NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 D 4.6006 8.2227 120.1952 53.9118 42.7338 176.1933 8 Q 3.9423 8.6334 126.7408 58.2203 28.9515 173.1689 9 V 3.6712 8.2816 119.4605 65.8130 31.8745 177.5120 10 V 3.6194 7.7302 117.9177 65.9837 31.4455 177.9627 11 I 3.7106 7.8162 118.9553 64.5208 36.9131 178.2041 12 F 3.9733 8.2037 118.0031 60.4421 38.7865 177.6300 13 K 4.1053 8.5122 119.3559 59.8384 32.0301 178.7554 14 Q 4.1577 8.5427 118.5196 58.9872 28.5232 178.9487 15 I 3.9150 7.7430 120.3574 64.6027 37.2737 178.5509 16 F 4.0381 8.1924 118.3371 60.5120 38.5272 177.3523 17 D 4.4966 8.7227 118.0501 57.3345 40.9475 178.7812 18 K 4.0990 8.2035 120.0712 59.5418 32.3841 179.4148 19 V 3.5957 7.8463 119.3649 64.6232 31.1089 178.3286 20 R 4.2433 7.9063 118.5070 58.4952 29.6398 177.5912 21 N 4.8537 7.9102 113.9319 53.9716 40.9347 175.4392 22 D 4.3268 8.4236 119.3061 55.5243 41.3993 176.9645 23 L 3.2002 7.2935 115.9270 54.7161 39.7314 173.7837 24 N 4.4598 7.5895 117.1287 52.8891 37.9046 175.1277 25 Y 4.8544 8.4788 119.9160 58.8938 38.9786 177.8976 26 Q 4.0519 8.1735 120.6534 59.1451 29.3113 177.8279 27 W 4.1912 8.1170 128.6217 60.2318 30.7046 177.5031 28 F 3.8630 8.4150 120.2773 61.7577 38.9099 176.6994 29 Y 3.7023 8.9032 116.5366 60.5608 37.6957 178.4594 30 S 4.0387 8.2967 114.5049 61.6027 62.4970 176.2272 31 E 3.6438 7.8911 121.1180 58.7186 28.8710 179.1710 32 L 3.7008 7.3465 119.4367 57.7797 41.5106 179.4693 33 K 3.9858 7.9462 118.0229 58.6044 32.2799 177.9135 34 R 4.2225 7.3666 116.6924 57.1206 30.2054 175.2729 35 H 4.7302 7.5599 112.1931 58.0988 30.9493 174.4513 36 N 4.6747 8.3837 123.5735 52.8702 37.1213 174.6994 37 V 4.0208 8.0738 122.0815 63.1433 33.3153 175.8405 38 S 4.6659 7.9190 112.5174 58.9221 65.4652 173.8678 39 H 5.9763 6.5484 115.9697 56.0557 33.0524 173.7483 40 Y 5.3743 8.4639 118.6807 55.4745 41.1386 174.5040 41 I 4.3216 9.1973 124.5241 60.1549 38.6838 173.9044 42 Y 4.5172 9.5222 130.9561 56.6267 40.2558 173.9946 43 Y 5.5582 9.0809 126.2001 56.0286 38.6880 176.5554 44 L 4.4513 9.0853 124.6058 56.5193 41.7472 178.6187 45 A 4.2892 8.5140 122.4155 54.5950 18.6394 178.5831 46 T 4.5792 7.5939 108.6763 62.1525 70.4171 174.0158 47 E 4.0965 8.5505 121.7767 56.8691 28.9974 172.4132 48 N 5.6907 7.5145 114.4150 50.1874 39.8900 173.7992 49 V 4.5386 7.9630 120.9179 61.5805 34.8682 174.0238 50 H 5.1835 9.5949 126.2615 54.7119 28.9763 173.1017 51 I 4.3835 9.0256 124.1399 60.2158 37.8032 175.0343 52 V 4.2183 8.5864 128.9231 61.5215 32.0730 176.0530 53 L 4.5942 8.0912 129.5419 53.8041 42.5030 176.6772 54 K 4.0374 8.2578 118.8002 58.8487 31.8912 178.2021 55 N 4.7039 8.1135 113.0065 54.4959 39.8734 175.2353 56 D 4.5252 7.6002 116.9902 54.3143 41.8760 176.9889 57 N 4.7033 7.3659 113.5966 53.0143 41.1668 172.3530 58 T 4.8839 8.3388 115.6167 61.9985 70.2640 174.6187 59 V 3.9661 8.6330 127.4095 61.3766 33.2416 174.1565 60 L 4.9933 8.3656 129.8899 53.4421 43.6653 175.2216 61 L 4.6284 8.4393 126.7963 53.3895 44.0699 176.1424 62 K 4.6967 8.5261 120.7333 54.8360 35.1071 175.5362 63 G 4.0386 8.3445 110.3791 44.0707 0.0000 171.8660 64 L 3.6466 8.2787 116.2555 55.6794 38.6497 177.3140 65 K 4.2366 7.5236 118.5460 56.6829 31.2050 174.4800 66 N 4.8363 8.2393 120.2642 53.7487 43.7956 173.1915 67 I 3.6384 8.0902 119.6292 61.9953 37.1089 172.5137 68 V 3.2538 8.4386 122.2717 63.9558 29.0905 172.0128 69 S 4.7146 7.9876 112.3863 57.7228 64.1958 174.2765 70 V 4.4406 7.5435 119.5309 60.7382 33.8898 174.7081 71 K 4.7336 8.4276 124.5461 54.5958 34.7577 176.3633 72 F 5.0493 8.7646 125.7626 57.6628 37.2681 175.0502 73 S 4.4122 7.4376 119.6878 55.8612 63.8920 171.7839 74 K 4.9092 7.6563 119.0710 55.7022 31.5850 176.9046 75 D 4.7982 8.1703 123.1760 51.8041 44.3359 176.4592 76 R 4.1186 8.4797 124.5297 58.9218 30.2845 178.5844 77 H 4.0127 8.1458 117.9226 