NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 K 4.3012 8.3149 121.7961 55.8102 33.3979 175.5208 7 L 4.1992 8.3789 125.5335 53.2676 42.3113 174.8324 8 H 5.0283 9.1164 117.2520 53.6392 32.5838 172.6477 9 K 4.5645 8.4702 120.5706 56.2226 33.0514 176.1263 10 E 5.0036 9.0056 122.9027 53.7573 33.5358 173.8916 11 P 5.0420 0.0000 0.0000 63.2780 32.5355 174.8758 12 A 4.9071 8.3241 120.6433 51.4498 22.9463 175.7464 13 T 4.6044 8.5607 115.6348 61.2434 71.8707 173.7307 14 L 4.2109 8.7008 128.7961 55.9066 42.3105 175.8287 15 I 4.3076 8.8360 127.6794 62.5596 38.3747 175.9620 16 K 4.6220 7.6245 121.2755 55.0664 35.7321 174.0596 17 A 4.5693 8.6733 130.4404 51.9112 19.4318 176.7183 18 I 4.1914 8.4196 123.4427 62.7261 38.4400 174.7496 19 D 4.7069 7.6055 116.9204 52.9716 44.2284 175.3051 20 G 3.7631 8.8502 108.2932 48.1876 0.0000 173.7786 21 D 5.0317 8.0869 116.2066 52.9532 41.3860 175.5448 22 T 5.2246 8.0072 115.7007 62.2758 72.7172 172.9348 23 L 5.1213 8.9659 124.8691 52.9340 46.6089 175.4294 24 K 5.0377 9.2700 121.9727 55.2180 33.8536 175.7247 25 L 5.2736 8.9946 124.4395 52.9984 46.2449 175.5147 26 M 4.8693 9.2438 122.5627 55.0486 33.4951 174.3408 27 Y 5.0221 9.3158 128.4939 55.7911 41.7188 175.7208 28 K 3.7949 9.3564 128.2061 57.5057 29.5738 176.1416 29 G 3.9364 8.1245 103.3432 45.7264 0.0000 172.7959 30 Q 4.8458 7.7912 119.8055 53.0773 31.3369 173.3260 31 P 4.9693 0.0000 0.0000 63.2004 32.2965 175.2899 32 M 4.8951 9.4179 122.5067 54.5673 36.5555 173.2263 33 T 4.9991 8.4528 120.2158 62.6238 70.7540 173.6517 34 F 5.1113 9.6836 124.6422 55.5865 42.4897 174.1527 35 R 5.0976 8.9609 123.1637 54.1990 32.4402 174.9645 36 L 4.4148 8.7974 127.5408 54.5916 42.0706 177.1883 37 L 3.8852 8.6465 125.0922 56.0136 42.6793 178.3444 38 L 3.8568 9.0266 121.1663 54.9844 39.3894 173.9564 39 V 4.9837 7.3021 110.8376 59.5505 35.3106 174.7854 40 D 5.0515 9.0659 124.0488 52.8804 43.1025 175.6557 41 T 4.7697 8.3943 113.7296 59.1997 71.2675 173.0156 42 P 4.5011 0.0000 0.0000 62.7059 32.3697 175.5073 43 E 4.8056 9.9968 121.9198 55.0447 31.9654 177.0528 44 T 4.1170 8.6729 111.4141 63.3596 70.5258 176.1709 45 K 4.3057 7.5885 122.7654 54.5665 30.9524 175.3074 46 H 5.4533 7.8550 118.5053 53.0936 31.7672 173.2090 47 P 4.2980 0.0000 0.0000 65.2670 31.2825 177.0701 48 K 4.3801 7.9462 114.0357 57.3090 34.1625 176.7195 49 K 4.3062 8.4106 117.8061 55.7543 34.6685 176.9398 50 G 3.7891 8.1072 107.3573 45.9356 0.0000 175.9985 51 V 4.3052 8.5942 128.3532 61.2970 32.0492 174.1085 52 E 4.3285 9.5513 129.2192 55.2367 31.1407 176.4177 53 K 3.8985 8.3246 123.2379 58.3513 32.5605 176.8497 54 Y 4.2819 8.1699 122.6377 59.2796 36.3309 171.1267 55 G 3.9940 8.1291 107.6110 47.5744 0.0000 173.8657 56 P 4.2822 0.0000 0.0000 65.0324 31.3717 178.6676 57 E 4.0216 8.2097 116.6260 59.3396 29.5049 178.9976 58 A 3.9996 8.7021 121.1864 55.2834 18.2853 179.6654 59 S 4.1334 8.3856 111.5140 61.5111 62.4387 176.2809 60 A 4.1496 8.2365 123.5806 54.7393 17.9608 179.5273 61 F 3.9447 8.4045 119.4230 61.8219 39.5852 177.4669 62 T 3.9196 8.0812 115.4033 66.4939 68.1841 176.3420 63 K 3.8818 8.0210 121.4046 59.5977 32.2332 178.9576 64 K 3.8979 8.1250 118.6370 59.4804 31.7275 178.9364 65 M 3.8153 7.7637 117.4997 58.9304 32.1690 178.4600 66 V 3.7888 7.8031 112.2872 64.2337 31.5319 178.5243 67 E 4.0133 8.3708 118.0781 58.8356 29.3735 178.0488 68 N 4.6226 7.8799 113.6817 52.3969 39.3117 175.1335 69 A 4.5224 7.0027 124.1077 51.5698 19.4280 178.2923 70 K 4.1858 8.9740 121.5944 58.6116 32.6053 178.1757 71 K 4.6663 8.6402 117.7282 54.4389 36.3748 175.7040 72 V 4.8679 8.4593 124.0767 61.1903 34.2091 174.0096 73 E 5.1663 9.3460 126.5376 54.6719 33.8843 174.9704 74 V 4.6059 9.1112 116.0180 59.5098 34.9141 174.6465 75 E 4.8230 9.0820 125.3114 54.2346 32.0082 175.0081 76 F 4.5855 8.7349 126.1436 57.7169 39.9331 175.8123 77 D 4.8936 8.5890 121.8295 53.6471 43.1941 176.1705 78 K 4.5516 9.4033 120.9054 56.8981 33.5939 177.4149 79 G 4.1718 8.4511 111.1341 45.0998 0.0000 174.1225 80 Q 4.0861 8.6703 122.7371 56.5982 29.4085 176.3653 81 R 4.7507 8.4930 119.1218 56.5257 31.9391 