NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 Q 4.2523 8.3444 119.6989 56.0812 30.3604 173.9845 10 S 4.5249 8.0111 110.8142 56.7019 65.0097 171.1373 11 Q 4.8984 8.4382 121.6322 54.2039 31.6352 174.0454 12 F 4.8226 8.7478 124.4922 55.7813 43.0271 174.7593 13 F 4.8388 9.1594 121.2635 55.7122 41.6076 176.4232 14 I 3.6722 8.6847 118.7555 64.7569 37.1773 177.4015 15 E 4.0366 8.1824 118.1368 59.6009 29.6004 178.5649 16 H 4.9061 8.5121 116.3588 58.9144 28.8522 177.7286 17 I 3.9845 7.9683 121.1639 64.7111 36.8047 178.2133 18 L 3.9979 7.9147 118.1318 57.7746 41.6026 178.9996 19 Q 4.1643 8.0355 116.0847 56.6766 28.6498 177.0288 20 I 3.3768 7.1678 118.3779 62.3809 39.0069 176.0698 21 L 4.1858 7.8308 119.7973 53.6223 42.0105 175.7617 22 P 4.3042 0.0000 0.0000 64.8623 31.9385 176.6467 23 H 4.1721 7.9851 116.1463 56.1716 29.1790 174.2817 24 R 4.7379 8.0697 120.2614 54.0937 34.3076 173.6946 25 Y 4.2843 8.5962 119.8395 57.8550 38.9484 173.8133 26 P 3.8329 0.0000 0.0000 63.2804 31.9710 175.8335 27 M 4.5099 8.4945 116.0950 55.8057 32.9534 175.4020 28 L 4.6125 7.8768 121.5055 53.9508 42.1398 175.7811 29 L 4.8736 9.3928 127.9100 54.2788 42.5633 176.6877 30 V 4.5080 7.8090 117.5231 61.3863 33.9481 174.4339 31 D 4.6707 8.6805 126.9597 55.9629 42.2021 176.9550 32 R 4.4435 7.0664 115.9147 55.0730 33.7916 173.6825 33 I 4.5618 8.5957 126.8702 59.9804 38.6353 176.3721 34 T 4.2221 8.6677 118.6003 63.5501 70.0648 175.1038 35 E 5.3811 8.1671 118.0032 55.5408 32.9208 174.2774 36 L 5.1021 8.4043 121.5138 54.7848 44.0489 174.7363 37 Q 4.7241 9.0607 121.4187 53.6866 31.3915 175.1482 38 A 4.0689 8.7691 126.8698 54.1654 18.7098 177.7284 39 N 4.7143 9.3964 118.8451 53.9277 37.3848 174.0104 40 Q 4.6133 7.7868 113.9175 56.5121 31.3590 174.9096 41 K 5.1325 8.7382 119.3335 54.9439 36.4406 174.2520 42 I 5.1136 9.1296 125.6524 59.4047 42.1081 173.6599 43 V 4.9149 9.2808 128.3608 61.2060 34.3427 174.2168 44 A 5.1231 9.3162 128.7034 51.2807 23.4872 173.7012 45 Y 5.0390 8.7616 115.7344 55.8155 41.9634 173.8767 46 K 4.8855 8.6982 121.7882 54.5454 35.3111 175.0062 47 N 4.8347 9.5878 125.6803 53.3694 39.6159 174.4409 48 I 4.5652 8.7856 124.3662 60.0265 39.2412 174.7564 49 T 4.8812 9.4208 121.2274 60.0946 70.2507 173.6484 50 F 3.9639 9.0051 127.7794 61.1629 39.8286 176.2471 51 N 4.7812 8.1243 119.8357 53.5936 38.0410 174.1242 52 E 4.8648 7.8554 116.0328 53.8665 33.4957 177.1646 53 D 4.3123 8.7290 121.3119 57.4049 41.3258 178.7294 54 V 3.4078 7.7164 112.6117 64.5898 31.1693 178.0834 55 F 4.4658 7.4311 115.7835 59.6988 38.8009 177.0338 56 N 4.6119 8.0631 115.9098 55.1953 38.7028 175.6335 57 G 4.1047 8.1983 106.9149 45.4176 0.0000 172.0625 58 H 3.9823 7.6702 118.9109 53.8862 30.1031 171.3827 59 F 5.2923 8.9800 121.2517 52.8571 42.7306 173.2245 60 P 4.4094 0.0000 0.0000 64.6595 31.3355 177.1831 61 N 4.5344 9.3348 118.4029 53.7872 37.2561 174.8315 62 K 4.5716 8.1100 119.3879 53.3435 32.3582 171.0044 63 P 5.0464 0.0000 0.0000 62.7450 32.1139 176.6410 64 I 4.9010 9.0175 125.8250 59.0155 40.4084 175.2570 65 F 4.0597 9.7778 131.1888 57.7205 39.9382 173.4243 66 P 3.9120 0.0000 0.0000 62.1334 32.1212 177.4264 67 G 2.9691 8.4030 109.4240 47.9869 0.0000 176.2734 68 V 3.7662 7.5364 113.8232 63.7883 31.5499 178.0009 69 L 4.2115 7.5023 118.0464 56.4608 41.5736 179.2340 70 I 4.1403 7.6769 119.9889 64.4874 37.1641 178.1856 71 V 3.7215 7.9514 118.8701 65.9543 31.2603 177.4965 72 E 4.2108 8.3522 119.1432 59.5348 29.5329 179.1607 73 G 3.3733 8.0979 106.8849 47.2802 0.0000 175.5039 74 M 3.7048 7.8356 120.7106 58.0032 31.9330 178.7048 75 A 3.8532 8.0593 120.9587 55.2976 18.5422 179.7714 76 Q 3.7916 8.1186 116.7480 58.9554 28.6567 179.1950 77 S 4.1710 7.9465 116.4884 61.5244 62.8820 176.9384 78 G 3.7060 