NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4198 8.3049 120.3504 55.1848 33.4177 174.1929 2 L 4.7323 7.4099 116.6525 53.2973 46.3572 174.6111 3 S 4.6646 9.1781 115.5296 56.6522 67.6020 172.6035 4 P 4.3056 0.0000 0.0000 63.3858 31.4286 176.0412 5 K 4.8346 8.5063 123.6024 54.9667 35.2316 174.8402 6 R 4.6667 8.0196 116.8015 54.4839 33.2395 175.3708 7 T 3.8924 8.4238 116.4360 62.5196 67.7345 173.0508 8 R 4.4776 7.6924 122.0818 55.9183 31.5989 173.9817 9 F 4.5737 9.1270 112.8892 56.4547 37.4451 176.7400 10 R 3.8006 7.6301 117.4904 57.2096 29.8538 176.4878 11 K 4.6005 7.4240 121.8715 55.8453 33.4277 172.8114 12 Q 4.7522 7.8131 120.3624 53.8854 31.7518 174.8463 13 H 4.5137 8.4947 115.0290 56.3086 28.7983 174.8538 14 R 4.1901 7.9716 119.1728 56.5497 30.9685 178.0522 15 G 3.7441 7.6497 107.2579 45.8403 0.0000 172.6865 16 R 4.2579 8.0028 113.2982 55.3503 31.2032 174.1025 17 M 3.9411 9.0054 121.7038 55.4088 31.4762 175.9619 18 K 4.4990 8.0892 125.4436 54.5186 34.7752 176.1677 19 G 3.9314 8.5064 108.1784 46.2617 0.0000 174.2317 20 I 3.8688 8.5390 119.1183 63.1592 37.5478 177.2683 21 S 3.7219 6.9971 110.6344 61.6374 63.1257 175.6071 22 Y 3.6412 7.8846 118.2997 60.8863 38.3061 177.3014 23 R 4.0302 8.3500 120.7928 57.0265 31.1943 176.7652 24 G 4.8259 7.6337 114.9449 45.8284 0.0000 173.1071 25 N 4.7288 8.3462 118.6040 52.7208 39.9418 173.8932 26 R 4.4714 8.0742 115.6639 55.6835 30.6206 175.4645 27 I 4.2278 8.3692 118.9976 59.9709 37.7725 174.8389 28 C 4.3295 8.1363 126.1789 60.5634 32.7910 173.4951 29 F 3.9520 8.5527 120.4825 57.5705 39.5747 175.6152 30 G 4.5618 8.6703 112.4948 45.3895 0.0000 173.4227 31 R 3.9891 8.2804 119.1385 58.4707 30.2138 178.9781 32 Y 4.4998 8.2575 113.6924 56.9863 40.1663 173.2464 33 A 4.9165 7.9578 120.5132 53.4983 21.6126 174.7090 34 L 4.7264 8.3510 116.8320 54.7909 45.6843 175.2020 35 Q 5.3173 9.3296 124.2960 53.4366 32.8602 173.8513 36 A 4.9172 8.3725 121.2569 50.7338 21.9537 177.0634 37 L 4.5276 8.5798 115.7419 55.3640 44.3099 177.4093 38 E 4.8070 7.8677 115.6761 53.6292 33.1555 174.1512 39 P 5.0818 0.0000 0.0000 62.8081 32.2182 174.7421 40 A 4.4241 7.9289 120.8340 52.1886 22.6565 175.7932 41 W 4.9185 8.9943 118.1740 55.4173 28.3921 174.5980 42 I 4.3516 7.8315 123.4013 61.1536 38.0476 176.2079 43 T 4.9538 9.3788 117.8930 59.7714 70.4253 175.7296 44 S 3.8699 7.3869 115.5276 60.7469 61.0898 175.4632 45 R 4.0626 7.0866 115.0483 57.3573 29.7587 177.7286 46 Q 4.3213 7.6837 118.5821 58.1296 29.5737 177.5714 47 I 3.8064 7.4898 119.1130 64.0499 38.0967 177.6730 48 E 3.9607 8.1242 119.0470 59.1980 29.1479 178.7647 49 A 4.2990 7.5031 117.0451 53.7520 17.2179 178.7612 50 G 3.9079 7.7001 103.8967 45.9913 0.0000 176.3336 51 R 4.1132 8.3073 121.1383 59.7086 30.2597 178.8001 52 R 3.9612 7.8885 117.1687 59.2295 28.8769 178.9384 53 A 4.0698 7.6077 119.8403 54.9988 18.1156 179.3223 54 M 4.2512 7.9198 116.4027 58.0232 32.5848 177.2091 55 T 4.3996 7.6125 110.4943 61.7731 68.1393 175.6721 56 R 3.9037 7.7884 120.6367 59.6865 30.4497 176.6147 57 N 4.6421 7.8000 113.5426 52.6800 37.4335 174.9846 58 A 4.2127 7.2765 118.6477 52.1689 21.4921 173.9469 59 R 3.5304 9.0348 125.5314 56.1563 29.2650 175.4272 60 R 3.8445 8.6586 124.5334 56.3609 28.7644 175.4975 61 G 4.1252 7.6169 118.6559 44.9442 0.0000 175.2792 62 G 3.9101 8.7726 119.1649 44.7299 0.0000 172.1197 63 K 4.3468 7.9266 121.5618 54.3720 35.3230 176.1257 64 I 4.0980 7.7332 124.9222 59.2750 38.8275 175.2176 65 W 4.9013 8.3418 123.4883 54.8490 32.0279 175.6017 66 V 4.2373 8.3084 114.5236 60.1026 32.6473 175.3891 67 R 4.4842 8.4509 124.9900 55.9173 30.4001 176.2484 68 I 4.7471 7.1596 109.7555 59.3188 40.8491 174.0773 69 F 4.6897 8.1047 119.3902 56.7249 41.9346 171.9207 70 P 4.2850 0.0000 0.0000 62.9273 31.6287 174.2037 71 D 4.3140 7.6359 117.0168 54.8894 47.3800 175.3137 72 K 3.6502 7.7561 123.1178 56.3981 33.2173 174.3434 73 P 4.5021 0.0000 0.0000 62.6840 32.6843 176.2451 74 V 4.7215 8.3983 119.3267 62.1657 34.2035 173.5015 75 T 4.8471 8.7570 118.7124 60.0966 70.3775 