175.7625 82 T 5.1735 7.7106 108.0915 60.0632 72.4241 173.5697 83 D 4.9437 8.6826 123.4002 51.9267 42.1953 176.8695 84 K 3.9382 8.6568 116.4371 59.4356 32.5952 176.9257 85 Y 4.3165 8.1083 115.9536 57.6610 38.1143 176.0992 86 G 3.8973 8.2017 108.0722 45.6333 0.0000 173.8055 87 R 4.4551 8.2676 118.9074 54.6023 32.0817 176.4137 88 G 3.3221 8.5499 110.5038 46.2000 0.0000 172.5704 89 L 5.2815 8.9217 124.4062 53.3150 43.0910 175.4796 90 A 4.3571 8.3889 124.7385 51.1111 23.7214 173.8834 91 Y 4.8606 8.7928 117.3196 57.1744 39.6839 175.2915 92 I 4.7916 8.7125 124.8343 59.6759 40.1034 174.0924 93 Y 5.0496 9.3359 124.0830 56.0743 41.0684 174.5084 94 A 4.8292 9.1781 126.6546 50.1011 21.0108 176.3719 95 D 4.3558 10.3203 125.0854 56.1758 38.9979 175.6195 96 G 3.9903 8.5753 105.5197 45.1835 0.0000 173.5641 97 K 4.5423 7.8245 120.1314 54.5552 34.0507 175.2133 98 M 3.9940 8.5089 123.3307 54.8439 32.8906 176.6389 99 V 3.6180 8.4479 127.6737 66.4130 31.6004 177.5907 100 N 4.3261 8.0234 115.4827 56.4231 38.4011 176.8544 101 E 3.9014 8.0576 119.9286 58.9598 29.8649 178.2890 102 A 4.0405 8.1364 120.9331 55.2865 18.3809 179.5895 103 L 3.5022 7.9490 117.3796 57.7325 41.5974 180.0330 104 V 3.6922 7.4904 118.2639 66.0691 31.3186 178.0687 105 R 3.8832 8.3579 117.4813 59.2039 29.9471 177.5068 106 Q 4.3157 7.8427 115.1509 55.2417 29.1715 176.3803 107 G 3.8529 8.0822 108.8421 46.3047 0.0000 174.6014 108 L 4.3720 7.6425 116.5345 53.8135 42.1891 175.9760 109 A 4.6376 7.4578 118.6961 51.0547 22.0574 176.2027 110 K 4.9160 8.6478 118.8986 54.3244 35.4662 176.1606 111 V 4.1804 8.9988 123.7987 62.8475 31.8437 176.0029 112 A 4.5117 8.9013 130.4021 51.4374 19.4876 176.4707 113 Y 3.8913 8.5620 120.5164 57.8410 39.2113 175.5712 114 V 3.9311 7.1738 126.5958 61.3119 33.2106 174.4546 115 Y 4.5934 8.0568 123.8951 55.7301 39.0740 175.4421 116 K 4.2903 8.6367 125.0142 56.3812 32.6514 175.0845 117 P 4.7790 0.0000 0.0000 63.0046 31.7111 176.8344 118 N 4.8237 8.3093 119.5606 52.2677 36.9233 175.0871 119 N 5.1024 7.8481 114.4299 53.2120 39.0097 177.5871 120 T 3.8156 8.7924 118.1810 67.7162 68.6747 175.0746 121 H 4.8488 7.8145 116.9869 55.8155 29.0784 176.8835 122 E 3.9780 8.2751 123.7479 59.6311 29.2427 178.8771 123 Q 3.9511 8.0088 117.5753 58.9849 28.8194 177.5126 124 H 4.1300 8.3159 118.8607 59.6618 29.7247 176.9515 125 L 3.9169 7.9222 120.3472 57.9110 41.4571 179.8390 126 R 3.9172 8.1899 118.1887 59.1364 29.8299 179.3022 127 K 3.9854 8.4464 118.8135 59.5643 32.0305 179.6577 128 S 4.1046 8.2261 115.6069 61.1529 62.6544 176.4382 129 E 3.9007 8.3359 122.3190 59.0769 29.3528 178.2950 130 A 3.7595 7.8808 120.9168 55.3080 18.3120 179.2772 131 Q 3.7899 7.7103 117.5076 59.4476 29.1892 178.4695 132 A 4.0480 7.8769 121.6661 54.8861 18.2842 179.5551 133 K 3.2746 7.6085 118.0485 59.3150 31.9786 178.7036 134 K 3.7457 7.7018 118.6463 59.6884 32.1376 177.6631 135 E 4.2085 8.3071 115.4772 55.5777 29.9259 176.4564 136 K 3.9952 8.0394 117.9658 57.2440 30.5210 175.3238 137 L 4.4150 8.1661 117.9443 55.2733 44.4371 177.4548 138 N 3.8413 8.9696 119.5580 52.7160 37.8648 176.5336 139 I 3.2004 5.4200 126.3740 64.7301 37.2986 176.4908 140 W 4.8915 7.7686 117.6186 56.7369 29.4628 176.4849 141 S 4.4351 8.1681 119.4370 58.4461 62.6900 173.9478 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 6 K 8.31 4.30 0.00 1.74 1.81 0.00 1.66 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.56 7.81 7 L 8.38 4.20 0.00 1.83 1.70 1.00 0.88 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 8 H 9.12 5.03 0.00 3.20 3.25 0.00 5.71 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 K 8.47 4.56 0.00 1.59 1.69 0.00 1.38 0.00 0.00 1.09 0.00 0.00 2.30 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.15 1.24 7.81 10 E 9.01 5.00 0.00 2.16 2.00 0.00 0.00 0.00 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 2.31 0.00 11 P 0.00 5.04 0.00 2.11 2.08 0.00 3.88 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 2.01 0.00 12 A 8.32 4.91 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 13 T 8.56 4.60 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 14 L 