8.1093 108.5993 47.7645 0.0000 176.0120 79 G 3.6652 8.2361 108.0557 47.1167 0.0000 175.7936 80 F 3.8607 8.2103 123.0990 60.9136 39.4549 176.9682 81 L 3.9257 8.0258 119.8342 58.0155 41.9373 178.7083 82 A 2.0000 7.7928 120.8128 54.3567 18.0531 179.4168 83 F 3.8791 7.8522 119.1477 61.6858 39.5546 177.5568 84 T 4.3184 7.5154 110.2319 64.2888 68.2064 176.6280 85 S 4.1614 7.5305 117.4878 61.2634 62.8835 176.2539 86 L 3.7578 7.3529 120.9509 56.6409 41.4712 178.0616 87 W 4.4238 7.6781 115.7867 55.4550 30.5074 177.9660 88 G 3.8718 7.8182 108.8522 44.8216 0.0000 173.1044 89 F 4.4789 8.7645 120.4139 57.4538 37.9637 174.4301 90 D 4.6900 8.0086 124.8283 50.1141 41.8406 173.7778 91 P 4.3284 0.0000 0.0000 64.4979 31.2030 177.7963 92 E 3.9397 8.0235 116.1996 59.2265 29.8032 178.9338 93 I 3.6771 7.5754 118.4579 64.0616 37.0679 178.1310 94 A 3.5434 7.9246 121.9412 54.7460 17.8182 179.6648 95 K 3.6322 7.7018 115.7816 59.4165 32.6718 177.7023 96 T 4.3718 7.4212 106.8199 61.0652 69.0379 173.6033 97 K 4.9971 7.7738 121.9923 55.5578 33.8915 175.5890 98 I 4.5499 8.8157 116.1251 59.0108 41.5768 173.9718 99 V 4.8736 7.8734 120.8786 61.2495 34.2458 173.9028 100 Y 4.8885 8.9494 125.0603 55.9351 40.8534 175.2862 101 F 4.4657 9.1457 122.4756 58.4398 39.3983 174.1665 102 M 4.8009 9.6410 122.2003 56.7640 33.9069 176.2006 103 T 4.9067 7.8972 106.5751 60.2375 73.0620 172.4470 104 I 5.2044 8.1858 121.9834 60.1262 41.0249 174.2944 105 D 4.7451 9.3221 125.6050 52.4292 46.0241 174.9985 106 K 3.7741 8.5239 115.9648 57.5600 29.8633 175.6248 107 V 4.8436 7.5468 109.8735 59.7894 33.1092 176.2095 108 K 4.4270 8.0426 124.6782 54.6330 35.7857 174.3765 109 F 5.2223 8.7657 125.4771 56.4743 40.0493 175.1578 110 R 4.5811 9.5900 122.9678 57.2294 31.9086 177.1447 111 I 4.6736 7.6436 117.5715 58.2690 40.6579 173.2584 112 P 4.4726 0.0000 0.0000 63.2173 32.0824 175.5660 113 V 4.6697 8.5554 122.6346 61.8362 33.4989 174.5249 114 T 5.0805 8.7529 116.6331 58.7845 72.6681 171.5332 115 P 4.4078 0.0000 0.0000 64.8181 31.6401 177.0109 116 G 4.0013 9.1845 111.5145 45.0431 0.0000 173.4410 117 D 4.5094 7.9178 120.3216 54.0563 42.3529 175.8423 118 R 4.5634 8.3913 123.3310 54.7657 30.7457 175.3960 119 L 4.2747 8.6794 130.7514 54.1610 42.9932 174.7393 120 E 4.7564 9.1533 129.2863 55.0474 31.3606 174.0842 121 Y 5.1779 9.0625 125.7089 57.0407 40.2676 174.3284 122 H 5.2311 9.7052 122.2091 54.2689 31.4267 172.7352 123 L 5.3459 9.0513 124.0824 52.8426 44.8305 175.7596 124 E 5.2268 9.1608 122.0015 54.3441 33.3388 175.3961 125 V 4.1418 8.7326 124.2130 63.1798 31.4406 175.7398 126 L 4.4414 9.0083 128.5110 56.2888 43.1053 177.2401 127 K 4.3035 7.4842 115.9819 55.8940 35.2453 173.4349 128 H 4.8859 8.3966 121.6018 53.8029 31.8415 173.1276 129 K 4.0636 8.5773 122.3618 55.7678 35.3122 177.1929 130 G 3.7862 8.2730 118.2633 47.3496 0.0000 175.5225 131 M 4.3734 8.8990 127.8191 56.3458 32.5611 175.0158 132 I 4.7538 7.7508 121.1131 59.9733 38.6899 174.7876 133 W 4.7749 9.3851 128.1318 54.7521 32.1552 174.5579 134 Q 5.0331 9.4216 127.1688 54.7117 30.2270 174.5549 135 V 5.0382 9.0662 120.4704 59.7030 35.4743 175.2161 136 G 4.4119 9.4520 109.4553 44.3338 0.0000 173.0901 137 G 4.1524 7.4635 107.0089 46.1969 0.0000 171.4026 138 T 5.2649 8.0245 110.4751 60.0224 73.0855 172.9603 139 A 5.4462 9.0569 124.0239 50.4568 21.9596 175.6975 140 Q 5.6254 9.4174 119.9226 53.0864 33.4983 174.5363 141 V 4.5739 8.0484 121.5835 61.3358 34.5419 174.9443 142 D 4.0607 9.5842 128.3067 55.4511 39.3228 173.9566 143 G 3.9154 8.1123 103.1805 45.8116 0.0000 173.2220 144 K 4.5018 7.5712 119.3580 54.2550 34.1554 175.7787 145 V 4.3429 8.2194 122.1730 62.6838 31.8093 175.8896 146 V 4.3538 8.9207 121.2141 62.6433 33.4874 175.8925 147 A 5.1916 7.7885 119.9823 50.7466 