174.1801 76 V 4.4900 8.2846 124.4730 60.8799 34.8112 174.5318 77 R 4.2387 8.4813 126.6968 54.6118 30.4926 173.3255 78 P 3.9934 0.0000 0.0000 65.4620 31.4209 176.0381 79 A 4.5971 6.8495 125.1869 53.1531 25.2610 177.2041 80 E 4.4002 7.8364 114.6396 55.8626 32.0190 178.0688 81 T 4.4553 7.9976 121.0703 62.6271 66.3143 177.9186 82 R 4.4702 8.2712 116.4397 54.4898 31.3763 173.5923 83 M 4.2487 8.5442 122.1399 56.8957 33.3227 175.6415 84 G 4.0890 7.3640 104.4743 44.5581 0.0000 172.0497 85 S 4.3451 8.4784 113.6460 57.4739 63.8372 173.9557 86 G 3.8791 8.2430 110.8796 45.1571 0.0000 173.7961 87 K 4.0447 8.1575 118.5427 58.5682 32.3033 178.0069 88 G 4.0931 7.7318 105.9784 46.3336 0.0000 174.2877 89 S 4.7951 7.9150 113.2867 57.5435 65.0992 172.9803 90 P 4.3658 0.0000 0.0000 65.3965 31.2840 176.8507 91 E 4.3296 7.8626 112.8248 56.6101 31.3277 175.0968 92 Y 4.2281 6.6322 116.9638 57.4170 44.2277 172.6226 93 W 5.4765 7.4230 119.1468 56.4116 32.0337 174.4957 94 V 5.1667 8.3766 110.4260 59.9923 35.0599 172.9146 95 A 4.0834 8.1686 126.7517 52.3181 25.0132 178.4437 96 V 4.2950 8.1382 110.7494 60.3098 35.3291 176.2674 97 V 4.2841 8.2147 127.0325 61.2465 30.1814 174.5801 98 K 4.6958 7.9577 123.8667 54.6922 33.8430 174.9160 99 P 4.7927 0.0000 0.0000 63.3798 31.6619 175.9917 100 G 4.0509 9.2205 108.6527 45.2372 0.0000 173.4255 101 R 4.4969 7.2693 119.4425 55.4765 31.7765 175.3692 102 I 3.9993 8.2569 124.0473 61.8159 39.1121 173.3394 103 L 4.4828 9.1763 125.8244 55.5234 43.3806 177.3877 104 Y 4.5092 9.1735 118.7670 58.3841 40.7057 175.2275 105 E 5.0595 8.7507 119.8296 55.2019 33.8251 174.9127 106 I 4.7509 8.3157 124.7032 59.9666 41.1962 174.4643 107 S 4.6369 8.7703 118.7001 58.6743 65.9524 175.1880 108 G 4.1048 9.2578 108.0964 45.7078 0.0000 172.9354 109 V 4.4410 7.1008 111.1723 58.3613 35.5191 174.9326 110 A 4.3617 8.1877 122.4450 52.1055 20.1596 177.5844 111 E 3.8552 8.5447 117.7425 59.0600 30.3034 178.3524 112 N 4.3804 7.9255 117.5144 55.9504 37.8910 177.0708 113 I 3.5742 7.7454 120.8202 62.9570 37.8823 176.6005 114 A 4.2906 7.2237 118.8366 52.6585 19.1696 178.6207 115 R 3.8492 7.7024 118.2266 58.6727 30.4376 178.5762 116 R 3.8959 7.7156 114.9681 58.7875 29.3729 178.3669 117 A 4.6592 7.3808 122.2784 54.7379 18.4180 179.7229 118 V 3.5783 7.4043 115.2380 65.4677 31.2941 177.7220 119 A 3.8254 7.1813 120.3811 55.4278 18.6233 179.1850 120 I 3.6946 7.5935 116.6473 64.3992 36.9878 178.4940 121 A 3.8429 7.5661 119.8550 54.8786 17.9204 179.4824 122 A 3.7203 7.8360 119.3962 54.9975 18.2279 179.7764 123 S 4.0242 7.5820 110.8934 61.3420 62.4987 176.2289 124 K 4.1463 7.3976 120.1147 57.9728 32.0194 177.3702 125 M 4.3477 7.0722 119.9936 54.0270 32.4678 174.9066 126 P 4.3751 0.0000 0.0000 65.0228 31.9709 176.6845 127 I 4.3741 7.4109 118.6615 59.0678 38.6147 175.5830 128 R 4.0876 8.4887 120.2564 56.9195 29.6913 175.8279 129 T 4.9313 8.2328 109.1536 60.0135 72.0870 172.5379 130 Q 4.7064 9.0382 124.8903 54.3989 31.5045 173.9318 131 F 5.2019 8.9698 129.2151 57.5554 40.5804 174.5935 132 I 4.4742 7.4646 118.6213 59.2133 40.2200 172.7229 133 I 4.0048 7.3061 116.4281 61.1934 40.3775 178.2917 134 S 4.3501 7.9033 120.4418 59.2433 66.9610 175.2412 135 G 3.9952 8.7663 111.5007 46.8357 0.0000 173.2011 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 4.42 0.00 1.98 2.11 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.54 0.00 2 L 7.41 4.73 0.00 1.68 1.59 1.00 0.79 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 S 9.18 4.66 0.00 3.98 3.78 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 4 P 0.00 4.31 0.00 2.08 2.10 0.00 3.69 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.17 0.00 5 K 8.51 4.83 0.00 1.86 1.97 0.00 0.79 0.00 0.00 0.61 0.00 0.00 2.61 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.22 1.22 7.81 6 R 8.02 4.67 0.00 1.72 1.77 0.00 3.25 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 7 T 8.42 3.89 4.26 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 1.23 0.00 0.00 8 R 7.69 4.48 0.00 1.90 1.87 0.00 2.92 0.00 