NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5478 8.1633 120.5921 55.8097 33.9011 174.0819 2 H 5.2970 9.4375 123.5762 53.5771 32.5860 171.9536 3 A 5.0870 10.0658 124.8354 50.4691 21.2979 175.4962 4 L 4.8033 8.8487 123.2571 54.4598 43.8975 176.6677 5 V 4.8390 8.4549 122.1841 61.2126 35.0364 173.9678 6 Q 4.6036 8.8466 129.9437 56.3022 29.5091 176.0145 7 L 4.9360 8.9293 124.6477 54.2332 44.2297 176.7811 8 R 4.6445 8.0483 117.5584 53.7169 32.6469 175.7765 9 G 3.9215 8.6051 111.5687 45.1411 0.0000 173.1671 10 E 3.9405 8.5838 116.4925 58.5360 30.0159 177.5443 11 V 3.7326 7.5878 119.2522 64.3247 31.6402 175.6570 12 N 4.5337 8.9689 123.5386 53.4053 36.5625 174.2360 13 M 4.2212 7.6010 116.1584 54.3052 32.4503 176.5540 14 H 4.0109 8.8174 118.2819 56.7849 30.4538 176.5161 15 T 3.8406 8.5519 121.9024 66.9157 68.2066 176.5729 16 D 4.3255 8.0790 120.2416 56.3388 39.4935 178.5240 17 I 3.7679 7.6153 121.0586 64.0718 37.2968 177.8441 18 Q 3.8728 8.0286 120.5353 59.2200 28.8608 177.9617 19 D 4.3699 8.3823 120.2369 57.4045 40.7168 178.9431 20 T 3.8380 7.6007 116.2380 66.7302 68.4618 176.6840 21 L 3.9563 7.7267 120.3172 57.8880 41.6129 179.5057 22 E 3.9015 8.0339 118.4504 59.3552 29.1953 179.1208 23 M 4.2172 7.9701 118.1686 57.6167 31.9996 177.1532 24 L 4.5524 7.8302 118.1520 54.6579 42.8521 176.2203 25 N 4.2334 7.7522 112.8512 54.0289 36.8520 173.8663 26 I 4.4905 7.8283 117.2780 59.6955 39.9267 174.6476 27 H 4.7990 8.8733 122.6160 55.7308 30.4704 173.0157 28 H 4.9380 7.4475 115.8412 53.4409 32.7603 172.8925 29 V 3.8102 8.1168 120.8238 64.4347 31.7185 176.3098 30 N 4.4975 9.3757 121.9181 53.7871 37.5186 173.8219 31 H 4.6750 7.9307 116.1789 55.5690 30.2312 173.9988 32 C 5.4306 9.1240 122.1342 58.0816 35.1310 172.4341 33 T 4.9257 8.7587 116.9979 60.5781 71.3270 172.3538 34 L 5.0807 8.4571 125.6902 53.1385 43.2230 176.1497 35 V 4.0479 8.6842 124.6065 58.8569 33.8050 173.9919 36 P 4.4626 0.0000 0.0000 62.6460 32.2867 176.8140 37 E 4.3701 8.8837 122.9669 55.2892 28.2687 176.3566 38 T 4.7735 7.7659 118.9944 60.8056 73.5703 173.8424 39 D 4.3804 8.6639 122.2553 57.7526 40.3309 179.2181 40 A 3.9006 7.8827 120.3499 55.5789 18.4680 179.2415 41 Y 4.1911 7.8427 114.6367 60.9878 37.8933 178.3934 42 R 4.0250 8.7062 120.5943 59.2977 29.9496 178.7975 43 G 3.6303 7.8360 104.5970 47.8655 0.0000 175.4700 44 M 4.2056 7.6368 119.9735 58.5100 32.0525 179.4076 45 V 3.5369 7.7947 111.9008 63.8304 29.9518 178.6029 46 A 3.9609 7.7065 120.8754 54.9131 18.0297 179.5000 47 K 4.1254 7.8158 116.5967 58.4574 32.5163 178.1065 48 V 4.3240 6.9701 115.2849 62.6516 31.7560 176.6490 49 N 4.2030 7.5247 116.3315 57.6484 38.9162 174.8922 50 D 4.4602 7.9460 114.4779 54.9287 41.5305 176.3511 51 F 4.9847 8.7030 117.5205 56.7266 41.3405 174.5206 52 V 5.0998 7.7662 117.9710 59.9166 35.9079 174.0678 53 A 5.2122 9.1679 122.2757 50.2644 21.8040 175.2514 54 F 6.1010 9.1472 116.4259 53.6019 42.4190 174.3109 55 G 4.2087 8.1572 107.3668 44.4835 0.0000 170.8356 56 E 4.7457 8.3143 120.3700 53.5399 30.1132 173.7318 57 P 4.8338 0.0000 0.0000 61.7935 32.9279 176.5657 58 S 4.3708 8.8603 115.1838 57.9355 65.1209 174.9563 59 Q 3.9508 8.6964 124.0941 59.7107 28.7633 178.7298 60 E 4.0612 8.2396 118.6675 59.9562 29.5109 179.3560 61 T 3.8270 7.6389 115.2023 66.7496 68.5910 176.3732 62 L 3.9191 8.2331 122.4160 58.3791 41.8363 178.9333 63 E 4.0473 8.2083 118.5124 59.3079 29.3683 179.4614 64 T 3.8884 7.7484 115.8111 66.6227 68.4983 176.9750 65 V 3.5813 7.9095 120.2285 65.9682 31.5216 178.0813 66 L 3.8587 7.9577 118.5279 57.7649 41.2556 179.3723 67 A 4.2178 7.6865 120.8392 54.5817 18.3490 178.9611 68 T 4.1436 7.8576 110.3860 63.5770 67.8683 175.5013 69 R 4.4538 8.4596 116.5761 55.3442 