22.6881 174.9975 148 E 5.2215 8.8875 119.2641 54.7842 33.6324 175.0702 149 A 4.7847 8.6766 122.7872 50.8512 23.4772 174.6863 150 E 5.2582 8.9505 122.6080 54.3489 32.5502 174.7681 151 L 5.1852 9.1818 125.7138 54.4936 44.7755 174.1001 152 K 5.2000 9.1362 121.5062 54.7424 34.9431 174.6774 153 A 5.2164 9.2954 128.6520 50.2731 22.9287 174.0259 154 M 5.1714 9.3602 120.2505 53.8527 34.9461 174.7483 155 I 4.8249 8.5674 127.2099 60.7622 38.6029 175.3171 156 A 4.8562 9.0016 127.5073 49.8834 22.9102 174.9619 157 E 4.3374 8.9777 123.0233 56.1415 30.3875 176.5570 158 R 4.1988 9.1866 128.9664 56.4130 30.8520 176.2010 159 E 4.2530 8.5373 123.0788 56.6444 29.7713 174.9628 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 9 Q 8.34 4.25 0.00 1.84 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.14 2.01 0.00 10 S 8.01 4.52 0.00 3.91 3.71 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 11 Q 8.44 4.90 0.00 1.87 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.46 0.00 0.00 0.00 0.00 0.00 2.24 2.18 0.00 12 F 8.75 4.82 0.00 2.76 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 F 9.16 4.84 0.00 3.09 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 14 I 8.68 3.67 2.02 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 1.66 1.25 0.96 0.00 0.00 15 E 8.18 4.04 0.00 1.89 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.47 0.00 16 H 8.51 4.91 0.00 3.74 3.92 0.00 5.82 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 17 I 7.97 3.98 2.02 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 1.26 0.58 0.96 0.00 0.00 18 L 7.91 4.00 0.00 1.84 1.76 0.94 0.86 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 Q 8.04 4.16 0.00 2.33 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.63 0.00 20 I 7.17 3.38 1.58 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.15 -0.03 0.00 0.00 21 L 7.83 4.19 0.00 1.75 1.65 0.98 1.04 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 22 P 0.00 4.30 0.00 2.00 2.21 0.00 3.73 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.88 0.00 23 H 7.99 4.17 0.00 3.10 3.43 0.00 5.84 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 R 8.07 4.74 0.00 1.78 1.83 0.00 3.32 0.00 0.00 3.28 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.53 0.00 25 Y 8.60 4.28 0.00 2.95 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 26 P 0.00 3.83 0.00 1.69 0.81 0.00 3.59 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 27 M 8.49 4.51 0.00 1.94 2.02 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.46 0.00 28 L 7.88 4.61 0.00 1.61 1.64 1.04 0.96 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 29 L 9.39 4.87 0.00 1.62 1.78 0.99 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 30 V 7.81 4.51 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 0.75 0.00 0.00 0.84 0.00 0.00 31 D 8.68 4.67 0.00 2.38 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 32 R 7.07 4.44 0.00 1.41 0.79 0.00 3.26 0.00 0.00 3.18 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.31 0.00 33 I 8.60 4.56 1.76 0.00 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.17 0.96 0.00 0.00 34 T 8.67 4.22 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 1.34 0.00 0.00 35 E 8.17 5.38 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.18 0.00 36 L 8.40 5.10 0.00 1.86 1.76 1.17 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 37 Q 9.06 4.72 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.93 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 38 A 8.77 4.07 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 N 9.40 4.71 0.00 2.94 3.04 0.00 0.00 6.82 7.23 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 40 Q 7.79 4.61 0.00 2.23 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.74 