NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1B H 4.6148 8.4449 120.3819 56.2932 30.5913 172.7021 1C H 4.6042 8.3785 124.1062 54.7726 30.1240 173.5637 1D H 4.6511 9.3473 118.3326 56.3814 30.7162 174.0922 1E H 5.1267 7.8247 114.7251 53.5885 32.5613 172.0844 1F H 4.7373 8.8804 116.7199 55.6280 29.3258 174.4241 1 F 4.8103 8.4469 119.5958 57.7721 39.9003 174.2752 2 N 4.7396 8.3692 117.2655 52.0924 39.3368 174.6403 3 L 4.9645 8.0870 122.7935 51.8966 44.9862 174.6119 4 P 4.4838 0.0000 0.0000 61.3128 32.2353 174.0966 5 P 4.4085 0.0000 0.0000 61.9610 31.9331 176.1255 6 G 3.5339 8.2217 107.5186 46.2840 0.0000 174.1428 7 N 4.7128 7.2511 123.5265 52.5446 38.8193 174.1127 8 Y 4.8645 7.6251 113.3531 57.4275 39.6139 177.1512 9 K 4.0851 8.3665 119.9755 58.7277 32.2035 176.6810 10 K 4.7542 7.5887 114.1534 53.5212 35.7390 173.6747 11 P 4.5934 0.0000 0.0000 63.7486 31.7053 175.1430 12 K 4.9450 9.2789 120.4275 54.7179 37.1557 174.5841 13 L 4.9532 8.7588 120.1245 53.1398 45.1034 176.3094 14 L 5.0953 8.7194 123.9316 54.0041 42.8088 174.7287 15 Y 5.0098 9.3469 126.8824 56.5305 40.8866 173.7806 16 C 3.9405 8.0041 127.9056 57.1181 32.3025 174.2898 17 S 3.7856 7.6688 121.5316 61.0098 62.0637 174.9070 18 N 3.6651 6.9930 116.5489 56.0890 38.8974 174.5480 19 G 3.8586 7.5219 106.2064 44.4939 0.0000 172.5393 20 G 3.5013 7.5787 106.6866 44.9602 0.0000 173.1132 21 H 4.8370 7.1829 114.1973 53.6211 33.1709 174.1164 22 F 5.4317 8.8256 119.0603 55.4526 41.0095 175.3982 23 L 4.4159 8.9833 126.5036 55.7028 43.1557 175.7119 24 R 4.9062 9.3217 125.9721 54.6541 33.7739 174.0485 25 I 4.6446 8.1772 126.0474 59.2331 38.7489 175.6494 26 L 4.0079 8.6994 127.6251 53.5402 42.2226 176.9754 27 P 4.1861 0.0000 0.0000 65.8368 31.2690 177.2478 28 D 4.5233 7.9973 114.6209 53.5461 39.6496 176.9836 29 G 4.1167 8.6063 109.0806 45.6181 0.0000 173.6846 30 T 4.4291 8.2986 117.1674 62.8390 69.2914 173.8932 31 V 4.9063 7.9005 124.0126 61.2734 34.4518 174.4842 32 D 4.5813 8.3975 124.5982 53.0449 42.7930 174.0652 33 G 4.5632 8.8068 105.2824 45.3746 0.0000 172.6837 34 T 4.9723 8.5508 115.5183 60.6812 70.9752 174.6137 35 R 4.2866 8.8189 125.2524 56.8600 30.9637 176.8852 36 D 4.6171 8.1372 118.9431 53.6090 39.4175 176.3664 37 R 3.5734 8.5291 125.9491 57.7703 30.3564 177.2556 38 S 4.3828 8.0970 110.7648 58.8562 63.7966 174.1077 39 D 4.3241 7.8183 121.4247 55.3289 41.1075 176.0100 40 Q 4.2813 8.6414 123.5973 56.8132 29.1531 175.8297 41 H 4.8774 8.9240 115.1482 55.4809 29.4337 174.9462 42 I 4.5276 7.5436 111.0099 59.8331 38.6531 175.0862 43 Q 4.1758 7.7933 124.4282 56.0730 29.8760 174.4481 44 L 5.2392 8.9390 126.3088 52.8663 46.0421 175.2075 45 Q 4.8428 9.2941 122.4435 54.3994 31.7223 173.9739 46 L 5.8418 8.9790 126.2155 52.5402 43.8384 175.8284 47 S 4.6175 8.5135 116.1460 56.3091 67.1368 172.1564 48 A 4.8788 8.0112 121.6556 49.6860 20.0967 175.7164 49 E 4.0294 8.9060 124.8728 57.3102 30.6317 176.2572 50 S 4.7896 7.2645 112.2876 55.7203 66.6057 173.7214 51 V 3.7944 8.2901 121.5035 65.0399 31.4296 176.2784 52 G 3.9216 9.2811 115.9719 44.8464 0.0000 171.9429 53 E 5.1972 8.3120 119.8349 55.0044 32.1735 175.5666 54 V 5.3380 8.5815 114.9373 59.9795 37.2114 173.1768 55 Y 5.3646 8.4852 118.4134 56.5663 41.6274 175.2933 56 I 4.4647 8.6817 123.3774 59.5313 39.5383 173.6105 57 K 4.6780 8.6039 128.8360 54.2114 34.6019 175.1293 58 S 4.4853 8.8137 123.1686 58.4189 62.7210 174.9755 59 T 3.7839 8.3987 118.1616 64.8531 68.9011 175.9763 60 E 3.9878 8.4075 122.4764 58.9157 29.9310 177.4771 61 T 