NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 S 4.3770 8.3349 115.4043 57.8634 64.3812 172.3329 4 I 3.6738 8.1162 121.2522 61.0352 37.9482 173.8708 5 N 4.6439 9.4169 123.5744 52.8629 40.4550 174.5762 6 N 4.7088 8.7879 120.6785 54.6378 37.5576 175.8981 7 G 3.7734 7.7315 105.2347 47.0511 0.0000 175.8288 8 T 4.2328 7.6687 108.2816 61.2704 69.6077 174.6387 9 F 4.1672 7.1465 119.1746 58.9256 36.7755 176.0670 10 D 4.6149 8.4475 120.8034 55.9016 41.1872 176.3551 11 E 4.8805 7.9661 117.2154 53.3200 32.7026 174.0617 12 P 4.5479 0.0000 0.0000 62.4407 32.0262 176.5371 13 I 4.2256 8.3151 121.8169 61.3297 37.6017 176.5973 14 V 3.6640 8.9709 125.9667 65.5949 32.1543 175.6236 15 N 4.3214 8.3218 115.2310 54.8338 37.7041 174.9356 16 D 4.7681 7.3066 117.8261 52.1954 41.8687 174.7001 17 Q 3.0930 8.1174 122.8605 58.4961 29.7212 177.4879 18 A 4.0355 7.9220 119.4545 54.5109 18.5108 177.6113 19 N 4.7991 7.9956 109.7868 53.5056 41.1183 174.8726 20 N 4.9169 8.1469 116.3893 51.4353 39.6149 173.7825 21 P 4.0685 0.0000 0.0000 64.4275 31.9305 177.8089 22 D 4.8328 7.6546 117.4104 53.8723 39.7896 175.4479 23 E 4.6599 7.6528 119.0858 53.8825 32.8222 175.8990 24 W 4.6274 8.5647 121.2320 57.8896 30.2112 175.2051 25 F 5.4683 8.9912 117.9294 55.4569 41.5435 173.1572 26 I 5.2040 9.1102 120.4023 59.3765 39.6357 174.9419 27 W 5.0874 9.4183 135.0000 55.5517 33.5886 174.1136 28 Q 4.8801 7.8839 123.5932 54.0601 30.9167 176.3145 29 A 3.5129 8.7865 126.0821 54.6170 18.6805 179.9153 30 G 3.8905 7.5456 104.3134 48.1604 0.0000 174.3111 31 D 4.3049 7.5971 117.6342 55.4565 40.8724 176.2751 32 Y 4.5344 7.4565 115.1825 56.9906 39.4935 175.9536 33 G 3.9446 8.2713 106.6521 46.4533 0.0000 174.9109 34 I 4.1501 7.8664 121.5040 62.9822 38.3383 175.4246 35 S 4.4353 7.3049 112.2005 57.9364 64.6893 174.4842 36 G 3.8146 8.5577 109.5670 45.8268 0.0000 173.6012 37 A 4.2570 7.5311 122.8977 52.5758 19.4207 177.1040 38 R 4.8707 9.0426 122.2665 55.0050 34.2702 173.6383 39 V 4.6998 8.8880 126.9687 61.4968 32.1481 175.7510 40 S 4.4677 8.7830 123.4535 60.8357 64.1291 173.9816 41 D 4.7982 7.9342 117.9495 53.4917 44.2929 173.6128 42 Y 4.7850 7.5012 121.3930 55.4701 41.4788 174.0035 43 G 3.6503 6.2133 104.5723 46.5572 0.0000 171.4645 44 V 5.1998 8.1400 112.2281 59.6160 35.1228 175.9608 45 R 4.5114 8.7042 119.4349 56.1121 32.3528 174.6103 46 D 4.2450 9.7358 118.3165 55.5023 38.5248 174.7709 47 G 4.0741 8.8731 104.2924 45.4475 0.0000 173.1785 48 Y 5.2615 7.4244 116.4879 54.9773 42.1282 174.2308 49 A 4.9029 8.4463 122.7315 51.3281 20.5780 176.0159 50 Y 5.0792 8.4651 118.8601 55.1487 41.8427 174.6439 51 I 4.6776 8.3877 122.1583 59.9895 41.1540 174.3662 52 T 4.6514 9.1105 125.3490 62.1648 69.9951 174.0635 53 I 4.3934 8.3557 128.4651 60.5152 37.4885 175.8637 54 A 4.3331 8.6387 129.5743 53.7341 20.0278 177.1521 55 D 4.6924 7.7224 115.2306 52.2421 44.2790 174.1586 56 P 4.3301 0.0000 0.0000 63.0176 32.7744 177.7139 57 G 3.6266 8.2966 110.1970 45.2354 0.0000 173.7602 58 T 4.4794 8.1953 109.2756 61.0001 69.8147 172.6693 59 D 4.7097 6.8415 120.5128 52.7419 44.5530 175.8227 60 T 4.0076 8.6998 113.1471 63.9015 67.5048 175.7225 61 W 4.6186 7.8882 116.6719 57.2517 28.6521 177.2990 62 H 4.4170 7.8980 117.6102 58.0471 28.5160 174.8336 63 I 5.2583 7.5876 118.6083 59.6271 40.9940 174.4580 64 Q 5.1765 9.5648 125.3397 54.0759 33.0363 174.2094 65 F 5.4313 9.3524 125.6103 56.7723 41.6990 173.4949 66 N 5.4503 8.5758 122.9290 51.6795 43.5056 173.4377 67 Q 4.7009 8.2055 120.1604 54.4794 32.7398 173.9057 68 W 4.9312 9.1226 126.8907 57.1860 30.0287 175.4636 69 I 4.5240 8.8149 122.4520 59.5918 41.4817 173.5805 70 G 4.1979 8.4949 115.1202 45.0621 0.0000 172.9384 71 L 4.8282 8.1097 123.6221 52.8437 45.8295 175.8032 72 Y 4.4498 8.8550 119.8944 56.7823 38.8603 175.7287 73 R 3.8974 8.6997 123.8981 58.1704 