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 41 K 8.74 5.13 0.00 1.83 1.63 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.43 7.81 42 I 9.13 5.11 1.94 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.80 1.03 0.00 0.00 43 V 9.28 4.91 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 0.72 0.00 0.00 0.93 0.00 0.00 44 A 9.32 5.12 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 45 Y 8.76 5.04 0.00 2.93 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 46 K 8.70 4.89 0.00 2.12 1.60 0.00 1.90 0.00 0.00 1.44 0.00 0.00 2.90 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.35 1.41 7.81 47 N 9.59 4.83 0.00 2.80 2.78 0.00 0.00 6.94 7.08 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 48 I 8.79 4.57 2.01 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.71 1.06 0.00 0.00 49 T 9.42 4.88 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 1.35 0.00 0.00 50 F 9.01 3.96 0.00 2.89 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 51 N 8.12 4.78 0.00 2.82 2.87 0.00 0.00 6.75 7.65 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 52 E 7.86 4.86 0.00 2.22 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.55 0.00 53 D 8.73 4.31 0.00 2.86 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 54 V 7.72 3.41 1.56 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 0.41 0.00 0.00 0.38 0.00 0.00 55 F 7.43 4.47 0.00 2.83 2.82 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 56 N 8.06 4.61 0.00 2.86 2.90 0.00 0.00 6.69 7.67 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 57 G 8.20 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 58 H 7.67 3.98 0.00 2.72 2.73 0.00 5.61 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 59 F 8.98 5.29 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 60 P 0.00 4.41 0.00 2.14 2.11 0.00 4.28 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.10 0.00 61 N 9.33 4.53 0.00 2.94 3.03 0.00 0.00 6.78 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 62 K 8.11 4.57 0.00 1.79 1.79 0.00 1.67 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.44 7.81 63 P 0.00 5.05 0.00 1.67 1.96 0.00 3.83 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.15 0.00 64 I 9.02 4.90 2.05 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.84 1.05 0.00 0.00 65 F 9.78 4.06 0.00 3.18 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 66 P 0.00 3.91 0.00 1.67 1.38 0.00 2.26 0.00 0.00 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.20 0.00 67 G 8.40 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 0.00 0.00 0.00 68 V 7.54 3.77 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 0.81 0.00 0.00 0.76 0.00 0.00 69 L 7.50 4.21 0.00 1.11 1.46 0.35 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 70 I 7.68 4.14 2.40 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.13 1.24 0.00 0.00 71 V 7.95 3.72 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 1.18 0.00 0.00 1.14 0.00 0.00 72 E 8.35 4.21 0.00 2.33 2.17 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 2.33 2.39 0.00 73 G 8.10 3.37 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 M 7.84 3.70 0.00 2.11 2.32 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.01 2.78 0.00 75 A 8.06 3.85 1.11 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 0.00 0.00 76 Q 8.12 3.79 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.75 0.00 0.00 0.00 0.00 0.00 1.82 2.28 0.00 77 S 7.95 4.17 0.00 3.95 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 78 G 8.11 3.71 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 0.00 0.00 0.00 79 G 8.24 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 0.00 0.00 0.00 80 F 8.21 3.86 0.00 3.13 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 81 L 8.03 3.93 0.00 1.85 1.85 1.04 