58.8766 30.0210 176.7822 78 L 3.8401 8.7832 122.5424 57.9542 41.7724 179.2299 79 I 3.2734 6.7329 116.9032 64.1664 37.0187 178.2789 80 E 4.0105 7.1083 119.1875 59.0143 29.3073 179.2388 81 T 3.7840 7.9108 117.1053 66.6414 68.4528 176.8660 82 T 3.9752 7.5455 117.6133 66.4523 68.6051 177.1548 83 S 4.4771 8.2201 116.3352 61.4932 63.1981 176.3241 84 N 4.3496 8.3605 120.2986 55.9352 38.2408 177.2760 85 K 3.9848 8.0196 121.1927 59.3669 32.4361 178.7139 86 L 3.9825 8.1754 120.7591 57.8008 41.7257 178.7178 87 K 3.8741 8.1798 119.3048 60.2906 32.1897 178.2974 88 S 4.3171 7.9530 114.2384 59.7851 63.1723 175.7658 89 R 4.3219 8.4583 120.2509 55.6092 30.7772 178.8134 90 E 4.4902 8.4752 115.1435 56.0111 29.9690 178.1054 91 I 3.0501 8.2649 108.8611 61.2466 39.7703 176.9458 92 T 4.7116 8.6100 112.7099 60.7785 74.1996 173.0054 93 F 4.3558 8.6544 126.5261 61.3050 39.5188 177.7156 94 Q 3.9717 8.1650 117.2269 59.2503 28.5492 177.9974 95 E 3.9501 8.1710 120.9576 58.8438 29.6364 177.6367 96 Y 4.1618 8.2113 119.7970 61.0995 38.7359 178.5176 97 R 3.9757 7.7583 117.6347 58.3596 30.2817 179.2105 98 R 3.8629 7.6097 118.0757 59.3355 29.8496 178.7212 99 N 4.3287 7.8242 115.1290 56.1014 38.7839 177.2381 100 L 3.8741 7.5240 120.3374 57.6046 41.5774 179.3906 101 A 3.8989 8.2089 120.9716 54.6868 18.0601 179.1994 102 K 3.9343 7.6359 116.0339 58.1466 32.5538 177.7210 103 A 4.5817 7.1922 121.4243 50.9385 19.0237 177.9158 104 G 4.0757 7.6434 105.9947 45.1752 0.0000 173.9210 105 V 4.0857 7.4762 119.6238 62.1594 30.5574 175.0767 106 F 4.6638 9.0965 126.8103 58.4647 41.0942 175.2818 107 R 4.4809 8.9372 118.5429 54.1783 31.9913 175.1768 108 W 4.4376 9.4822 135.0000 56.3403 30.8711 174.1718 109 V 4.4511 8.8032 127.0623 61.4158 32.2237 174.1750 110 T 4.3201 8.1149 125.7304 62.4121 69.4056 173.5163 111 N 5.3777 9.0280 128.4082 51.7656 37.9962 175.3013 112 I 3.8064 8.2561 125.4442 64.0599 37.8002 178.0758 113 H 4.2994 8.4660 119.3952 58.2807 29.6743 175.1259 114 E 4.4435 7.9485 117.0592 55.2051 30.5465 175.8309 115 Q 3.8100 8.2217 115.9540 57.1084 26.8079 172.3759 116 K 4.5481 7.6865 116.5019 54.4097 35.7857 175.1765 117 R 4.5146 8.7555 124.7329 54.9025 31.7462 174.0488 118 Y 4.5256 8.7125 125.3890 56.7405 40.2267 174.6145 119 Y 4.8095 8.7177 121.8641 56.7154 40.1207 174.3096 120 Y 5.3426 9.0145 122.8493 56.4533 41.5436 176.3500 121 T 5.5268 8.5475 116.8183 60.3094 68.9534 175.3046 122 F 4.1326 9.0203 124.6634 60.9822 39.3456 174.8277 123 D 4.6430 8.4552 119.3063 53.0247 39.4217 176.1970 124 N 4.3435 8.1118 113.7183 54.2798 37.0370 174.0915 125 S 4.3211 7.7605 114.9324 58.4006 63.4299 173.4117 126 L 4.2370 8.6093 127.0762 55.3321 42.1649 176.2355 127 L 4.3807 8.9950 127.4908 57.1155 42.3773 176.7132 128 F 4.6018 7.9108 118.0335 58.2159 42.7870 171.9359 129 T 5.6817 7.5434 114.7069 61.6968 70.2064 171.9381 130 E 4.7594 8.2185 122.5202 54.9189 33.5430 173.9760 131 S 4.9282 8.7217 116.9063 57.4197 63.7496 175.6295 132 I 4.3054 8.1816 119.1671 59.0645 35.5697 175.9785 133 Q 3.8511 7.6411 127.7976 57.2430 29.5238 174.3397 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 7 D 8.22 4.60 0.00 2.79 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 8 Q 8.63 3.94 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.92 0.00 0.00 0.00 0.00 0.00 2.81 2.66 0.00 9 V 8.28 3.67 2.40 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 1.08 0.00 0.00 0.94 0.00 0.00 10 V 7.73 3.62 2.26 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 1.13 0.00 0.00 0.98 0.00 0.00 11 I 7.82 3.71 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 1.61 0.66 0.64 0.00 0.00 12 F 8.20 3.97 0.00 3.30 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 13 K 8.51 4.11 0.00 1.98 2.02 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.81 1.52 7.81 14 Q 8.54 4.16 0.00 2.41 