30.4589 177.1284 74 G 3.9094 9.2758 111.9873 44.7702 0.0000 172.7717 75 K 4.5017 7.7069 121.4439 55.0311 34.7849 174.9156 76 T 4.9968 8.0336 122.0888 62.4089 70.7868 173.2923 77 Y 5.2167 9.3836 122.5951 56.5324 42.8326 174.2864 78 T 5.2073 9.2047 117.7709 62.0884 71.3790 173.4907 79 I 5.0768 8.8906 127.5711 59.8283 39.4021 174.7793 80 S 5.4850 9.3005 121.2304 57.0424 66.3812 172.4287 81 F 5.7053 8.8209 118.3111 57.0257 41.6458 172.7017 82 K 5.4675 9.3150 119.5464 55.3041 34.5962 175.3121 83 A 5.7594 9.6180 123.6324 52.2201 23.3086 175.2070 84 K 4.5421 7.8373 117.5782 56.3833 36.4888 173.9691 85 A 4.9808 8.5361 119.9900 50.6582 22.1820 177.3071 86 D 4.4250 8.9189 120.5003 56.9249 41.4991 177.5284 87 T 4.6234 7.3363 112.6421 60.4978 71.8970 171.9425 88 P 4.9516 0.0000 0.0000 62.6242 31.9385 175.7016 89 R 4.5497 8.1850 118.1344 55.0602 32.1321 171.7714 90 P 5.3010 0.0000 0.0000 62.2333 33.0501 174.7650 91 I 4.9161 8.4988 113.5611 59.5264 41.7081 173.6334 92 N 5.5837 8.7623 119.4703 51.6336 41.6476 174.4125 93 V 4.7737 8.7460 120.8026 59.9950 34.5448 174.7436 94 K 5.2157 8.7567 122.4267 54.8003 37.1712 175.0195 95 I 4.9148 8.5399 123.5129 59.5210 39.5021 174.8758 96 L 4.9328 8.6542 126.1934 53.8572 44.2702 175.4025 97 Q 4.3071 8.1034 119.2378 56.1786 29.2768 176.4967 98 N 4.8554 8.2150 118.6918 52.5537 37.6994 174.0290 99 H 3.7266 6.7495 112.7763 54.0008 31.0971 172.1060 100 D 3.3700 7.0819 119.8333 53.9176 41.1456 174.0116 101 P 4.3689 0.0000 0.0000 62.1134 31.6018 175.3409 102 W 3.4348 7.1384 116.1920 58.1813 27.0855 174.8515 103 T 3.6847 7.7979 114.7813 64.2540 69.0159 173.5416 104 N 4.6924 8.4474 124.0674 52.8126 38.5015 174.6214 105 Y 4.6532 8.7015 123.4170 59.9972 39.2140 176.2991 106 F 5.0176 8.0607 120.2099 56.4874 43.2228 173.4909 107 A 4.7810 7.4589 126.1723 50.9371 21.9200 175.3108 108 Q 4.3846 8.5974 120.6078 54.4798 33.7743 174.0131 109 T 5.1025 8.4500 117.4191 61.9989 71.2246 174.2336 110 V 4.6028 8.7226 118.2585 59.5657 35.5864 174.4687 111 N 5.0019 8.9416 122.1996 52.8174 39.4954 174.6169 112 L 4.8811 8.9494 124.6681 53.7360 44.5213 175.7984 113 T 5.1630 8.1074 110.7069 59.5730 72.4414 173.9972 114 A 4.5330 8.5805 121.6064 52.8147 18.5213 176.8453 115 D 4.8173 7.4999 116.5224 51.5489 42.7300 176.4629 116 W 4.3711 8.5746 123.3235 57.7681 29.6491 175.3955 117 Q 4.6259 9.0182 121.8838 54.6012 33.1823 173.8689 118 T 4.9699 8.0241 116.7833 61.8777 71.2683 174.0259 119 F 4.5825 8.6096 123.1235 55.9052 42.6849 174.1698 120 T 5.2210 7.9878 119.1488 61.9288 72.1738 173.3431 121 F 5.2567 9.4426 124.5574 55.8767 43.1820 174.6685 122 T 4.8724 8.9124 112.9638 62.0980 70.4496 173.4946 123 Y 4.9346 8.9106 123.3775 57.1059 42.7659 173.2187 124 T 4.3754 8.1108 123.5012 61.7295 70.5813 173.6793 125 H 4.0533 8.4990 127.4770 54.4840 31.0840 173.2599 126 P 4.5274 0.0000 0.0000 62.5675 31.8544 177.0745 127 D 4.3812 8.6884 120.9828 56.8017 40.8524 177.3017 128 D 4.8026 7.7761 115.3343 52.6498 39.7849 175.9085 129 A 4.0294 7.2875 122.0631 51.8757 18.8008 178.0288 130 D 4.5186 8.0241 119.4870 54.6813 41.5518 177.2138 131 E 4.3058 8.6293 120.9357 58.0381 30.9727 176.3408 132 V 4.5972 7.6393 118.9627 61.2638 33.8487 174.9620 133 V 4.5673 8.4258 121.5014 59.9877 36.1753 174.0814 134 Q 4.8709 8.5229 117.3517 55.1043 32.3676 174.1551 135 I 4.4299 8.1451 121.7710 60.5315 39.8526 174.4531 136 S 5.2559 8.4541 122.6275 55.5659 65.8988 172.2751 137 F 5.2133 9.1069 126.5892 56.2065 40.8981 174.6494 138 E 4.9970 9.1467 124.6142 55.3906 30.5204 176.6410 139 L 4.7232 9.1268 124.3464 54.4059 42.8057 177.0415 140 G 3.6950 8.3606 108.0691 46.8049 0.0000 174.2416 141 E 4.1547 9.2149 125.2248 56.4387 29.7853 175.0211 142 G 3.9046 7.5522 104.5332 44.4859 0.0000 172.6881 143 T 3.7272 8.3287 115.2191 63.6363 68.6808 174.1587 144 A 4.0221 