4.1480 8.1395 107.5797 61.5618 69.6195 176.0043 62 G 3.8293 8.1296 109.8200 45.2576 0.0000 173.6255 63 Q 4.4550 7.5547 119.1197 55.9841 30.3651 174.5729 64 Y 4.6288 9.0733 120.1449 56.2330 40.0311 175.3216 65 L 4.4903 9.1741 126.2089 55.6201 43.6094 175.4270 66 A 4.9955 8.1813 123.7098 51.3051 23.2144 174.7820 67 M 5.3971 8.5818 120.1786 53.7121 34.6716 175.6756 68 D 5.3767 10.0243 126.3256 52.1935 40.7956 177.2195 69 T 4.1352 8.5059 108.6533 64.5822 68.6851 174.6822 70 D 4.6203 8.4207 119.9554 54.1775 41.1244 176.9607 71 G 3.4281 8.5628 108.3317 45.0411 0.0000 172.9456 72 L 4.7540 8.4756 120.3848 53.5883 43.2688 176.2122 73 L 5.2030 8.4975 122.7698 54.8086 43.1991 175.1618 74 Y 4.8402 8.6438 118.9044 56.5899 42.0477 173.0330 75 G 4.2227 8.9097 107.9377 44.8945 0.0000 173.3391 76 S 5.0749 9.1091 121.4459 57.1716 63.9262 175.0773 77 Q 4.4100 8.9407 124.5570 57.5780 29.1916 176.2225 78 T 4.6282 7.4650 106.6955 58.5433 71.8078 171.7647 79 P 3.5792 0.0000 0.0000 62.4689 31.9712 175.0730 80 N 4.9412 8.0857 117.6502 51.1552 40.2615 174.6746 81 E 4.0183 8.7225 115.8014 58.5415 29.6722 177.4158 82 E 4.2872 8.9960 119.1499 57.0053 29.9939 177.0992 83 C 5.0554 8.0709 115.8779 59.6815 29.3729 173.9267 84 L 4.4918 7.4983 120.4373 54.3595 42.8103 175.9155 85 F 5.1216 8.8761 120.5162 55.7964 43.7225 174.0917 86 L 4.7242 9.4008 123.8263 53.9754 42.5803 175.8716 87 E 4.4163 9.1154 127.6011 55.3517 29.7874 175.6551 88 R 4.8206 8.5039 126.0871 53.9852 34.2629 175.0291 89 L 4.7644 8.5109 123.9344 55.0100 43.1275 175.7732 90 E 4.6504 8.8354 125.3933 55.1332 33.7798 175.1224 91 E 3.9692 9.7005 123.4454 57.4791 27.2164 176.6546 92 N 4.6395 8.6103 117.1884 54.1446 37.4842 174.7549 93 H 4.8867 7.9187 110.4558 55.0390 31.0326 172.7977 94 Y 4.8112 8.1528 118.2312 57.0428 40.4429 173.8886 95 N 5.5635 9.6354 118.0658 51.8271 41.8105 174.2611 96 T 5.2341 9.2808 113.4153 60.1352 72.8841 172.6602 97 Y 4.9638 8.6208 119.3838 56.6093 41.4044 174.2338 98 I 4.6230 8.7629 126.3039 59.3657 39.5538 175.5292 99 S 3.9428 8.9829 122.4529 58.3195 62.4160 174.0775 100 K 3.9664 8.3999 129.0065 59.2936 32.2566 178.8327 101 K 3.8015 7.8201 118.3747 58.8805 32.3055 176.6409 102 H 4.5075 7.8416 114.9909 54.9429 29.2511 175.8026 103 A 3.8785 7.5555 125.9707 55.2486 18.2712 180.6408 104 E 3.7408 7.7319 115.3030 58.5532 29.8300 177.3712 105 K 4.0778 7.6634 116.0801 55.7789 32.9318 175.9393 106 N 3.9255 7.2585 115.9785 53.9599 36.2768 174.4958 107 W 5.0464 7.5522 117.7439 55.5810 31.4045 177.7191 108 F 5.3581 9.6117 123.8964 55.6110 41.4350 175.2942 109 V 4.1322 8.8944 120.6659 62.3675 32.3124 175.1348 110 G 4.4916 8.6908 113.6657 44.7420 0.0000 170.7946 111 L 5.2594 8.5109 120.5413 52.4994 45.4125 177.2890 112 K 4.2893 8.9405 123.6244 55.4357 32.8824 178.2717 113 K 3.9841 8.4220 119.2979 58.9452 31.8998 177.8415 114 N 4.5748 8.0656 114.2240 52.5137 37.9005 175.8979 115 G 3.5874 8.0572 109.1985 45.0932 0.0000 173.6976 116 S 4.6595 8.3242 115.3428 57.1589 64.2619 173.7326 117 V 4.1835 8.0563 122.7077 63.0546 31.9438 175.5811 118 K 4.3669 8.6364 127.4385 55.7188 33.2644 176.6928 119 R 3.9659 8.5715 123.9617 56.0788 31.1001 177.0009 120 G 3.3075 8.6301 116.1133 48.3525 0.0000 174.0213 121 P 4.1153 0.0000 0.0000 64.5589 31.4091 177.6293 122 R 4.2460 7.8043 115.3886 56.6151 30.2638 176.1974 123 T 5.2183 7.6287 108.5083 59.5723 71.2246 173.1536 124 H 4.6999 7.7887 115.5792 55.1387 30.3096 173.1850 125 Y 4.0246 8.7390 118.4111 59.8770 38.0287 177.1282 126 G 4.0226 9.1476 