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.63 0.00 0.00 0.00 0.00 0.00 2.44 2.63 0.00 15 I 7.74 3.92 1.80 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.77 0.58 0.00 0.00 16 F 8.19 4.04 0.00 3.25 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 17 D 8.72 4.50 0.00 2.85 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 18 K 8.20 4.10 0.00 2.00 1.97 0.00 1.57 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.39 1.41 7.81 19 V 7.85 3.60 1.66 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 -0.15 0.00 0.00 -0.16 0.00 0.00 20 R 7.91 4.24 0.00 2.02 2.20 0.00 3.23 0.00 0.00 3.32 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.15 0.00 21 N 7.91 4.85 0.00 2.69 2.78 0.00 0.00 6.95 8.49 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 22 D 8.42 4.33 0.00 2.63 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 23 L 7.29 3.20 0.00 1.76 1.63 1.00 1.15 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 24 N 7.59 4.46 0.00 2.81 2.94 0.00 0.00 7.17 7.40 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 25 Y 8.48 4.85 0.00 3.16 3.29 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 26 Q 8.17 4.05 0.00 2.23 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.96 0.00 0.00 0.00 0.00 0.00 2.54 2.50 0.00 27 W 8.12 4.19 0.00 3.54 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 F 8.41 3.86 0.00 3.11 3.27 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 29 Y 8.90 3.70 0.00 3.22 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 30 S 8.30 4.04 0.00 4.05 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 31 E 7.89 3.64 0.00 1.27 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 32 L 7.35 3.70 0.00 1.54 1.55 -0.16 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 33 K 7.95 3.99 0.00 1.78 1.82 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.46 7.81 34 R 7.37 4.22 0.00 1.96 1.55 0.00 3.20 0.00 0.00 3.14 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.57 0.00 35 H 7.56 4.73 0.00 3.16 3.48 0.00 5.70 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 N 8.38 4.67 0.00 2.85 3.03 0.00 0.00 7.71 8.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 V 8.07 4.02 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 0.93 0.00 0.00 1.01 0.00 0.00 38 S 7.92 4.67 0.00 4.09 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 39 H 6.55 5.98 0.00 3.28 3.64 0.00 5.48 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 Y 8.46 5.37 0.00 3.10 3.13 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 41 I 9.20 4.32 1.87 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 1.13 0.95 0.49 0.00 0.00 42 Y 9.52 4.52 0.00 3.16 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 43 Y 9.08 5.56 0.00 3.19 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 44 L 9.09 4.45 0.00 1.59 1.77 1.36 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 45 A 8.51 4.29 1.58 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 0.00 0.00 0.00 0.00 0.00 46 T 7.59 4.58 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 47 E 8.55 4.10 0.00 2.31 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 2.27 2.32 0.00 48 N 7.51 5.69 0.00 3.08 2.94 0.00 0.00 6.48 7.49 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 49 V 7.96 4.54 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 0.71 0.00 0.00 -0.57 0.00 0.00 50 H 9.59 5.18 0.00 3.16 3.31 0.00 5.68 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 I 9.03 4.38 1.44 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.47 0.76 0.00 0.00 52 V 8.59 4.22 2.01 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 0.89 0.00 0.00 1.04 0.00 0.00 53 L 8.09 4.59 0.00 1.75 1.74 0.98 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 54 K 8.26 4.04 0.00 1.69 2.04 0.00 1.64 0.00 0.00 2.28 0.00 0.00 2.93 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.42 1.39 7.81 55 N 8.11 4.70 0.00 2.70 2.70 0.00 0.00 7.39 8.