32.0139 175.6897 70 A 4.2225 7.6963 120.3421 51.9572 19.1215 176.7994 71 E 4.5249 8.2653 118.3289 53.6818 34.2664 173.5296 72 P 4.5110 0.0000 0.0000 61.8603 32.5872 177.3661 73 L 3.8251 8.4108 122.1155 57.7829 42.1411 176.8533 74 E 4.5885 7.8150 116.1674 56.4916 33.7498 175.5473 75 G 4.0451 8.8450 108.4122 45.5116 0.0000 173.1982 76 D 4.3784 8.4772 117.3940 55.1564 41.3607 176.7786 77 A 3.8463 7.7931 121.0560 51.7231 18.3914 176.9509 78 D 4.1980 8.6370 123.7956 54.5517 41.0471 176.8774 79 V 3.6465 7.9980 124.1285 61.5097 30.6619 173.9685 80 D 5.0538 8.1432 126.7040 50.5287 43.7560 175.7531 81 D 4.4625 8.6942 118.1620 57.9542 40.7269 178.8551 82 E 4.0200 8.3329 118.8941 58.9438 29.6184 178.5646 83 W 3.9296 8.7580 128.4661 60.4065 30.8916 177.8706 84 V 3.9470 8.5704 118.4943 66.2748 30.7213 177.4738 85 A 4.2600 8.2388 120.3581 54.8623 18.2862 179.2414 86 E 3.9186 7.8586 115.1213 58.9288 29.6242 178.2922 87 H 4.4532 7.7155 114.1346 55.3129 29.8472 174.9057 88 T 4.6124 7.7358 116.9547 62.0313 70.5112 173.8195 89 D 4.5562 8.6763 119.6991 54.7033 40.8733 175.5835 90 Y 4.6519 7.6077 117.5966 56.2427 41.2307 175.8618 91 D 4.5998 8.8087 119.3769 56.6331 41.8949 176.0772 92 D 4.7015 7.6426 115.9556 51.2913 42.2344 175.4303 93 I 3.7391 9.1483 119.8137 65.0965 36.7779 178.7437 94 S 4.6556 7.7709 116.7202 60.9152 62.6616 176.8736 95 G 3.7325 7.8682 108.1688 47.6559 0.0000 175.5269 96 L 3.0186 7.7916 122.4867 57.4566 42.1488 178.5692 97 A 3.9103 8.3052 121.0984 55.3816 18.3057 179.3030 98 F 4.1298 8.7618 120.2383 60.8658 39.4613 177.1956 99 A 4.1587 7.8609 121.6529 54.3907 18.0093 179.5830 100 L 3.7812 7.8961 117.5777 58.0574 41.5554 179.6667 101 L 3.9052 7.4625 117.7023 57.6319 41.7679 179.0854 102 S 4.1219 7.7883 111.8083 57.7540 63.3708 173.7954 103 E 3.8116 7.9680 121.3732 57.7675 27.1565 174.8329 104 E 4.3088 8.6065 119.3130 57.4265 30.5715 174.5100 105 T 4.6266 7.3560 110.8237 60.4590 70.4598 171.9842 106 T 4.7714 8.0231 111.8414 59.0134 73.2136 174.5547 107 L 4.0221 8.3665 121.0643 57.8288 41.5329 180.1472 108 R 4.0593 7.9120 117.6889 59.4743 29.9796 178.5607 109 E 4.1288 7.7532 116.9949 59.0701 29.4363 178.5601 110 Q 4.6825 7.6175 115.7163 55.0131 29.4278 175.7934 111 G 4.0356 8.5689 108.7205 46.5760 0.0000 173.5298 112 L 5.0243 8.3131 118.5047 51.9075 44.3176 176.7439 113 S 4.2039 8.5755 117.0410 57.9082 62.6931 173.1306 114 P 4.3954 0.0000 0.0000 64.6971 31.4172 176.2303 115 T 4.8255 7.3003 114.5959 61.6144 71.0068 174.2885 116 L 4.4144 9.0421 126.0024 53.1771 43.6277 176.2301 117 R 4.2244 8.4162 124.3593 55.3266 29.1015 176.7352 118 L 4.3386 8.2164 123.9413 54.6585 42.8758 175.6259 119 H 4.8921 8.2648 119.8204 53.8295 31.5841 173.0151 120 P 4.3326 0.0000 0.0000 61.8701 31.8813 174.6113 121 P 4.4097 0.0000 0.0000 62.5798 31.5614 176.0175 122 R 4.0720 8.6722 124.3723 57.4480 30.1574 177.2762 123 G 3.7938 8.8895 111.3801 44.4723 0.0000 173.1995 124 G 3.9506 7.8962 108.5930 45.0349 0.0000 173.4301 125 H 4.7198 8.0085 115.2343 54.4017 30.2915 174.8121 126 D 4.5826 9.4783 117.9234 54.4498 40.7820 176.8967 127 G 4.1760 8.4029 108.7208 45.8335 0.0000 174.8272 128 V 4.4655 8.1476 116.4990 61.5306 32.1676 176.7634 129 K 4.4970 7.9850 117.4676 56.0924 34.2731 176.0352 130 H 4.9249 7.6001 115.2727 53.0889 32.8627 171.2079 131 P 4.9577 0.0000 0.0000 61.7485 32.7638 177.4048 132 V 4.0924 8.0244 116.7312 65.4732 31.3027 178.2917 133 K 3.9133 7.9914 117.3273 58.8462 31.9778 177.3057 134 E 4.3578 8.2218 116.2536 55.9020 29.4668 176.8310 135 G 3.8474 8.3420 107.7603 45.1030 0.0000 174.2256 136 G 4.3651 8.1589 107.9621 44.6459 0.0000 174.0353 137 Q 4.6957 8.6713 119.6292 55.7767 29.9261 175.7521 138 L 4.4361 7.7717 118.1304 55.7713 