8.4434 128.7243 52.7951 18.6551 176.2528 145 T 4.4422 7.9530 116.6026 62.3382 71.3103 171.4155 146 T 4.7915 8.2810 118.2162 62.2608 70.4566 174.2345 147 I 4.7249 8.0538 126.1668 59.5745 40.5626 174.2223 148 Y 5.1369 8.3955 122.7363 56.2502 41.7610 174.6711 149 F 5.7802 9.1096 120.1792 56.3985 43.7264 173.2618 150 D 5.3112 9.8400 119.5987 53.3354 45.0148 174.1483 151 D 4.5574 8.7517 119.3316 55.3686 38.1356 174.2104 152 V 4.9093 8.1240 119.3327 62.9456 33.1889 175.6255 153 T 4.8341 9.4168 117.7876 59.9995 72.6255 173.3271 154 V 4.8962 8.5258 122.5068 61.5766 33.8515 174.4738 155 S 5.0407 9.0361 123.8601 55.7267 66.8333 172.3069 156 P 4.3213 0.0000 0.0000 62.6672 31.9696 176.1672 157 Q 4.1780 8.3831 123.7917 56.4286 28.5987 175.5730 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 3 S 8.33 4.38 0.00 3.99 4.01 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 4 I 8.12 3.67 1.86 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.19 0.86 0.00 0.00 5 N 9.42 4.64 0.00 2.51 2.73 0.00 0.00 6.29 6.86 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 6 N 8.79 4.71 0.00 3.03 3.03 0.00 0.00 7.11 8.20 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 7 G 7.73 3.77 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 0.00 0.00 0.00 8 T 7.67 4.23 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 1.23 0.00 0.00 9 F 7.15 4.17 0.00 3.59 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 10 D 8.45 4.61 0.00 2.72 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 11 E 7.97 4.88 0.00 2.19 1.91 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 2.28 2.43 0.00 12 P 0.00 4.55 0.00 2.14 2.06 0.00 3.76 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 13 I 8.32 4.23 2.18 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 1.64 0.70 1.15 0.00 0.00 14 V 8.97 3.66 2.21 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 0.82 0.00 0.00 1.03 0.00 0.00 15 N 8.32 4.32 0.00 2.86 2.93 0.00 0.00 6.98 8.08 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 16 D 7.31 4.77 0.00 2.75 2.46 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 0.00 0.00 0.00 0.00 17 Q 8.12 3.09 0.00 1.23 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.84 0.00 0.00 0.00 0.00 0.00 1.87 1.16 0.00 18 A 7.92 4.04 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 19 N 8.00 4.80 0.00 2.88 2.79 0.00 0.00 6.84 7.30 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 20 N 8.15 4.92 0.00 2.61 2.63 0.00 0.00 6.59 8.20 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 21 P 0.00 4.07 0.00 0.49 1.30 0.00 3.26 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.47 0.00 22 D 7.65 4.83 0.00 2.76 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 23 E 7.65 4.66 0.00 1.98 1.91 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 2.18 2.39 0.00 24 W 8.56 4.63 0.00 3.43 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 25 F 8.99 5.47 0.00 3.27 3.12 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 26 I 9.11 5.20 1.78 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.74 0.97 0.00 0.00 27 W 9.42 5.09 0.00 3.67 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 28 Q 7.88 4.88 0.00 2.11 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.67 0.00 0.00 0.00 0.00 0.00 2.14 2.13 0.00 29 A 8.79 3.51 1.08 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 30 G 7.55 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 0.00 0.00 0.00 31 D 7.60 4.30 0.00 2.32 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 0.00 0.00 0.00 0.00 32 Y 7.46 4.53 0.00 2.95 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 33 G 8.27 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 34 I 7.87 4.15 2.03 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.93 0.81 0.00 0.00 35 S 7.30 4.44 0.00 3.92 