111.8196 45.2710 0.0000 173.2855 127 Q 4.3991 7.2674 118.1244 54.5493 30.1710 176.8529 128 K 3.9092 8.2256 118.7103 58.0628 32.9378 179.3056 129 A 3.9944 8.0087 121.4168 53.8672 18.4114 178.6110 130 I 4.4918 7.1826 106.2124 60.6182 38.2455 175.5061 131 L 4.1908 7.2672 123.4329 54.4542 42.3619 176.0736 132 F 5.5822 9.5183 122.4516 54.7616 43.4890 174.2789 133 L 5.1125 8.5622 121.0054 54.0737 45.4159 174.4901 134 C 4.9900 9.1117 124.6659 59.5284 28.6382 173.0876 135 L 4.8154 9.1387 124.7408 52.3575 44.2095 174.5982 136 P 4.6469 0.0000 0.0000 62.2431 32.3660 176.9099 137 V 3.6912 8.1903 121.2858 63.2270 31.5186 175.8017 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 1B H 8.44 4.61 0.00 3.09 3.25 0.00 5.68 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 1C H 8.38 4.60 0.00 3.16 3.29 0.00 5.75 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 1D H 9.35 4.65 0.00 3.10 3.26 0.00 5.64 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E H 7.82 5.13 0.00 3.16 3.33 0.00 5.70 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1F H 8.88 4.74 0.00 3.37 3.41 0.00 5.47 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1 F 8.45 4.81 0.00 2.93 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 2 N 8.37 4.74 0.00 3.00 2.78 0.00 0.00 6.77 6.74 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 3 L 8.09 4.96 0.00 1.45 1.39 0.51 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.48 0.00 2.14 2.16 0.00 3.70 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 1.94 1.92 0.00 5 P 0.00 4.41 0.00 2.15 2.09 0.00 3.74 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 1.93 1.93 0.00 6 G 8.22 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 0.00 0.00 0.00 7 N 7.25 4.71 0.00 2.44 2.57 0.00 0.00 7.00 7.54 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 8 Y 7.63 4.86 0.00 3.06 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 9 K 8.37 4.09 0.00 1.75 1.92 0.00 1.73 0.00 0.00 1.80 0.00 0.00 3.09 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.41 7.81 10 K 7.59 4.75 0.00 1.81 1.74 0.00 1.59 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.30 1.40 7.81 11 P 0.00 4.59 0.00 2.08 2.10 0.00 3.71 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 1.98 2.01 0.00 12 K 9.28 4.95 0.00 1.65 1.78 0.00 1.65 0.00 0.00 1.67 0.00 0.00 3.03 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.57 1.59 7.81 13 L 8.76 4.95 0.00 1.64 1.58 0.57 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.72 5.10 0.00 1.65 1.73 0.87 0.02 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 15 Y 9.35 5.01 0.00 3.29 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 16 C 8.00 3.94 0.00 2.16 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 0.00 0.00 0.00 17 S 7.67 3.79 0.00 4.06 3.92 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 18 N 6.99 3.67 0.00 2.55 2.55 0.00 0.00 6.76 7.98 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 19 G 7.52 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 20 G 7.58 3.50 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 0.00 0.00 0.00 21 H 7.18 4.84 0.00 2.96 3.21 0.00 5.78 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 F 8.83 5.43 0.00 3.13 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 23 L 8.98 4.42 0.00 1.88 1.56 0.91 0.15 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 R 9.32 4.91 0.00 1.93 1.92 0.00 3.13 0.00 0.00 3.32 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.72 0.00 25 I 8.18 4.64 1.85 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 