43.9710 178.1856 139 G 4.1054 8.9245 109.5526 44.3033 0.0000 172.2918 140 K 2.9964 8.0816 120.1784 56.4568 32.7470 177.0851 141 H 4.8847 8.0926 122.8743 53.5584 32.6111 172.7016 142 D 4.5686 8.3507 119.1593 54.0970 42.4452 177.2289 143 T 4.2437 8.4288 119.1552 66.0070 68.3460 176.6939 144 E 4.0672 8.1669 121.1851 58.9606 29.6901 178.8438 145 G 3.6117 7.9013 105.3884 47.9082 0.0000 175.6157 146 I 3.6849 8.0114 122.6844 63.9834 37.0719 178.2262 147 D 4.3320 8.0048 119.5799 57.6612 40.6517 178.5831 148 D 4.4068 8.2124 119.2504 57.1933 40.8632 178.8429 149 L 3.9126 7.6748 120.4657 58.2361 42.0292 178.8258 150 L 4.0064 8.1276 117.9322 58.0717 41.7533 179.2722 151 E 4.0956 8.9304 118.4899 59.1650 29.3510 179.0875 152 A 4.1885 7.9535 120.1986 54.0003 18.3492 178.3598 153 M 4.8156 7.5702 117.0014 54.8779 32.7387 176.4004 154 R 4.0785 7.6433 121.4292 56.5980 29.4320 176.1753 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 M 8.16 4.55 0.00 2.00 1.92 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.55 0.00 2 H 9.44 5.30 0.00 3.12 3.24 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 3 A 10.07 5.09 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 4 L 8.85 4.80 0.00 1.59 1.59 0.88 0.54 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 5 V 8.45 4.84 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 1.05 0.00 0.00 0.94 0.00 0.00 6 Q 8.85 4.60 0.00 2.25 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.35 0.00 0.00 0.00 0.00 0.00 2.42 2.43 0.00 7 L 8.93 4.94 0.00 1.56 1.63 0.89 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 8 R 8.05 4.64 0.00 2.09 2.08 0.00 3.21 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 9 G 8.61 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 10 E 8.58 3.94 0.00 2.26 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 2.34 2.27 0.00 11 V 7.59 3.73 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 0.82 0.00 0.00 0.93 0.00 0.00 12 N 8.97 4.53 0.00 2.97 3.04 0.00 0.00 7.16 7.66 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 13 M 7.60 4.22 0.00 1.68 0.99 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.49 0.00 14 H 8.82 4.01 0.00 3.16 3.40 0.00 5.65 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 T 8.55 3.84 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 1.21 0.00 0.00 16 D 8.08 4.33 0.00 2.86 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 17 I 7.62 3.77 1.85 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.99 0.89 0.00 0.00 18 Q 8.03 3.87 0.00 2.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 19 D 8.38 4.37 0.00 2.69 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 20 T 7.60 3.84 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 21 L 7.73 3.96 0.00 1.84 1.81 0.89 0.75 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 22 E 8.03 3.90 0.00 2.16 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.45 0.00 23 M 7.97 4.22 0.00 1.99 2.26 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.57 0.00 24 L 7.83 4.55 0.00 1.74 1.69 0.94 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 25 N 7.75 4.23 0.00 2.87 2.90 0.00 0.00 6.54 7.66 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 26 I 7.83 4.49 1.89 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 1.27 0.90 0.95 0.00 0.00 27 H 8.87 4.80 0.00 2.93 3.11 0.00 5.90 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 H 7.45 4.94 0.00 2.50 2.94 0.00 5.62 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 V 8.12 3.81 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 0.83 0.00 0.00 0.96 0.00 0.00 30 N 9.38 4.50 0.00 2.98 3.01 0.00 0.00 7.06 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 31 H 7.93 4.67 0.00 3.34 3.22 0.00 