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 36 G 8.56 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 37 A 7.53 4.26 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 38 R 9.04 4.87 0.00 1.94 1.68 0.00 3.05 0.00 0.00 3.06 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.54 0.00 39 V 8.89 4.70 2.23 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 0.93 0.00 0.00 0.91 0.00 0.00 40 S 8.78 4.47 0.00 3.93 3.97 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 41 D 7.93 4.80 0.00 2.81 2.55 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 42 Y 7.50 4.78 0.00 2.76 2.70 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 43 G 6.21 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 44 V 8.14 5.20 2.16 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 0.96 0.00 0.00 1.01 0.00 0.00 45 R 8.70 4.51 0.00 1.88 1.99 0.00 2.95 0.00 0.00 3.14 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.16 0.00 46 D 9.74 4.24 0.00 2.73 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 47 G 8.87 4.07 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 0.00 48 Y 7.42 5.26 0.00 3.59 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 49 A 8.45 4.90 0.16 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 0.00 0.00 50 Y 8.47 5.08 0.00 2.63 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 51 I 8.39 4.68 1.65 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.53 0.78 0.00 0.00 52 T 9.11 4.65 4.38 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 1.19 0.00 0.00 53 I 8.36 4.39 1.92 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 1.13 0.45 0.91 0.00 0.00 54 A 8.64 4.33 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 55 D 7.72 4.69 0.00 2.64 2.53 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 56 P 0.00 4.33 0.00 2.20 2.32 0.00 3.80 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 2.02 1.94 0.00 57 G 8.30 3.63 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 0.00 0.00 0.00 58 T 8.20 4.48 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 1.17 0.00 0.00 59 D 6.84 4.71 0.00 2.08 1.54 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 0.00 60 T 8.70 4.01 4.28 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 1.22 0.00 0.00 61 W 7.89 4.62 0.00 3.47 3.49 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 62 H 7.90 4.42 0.00 3.17 3.23 0.00 5.58 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 7.59 5.26 1.93 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 1.24 0.80 0.97 0.00 0.00 64 Q 9.56 5.18 0.00 2.21 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 2.38 2.68 0.00 65 F 9.35 5.43 0.00 2.92 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 66 N 8.58 5.45 0.00 1.45 2.33 0.00 0.00 6.10 6.85 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 67 Q 8.21 4.70 0.00 0.93 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.98 0.00 0.00 0.00 0.00 0.00 1.91 1.79 0.00 68 W 9.12 4.93 0.00 3.11 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 69 I 8.81 4.52 1.72 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.18 0.73 0.00 0.00 70 G 8.49 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 0.00 0.00 0.00 0.00 71 L 8.11 4.83 0.00 0.95 1.14 0.65 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 72 Y 8.85 4.45 0.00 3.15 2.87 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 0.00 0.00 0.00 73 R 8.70 3.90 0.00 1.85 1.99 0.00 3.22 0.00 0.00 3.35 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.66 0.00 74 G 9.28 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 75 K 7.71 4.50 0.00 1.79 1.92 0.00 1.46 0.00 0.00 1.71 0.00 0.00 2.68 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.70 1.14 7.81 76 T 8.03 5.00 4.14 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 1.20 0.00 0.00 77 Y 9.38 5.22 0.00 3.06 