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 D 7.60 4.53 0.00 2.69 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 57 N 7.37 4.70 0.00 2.68 2.88 0.00 0.00 5.83 7.16 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 58 T 8.34 4.88 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 1.18 0.00 0.00 59 V 8.63 3.97 1.43 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 0.68 0.00 0.00 0.41 0.00 0.00 60 L 8.37 4.99 0.00 1.50 1.44 0.86 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 61 L 8.44 4.63 0.00 1.37 1.42 0.68 0.45 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 62 K 8.53 4.70 0.00 1.56 1.68 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.30 1.37 7.81 63 G 8.34 4.04 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 0.00 0.00 0.00 64 L 8.28 3.65 0.00 1.77 1.76 0.96 0.97 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 65 K 7.52 4.24 0.00 1.73 1.78 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.44 7.81 66 N 8.24 4.84 0.00 2.66 2.75 0.00 0.00 7.35 7.96 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 67 I 8.09 3.64 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.55 0.98 0.00 0.00 68 V 8.44 3.25 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 0.84 0.00 0.00 0.96 0.00 0.00 69 S 7.99 4.71 0.00 3.88 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 70 V 7.54 4.44 1.71 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 0.83 0.00 0.00 71 K 8.43 4.73 0.00 1.81 1.70 0.00 1.71 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.31 7.81 72 F 8.76 5.05 0.00 3.12 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 73 S 7.44 4.41 0.00 4.01 3.67 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 0.00 0.00 0.00 0.00 74 K 7.66 4.91 0.00 1.79 1.66 0.00 0.83 0.00 0.00 2.21 0.00 0.00 2.75 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.14 1.29 7.81 75 D 8.17 4.80 0.00 2.66 2.41 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 76 R 8.48 4.12 0.00 1.92 2.07 0.00 3.23 0.00 0.00 3.34 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.70 0.00 77 H 8.15 4.01 0.00 3.13 3.35 0.00 5.68 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.78 3.84 0.00 1.65 1.52 0.85 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 79 I 6.73 3.27 1.34 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.57 0.07 0.00 0.00 80 E 7.11 4.01 0.00 1.97 1.49 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 1.93 2.02 0.00 81 T 7.91 3.78 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 1.18 0.00 0.00 82 T 7.55 3.98 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 1.21 0.00 0.00 83 S 8.22 4.48 0.00 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 0.00 84 N 8.36 4.35 0.00 2.95 2.89 0.00 0.00 6.49 6.37 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 85 K 8.02 3.98 0.00 2.00 2.03 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.46 7.81 86 L 8.18 3.98 0.00 1.81 1.74 0.93 -0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 87 K 8.18 3.87 0.00 1.82 1.97 0.00 1.84 0.00 0.00 1.69 0.00 0.00 3.17 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.47 7.81 88 S 7.95 4.32 0.00 3.93 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 89 R 8.46 4.32 0.00 1.86 1.98 0.00 3.40 0.00 0.00 3.18 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.80 0.00 90 E 8.48 4.49 0.00 2.21 2.28 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 2.40 2.30 0.00 91 I 8.26 3.05 1.93 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.54 0.95 0.00 0.00 92 T 8.61 4.71 4.31 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 1.37 0.00 0.00 93 F 8.65 4.36 0.00 3.19 3.16 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 94 Q 8.17 3.97 0.00 2.35 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.73 0.00 