NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.7640 8.0932 114.8132 57.7158 64.5821 174.3522 2 L 4.1374 8.5965 120.6290 56.6720 40.9884 178.3100 3 L 3.9745 8.5527 121.9855 58.3546 42.2873 178.6070 4 E 4.0424 8.0332 117.9464 59.2477 29.3488 178.9256 5 F 4.7541 8.5026 120.9248 61.4094 39.5091 177.3303 6 G 3.5455 8.2860 105.2769 48.2246 0.0000 175.5711 7 M 4.1726 7.9121 121.4518 58.1389 31.9910 178.5882 8 M 4.1495 8.4297 120.1333 58.0808 32.4103 178.3243 9 I 3.6130 7.7689 119.9966 64.2870 37.3050 178.0200 10 L 4.3066 7.4171 122.5414 57.7161 41.6812 179.3877 11 G 3.6841 8.1974 104.3097 47.2276 0.0000 174.6677 12 E 4.3029 8.0381 120.5906 58.1526 30.1195 177.5103 13 T 4.3683 8.1281 108.2887 61.3302 69.8036 176.0767 14 G 3.9493 8.2391 108.4009 45.0703 0.0000 172.9974 15 K 4.4532 7.8449 119.6193 53.9925 34.3720 175.2646 16 N 4.6234 8.5369 121.2815 53.1995 39.7999 174.1751 17 P 4.3932 0.0000 0.0000 65.8730 31.2017 178.4172 18 L 4.2306 8.6280 119.9618 56.4979 41.5898 178.3897 19 T 4.3633 7.7897 107.4960 62.4271 69.7276 175.9201 20 S 4.5160 7.5650 117.6794 57.9081 64.3207 174.3118 21 Y 4.7377 7.6102 116.3093 57.6046 38.7317 176.1848 22 S 4.5546 8.1121 117.2572 58.9542 65.1263 173.8328 23 F 5.1535 7.7868 118.2849 55.6663 39.9192 171.3953 24 Y 5.0625 9.1548 123.4052 56.4445 42.4765 175.3814 25 G 3.6512 8.4414 116.5907 46.5658 0.0000 172.9450 26 C 4.5960 9.4645 115.7406 57.8800 41.0063 174.7488 27 Y 4.2346 8.6669 115.4105 58.0985 40.0173 175.4944 28 C 4.6956 8.7462 117.9516 55.6982 38.9795 173.9015 29 G 3.6006 7.7339 111.0212 43.4372 0.0000 169.9212 30 V 3.8254 7.7039 119.6870 63.4065 32.2392 176.2010 31 G 3.8093 8.7658 112.5072 46.1152 0.0000 174.3096 32 G 3.8038 8.1116 107.8912 45.4075 0.0000 173.4439 33 K 4.4356 7.4794 121.2032 56.5590 36.3125 177.0981 34 G 4.0969 9.1149 105.7935 46.2967 0.0000 172.5571 35 T 4.7331 8.2261 111.9169 58.6390 71.1704 172.5100 36 P 4.5074 0.0000 0.0000 63.3752 31.8007 176.7569 37 K 3.8495 8.7624 121.6987 58.8521 32.5695 176.0128 38 D 4.4444 7.2261 115.7099 51.3331 41.9161 175.4048 39 A 3.9998 8.7229 119.7979 55.8224 18.1578 179.7316 40 T 3.9770 8.0807 113.7451 67.0812 68.6377 175.9872 41 D 4.6831 8.8895 120.0227 57.6285 41.1182 178.3804 42 R 3.9703 8.1657 119.0344 59.2467 29.9831 177.6776 43 C 4.0809 8.2552 116.7513 60.2815 40.4599 175.5486 44 C 4.3521 8.0330 116.4607 59.8479 40.7660 175.6722 45 F 3.8663 8.2233 122.3116 61.4248 38.7803 177.3877 46 V 3.1904 7.9803 117.8417 66.0042 31.2986 177.3212 47 H 3.7910 8.1516 117.9811 59.2935 29.5759 176.8007 48 D 4.2436 8.1290 120.7532 57.6974 40.5353 178.2927 49 C 4.0878 7.8311 116.8027 59.9171 39.8655 175.3862 50 C 4.1284 7.8625 119.3867 59.9014 40.0862 174.9906 51 Y 4.3512 8.0136 118.4870 61.0645 37.2386 178.6463 52 G 3.7556 8.1828 105.6425 47.2781 0.0000 174.0993 53 N 4.7589 7.5611 117.1733 53.2000 40.1802 174.9570 54 L 4.8552 7.7519 117.6202 53.3247 42.1826 176.2892 55 P 4.3017 0.0000 0.0000 65.3104 31.9863 177.3148 56 D 4.6176 7.9672 116.5418 53.5626 39.5739 175.6983 57 C 5.0985 7.9607 116.6434 55.7348 45.5325 174.5438 58 S 4.5521 7.8916 114.7200 55.8035 62.2023 173.1127 59 P 3.9117 0.0000 0.0000 65.1077 31.7224 179.1465 60 K 4.2366 7.8511 117.1536 58.2519 32.3306 178.2498 61 T 4.2912 7.6311 106.1775 61.3402 70.5291 173.5138 62 D 4.5151 8.0587 122.1477 53.1761 40.6747 176.0506 63 R 4.2114 8.5902 125.7233 56.0310 30.6883 175.5073 64 Y 4.9751 7.8541 117.5607 55.7948 41.3909 173.7879 65 K 4.9804 8.7444 118.6886 54.9738 35.0004 175.1028 66 Y 5.5276 8.2762 120.2181 56.4788 42.4208 173.2156 67 H 