5.57 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 C 9.12 5.43 0.00 2.94 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 33 T 8.76 4.93 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 34 L 8.46 5.08 0.00 1.48 1.52 0.87 0.82 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 35 V 8.68 4.05 1.77 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 0.77 0.00 0.00 0.20 0.00 0.00 36 P 0.00 4.46 0.00 1.94 1.98 0.00 2.37 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.97 0.00 37 E 8.88 4.37 0.00 1.92 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 2.10 2.18 0.00 38 T 7.77 4.77 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 1.26 0.00 0.00 39 D 8.66 4.38 0.00 2.67 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 40 A 7.88 3.90 1.12 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 0.00 0.00 41 Y 7.84 4.19 0.00 3.20 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 42 R 8.71 4.02 0.00 2.10 2.02 0.00 3.14 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 43 G 7.84 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 44 M 7.64 4.21 0.00 2.13 2.34 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.55 0.00 45 V 7.79 3.54 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 0.88 0.00 0.00 0.51 0.00 0.00 46 A 7.71 3.96 1.37 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 47 K 7.82 4.13 0.00 1.84 2.01 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.47 1.45 7.81 48 V 6.97 4.32 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 1.13 0.00 0.00 0.99 0.00 0.00 49 N 7.52 4.20 0.00 2.97 2.92 0.00 0.00 7.12 9.28 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 50 D 7.95 4.46 0.00 2.08 2.19 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 51 F 8.70 4.98 0.00 3.03 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 52 V 7.77 5.10 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 1.12 0.00 0.00 1.09 0.00 0.00 53 A 9.17 5.21 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 54 F 9.15 6.10 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 55 G 8.16 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 56 E 8.31 4.75 0.00 2.09 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 2.34 2.34 0.00 57 P 0.00 4.83 0.00 2.21 2.02 0.00 3.82 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 58 S 8.86 4.37 0.00 4.09 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 59 Q 8.70 3.95 0.00 2.23 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.89 0.00 0.00 0.00 0.00 0.00 2.50 2.70 0.00 60 E 8.24 4.06 0.00 2.05 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 2.42 2.43 0.00 61 T 7.64 3.83 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 1.20 0.00 0.00 62 L 8.23 3.92 0.00 1.71 1.80 0.89 0.91 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 63 E 8.21 4.05 0.00 2.29 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 2.34 2.51 0.00 64 T 7.75 3.89 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 1.20 0.00 0.00 65 V 7.91 3.58 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 1.01 0.00 0.00 0.92 0.00 0.00 66 L 7.96 3.86 0.00 1.76 1.66 0.88 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 67 A 7.69 4.22 1.37 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 68 T 7.86 4.14 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 1.38 0.00 0.00 69 R 8.46 4.45 0.00 1.80 1.85 0.00 3.62 0.00 0.00 3.20 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 70 A 7.70 4.22 1.17 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 0.00 0.00 71 E 8.27 4.52 0.00 1.77 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.37 0.00 72 P 0.00 4.51 0.00 2.29 2.15 0.00 3.61 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 2.00 