0.00 3.07 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.37 0.00 9 F 9.13 4.57 0.00 3.22 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 10 R 7.63 3.80 0.00 1.76 1.77 0.00 2.78 0.00 0.00 2.86 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.53 0.00 11 K 7.42 4.60 0.00 1.72 1.75 0.00 1.76 0.00 0.00 1.79 0.00 0.00 3.06 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.20 1.27 7.81 12 Q 7.81 4.75 0.00 2.10 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.74 0.00 0.00 0.00 0.00 0.00 2.13 2.29 0.00 13 H 8.49 4.51 0.00 3.15 3.33 0.00 5.71 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 R 7.97 4.19 0.00 1.98 2.33 0.00 3.30 0.00 0.00 3.44 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.75 0.00 15 G 7.65 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 16 R 8.00 4.26 0.00 1.91 1.94 0.00 3.07 0.00 0.00 3.29 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.48 0.00 17 M 9.01 3.94 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.69 0.00 18 K 8.09 4.50 0.00 1.70 1.85 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.35 1.45 7.81 19 G 8.51 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 20 I 8.54 3.87 1.91 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.07 0.94 0.00 0.00 21 S 7.00 3.72 0.00 4.07 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 22 Y 7.88 3.64 0.00 2.90 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 23 R 8.35 4.03 0.00 1.89 2.12 0.00 3.45 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.76 0.00 24 G 7.63 4.83 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 25 N 8.35 4.73 0.00 2.84 2.84 0.00 0.00 6.89 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 26 R 8.07 4.47 0.00 1.85 1.81 0.00 2.98 0.00 0.00 3.14 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.59 0.00 27 I 8.37 4.23 1.87 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.82 0.88 0.00 0.00 28 C 8.14 4.33 0.00 3.02 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 29 F 8.55 3.95 0.00 3.25 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 30 G 8.67 4.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 R 8.28 3.99 0.00 2.21 2.00 0.00 3.38 0.00 0.00 3.30 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.92 0.00 32 Y 8.26 4.50 0.00 3.16 2.97 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 33 A 7.96 4.92 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 34 L 8.35 4.73 0.00 1.85 1.67 1.02 1.00 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 35 Q 9.33 5.32 0.00 2.08 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.33 0.00 0.00 0.00 0.00 0.00 2.48 2.16 0.00 36 A 8.37 4.92 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 37 L 8.58 4.53 0.00 1.63 1.70 0.95 0.86 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 38 E 7.87 4.81 0.00 1.79 1.82 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 2.22 2.40 0.00 39 P 0.00 5.08 0.00 1.97 2.00 0.00 3.80 0.00 0.00 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.96 0.00 40 A 7.93 4.42 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 41 W 8.99 4.92 0.00 3.09 3.23 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 42 I 7.83 4.35 1.88 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 1.43 1.16 1.01 0.00 0.00 43 T 9.38 4.95 3.99 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 0.00 0.00 0.00 1.25 0.00 0.00 44 S 7.39 3.87 0.00 3.24 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 45 R 7.09 4.06 0.00 1.99 2.08 0.00 3.02 0.00 0.00 3.36 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 46 Q 7.68 4.32 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.85 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 47 I 7.49 3.81 1.94 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.43 0.89 0.00 0.00 48 E 8.12 3.96 0.00 2.02 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 2.49 2.44 0.00 49 A 7.50 4.30 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 50 G 7.70 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 0.00 0.00 0.00 0.00 51 R 8.31 4.11 