8.70 4.21 0.00 1.63 1.58 0.96 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 15 I 8.84 4.31 2.04 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.76 0.94 0.00 0.00 16 K 7.62 4.62 0.00 1.81 1.61 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.84 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.46 7.81 17 A 8.67 4.57 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 18 I 8.42 4.19 2.02 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 1.31 0.68 0.91 0.00 0.00 19 D 7.61 4.71 0.00 2.66 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.85 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 0.00 0.00 0.00 21 D 8.09 5.03 0.00 2.70 2.85 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 22 T 8.01 5.22 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 1.28 0.00 0.00 23 L 8.97 5.12 0.00 1.60 1.52 0.90 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 24 K 9.27 5.04 0.00 1.78 1.79 0.00 1.67 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.58 7.81 25 L 8.99 5.27 0.00 1.68 1.53 0.31 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 26 M 9.24 4.87 0.00 2.15 2.01 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.56 0.00 27 Y 9.32 5.02 0.00 3.20 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 28 K 9.36 3.79 0.00 1.44 1.57 0.00 1.69 0.00 0.00 1.51 0.00 0.00 2.40 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.91 0.21 7.81 29 G 8.12 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 0.00 0.00 0.00 30 Q 7.79 4.85 0.00 2.22 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.95 0.00 0.00 0.00 0.00 0.00 2.30 2.45 0.00 31 P 0.00 4.97 0.00 2.12 2.11 0.00 3.80 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 2.02 2.00 0.00 32 M 9.42 4.90 0.00 2.26 1.97 0.00 0.00 0.00 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.10 0.00 33 T 8.45 5.00 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 1.23 0.00 0.00 34 F 9.68 5.11 0.00 2.88 2.85 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 35 R 8.96 5.10 0.00 1.87 1.77 0.00 3.35 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.63 0.00 36 L 8.80 4.41 0.00 1.56 1.61 0.98 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.65 3.89 0.00 1.09 1.19 0.37 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 38 L 9.03 3.86 0.00 2.03 1.91 1.08 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 39 V 7.30 4.98 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 0.82 0.00 0.00 0.94 0.00 0.00 40 D 9.07 5.05 0.00 2.57 2.56 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 41 T 8.39 4.77 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 42 P 0.00 4.50 0.00 2.33 2.06 0.00 3.53 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 2.13 2.05 0.00 43 E 10.00 4.81 0.00 2.11 1.87 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 2.25 2.39 0.00 44 T 8.67 4.12 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 1.25 0.00 0.00 45 K 7.59 4.31 0.00 1.71 1.80 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.35 7.81 46 H 7.86 5.45 0.00 3.22 3.29 0.00 5.67 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.30 0.00 1.90 2.05 0.00 3.13 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.98 0.00 48 K 7.95 4.38 0.00 1.86 1.91 0.00 1.55 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.38 7.81 49 K 8.41 4.31 0.00 1.67 1.77 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.09 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.31 1.44 7.81 50 G 8.11 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 51 V 8.59 4.31 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 0.81 0.00 0.00 0.92 0.00 0.00 52 E 9.55 4.33 0.00 1.88 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 0.00 2.19 2.42 0.00 53 K 8.32 3.90 0.00 1.63 1.61 0.00 1.64 0.00 0.00 1.46 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.62 1.07 7.81 54 Y 8.17 4.28 0.00 3.19 2.99 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 0.00 55 G 8.13 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 0.00 0.00 0.00 0.00 56 P 0.00 4.28 0.00 2.16 2.12 0.00 3.58 0.00 0.00 3.87 