0.00 0.00 0.00 0.00 2.48 2.45 0.00 95 E 8.17 3.95 0.00 2.09 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 0.00 2.40 2.38 0.00 96 Y 8.21 4.16 0.00 3.19 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 97 R 7.76 3.98 0.00 1.69 1.81 0.00 2.44 0.00 0.00 2.25 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.23 0.00 98 R 7.61 3.86 0.00 2.01 1.94 0.00 3.26 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.81 0.00 99 N 7.82 4.33 0.00 2.56 2.75 0.00 0.00 7.09 7.91 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 0.00 100 L 7.52 3.87 0.00 1.66 1.60 0.44 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 101 A 8.21 3.90 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 0.00 102 K 7.64 3.93 0.00 1.83 1.96 0.00 1.76 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.41 7.81 103 A 7.19 4.58 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 0.00 104 G 7.64 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 0.00 105 V 7.48 4.09 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 1.10 0.00 0.00 0.90 0.00 0.00 106 F 9.10 4.66 0.00 3.39 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 0.00 107 R 8.94 4.48 0.00 2.00 2.04 0.00 3.12 0.00 0.00 3.03 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.81 0.00 108 W 9.48 4.44 0.00 3.54 3.24 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 0.00 109 V 8.80 4.45 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 0.98 0.00 0.00 1.14 0.00 0.00 110 T 8.11 4.32 3.30 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 1.32 0.00 0.00 111 N 9.03 5.38 0.00 2.99 2.96 0.00 0.00 7.12 7.61 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 0.00 112 I 8.26 3.81 2.07 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 1.44 1.21 0.98 0.00 0.00 113 H 8.47 4.30 0.00 3.38 3.55 0.00 5.72 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 E 7.95 4.44 0.00 2.01 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 2.25 2.25 0.00 115 Q 8.22 3.81 0.00 2.32 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.56 0.00 0.00 0.00 0.00 0.00 2.26 2.46 0.00 116 K 7.69 4.55 0.00 1.33 0.74 0.00 1.44 0.00 0.00 1.79 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.12 1.15 7.81 117 R 8.76 4.51 0.00 1.68 1.67 0.00 2.58 0.00 0.00 3.32 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.91 0.00 118 Y 8.71 4.53 0.00 2.78 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 0.00 0.00 0.00 119 Y 8.72 4.81 0.00 2.87 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 0.00 120 Y 9.01 5.34 0.00 2.94 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 0.00 121 T 8.55 5.53 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 1.48 0.00 0.00 122 F 9.02 4.13 0.00 1.64 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 0.00 123 D 8.46 4.64 0.00 2.95 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 0.00 124 N 8.11 4.34 0.00 2.73 2.82 0.00 0.00 6.76 6.94 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 0.00 125 S 7.76 4.32 0.00 3.97 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 0.00 126 L 8.61 4.24 0.00 1.72 1.66 0.78 1.03 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 0.00 127 L 9.00 4.38 0.00 1.75 1.74 1.07 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 128 F 7.91 4.60 0.00 2.97 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 0.00 129 T 7.54 5.68 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 1.00 0.00 0.00 130 E 8.22 4.76 0.00 2.08 2.13 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 2.49 2.40 0.00 131 S 8.72 4.93 0.00 3.74 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 0.00 132 I 8.18 4.31 2.21 0.00 0.00 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 1.44 0.51 1.09 0.00 0.00 133 Q 7.64 3.85 0.00 1.94 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.59 0.00 0.00 0.00 0.00 0.00 2.15 2.19 0.00