1.19 0.76 0.90 0.00 0.00 26 L 8.70 4.01 0.00 1.86 1.51 0.91 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 27 P 0.00 4.19 0.00 2.01 2.13 0.00 3.53 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.06 0.00 28 D 8.00 4.52 0.00 2.79 2.77 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 29 G 8.61 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 0.00 0.00 0.00 30 T 8.30 4.43 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 1.22 0.00 0.00 31 V 7.90 4.91 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 0.90 0.00 0.00 0.96 0.00 0.00 32 D 8.40 4.58 0.00 2.85 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 G 8.81 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 34 T 8.55 4.97 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 1.41 0.00 0.00 35 R 8.82 4.29 0.00 1.86 1.96 0.00 3.20 0.00 0.00 3.08 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 36 D 8.14 4.62 0.00 2.76 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 37 R 8.53 3.57 0.00 1.94 1.93 0.00 3.39 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 1.40 0.97 0.00 38 S 8.10 4.38 0.00 4.00 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 39 D 7.82 4.32 0.00 2.84 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 40 Q 8.64 4.28 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.93 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 41 H 8.92 4.88 0.00 3.37 3.38 0.00 5.78 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.54 4.53 1.92 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.89 1.05 0.00 0.00 43 Q 7.79 4.18 0.00 2.10 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 6.83 0.00 0.00 0.00 0.00 0.00 2.38 2.34 0.00 44 L 8.94 5.24 0.00 1.54 1.42 0.83 0.62 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 45 Q 9.29 4.84 0.00 2.05 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 2.21 2.33 0.00 46 L 8.98 5.84 0.00 1.81 1.68 0.89 1.13 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 47 S 8.51 4.62 0.00 3.84 3.92 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 48 A 8.01 4.88 1.07 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 0.00 0.00 49 E 8.91 4.03 0.00 1.52 1.72 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 2.09 2.31 0.00 50 S 7.26 4.79 0.00 4.13 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.29 3.79 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 0.98 0.00 0.00 1.03 0.00 0.00 52 G 9.28 3.92 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 0.00 0.00 0.00 53 E 8.31 5.20 0.00 2.11 1.72 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 2.19 2.26 0.00 54 V 8.58 5.34 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 0.68 0.00 0.00 1.27 0.00 0.00 55 Y 8.49 5.36 0.00 2.94 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 56 I 8.68 4.46 1.73 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.73 0.68 0.00 0.00 57 K 8.60 4.68 0.00 1.34 1.37 0.00 1.26 0.00 0.00 1.15 0.00 0.00 2.63 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.00 0.21 7.81 58 S 8.81 4.49 0.00 3.86 3.84 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 59 T 8.40 3.78 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 60 E 8.41 3.99 0.00 1.95 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 2.13 2.33 0.00 61 T 8.14 4.15 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 1.27 0.00 0.00 62 G 8.13 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 63 Q 7.55 4.46 0.00 1.97 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.76 6.76 0.00 0.00 0.00 0.00 0.00 2.55 2.34 0.00 64 Y 9.07 4.63 0.00 2.79 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 65 L 9.17 4.49 0.00 1.65 1.48 0.80 0.26 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 66 A 8.18 5.