998 7.2430 110.9180 63.4209 37.6226 177.6099 16 S 4.3917 7.7861 115.2422 59.8664 62.9237 174.2318 17 D 4.4862 7.8215 119.5820 55.3604 41.2401 176.4839 18 T 3.9994 7.3749 107.7277 62.3072 68.8463 173.3934 19 G 4.1633 7.6824 120.1009 47.2414 0.0000 175.5910 20 S 4.0766 8.0721 117.6690 60.5089 63.3244 175.8560 21 A 4.0887 8.0093 122.1219 52.7124 18.7871 179.0642 22 G 4.0774 9.2758 105.4542 45.6809 0.0000 172.8937 23 L 5.0580 7.2649 117.4655 55.1371 44.0649 174.3978 24 M 4.9752 9.0938 118.2808 53.6920 35.4201 173.7041 25 L 5.4226 8.9796 127.5497 53.6083 44.9233 175.3794 26 V 4.8768 8.9025 123.3512 60.1000 35.5907 173.4298 27 E 4.7458 8.9120 124.1984 54.4487 31.7667 174.5974 28 F 5.2939 9.2088 127.3842 57.0572 40.8828 175.2610 29 F 5.3393 8.9542 117.1683 56.0352 41.5497 172.5234 30 A 4.1853 7.8236 118.7084 49.3813 21.6358 174.9755 31 P 4.1602 0.0000 0.0000 64.0216 31.8679 177.2383 32 W 4.7737 6.9834 118.8036 56.4459 29.6641 175.6077 33 C 4.2836 8.9909 118.9266 59.2170 28.3559 174.2085 34 G 3.9985 8.2520 110.0856 45.3124 0.0000 172.3350 35 H 4.3099 8.1914 115.5203 58.7460 28.4160 177.3778 36 C 4.1353 8.3329 116.2855 61.5107 29.0570 176.0962 37 K 4.0523 7.9528 119.9425 59.1552 31.6768 179.2619 38 R 4.1204 7.9210 117.3004 58.7634 30.3808 178.0218 39 L 4.1968 8.2602 119.7414 57.0069 42.0975 178.3499 40 A 3.9167 7.9191 121.5320 54.8441 17.8043 177.9115 41 P 4.2429 0.0000 0.0000 65.5323 31.4178 178.4166 42 E 4.0160 8.0892 118.5805 59.4426 29.6801 178.1741 43 Y 3.9954 8.3552 119.8563 60.3607 38.8911 177.5938 44 E 3.8289 8.4419 119.6392 59.4471 29.6173 179.2311 45 A 3.9446 7.6716 119.6517 54.9824 18.5060 179.4500 46 A 3.8243 8.0651 119.1339 55.3224 18.1966 179.7862 47 A 3.7989 7.3987 117.9957 55.3010 18.4145 179.7706 48 T 4.0060 7.4864 113.4374 66.9626 68.6580 177.0175 49 R 4.1338 7.9778 118.3367 57.9638 30.2140 177.4977 50 L 4.7182 7.4564 117.1401 54.0642 42.5836 178.1408 51 K 3.9511 8.3600 122.6379 58.8117 32.0654 177.6116 52 G 4.1845 7.9796 105.2145 45.1102 0.0000 173.3273 53 I 4.2943 7.6842 119.1882 62.0641 39.9492 176.1834 54 V 4.1749 8.1733 121.6930 60.6180 32.9346 172.1527 55 P 4.3505 0.0000 0.0000 63.1169 32.2860 175.5560 56 L 5.3561 8.4839 122.6164 53.0972 45.5236 175.1857 57 A 5.4263 8.7698 122.4994 50.5319 23.6224 175.0617 58 K 5.0540 9.2605 118.1061 55.2381 36.4934 175.7032 59 V 4.3587 8.6603 121.7767 61.4223 35.3549 173.5383 60 D 3.9465 8.5965 127.9679 54.0785 40.4822 176.5213 61 C 4.1439 9.0139 126.8035 62.4888 32.0604 176.0711 62 T 3.8853 7.6849 107.5863 63.3733 68.6217 174.6972 63 A 4.5503 7.4811 122.2961 52.1380 20.6367 175.9074 64 N 5.0423 7.8666 114.2042 51.9933 40.0182 177.0151 65 T 3.9995 8.3385 118.5788 66.0620 68.8153 175.5127 66 N 4.2429 7.9855 118.5760 56.2555 37.2547 177.3972 67 T 3.5304 7.4602 117.4214 66.4538 68.5681 176.5882 68 C 3.7359 7.6813 118.4277 62.3728 27.7512 175.8329 69 N 4.3503 8.3239 118.5358 55.8099 37.9979 177.3982 70 K 4.0251 7.5022 119.3189 59.1600 32.3825 177.6004 71 Y 4.5548 7.8609 114.8243 57.1618 38.2341 175.6736 72 G 3.8832 7.6626 107.6294 46.4589 0.0000 175.8494 73 V 3.5824 8.1324 120.8464 65.8348 31.5405 177.2438 74 S 3.7435 8.3188 110.3441 57.8822 60.6253 172.0511 75 G 3.6848 6.5625 110.5048 45.8116 0.0000 171.1776 76 Y 5.2293 6.9564 116.3556 54.7742 40.8299 172.7896 77 P 4.8874 0.0000 0.0000 63.4040 32.6467 175.9966 78 T 4.6666 9.1449 118.6484 62.1159 72.2184 172.6137 79 L 5.1954 8.6622 126.9214 53.4128 43.9536 176.1433 80 K 5.1969 9.4326 121.7857 54.9076 37.3990 175.1081 81 I 5.1177 8.0196 120.8973 59.9092 41.2898 174.8815 82 F 5.3413 9.2927 124.4148 53.9708 41.4128 173.0194 83 R 4.2356 8.4699 123.9993 56.8702 31.1571 175.4661 84 D 4.2682 10.0661 125.6412 55.1840 40.3583 173.7819 85 G 3.9996 8.9914 101.5897 45.2333 0.0000 173.6925 86 E 4.8929 8.2914 117.7789 53.6437 33.4499 174.7625 87 E 3.4775 9.1189 122.5871 56.8912 29.9172 176.3240 88 A 4.3852 8.6997 