NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 Q 4.1954 8.3444 119.6732 55.9720 30.0666 173.4312 10 S 4.5561 8.1643 110.3167 58.2361 64.8896 172.7673 11 Q 4.7142 8.4877 119.7369 54.0385 30.6280 174.8305 12 F 4.6730 9.1392 122.6415 55.6586 43.0176 174.8752 13 F 4.7427 9.0701 120.9532 55.7602 41.5892 176.3993 14 I 3.6456 8.7512 118.9841 64.8094 37.1383 177.1490 15 E 4.0036 8.2483 117.5933 59.9978 29.7901 178.6929 16 H 4.8298 8.2479 115.5310 59.0990 28.9460 177.7606 17 I 3.9032 8.1019 121.6931 64.4622 36.6970 178.4624 18 L 4.1046 7.9649 118.6494 57.2455 41.5724 178.7541 19 Q 4.1814 8.0639 117.0204 56.8424 28.6806 177.5012 20 I 3.4646 7.4023 119.1976 62.4082 38.4235 176.1074 21 L 4.2145 7.4541 119.0289 53.1024 42.3753 175.4475 22 P 4.3720 0.0000 0.0000 65.0214 31.9820 176.7050 23 H 4.2184 8.1578 116.1818 56.1935 29.1640 174.3265 24 R 4.7753 8.1572 120.7260 54.0026 34.2282 173.7318 25 Y 4.3779 8.5751 119.8622 57.6780 39.1129 173.8216 26 P 3.9260 0.0000 0.0000 63.2713 31.9387 175.7392 27 M 4.5227 8.4811 115.5486 55.9172 33.0428 175.8691 28 L 4.5809 7.9026 121.6657 53.9489 41.7185 176.4604 29 L 4.8526 8.7622 130.9143 53.8157 42.2292 177.6696 30 V 4.5145 7.6006 117.1484 61.7494 34.3910 173.5411 31 D 4.7619 8.3072 126.5354 55.2834 42.7008 176.7604 32 R 4.3873 7.1018 115.7029 55.2185 33.7496 173.4393 33 I 4.6905 8.6550 127.2385 60.0698 38.7352 176.0670 34 T 4.4301 8.5849 117.2751 61.6402 69.9760 174.5912 35 E 4.6457 7.6567 121.5652 55.5867 33.0223 173.4908 36 L 5.1699 8.7139 129.1449 53.4582 45.4564 175.6486 37 Q 4.4662 9.1718 126.4143 53.8191 31.4945 173.4509 38 A 4.0208 8.6345 127.6243 53.7113 18.6601 177.6476 39 N 4.6088 9.1142 118.8716 53.8778 37.2662 174.0352 40 Q 4.7541 8.0710 115.2991 56.1441 31.4847 176.5639 41 K 5.1401 7.5775 115.2085 56.2351 37.4895 173.8485 42 I 5.0337 8.4047 118.2568 60.0277 42.0228 173.2723 43 V 4.9469 9.3922 128.7090 61.1830 33.6391 174.1594 44 A 5.2529 8.9596 128.4027 51.2427 23.5747 173.6475 45 Y 4.7170 8.5001 116.4378 55.8337 42.5724 173.9758 46 K 4.8677 8.7236 120.1264 54.8691 35.5200 175.1344 47 N 4.9514 9.0023 125.0517 53.4138 39.6454 174.5106 48 I 4.6294 8.6435 123.3495 60.0156 39.3174 174.7783 49 T 4.9931 9.6116 121.4103 60.0361 70.1995 173.7494 50 F 4.0291 8.9846 127.0142 60.8766 39.9520 175.8586 51 N 4.7974 8.1532 120.0617 53.6532 38.2274 174.2198 52 E 4.8334 7.8304 116.4788 54.1668 33.5152 176.8777 53 D 4.3027 8.9167 122.4525 57.5383 41.6499 178.5990 54 V 3.3509 7.7633 111.8423 64.6598 31.4282 177.9010 55 F 4.6026 7.2781 115.3094 59.1133 38.7716 176.2032 56 N 4.5308 8.4642 119.1141 55.4269 38.4550 176.0983 57 G 4.2094 7.8236 104.4294 45.1063 0.0000 173.2644 58 H 3.7936 7.7492 118.6274 54.1075 30.4116 171.8009 59 F 5.2477 9.0059 121.7853 53.9262 43.0304 173.2366 60 P 4.5594 0.0000 0.0000 64.6984 31.2248 175.7672 61 N 4.2491 8.8294 117.8483 53.9503 36.5723 174.5005 62 K 4.6565 7.4734 114.8407 55.5320 34.7926 170.6654 63 P 5.0105 0.0000 0.0000 62.9528 32.1967 177.0477 64 I 4.8954 8.6110 126.0284 58.8966 39.6895 175.7175 65 F 4.3263 9.6677 130.7717 57.6026 40.2166 173.2527 66 P 3.9946 0.0000 0.0000 62.0663 32.0192 177.3117 67 G 3.0343 8.5705 110.2205 48.0009 0.0000 176.1074 68 V 3.7698 7.5765 114.2034 63.9237 31.4777 178.3214 69 L 4.1071 7.7138 118.6366 57.1205 41.5650 179.3296 70 I 4.1608 7.8768 120.2572 64.5835 37.2345 178.5257 71 V 3.7807 8.0516 118.6427 66.0516 31.4200 177.5173 72 E 4.3215 8.3013 118.9723 59.2185 29.4836 179.0637 73 G 3.7690 8.2234 107.2655 47.3314 0.0000 175.6862 74 M 3.7608 7.7651 120.3082 57.8346 31.8639 178.6902 75 A 3.8450 7.9291 120.9408 55.0778 18.4355 179.7388 76 Q 3.7389 7.9756 116.6350 58.9312 28.6865 179.1295 77 S 4.1154 7.8671 116.4042 61.5391 62.9015 176.9079 78 G 3.6756 8.2714 108.7807 