0.00 2.06 1.97 0.00 3.09 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 52 R 7.89 3.96 0.00 1.90 1.97 0.00 3.18 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.85 0.00 53 A 7.61 4.07 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 54 M 7.92 4.25 0.00 2.28 2.29 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.73 0.00 55 T 7.61 4.40 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 1.31 0.00 0.00 56 R 7.79 3.90 0.00 2.05 2.08 0.00 3.29 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.56 0.00 57 N 7.80 4.64 0.00 3.08 2.99 0.00 0.00 6.62 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 A 7.28 4.21 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 59 R 9.03 3.53 0.00 1.93 1.98 0.00 3.31 0.00 0.00 3.14 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.66 0.00 60 R 8.66 3.84 0.00 1.91 1.92 0.00 3.26 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 61 G 7.62 4.13 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 0.00 0.00 0.00 62 G 8.77 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 0.00 0.00 0.00 0.00 63 K 7.93 4.35 0.00 1.47 1.09 0.00 1.62 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.16 0.90 7.81 64 I 7.73 4.10 1.75 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 1.32 0.58 0.87 0.00 0.00 65 W 8.34 4.90 0.00 3.53 2.72 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 66 V 8.31 4.24 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 0.64 0.00 0.00 0.92 0.00 0.00 67 R 8.45 4.48 0.00 1.77 1.89 0.00 3.33 0.00 0.00 3.35 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.56 0.00 68 I 7.16 4.75 1.88 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.89 0.91 0.00 0.00 69 F 8.10 4.69 0.00 2.85 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 70 P 0.00 4.28 0.00 2.03 1.94 0.00 3.32 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.91 0.00 71 D 7.64 4.31 0.00 2.48 2.45 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 72 K 7.76 3.65 0.00 1.24 1.49 0.00 1.40 0.00 0.00 1.39 0.00 0.00 2.13 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.39 1.26 7.81 73 P 0.00 4.50 0.00 1.98 2.08 0.00 3.80 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.10 0.00 74 V 8.40 4.72 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 1.26 0.00 0.00 1.33 0.00 0.00 75 T 8.76 4.85 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 1.32 0.00 0.00 76 V 8.28 4.49 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 0.78 0.00 0.00 0.94 0.00 0.00 77 R 8.48 4.24 0.00 1.78 1.80 0.00 3.43 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00 78 P 0.00 3.99 0.00 2.07 1.92 0.00 3.75 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 2.03 2.10 0.00 79 A 6.85 4.60 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 80 E 7.84 4.40 0.00 1.95 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 0.00 2.31 2.35 0.00 81 T 8.00 4.46 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 1.21 0.00 0.00 82 R 8.27 4.47 0.00 1.77 1.80 0.00 3.24 0.00 0.00 3.14 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 83 M 8.54 4.25 0.00 1.95 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 2.53 2.58 0.00 84 G 7.36 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 0.00 0.00 0.00 0.00 85 S 8.48 4.35 0.00 4.02 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 86 G 8.24 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 87 K 8.16 4.04 0.00 1.79 1.86 0.00 1.77 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.39 7.81 88 G 7.73 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 0.00 0.00 0.00 0.00 89 S 7.92 4.80 0.00 3.87 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 90 P 0.00 4.37 0.00 2.03 2.11 0.00 3.69 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 91 E 7.86 4.33 0.00 2.05 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 0.00 2.21 2.39 0.00 92 Y 6.63 4.23 0.00 2.72 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 W 7.42 5.48 0.00 3.40 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 94 V 8.38 5.17 