129.2105 51.5981 20.9436 179.2812 89 G 4.3475 7.3570 107.8112 45.8961 0.0000 172.7095 90 A 4.6041 8.0045 118.3699 50.5183 23.0890 176.6807 91 Y 4.3666 8.4139 120.9758 58.1271 39.6401 175.3229 92 D 4.5343 6.8576 123.2023 51.0210 41.5077 173.5242 93 G 3.7878 6.1935 109.4575 43.8548 0.0000 168.8441 94 P 4.3891 0.0000 0.0000 63.0530 32.0072 177.9470 95 R 4.4958 8.3687 121.6497 54.9402 28.4084 176.2050 96 T 4.7017 7.4140 109.8067 58.9880 73.4741 174.4009 97 A 3.9742 9.0656 124.6718 55.6981 18.3207 179.7897 98 D 4.4174 8.2347 115.9677 57.2812 41.2159 178.5583 99 G 3.8482 8.0252 107.3612 47.3380 0.0000 175.7461 100 I 3.7724 7.5305 122.6019 64.0347 37.0553 178.7679 101 V 3.6018 7.7568 118.9924 66.1309 31.3946 178.1857 102 S 4.1338 8.5156 115.3381 61.9865 62.4765 176.1978 103 H 4.2069 8.4041 119.8684 58.9257 29.7264 176.9738 104 L 4.0943 7.8750 122.1540 58.1708 42.0861 178.8557 105 K 3.8900 8.3064 118.7107 59.5758 31.7962 179.3052 106 K 4.0873 8.0610 117.6358 58.4356 31.9367 177.6304 107 Q 4.4426 7.8128 114.5611 56.7862 30.7553 176.7109 108 A 4.0919 8.5378 121.3586 53.1093 18.8652 177.8953 109 G 5.1578 7.0322 116.0834 45.8761 0.0000 170.7653 110 P 4.3229 0.0000 0.0000 64.8149 32.1659 178.0143 111 A 4.0400 7.8252 122.6794 53.2754 18.8354 177.5163 112 S 3.7740 8.8179 114.6493 59.0657 61.0290 172.8447 113 V 3.7581 7.3442 124.7384 63.2237 31.1440 175.5999 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 S 8.33 4.55 0.00 3.86 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 2 D 8.39 4.61 0.00 2.66 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 V 8.36 4.04 2.19 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 0.86 0.00 0.00 0.80 0.00 0.00 4 L 8.86 4.09 0.00 1.63 1.56 0.87 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 5 E 8.19 4.59 0.00 1.85 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 2.24 2.43 0.00 6 L 7.85 4.50 0.00 1.84 1.86 0.80 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 7 T 8.28 4.80 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 1.21 0.00 0.00 8 D 8.96 4.57 0.00 2.61 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 D 7.56 4.53 0.00 2.62 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 10 N 7.94 5.02 0.00 2.93 2.97 0.00 0.00 5.92 8.15 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 11 F 9.05 4.00 0.00 3.09 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 12 E 8.49 4.29 0.00 2.07 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 0.00 2.50 2.33 0.00 13 S 7.99 4.61 0.00 3.95 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 14 R 7.82 4.19 0.00 1.66 1.88 0.00 3.25 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 1.75 1.65 0.00 15 I 7.24 3.60 1.62 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.03 0.02 0.00 0.00 16 S 7.79 4.39 0.00 3.99 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 17 D 7.82 4.49 0.00 2.61 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 T 7.37 4.00 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 1.29 0.00 0.00 19 G 7.68 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 0.00 0.00 0.00 20 S 8.07 4.08 0.00 3.87 3.94 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 21 A 8.01 4.09 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 22 G 9.28 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 23 L 7.26 5.06 0.00 1.77 1.67 0.99 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 24 M 9.09 4.98 0.00 2.13 1.89 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.47 0.00 25 L 8.98 5.42 0.00 1.79 1.55 0.88 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 26 V 8.90 4.88 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 1.04 0.00 0.00 0.55 0.00 0.00 27 E 8.91 4.75 0.00 1.16 1.12 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 1.97 1.95 0.00 28 F 9.21 5.29 0.00 3.26 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 29 F 8.95 5.34 0.00 2.99 