47.7575 0.0000 175.9166 79 G 3.5285 8.5472 108.6458 47.4422 0.0000 175.5888 80 F 4.0691 8.5326 123.3291 60.8899 39.4093 176.9680 81 L 3.8115 7.9856 119.8670 57.8757 41.7770 178.9298 82 A 2.0000 7.4344 120.4942 54.5972 18.1007 179.0646 83 F 3.8905 7.6599 116.3406 61.4811 39.0430 178.3320 84 T 4.4181 7.4966 109.9976 64.4187 68.2142 176.5373 85 S 4.1679 7.3679 117.1737 60.9049 62.8678 176.2378 86 L 3.8700 7.5620 121.6975 56.3303 41.4595 179.0665 87 W 4.7801 7.7844 117.1666 56.0970 30.5424 177.8872 88 G 4.3362 7.9728 108.7919 47.0084 0.0000 173.6210 89 F 4.3771 8.7549 119.6310 56.9164 38.0279 174.2989 90 D 4.7117 7.6904 124.6198 50.8035 41.4128 174.4747 91 P 4.5587 0.0000 0.0000 64.1491 31.9695 178.7980 92 E 4.0392 8.5560 118.6332 59.4474 29.5544 179.1661 93 I 3.6074 7.4245 117.9247 63.7938 37.1479 178.2667 94 A 4.0735 7.6841 121.1114 54.6005 17.9106 179.4571 95 K 4.0246 7.4678 115.2624 58.5961 32.3591 177.8877 96 T 4.4930 7.5821 108.0124 60.9055 69.0019 173.5341 97 K 5.8015 7.9583 120.0499 54.1136 35.4291 175.2441 98 I 4.7426 8.2060 114.4791 59.2437 41.8109 174.1545 99 V 4.5187 8.4255 122.4058 61.3970 32.8165 174.4284 100 A 4.7121 8.6857 131.3150 50.0978 20.8249 175.5310 101 F 4.2305 8.9573 126.0135 58.9338 39.7577 173.8984 102 M 4.7670 9.2705 125.3149 56.8161 33.7581 176.1100 103 T 4.9094 7.8613 106.4614 60.4826 73.0429 172.2769 104 I 5.1601 8.1055 121.6600 60.3012 41.4052 173.8474 105 D 4.5260 9.7733 124.9185 53.0835 45.4008 174.4442 106 K 3.9585 8.5101 118.1087 57.2525 29.8674 174.9231 107 V 4.9612 7.5289 116.2636 59.9097 33.2757 175.6077 108 K 4.4617 8.0211 121.7842 54.5874 36.7425 175.0046 109 F 4.9856 8.6937 122.2886 56.4739 40.1316 175.3606 110 R 4.3993 9.1487 123.6687 57.9141 30.8327 177.4354 111 I 4.6435 7.6041 117.4091 58.2870 40.3501 173.4746 112 P 4.5153 0.0000 0.0000 63.0150 32.0881 175.8426 113 V 4.5405 8.5626 123.1272 62.4190 33.4854 174.5631 114 T 5.1174 8.8192 115.9703 59.2007 73.0022 171.2503 115 P 4.3606 0.0000 0.0000 64.5728 31.5644 177.0132 116 G 4.0287 9.3888 111.6470 45.1227 0.0000 173.4698 117 D 4.6610 7.9187 119.7770 53.6822 42.8003 175.5838 118 R 4.5151 8.3446 121.9706 54.8203 32.0453 174.9110 119 L 4.5794 8.4819 130.5753 53.8486 42.7858 174.4242 120 E 4.6894 9.4340 129.4298 55.2885 31.4603 174.2887 121 Y 5.1995 9.6922 125.0507 57.0963 40.3286 174.4486 122 H 5.0488 9.5080 120.8210 54.2118 32.0339 172.4524 123 L 5.4666 8.7248 122.9697 52.7076 45.8029 175.7714 124 E 5.1667 8.7344 118.3261 54.3890 33.4750 174.8244 125 V 4.2084 8.9896 122.7138 63.4469 31.4917 175.4002 126 L 4.5658 9.1356 128.2942 56.3926 43.1956 177.2123 127 K 4.6308 7.6743 115.5636 55.4990 36.8087 174.7675 128 H 4.6224 8.2214 121.9444 54.7327 33.2436 173.3779 129 K 3.9144 8.8058 125.2685 56.3828 35.5806 176.7772 130 G 3.9128 7.9216 117.0418 47.2506 0.0000 175.2368 131 M 4.3598 8.6695 126.6642 56.0793 32.6063 175.2406 132 I 4.6721 7.5332 121.1837 60.5048 38.7946 175.0961 133 W 5.4051 9.4699 126.1655 54.9296 33.6369 173.7377 134 Q 5.1202 9.4447 125.7114 54.5007 31.2835 174.6993 135 V 5.3721 8.0951 118.3792 58.9196 36.7581 174.5794 136 G 4.3172 7.7706 106.8208 45.0953 0.0000 173.0074 137 G 4.4263 8.1556 111.5188 46.1058 0.0000 171.8146 138 T 5.3166 8.4391 112.7867 59.9458 73.3687 173.2271 139 A 5.1791 9.1312 123.3145 50.4360 21.5401 175.2762 140 Q 5.1309 9.7222 122.3743 54.3118 32.7461 175.2928 141 V 4.5874 7.7885 120.9539 60.1632 34.1495 174.8223 142 D 4.2319 9.9829 128.9340 55.2839 39.7210 172.9336 143 G 4.3085 8.5398 108.4675 45.6040 0.0000 175.0126 144 K 4.1541 7.6058 118.2938 55.6657 32.7994 176.0147 145 V 4.2187 8.1449 121.1919 62.2879 32.1806 176.0816 146 V 4.2547 9.0584 127.2130 63.4064 33.2265 175.4318 147 A 5.1556 7.7255 120.8300 51.2156 22.7591 174.7302 148 E 