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 M 8.58 5.40 0.00 2.24 2.27 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.75 0.00 68 D 10.02 5.38 0.00 2.94 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 69 T 8.51 4.14 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 1.31 0.00 0.00 70 D 8.42 4.62 0.00 2.81 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 71 G 8.56 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.48 4.75 0.00 2.02 1.64 0.87 0.45 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 73 L 8.50 5.20 0.00 1.57 1.62 0.90 0.94 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 74 Y 8.64 4.84 0.00 3.11 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 75 G 8.91 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 0.00 0.00 0.00 0.00 76 S 9.11 5.07 0.00 3.80 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 77 Q 8.94 4.41 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.51 0.00 0.00 0.00 0.00 0.00 2.41 2.32 0.00 78 T 7.46 4.63 4.15 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 1.20 0.00 0.00 79 P 0.00 3.58 0.00 1.57 0.49 0.00 3.47 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.50 0.00 80 N 8.09 4.94 0.00 2.90 2.89 0.00 0.00 6.00 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 81 E 8.72 4.02 0.00 2.05 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 0.00 2.22 2.22 0.00 82 E 9.00 4.29 0.00 2.21 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 2.33 2.33 0.00 83 C 8.07 5.06 0.00 3.20 3.22 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 0.00 84 L 7.50 4.49 0.00 1.43 1.39 0.79 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 85 F 8.88 5.12 0.00 3.07 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 86 L 9.40 4.72 0.00 1.51 1.58 0.88 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 87 E 9.12 4.42 0.00 2.11 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 2.15 1.83 0.00 88 R 8.50 4.82 0.00 1.81 1.84 0.00 3.09 0.00 0.00 2.86 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.62 0.00 89 L 8.51 4.76 0.00 1.76 1.61 1.02 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 90 E 8.84 4.65 0.00 2.23 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 2.28 2.44 0.00 91 E 9.70 3.97 0.00 2.46 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 2.37 2.44 0.00 92 N 8.61 4.64 0.00 2.76 2.89 0.00 0.00 6.88 8.16 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 93 H 7.92 4.89 0.00 2.91 3.02 0.00 5.66 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 8.15 4.81 0.00 3.26 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 95 N 9.64 5.56 0.00 3.04 2.68 0.00 0.00 6.95 7.02 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 96 T 9.28 5.23 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 97 Y 8.62 4.96 0.00 2.72 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 I 8.76 4.62 1.70 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 0.98 0.51 0.00 0.00 99 S 8.98 3.94 0.00 4.03 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 0.00 100 K 8.40 3.97 0.00 1.72 1.59 0.00 1.59 0.00 0.00 1.47 0.00 0.00 2.78 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.29 7.81 101 K 7.82 3.80 0.00 1.74 1.53 0.00 1.80 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.97 1.27 7.81 102 H 7.84 4.51 