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 30 A 7.82 4.19 0.06 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 31 P 0.00 4.16 0.00 1.74 1.78 0.00 2.61 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.14 0.00 32 W 6.98 4.77 0.00 3.35 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 33 C 8.99 4.28 0.00 3.04 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 34 G 8.25 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 0.00 0.00 0.00 35 H 8.19 4.31 0.00 3.34 3.42 0.00 5.83 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 36 C 8.33 4.14 0.00 3.29 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 37 K 7.95 4.05 0.00 1.98 1.94 0.00 1.66 0.00 0.00 1.79 0.00 0.00 3.31 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.52 1.56 7.81 38 R 7.92 4.12 0.00 1.98 2.03 0.00 3.28 0.00 0.00 3.33 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.77 0.00 39 L 8.26 4.20 0.00 1.85 1.68 0.99 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 40 A 7.92 3.92 1.27 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 0.00 0.00 0.00 41 P 0.00 4.24 0.00 2.27 2.32 0.00 3.73 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 2.17 2.05 0.00 42 E 8.09 4.02 0.00 2.23 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 0.00 2.41 2.33 0.00 43 Y 8.36 4.00 0.00 3.04 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 44 E 8.44 3.83 0.00 2.15 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 2.46 0.00 45 A 7.67 3.94 1.38 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 0.00 0.00 46 A 8.07 3.82 1.17 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 0.00 0.00 47 A 7.40 3.80 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 48 T 7.49 4.01 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 49 R 7.98 4.13 0.00 1.87 1.96 0.00 3.14 0.00 0.00 3.20 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 50 L 7.46 4.72 0.00 1.68 1.56 0.87 0.60 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 51 K 8.36 3.95 0.00 1.90 1.82 0.00 1.57 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.39 1.48 7.81 52 G 7.98 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 53 I 7.68 4.29 1.85 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 1.29 0.69 0.91 0.00 0.00 54 V 8.17 4.17 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 0.71 0.00 0.00 0.94 0.00 0.00 55 P 0.00 4.35 0.00 2.09 1.94 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 2.10 2.11 0.00 56 L 8.48 5.36 0.00 1.33 1.10 0.82 -0.26 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 57 A 8.77 5.43 1.19 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 0.00 0.00 58 K 9.26 5.05 0.00 1.52 1.77 0.00 1.39 0.00 0.00 1.28 0.00 0.00 2.70 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.50 1.48 7.81 59 V 8.66 4.36 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 0.92 0.00 0.00 0.97 0.00 0.00 60 D 8.60 3.95 0.00 2.33 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 0.00 0.00 0.00 61 C 9.01 4.14 0.00 2.98 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 62 T 7.68 3.89 4.05 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 0.89 0.00 0.00 63 A 7.48 4.55 1.12 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 64 N 7.87 5.04 0.00 2.68 2.57 0.00 0.00 6.97 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 T 8.34 4.00 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 1.20 0.00 0.00 66 N 7.99 4.24 0.00 2.84 3.02 0.00 0.00 6.24 7.31 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 67 T 7.46 3.53 3.91 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 -0.05 0.00 0.00 68 C 7.68 3.74 0.00 2.84 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 69 N 8.32 4.35 0.00 2.77 2.83 0.00 0.00 6.74 7.94 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 70 K 7.50 4.03 0.00 1.94 2.04 0.00 1.88 0.00 0.00 1.75 0.00 0.00 3.04 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.66 1.56 7.81 71 