4.9608 9.0580 113.8000 54.9744 32.0566 172.1063 68 R 5.1835 8.6985 115.8604 54.8122 33.3908 174.9087 69 E 4.5638 8.6230 120.5075 55.5553 32.4737 175.6165 70 N 4.1574 9.9716 123.0522 54.6118 37.3448 174.9781 71 G 3.9761 8.6373 104.9722 44.8544 0.0000 173.8377 72 A 4.7201 7.4036 122.5382 50.0211 20.8915 176.1678 73 I 4.4123 8.2757 122.3858 61.6220 38.0014 175.7098 74 V 4.3586 9.0562 127.0055 60.9012 34.0391 174.1193 75 C 4.7465 8.9597 125.9908 56.8217 40.7651 174.0198 76 G 3.9146 8.9815 110.9023 46.1869 0.0000 173.9015 77 K 4.4418 8.6702 120.2028 55.1487 31.4709 176.2245 78 G 4.4485 8.6801 117.3135 43.7958 0.0000 171.7337 79 T 4.0607 8.4703 110.7219 61.4956 70.6403 174.8773 80 S 4.0421 8.5655 115.5166 61.8266 62.2275 176.9574 81 C 4.2145 8.0938 118.4197 60.1814 41.1769 175.6979 82 E 3.8932 8.1722 119.9761 59.5419 29.0618 179.3048 83 N 4.2102 8.4502 116.7008 56.4202 38.6277 177.7544 84 R 3.8688 8.0225 119.4271 59.1178 30.1215 179.2657 85 I 3.5592 7.8024 119.7587 64.4590 37.1211 177.5248 86 C 3.3632 7.6805 119.2691 59.5469 44.0702 175.5393 87 E 3.8172 8.0295 119.9733 59.3456 28.9890 178.5176 88 C 4.1291 8.0450 116.6358 60.2390 40.7296 176.0717 89 D 3.8788 7.9570 120.1429 57.1465 40.4337 178.7035 90 R 3.7694 8.2907 119.3998 59.4103 30.0711 178.3071 91 A 3.8954 7.9859 120.1866 55.0447 18.2517 179.5179 92 A 3.5123 7.8371 118.8747 55.1012 18.4702 179.6272 93 A 3.9746 8.1716 119.4990 55.5310 18.3607 179.9884 94 I 3.6596 7.8073 118.2384 64.4123 36.9020 177.7490 95 C 4.1323 7.8583 118.4693 59.6851 37.9069 175.2888 96 F 4.5339 7.8597 119.4548 60.6735 38.3587 177.5596 97 R 3.9655 8.0055 118.1052 59.5996 29.7376 178.7376 98 K 4.2023 8.3133 116.5359 58.3199 32.2386 177.4961 99 N 5.0377 7.7329 115.0136 52.7980 39.4306 176.2373 100 L 4.1887 7.9752 121.8578 57.8187 41.7886 179.6803 101 K 4.1330 8.2488 116.4270 59.1223 32.4294 177.2788 102 T 4.6312 7.9178 107.6339 60.9976 69.3941 173.4340 103 Y 4.1627 8.1015 124.3537 58.4367 39.3700 174.7999 104 N 5.1853 8.9307 124.2320 51.9386 41.4652 174.4726 105 Y 4.3241 9.3643 124.3267 61.0302 38.2107 178.7275 106 I 3.6721 8.0403 119.1411 63.6017 38.1633 175.9931 107 Y 4.4274 7.6144 116.5327 58.0693 37.1237 175.6247 108 R 4.3827 7.7117 120.9979 57.5239 30.5704 176.4680 109 N 4.4842 9.2342 118.5250 54.2230 36.7429 173.9684 110 Y 4.1192 7.4519 119.9032 56.7910 39.6177 173.8953 111 P 4.4105 0.0000 0.0000 62.2815 32.3839 176.8546 112 D 4.3874 8.8276 120.7943 57.3954 40.8821 178.1151 113 F 4.0782 8.3295 120.8321 61.0097 39.1000 175.9666 114 L 4.4132 7.6339 115.4197 55.2990 41.8426 176.4210 115 C 4.7829 8.0892 116.9105 56.7680 40.9470 174.6189 116 K 4.4201 7.1877 119.9225 55.6195 29.8040 176.1607 117 K 4.6200 7.2600 119.7360 53.6232 36.3888 175.8544 118 E 4.0575 8.7124 121.5088 56.6949 29.7564 176.8875 119 S 4.6642 8.5847 122.8692 58.3561 63.5286 173.9221 120 E 4.1971 8.7046 126.3779 56.2545 30.0058 176.2569 121 K 4.5920 8.5295 125.0057 55.7700 34.6431 177.3133 122 C 4.4409 8.6716 118.2254 57.4788 41.1838 173.6693 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 S 8.09 4.76 0.00 4.21 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 2 L 8.60 4.14 0.00 1.81 1.91 1.04 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.55 3.97 0.00 1.67 1.64 0.92 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 4 E 8.03 4.04 0.00 1.78 1.80 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 1.77 2.27 0.00 5 F 8.50 4.75 0.00 3.31 3.28 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 6 G 8.29 3.55 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 0.00 