1.32 0.00 73 L 8.41 3.83 0.00 1.86 1.75 1.01 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 74 E 7.81 4.59 0.00 1.81 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 2.27 2.28 0.00 75 G 8.85 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 D 8.48 4.38 0.00 2.68 2.71 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 77 A 7.79 3.85 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 78 D 8.64 4.20 0.00 2.69 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 79 V 8.00 3.65 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 0.86 0.00 0.00 0.20 0.00 0.00 80 D 8.14 5.05 0.00 2.99 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 81 D 8.69 4.46 0.00 2.76 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 82 E 8.33 4.02 0.00 2.08 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 83 W 8.76 3.93 0.00 3.70 3.35 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 0.00 84 V 8.57 3.95 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 1.08 0.00 0.00 1.14 0.00 0.00 85 A 8.24 4.26 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 86 E 7.86 3.92 0.00 1.62 1.67 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 2.23 2.38 0.00 87 H 7.72 4.45 0.00 1.84 2.75 0.00 5.63 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 T 7.74 4.61 4.56 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 1.66 0.00 0.00 89 D 8.68 4.56 0.00 2.28 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 Y 7.61 4.65 0.00 3.16 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 91 D 8.81 4.60 0.00 2.72 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 92 D 7.64 4.70 0.00 3.15 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 93 I 9.15 3.74 1.97 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 1.57 0.65 0.97 0.00 0.00 94 S 7.77 4.66 0.00 4.02 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 95 G 7.87 3.73 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 0.00 0.00 0.00 96 L 7.79 3.02 0.00 1.73 1.79 0.71 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 97 A 8.31 3.91 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 98 F 8.76 4.13 0.00 3.24 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 A 7.86 4.16 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 0.00 100 L 7.90 3.78 0.00 1.78 1.64 0.85 0.49 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 0.00 101 L 7.46 3.91 0.00 1.40 1.58 0.88 1.01 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 0.00 102 S 7.79 4.12 0.00 3.84 3.45 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 0.00 103 E 7.97 3.81 0.00 2.06 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 2.17 2.32 0.00 104 E 8.61 4.31 0.00 1.88 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 0.00 2.37 2.36 0.00 105 T 7.36 4.63 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 1.20 0.00 0.00 106 T 8.02 4.77 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 1.22 0.00 0.00 107 L 8.37 4.02 0.00 1.70 1.76 0.93 0.84 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 0.00 108 R 7.91 4.06 0.00 1.89 2.01 0.00 3.18 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.74 0.00 109 E 7.75 4.13 0.00 2.13 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 110 Q 7.62 4.68 0.00 2.10 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.49 0.00 0.00 0.00 0.00 0.00 2.65 2.65 0.00 111 G 8.57 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 L 8.31 5.02 0.00 1.77 1.57 0.95 0.57 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 0.00 113 S 8.58 4.20 0.00 3.89 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 0.00 114 P 0.00 4.40 0.00 2.09 2.11 0.00 3.70 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 115 T 7.30 4.83 