Y 7.86 4.55 0.00 2.78 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 72 G 7.66 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 0.00 0.00 0.00 73 V 8.13 3.58 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 1.11 0.00 0.00 0.44 0.00 0.00 74 S 8.32 3.74 0.00 4.01 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 75 G 6.56 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 0.00 0.00 0.00 76 Y 6.96 5.23 0.00 3.04 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 77 P 0.00 4.89 0.00 2.12 2.16 0.00 3.83 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.07 0.00 78 T 9.14 4.67 4.52 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 1.40 0.00 0.00 79 L 8.66 5.20 0.00 1.82 1.58 0.90 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 80 K 9.43 5.20 0.00 2.22 1.76 0.00 1.76 0.00 0.00 2.06 0.00 0.00 2.76 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.75 7.81 81 I 8.02 5.12 1.85 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 1.46 0.85 0.95 0.00 0.00 82 F 9.29 5.34 0.00 3.04 3.10 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 0.00 83 R 8.47 4.24 0.00 1.91 1.83 0.00 3.33 0.00 0.00 3.27 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.78 0.00 84 D 10.07 4.27 0.00 2.77 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 85 G 8.99 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 0.00 0.00 0.00 86 E 8.29 4.89 0.00 2.06 1.86 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 2.31 2.29 0.00 87 E 9.12 3.48 0.00 1.75 1.77 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 2.03 1.76 0.00 88 A 8.70 4.39 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 89 G 7.36 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 0.00 0.00 0.00 0.00 90 A 8.00 4.60 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 91 Y 8.41 4.37 0.00 3.07 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 92 D 6.86 4.53 0.00 2.47 2.38 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 93 G 6.19 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 94 P 0.00 4.39 0.00 2.14 2.06 0.00 3.76 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.14 0.00 95 R 8.37 4.50 0.00 1.86 1.96 0.00 3.25 0.00 0.00 3.32 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.72 0.00 96 T 7.41 4.70 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 1.25 0.00 0.00 97 A 9.07 3.97 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.23 4.42 0.00 2.82 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 G 8.03 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 0.00 100 I 7.53 3.77 1.80 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 1.56 1.56 0.79 0.00 0.00 101 V 7.76 3.60 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 1.08 0.00 0.00 0.97 0.00 0.00 102 S 8.52 4.13 0.00 4.09 3.94 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 0.00 103 H 8.40 4.21 0.00 3.34 3.79 0.00 5.95 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 L 7.87 4.09 0.00 1.73 1.87 0.93 1.20 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 0.00 105 K 8.31 3.89 0.00 1.83 1.86 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.70 7.81 106 K 8.06 4.09 0.00 1.78 1.87 0.00 1.72 0.00 0.00 1.75 0.00 0.00 3.10 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.57 7.81 107 Q 7.81 4.44 0.00 2.09 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.99 0.00 0.00 0.00 0.00 0.00 2.41 2.31 0.00 108 A 8.54 4.09 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 0.00 109 G 7.03 5.16 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 0.00 110 P 0.00 4.32 0.00 2.19 2.19 0.00 3.77 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 1.98 2.10 0.00 111 A 7.83 4.04 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 0.00 112 S 8.82 3.77 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 0.00 113 V 7.34 3.76 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 0.66 0.00 0.00 1.01 0.00 0.00