1.39 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 82 A 7.79 2.00 0.30 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 83 F 7.85 3.88 0.00 3.10 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 84 T 7.52 4.32 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 0.71 0.00 0.00 85 S 7.53 4.16 0.00 3.83 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 L 7.35 3.76 0.00 1.01 0.13 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 87 W 7.68 4.42 0.00 2.61 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 88 G 7.82 3.87 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 0.00 0.00 0.00 89 F 8.76 4.48 0.00 3.16 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 D 8.01 4.69 0.00 2.76 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 91 P 0.00 4.33 0.00 2.08 1.90 0.00 3.82 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.42 0.00 92 E 8.02 3.94 0.00 2.03 1.95 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 2.28 2.31 0.00 93 I 7.58 3.68 1.85 0.00 0.00 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 1.20 1.01 -0.17 0.00 0.00 94 A 7.92 3.54 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 K 7.70 3.63 0.00 1.79 1.93 0.00 1.48 0.00 0.00 1.87 0.00 0.00 3.10 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.30 7.81 96 T 7.42 4.37 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 97 K 7.77 5.00 0.00 1.59 1.76 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.67 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.44 1.57 7.81 98 I 8.82 4.55 1.49 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 1.22 0.70 0.75 0.00 0.00 99 V 7.87 4.87 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 0.80 0.00 0.00 0.88 0.00 0.00 100 Y 8.95 4.89 0.00 2.99 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 0.00 101 F 9.15 4.47 0.00 3.04 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 M 9.64 4.80 0.00 1.89 2.30 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 2.64 2.51 0.00 103 T 7.90 4.91 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 1.26 0.00 0.00 104 I 8.19 5.20 1.79 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.47 0.90 0.00 0.00 105 D 9.32 4.75 0.00 2.58 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 K 8.52 3.77 0.00 1.83 1.84 0.00 1.62 0.00 0.00 1.71 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.49 7.81 107 V 7.55 4.84 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 0.76 0.00 0.00 0.45 0.00 0.00 108 K 8.04 4.43 0.00 1.70 1.50 0.00 1.68 0.00 0.00 1.81 0.00 0.00 2.83 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.43 7.81 109 F 8.77 5.22 0.00 3.02 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 0.00 110 R 9.59 4.58 0.00 1.83 2.00 0.00 3.26 0.00 0.00 3.25 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 111 I 7.64 4.67 1.93 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 1.51 0.65 0.96 0.00 0.00 112 P 0.00 4.47 0.00 2.15 2.14 0.00 3.81 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.03 0.00 113 V 8.56 4.67 2.32 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 1.00 0.00 0.00 1.06 0.00 0.00 114 T 8.75 5.08 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 1.34 0.00 0.00 115 P 0.00 4.41 0.00 1.99 2.02 0.00 3.50 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.23 0.00 116 G 9.18 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.92 4.51 0.00 2.76 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 0.00 118 R 8.39 4.56 0.00 1.69 1.73 0.00 2.88 0.00 0.00 2.84 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.32 0.00 119 L 8.68 4.27 0.00 1.63 1.46 0.94 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 120 E 9.15 4.76 0.00 1.96 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 2.21 2.38 0.00 121 Y 