5.1340 8.6130 116.0212 55.2996 33.6000 174.1729 149 A 4.8939 8.2718 121.0281 52.5562 23.7867 174.8479 150 E 5.3188 8.7849 117.7251 54.9576 34.1318 175.1157 151 L 5.0995 8.7702 122.2637 54.6202 44.7497 174.0791 152 K 5.2835 8.9241 120.3536 54.8176 35.4126 174.6657 153 A 5.1773 9.1577 127.4211 50.6522 22.9974 174.8439 154 M 5.1051 8.9960 118.0701 53.8385 34.5921 175.1871 155 I 4.7571 8.4500 121.8727 59.3722 36.6614 175.7027 156 A 4.5099 7.8310 128.3141 51.1339 21.7514 175.7773 157 E 5.3790 8.4842 114.3464 53.8093 32.2796 175.9633 158 R 4.2073 8.9552 118.0919 61.4249 30.7316 176.8063 159 E 4.1018 7.3606 121.2935 55.8525 30.8855 175.8911 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 4.20 0.00 0.99 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.82 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 10 S 8.16 4.56 0.00 3.90 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 11 Q 8.49 4.71 0.00 1.77 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.47 0.00 0.00 0.00 0.00 0.00 2.17 2.29 0.00 12 F 9.14 4.67 0.00 2.63 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 F 9.07 4.74 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 14 I 8.75 3.65 1.92 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 1.65 1.64 0.96 0.00 0.00 15 E 8.25 4.00 0.00 1.93 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 2.30 2.48 0.00 16 H 8.25 4.83 0.00 3.73 4.03 0.00 5.82 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 I 8.10 3.90 2.01 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.91 0.87 0.00 0.00 18 L 7.96 4.10 0.00 1.84 1.75 0.99 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 19 Q 8.06 4.18 0.00 2.15 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.62 0.00 0.00 0.00 0.00 0.00 2.38 2.77 0.00 20 I 7.40 3.46 1.85 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.50 0.10 0.00 0.00 21 L 7.45 4.21 0.00 1.75 1.70 0.90 1.00 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 22 P 0.00 4.37 0.00 2.13 2.34 0.00 3.90 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 2.05 0.00 23 H 8.16 4.22 0.00 3.12 3.47 0.00 5.84 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 24 R 8.16 4.78 0.00 1.82 1.86 0.00 3.33 0.00 0.00 3.30 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.54 0.00 25 Y 8.58 4.38 0.00 2.96 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 26 P 0.00 3.93 0.00 1.61 0.62 0.00 3.63 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 27 M 8.48 4.52 0.00 1.96 2.04 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.49 0.00 28 L 7.90 4.58 0.00 1.75 1.66 0.98 1.07 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 29 L 8.76 4.85 0.00 1.72 1.84 0.98 1.09 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 30 V 7.60 4.51 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 0.75 0.00 0.00 0.89 0.00 0.00 31 D 8.31 4.76 0.00 2.32 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 32 R 7.10 4.39 0.00 1.50 0.96 0.00 3.28 0.00 0.00 3.27 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.32 0.00 33 I 8.65 4.69 1.91 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 -0.36 0.87 0.00 0.00 34 T 8.58 4.43 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 1.38 0.00 0.00 35 E 7.66 4.65 0.00 2.06 1.83 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 2.29 2.30 0.00 36 L 8.71 5.17 0.00 1.82 1.76 1.06 1.10 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 37 Q 9.17 4.47 0.00 2.17 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.58 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 38 A 8.63 4.02 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 39 N 9.11 4.61 0.00 2.98 3.08 0.00 0.00 6.88 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 40 Q 8.07 4.75 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.55 