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 78 T 9.20 5.21 4.34 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 1.31 0.00 0.00 79 I 8.89 5.08 1.94 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.68 1.07 0.00 0.00 80 S 9.30 5.48 0.00 3.97 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 81 F 8.82 5.71 0.00 3.55 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 82 K 9.32 5.47 0.00 2.05 2.03 0.00 1.71 0.00 0.00 1.48 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.46 7.81 83 A 9.62 5.76 1.31 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 84 K 7.84 4.54 0.00 1.57 1.47 0.00 0.81 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.61 7.81 85 A 8.54 4.98 1.16 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 0.00 0.00 86 D 8.92 4.42 0.00 2.58 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 87 T 7.34 4.62 4.21 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 1.19 0.00 0.00 88 P 0.00 4.95 0.00 1.92 1.99 0.00 3.74 0.00 0.00 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.91 0.00 89 R 8.18 4.55 0.00 1.81 1.95 0.00 3.07 0.00 0.00 3.34 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.49 0.00 90 P 0.00 5.30 0.00 2.11 2.10 0.00 3.70 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 91 I 8.50 4.92 2.13 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.02 0.94 0.00 0.00 92 N 8.76 5.58 0.00 2.73 2.73 0.00 0.00 6.90 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 93 V 8.75 4.77 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 1.05 0.00 0.00 0.67 0.00 0.00 94 K 8.76 5.22 0.00 1.57 1.59 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.82 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.24 1.32 7.81 95 I 8.54 4.91 1.54 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.06 0.84 0.00 0.00 96 L 8.65 4.93 0.00 1.70 1.59 0.86 0.64 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 97 Q 8.10 4.31 0.00 1.64 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.37 0.00 0.00 0.00 0.00 0.00 2.48 1.91 0.00 98 N 8.21 4.86 0.00 2.12 2.15 0.00 0.00 5.88 7.90 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 99 H 6.75 3.73 0.00 2.94 3.09 0.00 5.67 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 D 7.08 3.37 0.00 2.28 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 0.00 0.00 0.00 101 P 0.00 4.37 0.00 2.07 1.95 0.00 3.81 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.82 0.00 102 W 7.14 3.43 0.00 3.20 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 0.00 103 T 7.80 3.68 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 0.94 0.00 0.00 104 N 8.45 4.69 0.00 2.50 2.68 0.00 0.00 7.12 7.46 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 0.00 105 Y 8.70 4.65 0.00 3.09 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 0.00 106 F 8.06 5.02 0.00 2.76 2.53 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 0.00 107 A 7.46 4.78 1.01 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 0.00 0.00 108 Q 8.60 4.38 0.00 1.42 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.71 0.00 0.00 0.00 0.00 0.00 1.16 1.39 0.00 109 T 8.45 5.10 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 1.30 0.00 0.00 110 V 8.72 4.60 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 0.97 0.00 0.00 0.86 0.00 0.00 111 N 8.94 5.00 0.00 2.70 2.82 0.00 0.00 6.96 7.85 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 0.00 112 L 8.95 4.88 0.00 1.64 1.54 0.78 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 113 T 8.11 5.16 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 1.23 0.00 0.00 114 A 8.58 4.53 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 0.00 115 D 7.50 4.82 0.00 2.66 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 W 8.57 4.37 0.00 3.08 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 0.00 117 Q 9.02 4.63 0.00 1.65 