0.00 2.89 2.04 0.00 5.69 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 0.00 103 A 7.56 3.88 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 0.00 104 E 7.73 3.74 0.00 1.48 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.27 0.00 105 K 7.66 4.08 0.00 0.83 1.51 0.00 1.55 0.00 0.00 1.43 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.19 0.93 7.81 106 N 7.26 3.93 0.00 2.97 3.06 0.00 0.00 6.87 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 0.00 107 W 7.55 5.05 0.00 3.31 3.08 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 0.00 108 F 9.61 5.36 0.00 2.78 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 0.00 109 V 8.89 4.13 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 0.59 0.00 0.00 0.59 0.00 0.00 110 G 8.69 4.49 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 0.00 0.00 0.00 111 L 8.51 5.26 0.00 1.44 1.42 0.97 1.03 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 0.00 112 K 8.94 4.29 0.00 1.98 1.68 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.50 7.81 113 K 8.42 3.98 0.00 1.70 1.84 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.36 7.81 114 N 8.07 4.57 0.00 2.79 2.89 0.00 0.00 6.26 7.00 0.00 0.00 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 G 8.06 3.59 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 0.00 116 S 8.32 4.66 0.00 3.96 3.95 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 0.00 117 V 8.06 4.18 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 0.86 0.00 0.00 0.99 0.00 0.00 118 K 8.64 4.37 0.00 1.65 1.68 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.98 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.40 1.33 7.81 119 R 8.57 3.97 0.00 1.79 1.64 0.00 3.21 0.00 0.00 3.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.44 0.00 120 G 8.63 3.31 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 0.00 0.00 0.00 0.00 121 P 0.00 4.12 0.00 1.89 2.16 0.00 3.04 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.48 0.00 122 R 7.80 4.25 0.00 1.86 1.92 0.00 3.27 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 1.55 1.63 0.00 123 T 7.63 5.22 4.32 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 1.31 0.00 0.00 124 H 7.79 4.70 0.00 3.45 3.53 0.00 5.66 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 8.74 4.02 0.00 3.15 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 0.00 126 G 9.15 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 0.00 0.00 0.00 127 Q 7.27 4.40 0.00 2.01 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.72 0.00 0.00 0.00 0.00 0.00 2.10 1.98 0.00 128 K 8.23 3.91 0.00 1.78 1.65 0.00 1.59 0.00 0.00 1.72 0.00 0.00 2.85 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.34 7.81 129 A 8.01 3.99 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 0.00 130 I 7.18 4.49 1.66 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.87 0.57 0.00 0.00 131 L 7.27 4.19 0.00 0.88 0.46 0.56 1.00 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 0.00 132 F 9.52 5.58 0.00 3.39 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 0.00 133 L 8.56 5.11 0.00 2.08 1.76 1.08 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 134 C 9.11 4.99 0.00 2.99 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 0.00 135 L 9.14 4.82 0.00 1.66 1.60 0.97 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 136 P 0.00 4.65 0.00 1.92 1.96 0.00 3.67 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 137 V 8.19 3.69 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 0.68 0.00 0.00 0.94 0.00 0.00