0.00 0.00 0.00 0.00 0.00 2.48 2.44 0.00 41 K 7.58 5.14 0.00 1.95 1.93 0.00 1.58 0.00 0.00 1.79 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.48 7.81 42 I 8.40 5.03 1.92 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.37 0.98 0.00 0.00 43 V 9.39 4.95 2.12 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 0.86 0.00 0.00 1.07 0.00 0.00 44 A 8.96 5.25 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 8.50 4.72 0.00 2.86 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 8.72 4.87 0.00 2.04 1.58 0.00 1.96 0.00 0.00 1.54 0.00 0.00 2.95 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.35 1.52 7.81 47 N 9.00 4.95 0.00 2.76 2.79 0.00 0.00 6.95 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 48 I 8.64 4.63 2.04 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.99 1.14 0.00 0.00 49 T 9.61 4.99 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 1.39 0.00 0.00 50 F 8.98 4.03 0.00 2.90 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 51 N 8.15 4.80 0.00 2.85 2.88 0.00 0.00 6.76 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 7.83 4.83 0.00 2.14 1.76 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 2.42 2.66 0.00 53 D 8.92 4.30 0.00 2.70 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 54 V 7.76 3.35 1.46 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 0.59 0.00 0.00 0.15 0.00 0.00 55 F 7.28 4.60 0.00 2.89 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 N 8.46 4.53 0.00 2.78 2.88 0.00 0.00 6.65 7.20 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 57 G 7.82 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 0.00 0.00 0.00 0.00 58 H 7.75 3.79 0.00 2.77 2.78 0.00 5.81 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 F 9.01 5.25 0.00 3.19 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 60 P 0.00 4.56 0.00 2.25 2.16 0.00 4.18 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 2.10 2.09 0.00 61 N 8.83 4.25 0.00 2.93 2.97 0.00 0.00 6.84 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 7.47 4.66 0.00 1.90 1.79 0.00 1.58 0.00 0.00 1.74 0.00 0.00 3.14 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.24 1.38 7.81 63 P 0.00 5.01 0.00 1.66 2.16 0.00 3.82 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.11 0.00 64 I 8.61 4.90 2.03 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.19 1.06 0.00 0.00 65 F 9.67 4.33 0.00 3.15 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 66 P 0.00 3.99 0.00 1.67 1.42 0.00 2.20 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.31 0.00 67 G 8.57 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 0.00 0.00 0.00 68 V 7.58 3.77 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 0.92 0.00 0.00 0.76 0.00 0.00 69 L 7.71 4.11 0.00 1.23 1.39 0.30 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 70 I 7.88 4.16 2.42 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.67 1.22 0.00 0.00 71 V 8.05 3.78 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 1.12 0.00 0.00 1.20 0.00 0.00 72 E 8.30 4.32 0.00 2.23 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 2.34 2.41 0.00 73 G 8.22 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 74 M 7.77 3.76 0.00 2.14 2.31 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.97 2.76 0.00 75 A 7.93 3.84 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 7.98 3.74 0.00 2.07 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.76 0.00 0.00 0.00 0.00 0.00 1.98 2.42 0.00 77 S 7.87 4.12 0.00 3.83 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 G 8.27 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 79 G 8.55 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 F 8.53 4.07 0.00 3.15 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 81 L 7.99 