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.77 0.00 0.00 0.00 0.00 0.00 2.45 2.42 0.00 118 T 8.02 4.97 4.07 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 1.15 0.00 0.00 119 F 8.61 4.58 0.00 1.95 2.67 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 0.00 120 T 7.99 5.22 4.14 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 1.25 0.00 0.00 121 F 9.44 5.26 0.00 3.06 3.18 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 0.00 122 T 8.91 4.87 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 1.36 0.00 0.00 123 Y 8.91 4.93 0.00 2.80 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 0.00 124 T 8.11 4.38 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 1.12 0.00 0.00 125 H 8.50 4.05 0.00 3.26 3.34 0.00 5.84 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 P 0.00 4.53 0.00 2.02 1.91 0.00 3.11 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 1.99 2.11 0.00 127 D 8.69 4.38 0.00 2.63 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 0.00 128 D 7.78 4.80 0.00 2.72 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 0.00 129 A 7.29 4.03 0.34 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 0.00 130 D 8.02 4.52 0.00 2.76 2.58 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 0.00 131 E 8.63 4.31 0.00 1.85 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 2.36 2.26 0.00 132 V 7.64 4.60 1.90 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 0.69 0.00 0.00 0.87 0.00 0.00 133 V 8.43 4.57 2.27 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 0.86 0.00 0.00 0.85 0.00 0.00 134 Q 8.52 4.87 0.00 2.24 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.99 6.95 0.00 0.00 0.00 0.00 0.00 2.33 2.25 0.00 135 I 8.15 4.43 1.64 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 1.14 0.73 0.00 0.00 136 S 8.45 5.26 0.00 3.78 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 0.00 137 F 9.11 5.21 0.00 2.96 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 0.00 138 E 9.15 5.00 0.00 2.00 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 2.36 2.32 0.00 139 L 9.13 4.72 0.00 1.53 1.70 0.98 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 140 G 8.36 3.69 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 0.00 0.00 0.00 141 E 9.21 4.15 0.00 1.87 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 0.00 2.15 2.17 0.00 142 G 7.55 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 0.00 143 T 8.33 3.73 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 0.00 144 A 8.44 4.02 1.22 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 0.00 145 T 7.95 4.44 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 1.14 0.00 0.00 146 T 8.28 4.79 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 0.57 0.00 0.00 147 I 8.05 4.72 1.66 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 1.07 0.59 0.50 0.00 0.00 148 Y 8.40 5.14 0.00 2.09 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 0.00 149 F 9.11 5.78 0.00 2.68 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 0.00 150 D 9.84 5.31 0.00 2.73 2.33 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 0.00 151 D 8.75 4.56 0.00 2.97 2.76 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 0.00 152 V 8.12 4.91 2.53 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 1.45 0.00 0.00 1.40 0.00 0.00 153 T 9.42 4.83 4.34 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 1.30 0.00 0.00 154 V 8.53 4.90 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 0.67 0.00 0.00 0.88 0.00 0.00 155 S 9.04 5.04 0.00 3.88 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 0.00 156 P 0.00 4.32 0.00 1.88 1.80 0.00 3.75 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 2.20 0.00 157 Q 8.38 4.18 0.00 2.03 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.55 0.00 0.00 0.00 0.00 0.00 2.36 2.33 0.00