9.06 5.18 0.00 3.01 2.82 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 0.00 122 H 9.71 5.23 0.00 3.04 3.27 0.00 5.56 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 L 9.05 5.35 0.00 1.58 1.60 0.99 1.11 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 0.00 124 E 9.16 5.23 0.00 1.90 1.85 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 2.26 2.27 0.00 125 V 8.73 4.14 2.31 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 0.78 0.00 0.00 1.33 0.00 0.00 126 L 9.01 4.44 0.00 1.62 1.71 0.95 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 127 K 7.48 4.30 0.00 1.73 1.53 0.00 1.62 0.00 0.00 1.81 0.00 0.00 2.77 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.14 1.19 7.81 128 H 8.40 4.89 0.00 1.40 1.92 0.00 5.76 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 K 8.58 4.06 0.00 1.57 1.54 0.00 1.71 0.00 0.00 1.58 0.00 0.00 2.83 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.22 1.24 7.81 130 G 8.27 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 M 8.90 4.37 0.00 2.46 2.22 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.59 0.00 132 I 7.75 4.75 1.86 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.68 0.94 0.00 0.00 133 W 9.39 4.77 0.00 3.22 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 0.00 134 Q 9.42 5.03 0.00 2.09 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.72 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 135 V 9.07 5.04 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 0.85 0.00 0.00 0.99 0.00 0.00 136 G 9.45 4.41 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 0.00 137 G 7.46 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 0.00 0.00 0.00 0.00 138 T 8.02 5.26 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 139 A 9.06 5.45 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 0.00 140 Q 9.42 5.63 0.00 1.94 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.70 0.00 0.00 0.00 0.00 0.00 2.29 2.10 0.00 141 V 8.05 4.57 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 0.96 0.00 0.00 0.92 0.00 0.00 142 D 9.58 4.06 0.00 2.77 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 0.00 143 G 8.11 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 0.00 144 K 7.57 4.50 0.00 2.03 1.72 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.34 7.81 145 V 8.22 4.34 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 0.86 0.00 0.00 0.93 0.00 0.00 146 V 8.92 4.35 2.38 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 0.76 0.00 0.00 1.07 0.00 0.00 147 A 7.79 5.19 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 E 8.89 5.22 0.00 1.82 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.21 0.00 149 A 8.68 4.78 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 0.00 150 E 8.95 5.26 0.00 2.06 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 2.23 2.25 0.00 151 L 9.18 5.19 0.00 2.24 1.92 0.83 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 152 K 9.14 5.20 0.00 1.91 1.75 0.00 1.60 0.00 0.00 1.69 0.00 0.00 2.89 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.39 1.54 7.81 153 A 9.30 5.22 1.04 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 0.00 154 M 9.36 5.17 0.00 2.20 2.00 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 2.58 2.62 0.00 155 I 8.57 4.82 2.05 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 1.23 0.70 1.22 0.00 0.00 156 A 9.00 4.86 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 0.00 0.00 0.00 0.00 0.00 0.00 157 E 8.98 4.34 0.00 2.00 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 2.29 2.37 0.00 158 R 9.19 4.20 0.00 1.95 1.80 0.00 3.22 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.56 0.00 159 E 8.54 4.25 0.00 2.06 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 2.21 2.31 0.00