3.81 0.00 1.79 1.66 0.88 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 82 A 7.43 2.00 -0.21 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 83 F 7.66 3.89 0.00 3.09 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 84 T 7.50 4.42 4.09 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 0.68 0.00 0.00 85 S 7.37 4.17 0.00 3.70 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 86 L 7.56 3.87 0.00 0.67 0.13 0.84 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 87 W 7.78 4.78 0.00 3.42 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 88 G 7.97 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 0.00 0.00 0.00 0.00 89 F 8.75 4.38 0.00 3.12 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 90 D 7.69 4.71 0.00 2.87 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 91 P 0.00 4.56 0.00 2.01 2.11 0.00 3.71 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.68 0.00 92 E 8.56 4.04 0.00 2.20 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 0.00 2.28 2.45 0.00 93 I 7.42 3.61 1.27 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.19 -0.04 0.00 0.00 94 A 7.68 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 K 7.47 4.02 0.00 1.80 1.83 0.00 1.60 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.41 1.50 7.81 96 T 7.58 4.49 4.18 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 1.14 0.00 0.00 97 K 7.96 5.80 0.00 2.06 1.88 0.00 1.70 0.00 0.00 1.69 0.00 0.00 2.50 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.50 1.38 7.81 98 I 8.21 4.74 1.88 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 1.24 1.25 0.92 0.00 0.00 99 V 8.43 4.52 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 0.71 0.00 0.00 1.13 0.00 0.00 100 A 8.69 4.71 1.26 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 0.00 0.00 0.00 101 F 8.96 4.23 0.00 3.14 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 0.00 102 M 9.27 4.77 0.00 1.98 2.28 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 2.58 2.50 0.00 103 T 7.86 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 1.25 0.00 0.00 104 I 8.11 5.16 1.81 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.30 0.91 0.00 0.00 105 D 9.77 4.53 0.00 2.69 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 0.00 106 K 8.51 3.96 0.00 1.94 1.82 0.00 1.71 0.00 0.00 1.87 0.00 0.00 2.96 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.35 7.81 107 V 7.53 4.96 1.96 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 0.82 0.00 0.00 0.43 0.00 0.00 108 K 8.02 4.46 0.00 1.57 1.61 0.00 1.73 0.00 0.00 1.79 0.00 0.00 2.78 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.36 1.36 7.81 109 F 8.69 4.99 0.00 2.97 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 0.00 110 R 9.15 4.40 0.00 1.98 2.02 0.00 3.11 0.00 0.00 3.40 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 111 I 7.60 4.64 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 0.66 0.95 0.00 0.00 112 P 0.00 4.52 0.00 2.16 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 2.02 0.00 113 V 8.56 4.54 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 0.88 0.00 0.00 1.02 0.00 0.00 114 T 8.82 5.12 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 1.30 0.00 0.00 115 P 0.00 4.36 0.00 1.98 2.09 0.00 3.50 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.08 0.00 116 G 9.39 4.03 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 0.00 0.00 0.00 117 D 7.92 4.66 0.00 2.74 2.54 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 0.00 118 R 8.34 4.52 0.00 1.76 1.67 0.00 2.77 0.00 0.00 2.95 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.39 0.00 119 L 8.48 4.58 0.00 1.58 1.37 0.89 0.48 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 0.00 120 E 9.43 4.69 0.00 1.96 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 