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 1.14 0.00 0.00 0.93 0.00 0.00 95 A 8.17 4.08 0.94 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 0.00 0.00 96 V 8.14 4.29 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 0.63 0.00 0.00 0.77 0.00 0.00 97 V 8.21 4.28 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 1.05 0.00 0.00 0.94 0.00 0.00 98 K 7.96 4.70 0.00 1.79 1.74 0.00 1.72 0.00 0.00 2.12 0.00 0.00 2.63 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.40 7.81 99 P 0.00 4.79 0.00 2.10 2.14 0.00 3.39 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 2.02 1.95 0.00 100 G 9.22 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 0.00 0.00 0.00 0.00 101 R 7.27 4.50 0.00 1.82 1.83 0.00 3.12 0.00 0.00 3.12 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.87 0.00 102 I 8.26 4.00 2.09 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 1.44 1.06 0.99 0.00 0.00 103 L 9.18 4.48 0.00 1.93 1.68 1.08 1.09 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 0.00 104 Y 9.17 4.51 0.00 3.00 2.97 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 0.00 105 E 8.75 5.06 0.00 2.24 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 2.41 2.52 0.00 106 I 8.32 4.75 1.99 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.37 0.93 0.00 0.00 107 S 8.77 4.64 0.00 4.16 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 0.00 108 G 9.26 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 0.00 0.00 0.00 0.00 109 V 7.10 4.44 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 0.77 0.00 0.00 0.94 0.00 0.00 110 A 8.19 4.36 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 E 8.54 3.86 0.00 2.25 2.25 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 2.30 2.38 0.00 112 N 7.93 4.38 0.00 2.90 3.09 0.00 0.00 5.90 7.68 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 0.00 113 I 7.75 3.57 1.84 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 1.55 1.16 0.92 0.00 0.00 114 A 7.22 4.29 1.25 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 0.00 0.00 115 R 7.70 3.85 0.00 1.90 1.94 0.00 3.05 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.13 0.00 116 R 7.72 3.90 0.00 1.99 2.08 0.00 2.98 0.00 0.00 3.29 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.62 0.00 117 A 7.38 4.66 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.40 3.58 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 1.06 0.00 0.00 1.09 0.00 0.00 119 A 7.18 3.83 1.21 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 0.00 120 I 7.59 3.69 1.80 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.91 0.86 0.00 0.00 121 A 7.57 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 A 7.84 3.72 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 0.00 123 S 7.58 4.02 0.00 3.87 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 0.00 124 K 7.40 4.15 0.00 1.93 1.86 0.00 1.76 0.00 0.00 1.68 0.00 0.00 3.17 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.63 1.70 7.81 125 M 7.07 4.35 0.00 2.00 2.15 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.81 0.00 126 P 0.00 4.38 0.00 2.20 2.20 0.00 3.78 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.02 0.00 127 I 7.41 4.37 1.91 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.02 1.03 0.00 0.00 128 R 8.49 4.09 0.00 1.93 1.97 0.00 3.27 0.00 0.00 3.30 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.66 0.00 129 T 8.23 4.93 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 1.30 0.00 0.00 130 Q 9.04 4.71 0.00 2.16 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.95 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 131 F 8.97 5.20 0.00 3.02 3.02 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 0.00 132 I 7.46 4.47 1.74 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 1.22 0.71 0.87 0.00 0.00 133 I 7.31 4.00 1.59 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 1.01 0.44 0.75 0.00 0.00 134 S 7.90 4.35 0.00 3.69 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 0.00 135 G 8.77 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