7 M 7.91 4.17 0.00 2.13 2.39 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.84 0.00 8 M 8.43 4.15 0.00 2.21 2.03 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.33 0.00 9 I 7.77 3.61 1.79 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 1.23 0.17 0.66 0.00 0.00 10 L 7.42 4.31 0.00 1.77 1.84 0.96 0.66 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 11 G 8.20 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 E 8.04 4.30 0.00 2.11 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 2.29 2.37 0.00 13 T 8.13 4.37 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 1.28 0.00 0.00 14 G 8.24 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 0.00 0.00 0.00 15 K 7.84 4.45 0.00 1.78 1.51 0.00 1.63 0.00 0.00 1.48 0.00 0.00 2.68 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.33 1.24 7.81 16 N 8.54 4.62 0.00 2.72 2.66 0.00 0.00 6.93 7.71 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 17 P 0.00 4.39 0.00 2.21 2.18 0.00 3.73 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 2.03 2.16 0.00 18 L 8.63 4.23 0.00 1.73 1.82 0.94 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 19 T 7.79 4.36 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 1.20 0.00 0.00 20 S 7.57 4.52 0.00 3.31 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 21 Y 7.61 4.74 0.00 2.61 2.39 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 22 S 8.11 4.55 0.00 4.06 3.56 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 23 F 7.79 5.15 0.00 3.13 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 24 Y 9.15 5.06 0.00 2.87 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 25 G 8.44 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 C 9.46 4.60 0.00 3.10 3.14 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 0.00 0.00 0.00 0.00 27 Y 8.67 4.23 0.00 3.35 3.21 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 28 C 8.75 4.70 0.00 3.44 3.41 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 29 G 7.73 3.60 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 0.00 0.00 0.00 30 V 7.70 3.83 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 0.84 0.00 0.00 0.90 0.00 0.00 31 G 8.77 3.81 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 0.00 0.00 0.00 32 G 8.11 3.80 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 0.00 0.00 0.00 33 K 7.48 4.44 0.00 1.80 1.72 0.00 1.63 0.00 0.00 2.00 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.30 1.57 7.81 34 G 9.11 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 35 T 8.23 4.73 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 1.15 0.00 0.00 36 P 0.00 4.51 0.00 1.89 2.05 0.00 3.38 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.50 0.00 37 K 8.76 3.85 0.00 0.85 0.78 0.00 1.53 0.00 0.00 1.37 0.00 0.00 2.49 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.10 0.30 7.81 38 D 7.23 4.44 0.00 2.80 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 39 A 8.72 4.00 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 40 T 8.08 3.98 4.43 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 1.07 0.00 0.00 41 D 8.89 4.68 0.00 3.02 2.83 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 42 R 8.17 3.97 0.00 1.89 2.09 0.00 3.14 0.00 0.00 3.16 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.71 0.00 43 C 8.26 4.08 0.00 2.99 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 C 8.03 4.35 0.00 3.48 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 F 8.22 3.87 0.00 2.29 2.98 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 0.00 0.00 0.00 46 V 7.98 3.19 