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 1.24 0.00 0.00 116 L 9.04 4.41 0.00 1.50 1.55 0.89 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 117 R 8.42 4.22 0.00 1.62 1.82 0.00 3.20 0.00 0.00 3.20 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.52 0.00 118 L 8.22 4.34 0.00 1.68 1.83 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 119 H 8.26 4.89 0.00 3.12 3.15 0.00 5.97 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.33 0.00 2.01 1.95 0.00 3.12 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.02 0.00 121 P 0.00 4.41 0.00 2.23 2.24 0.00 3.70 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.02 0.00 122 R 8.67 4.07 0.00 1.79 1.93 0.00 3.16 0.00 0.00 3.20 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.75 0.00 123 G 8.89 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 0.00 124 G 7.90 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 0.00 125 H 8.01 4.72 0.00 3.44 3.37 0.00 5.54 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 D 9.48 4.58 0.00 2.75 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 0.00 127 G 8.40 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 0.00 0.00 0.00 0.00 128 V 8.15 4.47 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 0.97 0.00 0.00 129 K 7.98 4.50 0.00 1.54 1.56 0.00 1.66 0.00 0.00 1.66 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.26 1.37 7.81 130 H 7.60 4.92 0.00 3.10 3.07 0.00 5.61 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 P 0.00 4.96 0.00 2.18 2.17 0.00 3.92 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.93 0.00 132 V 8.02 4.09 1.92 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 1.24 0.00 0.00 0.63 0.00 0.00 133 K 7.99 3.91 0.00 1.75 1.83 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.42 7.81 134 E 8.22 4.36 0.00 2.04 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 2.19 2.25 0.00 135 G 8.34 3.85 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 0.00 0.00 0.00 136 G 8.16 4.37 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 0.00 137 Q 8.67 4.70 0.00 2.05 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.77 0.00 0.00 0.00 0.00 0.00 2.25 2.38 0.00 138 L 7.77 4.44 0.00 1.68 1.51 0.88 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 139 G 8.92 4.11 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 0.00 140 K 8.08 3.00 0.00 1.36 1.48 0.00 1.80 0.00 0.00 1.68 0.00 0.00 2.70 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.17 0.96 7.81 141 H 8.09 4.88 0.00 2.96 3.08 0.00 5.72 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 D 8.35 4.57 0.00 2.69 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 T 8.43 4.24 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 1.26 0.00 0.00 144 E 8.17 4.07 0.00 2.02 1.92 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 2.52 2.37 0.00 145 G 7.90 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 I 8.01 3.68 2.01 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.64 0.89 0.00 0.00 147 D 8.00 4.33 0.00 2.89 2.71 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 0.00 148 D 8.21 4.41 0.00 2.81 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 0.00 149 L 7.67 3.91 0.00 1.73 1.79 0.95 1.04 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 0.00 150 L 8.13 4.01 0.00 1.64 1.72 0.91 0.99 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 0.00 151 E 8.93 4.10 0.00 2.03 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 2.32 2.42 0.00 152 A 7.95 4.19 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 0.00 153 M 7.57 4.82 0.00 2.25 2.05 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.53 0.00 154 R 7.64 4.08 0.00 1.86 2.13 0.00 3.07 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00