0.00 2.10 2.24 0.00 121 Y 9.69 5.20 0.00 3.09 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 0.00 122 H 9.51 5.05 0.00 3.09 3.26 0.00 5.55 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 8.72 5.47 0.00 1.65 1.55 0.99 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 124 E 8.73 5.17 0.00 2.07 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 2.41 2.26 0.00 125 V 8.99 4.21 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 0.85 0.00 0.00 1.21 0.00 0.00 126 L 9.14 4.57 0.00 1.53 1.70 0.94 0.86 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 0.00 127 K 7.67 4.63 0.00 1.58 1.55 0.00 1.61 0.00 0.00 1.69 0.00 0.00 2.74 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.35 7.81 128 H 8.22 4.62 0.00 1.89 2.54 0.00 5.77 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 0.00 129 K 8.81 3.91 0.00 1.63 1.53 0.00 1.68 0.00 0.00 1.37 0.00 0.00 2.72 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.17 1.39 7.81 130 G 7.92 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 0.00 0.00 0.00 131 M 8.67 4.36 0.00 2.28 2.15 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.65 0.00 132 I 7.53 4.67 1.92 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 0.91 0.90 0.00 0.00 133 W 9.47 5.41 0.00 3.08 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 0.00 134 Q 9.44 5.12 0.00 2.05 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.64 0.00 0.00 0.00 0.00 0.00 2.27 2.45 0.00 135 V 8.10 5.37 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 1.18 0.00 0.00 0.96 0.00 0.00 136 G 7.77 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 G 8.16 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 0.00 0.00 0.00 0.00 138 T 8.44 5.32 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 1.24 0.00 0.00 139 A 9.13 5.18 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 0.00 140 Q 9.72 5.13 0.00 1.99 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.70 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 141 V 7.79 4.59 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 1.00 0.00 0.00 0.93 0.00 0.00 142 D 9.98 4.23 0.00 2.76 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 G 8.54 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 0.00 0.00 0.00 0.00 144 K 7.61 4.15 0.00 1.84 1.75 0.00 1.67 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.53 1.43 7.81 145 V 8.14 4.22 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 0.90 0.00 0.00 0.94 0.00 0.00 146 V 9.06 4.25 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 0.77 0.00 0.00 1.04 0.00 0.00 147 A 7.73 5.16 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 E 8.61 5.13 0.00 2.08 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 2.12 2.19 0.00 149 A 8.27 4.89 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 0.00 150 E 8.78 5.32 0.00 2.09 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 2.24 2.26 0.00 151 L 8.77 5.10 0.00 2.33 1.96 1.02 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 152 K 8.92 5.28 0.00 1.90 1.70 0.00 1.61 0.00 0.00 1.66 0.00 0.00 2.87 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.34 1.49 7.81 153 A 9.16 5.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 M 9.00 5.11 0.00 2.09 2.18 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.50 0.00 155 I 8.45 4.76 1.68 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 1.25 0.43 0.00 0.00 156 A 7.83 4.51 1.27 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 0.00 0.00 157 E 8.48 5.38 0.00 1.85 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.10 0.00 158 R 8.96 4.21 0.00 1.78 1.93 0.00 3.20 0.00 0.00 3.27 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 159 E 7.36 4.10 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.34 0.00