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 0.89 0.00 0.00 1.01 0.00 0.00 47 H 8.15 3.79 0.00 3.13 3.28 0.00 5.65 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 48 D 8.13 4.24 0.00 2.81 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 C 7.83 4.09 0.00 2.81 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 50 C 7.86 4.13 0.00 2.95 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 51 Y 8.01 4.35 0.00 3.00 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 52 G 8.18 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 53 N 7.56 4.76 0.00 2.73 2.92 0.00 0.00 6.97 8.90 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 54 L 7.75 4.86 0.00 1.74 1.46 0.82 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 55 P 0.00 4.30 0.00 2.15 2.17 0.00 3.81 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.93 0.00 56 D 7.97 4.62 0.00 2.78 2.78 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 57 C 7.96 5.10 0.00 2.95 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 58 S 7.89 4.55 0.00 3.79 3.70 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 3.91 0.00 0.58 0.74 0.00 3.38 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 1.63 1.70 0.00 60 K 7.85 4.24 0.00 1.83 1.91 0.00 1.67 0.00 0.00 1.96 0.00 0.00 3.11 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.73 1.47 7.81 61 T 7.63 4.29 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 1.22 0.00 0.00 62 D 8.06 4.52 0.00 2.74 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 63 R 8.59 4.21 0.00 1.84 1.91 0.00 3.42 0.00 0.00 3.92 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.51 0.00 64 Y 7.85 4.98 0.00 3.01 2.93 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 65 K 8.74 4.98 0.00 1.81 1.78 0.00 1.65 0.00 0.00 1.91 0.00 0.00 2.90 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.45 7.81 66 Y 8.28 5.53 0.00 3.18 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 67 H 9.06 4.96 0.00 3.15 3.39 0.00 5.20 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 R 8.70 5.18 0.00 1.83 1.88 0.00 3.22 0.00 0.00 3.44 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.74 0.00 69 E 8.62 4.56 0.00 2.01 1.84 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 2.30 2.32 0.00 70 N 9.97 4.16 0.00 2.82 2.87 0.00 0.00 7.34 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 71 G 8.64 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 72 A 7.40 4.72 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 73 I 8.28 4.41 1.85 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.61 0.83 0.00 0.00 74 V 9.06 4.36 1.80 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 1.07 0.00 0.00 0.97 0.00 0.00 75 C 8.96 4.75 0.00 2.85 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 G 8.98 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 77 K 8.67 4.44 0.00 1.78 1.82 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.45 7.81 78 G 8.68 4.45 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 0.00 0.00 0.00 79 T 8.47 4.06 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 1.22 0.00 0.00 80 S 8.57 4.04 0.00 3.89 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 81 C 8.09 4.21 0.00 2.98 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 82 E 8.17 3.89 0.00 2.24 2.07 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 2.59 2.53 0.00 83 N 8.45 4.21 0.00 2.79 2.80 0.00 0.00 7.05 7.28 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 84 R 8.02 3.87 0.00 1.97 1.90 0.00 3.07 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.72 0.00 85 I 7.80 3.56 1.76 