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 57 E 8.21 4.02 0.00 2.35 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 0.00 2.53 2.51 0.00 58 A 8.70 4.00 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 59 S 8.39 4.13 0.00 4.04 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 60 A 8.24 4.15 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 61 F 8.40 3.94 0.00 3.22 3.19 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 62 T 8.08 3.92 4.30 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 1.24 0.00 0.00 63 K 8.02 3.88 0.00 1.93 2.02 0.00 1.64 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.58 1.49 7.81 64 K 8.13 3.90 0.00 1.65 1.73 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.72 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.42 1.62 7.81 65 M 7.76 3.82 0.00 1.87 1.80 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.52 0.00 66 V 7.80 3.79 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 0.76 0.00 0.00 0.99 0.00 0.00 67 E 8.37 4.01 0.00 1.92 1.99 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 2.33 2.54 0.00 68 N 7.88 4.62 0.00 2.76 2.81 0.00 0.00 7.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 A 7.00 4.52 1.33 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 0.00 0.00 0.00 70 K 8.97 4.19 0.00 1.88 1.88 0.00 1.65 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.47 1.40 7.81 71 K 8.64 4.67 0.00 1.66 1.65 0.00 1.61 0.00 0.00 1.57 0.00 0.00 2.76 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.35 7.81 72 V 8.46 4.87 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 0.96 0.00 0.00 0.92 0.00 0.00 73 E 9.35 5.17 0.00 1.93 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 2.21 2.26 0.00 74 V 9.11 4.61 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 -0.11 0.00 0.00 0.60 0.00 0.00 75 E 9.08 4.82 0.00 2.22 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 0.00 2.49 2.38 0.00 76 F 8.73 4.59 0.00 3.05 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 77 D 8.59 4.89 0.00 2.69 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 78 K 9.40 4.55 0.00 1.85 1.94 0.00 1.68 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.41 7.81 79 G 8.45 4.17 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 0.00 80 Q 8.67 4.09 0.00 2.05 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.95 6.79 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 81 R 8.49 4.75 0.00 1.54 1.58 0.00 2.77 0.00 0.00 2.47 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.50 0.00 82 T 7.71 5.17 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 1.15 0.00 0.00 83 D 8.68 4.94 0.00 2.82 2.89 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 84 K 8.66 3.94 0.00 1.49 1.77 0.00 1.04 0.00 0.00 1.10 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.19 0.80 7.81 85 Y 8.11 4.32 0.00 3.12 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 86 G 8.20 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 0.00 0.00 0.00 87 R 8.27 4.46 0.00 1.99 1.89 0.00 3.12 0.00 0.00 3.14 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 88 G 8.55 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 0.00 0.00 0.00 89 L 8.92 5.28 0.00 1.54 1.62 0.93 0.66 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 90 A 8.39 4.36 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Y 8.79 4.86 0.00 2.98 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 92 I 8.71 4.79 1.77 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.98 0.81 0.00 0.00 93 Y 9.34 5.05 0.00 2.84 2.84 0.00 0.00 0.00 0.00 0.00 0.00 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 A 9.18 4.83 1.20 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 0.00 0.00 95 D 10.32 4.36 0.00 2.77 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 96 G 8.58 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 0.00 0.00 0.00 0.00 97 K 7.82 4.54 0.00 1.99 1.75 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.37 7.81 98 M 8.51 3.99 0.00 1.90 1.66 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 2.32 0.00 99 V 8.45 3.62 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 1.02 0.00 0.00 0.93 0.00 0.00 100 N 8.02 4.33 0.00 2.90 2.91 0.00 0.00 6.74 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 0.00 101 E 8.06 3.90 0.00 1.93 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 2.27 2.06 0.00 102 A 8.14 4.04 1.59 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 0.00 0.00 103 L 7.95 3.50 0.00 1.80 1.61 0.80 1.20 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 0.00 104 V 7.49 3.69 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 1.15 0.00 0.00 0.98 0.00 0.00 105 R 8.36 3.88 0.00 1.93 2.06 0.00 3.34 0.00 0.00 3.20 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 106 Q 7.84 4.32 0.00 1.61 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.10 0.00 0.00 0.00 0.00 0.00 2.39 2.12 0.00 107 G 8.08 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 0.00 108 L 7.64 4.37 0.00 1.25 1.46 0.49 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.46 4.64 1.13 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 0.00 110 K 8.65 4.92 0.00 1.71 1.79 0.00 1.65 0.00 0.00 1.49 0.00 0.00 2.85 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.69 1.16 7.81 111 V 9.00 4.18 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 0.78 0.00 0.00 0.97 0.00 0.00 112 A 8.90 4.51 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 0.00 113 Y 8.56 3.89 0.00 2.85 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 0.00 114 V 7.17 3.93 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 0.82 0.00 0.00 0.88 0.00 0.00 115 Y 8.06 4.59 0.00 3.07 2.85 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 0.00 116 K 8.64 4.29 0.00 1.77 1.79 0.00 1.71 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.45 7.81 117 P 0.00 4.78 0.00 2.20 2.15 0.00 3.80 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.00 0.00 118 N 8.31 4.82 0.00 2.90 2.86 0.00 0.00 6.64 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 0.00 119 N 7.85 5.10 0.00 2.89 2.95 0.00 0.00 6.10 7.22 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 0.00 120 T 8.79 3.82 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 1.10 0.00 0.00 121 H 7.81 4.85 0.00 2.86 3.13 0.00 5.62 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 0.00 122 E 8.28 3.98 0.00 2.14 1.99 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 2.30 2.35 0.00 123 Q 8.01 3.95 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.61 0.00 0.00 0.00 0.00 0.00 2.45 2.35 0.00 124 H 8.32 4.13 0.00 3.16 3.44 0.00 5.69 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 L 7.92 3.92 0.00 1.93 1.72 0.99 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 126 R 8.19 3.92 0.00 2.07 1.95 0.00 3.24 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 127 K 8.45 3.99 0.00 1.98 1.84 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.66 7.81 128 S 8.23 4.10 0.00 3.90 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 0.00 129 E 8.34 3.90 0.00 2.16 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.58 0.00 130 A 7.88 3.76 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 0.00 131 Q 7.71 3.79 0.00 2.19 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 132 A 7.88 4.05 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 0.00 0.00 0.00 0.00 0.00 133 K 7.61 3.27 0.00 1.21 1.37 0.00 1.05 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.73 0.21 7.81 134 K 7.70 3.75 0.00 1.83 1.94 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.45 7.81 135 E 8.31 4.21 0.00 1.95 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 2.33 2.47 0.00 136 K 8.04 4.00 0.00 1.89 1.93 0.00 1.72 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.40 7.81 137 L 8.17 4.41 0.00 1.79 1.55 0.94 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 138 N 8.97 3.84 0.00 2.54 1.42 0.00 0.00 7.58 7.22 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 0.00 139 I 5.42 3.20 1.29 0.00 0.00 0.51 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 -0.05 -0.59 0.00 0.00 140 W 7.77 4.89 0.00 3.44 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 0.00 141 S 8.17 4.44 0.00 4.01 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