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.76 0.89 0.00 0.00 86 C 7.68 3.36 0.00 1.73 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 87 E 8.03 3.82 0.00 2.07 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 2.41 2.42 0.00 88 C 8.04 4.13 0.00 3.21 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 89 D 7.96 3.88 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 90 R 8.29 3.77 0.00 1.78 1.98 0.00 3.04 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 91 A 7.99 3.90 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 92 A 7.84 3.51 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 93 A 8.17 3.97 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 94 I 7.81 3.66 1.81 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 1.39 0.75 0.88 0.00 0.00 95 C 7.86 4.13 0.00 2.93 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 96 F 7.86 4.53 0.00 3.00 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 97 R 8.01 3.97 0.00 1.94 2.14 0.00 3.12 0.00 0.00 3.39 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.84 0.00 98 K 8.31 4.20 0.00 1.76 1.88 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.64 7.81 99 N 7.73 5.04 0.00 2.99 2.90 0.00 0.00 6.81 6.34 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 0.00 100 L 7.98 4.19 0.00 1.74 1.79 1.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.25 4.13 0.00 1.91 2.01 0.00 1.55 0.00 0.00 1.79 0.00 0.00 3.07 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.47 1.50 7.81 102 T 7.92 4.63 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 103 Y 8.10 4.16 0.00 3.14 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 0.00 104 N 8.93 5.19 0.00 2.84 2.64 0.00 0.00 6.96 6.84 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 0.00 105 Y 9.36 4.32 0.00 3.05 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 0.00 106 I 8.04 3.67 1.77 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.43 0.19 0.00 0.00 107 Y 7.61 4.43 0.00 1.77 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 0.00 0.00 0.00 108 R 7.71 4.38 0.00 2.04 1.88 0.00 2.99 0.00 0.00 3.03 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.67 0.00 109 N 9.23 4.48 0.00 2.85 2.88 0.00 0.00 6.94 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 0.00 110 Y 7.45 4.12 0.00 3.26 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 0.00 111 P 0.00 4.41 0.00 2.20 2.06 0.00 2.47 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.70 0.00 112 D 8.83 4.39 0.00 2.86 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 0.00 113 F 8.33 4.08 0.00 3.13 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 0.00 114 L 7.63 4.41 0.00 1.41 1.72 0.79 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 115 C 8.09 4.78 0.00 3.08 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 0.00 116 K 7.19 4.42 0.00 1.48 1.62 0.00 1.54 0.00 0.00 0.96 0.00 0.00 2.87 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.29 7.81 117 K 7.26 4.62 0.00 1.75 1.63 0.00 1.68 0.00 0.00 1.73 0.00 0.00 2.82 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.35 7.81 118 E 8.71 4.06 0.00 1.90 1.88 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 2.30 2.42 0.00 119 S 8.58 4.66 0.00 3.88 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 0.00 120 E 8.70 4.20 0.00 1.76 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 2.31 2.18 0.00 121 K 8.53 4.59 0.00 1.84 1.83 0.00 1.65 0.00 0.00 1.73 0.00 0.00 2.91 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.40 1.50 7.81 122 C 8.67 4.44 0.00 2.93 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