NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 L 4.4417 8.0385 120.6275 54.3646 43.5866 178.6113 23 A 3.8224 8.2081 123.7051 55.0738 18.1234 178.3776 24 D 4.3173 9.1790 118.8033 57.2776 41.5296 177.5068 25 S 4.1705 8.7782 116.1262 61.6675 63.0100 176.8440 26 K 3.9671 8.2426 120.8874 59.4131 31.7740 179.2605 27 A 4.0243 8.2243 121.4605 55.2136 18.2781 180.1140 28 V 3.7473 8.1098 117.7136 64.6064 31.5938 178.5284 29 L 4.2284 8.1716 119.8869 57.9748 41.5021 179.0410 30 N 4.3642 8.2020 116.6252 56.4430 38.7183 176.6988 31 Q 4.2222 8.4269 120.9994 59.2985 29.1632 178.1047 32 A 4.2251 8.6245 122.1507 55.2273 18.4641 179.5935 33 V 3.5833 8.1206 116.4715 66.2103 31.5497 178.0556 34 A 4.1741 8.4020 120.2864 55.6092 18.3080 179.4475 35 D 4.4152 8.6268 117.6743 57.4286 40.8514 179.0612 36 L 4.2997 8.8316 120.0200 57.7333 41.6633 179.6774 37 S 3.8798 7.8567 115.3211 61.3704 62.5060 176.8701 38 V 3.6316 7.6592 120.4929 65.6287 31.2725 177.8351 39 A 3.9981 8.4863 121.0650 55.5786 18.3737 178.9275 40 H 4.0007 8.4856 116.8225 59.6073 29.9632 177.3559 41 S 4.1659 7.9576 114.3201 61.4998 62.2575 176.2225 42 I 3.7475 8.0570 122.7342 64.2806 36.7005 178.3934 43 L 4.0463 7.9258 119.9375 57.5856 41.4300 178.9717 44 H 3.6803 7.8474 118.0628 58.8294 29.7350 176.8159 45 Q 4.2473 7.7831 121.1805 59.4433 28.3580 178.4771 46 V 3.6287 7.7988 118.9171 66.5415 31.3156 177.2213 47 H 4.1305 8.1932 116.5607 59.2513 29.6390 176.6142 48 W 4.8285 8.1044 119.2214 59.1048 29.2625 177.3785 49 Y 4.4021 8.7685 114.8857 57.1989 37.7308 175.1083 50 M 4.4897 7.5431 120.0303 55.7545 33.0548 175.7651 51 R 4.5234 8.5502 122.5316 55.6958 34.5607 173.8240 52 G 4.1901 9.0864 107.5359 43.0928 0.0000 173.3035 53 R 4.2088 8.3767 119.1994 57.9457 30.4381 177.6497 54 G 4.2079 9.3145 110.6305 45.2668 0.0000 174.8117 55 F 4.0923 8.5840 122.1911 61.9763 39.0574 176.7990 56 M 4.0437 8.3260 115.3739 58.2952 31.7566 177.2200 57 I 3.7555 7.5837 118.1388 62.9883 38.3264 177.2926 58 W 4.3484 8.2342 119.6425 58.9438 28.7929 178.0464 59 H 3.9025 8.1719 119.1987 58.8136 29.0777 175.6027 60 P 4.0711 0.0000 0.0000 65.3355 31.2237 178.1015 61 K 3.5865 7.4176 118.7189 59.3853 31.9535 178.6624 62 M 4.1123 7.7560 119.2216 58.0791 31.7780 178.1109 63 D 4.1683 7.3529 119.0109 57.5982 41.1252 178.8441 64 E 3.8846 7.6249 118.7895 59.6666 29.3105 179.2056 65 Y 4.4887 7.7787 116.6778 61.4400 37.9212 178.1242 66 M 4.1249 8.8163 122.4942 59.0407 32.0058 179.3757 67 E 3.9407 8.3473 118.5173 60.9840 29.8423 181.0172 68 E 3.8570 8.0879 120.4103 58.9746 29.6937 178.8158 69 I 3.8330 8.0073 120.1246 64.7550 37.1565 178.1190 70 D 4.4637 8.4590 119.8981 57.1144 40.5961 178.9872 71 G 3.5294 8.0031 106.1873 48.0703 0.0000 175.1199 72 Y 4.3541 7.5821 119.9366 60.6058 38.0281 178.4605 73 L 4.0304 8.5959 121.4240 58.5316 42.2518 178.6895 74 D 4.3308 8.4516 118.0740 57.1644 41.1879 177.7727 75 E 3.9135 8.3248 119.9465 59.6169 29.6958 178.7848 76 M 3.9912 8.1845 119.0090 57.9485 31.9531 178.8797 77 S 4.1148 8.0221 114.3860 61.5511 63.0751 176.0934 78 E 3.8835 7.9044 122.4235 59.1831 29.2702 179.4498 79 R 3.7416 7.9651 118.1860 59.3795 30.0201 178.2304 80 L 3.9128 7.8869 119.9395 58.1900 42.1297 178.9774 81 I 3.8470 8.2069 120.0318 64.8871 36.8589 178.6098 82 T 3.9323 8.4408 115.9552 66.1141 68.3078 175.6920 83 L 4.4202 7.5453 118.5014 54.6589 41.9566 177.3467 84 G 3.9220 8.1001 107.9516 45.2187 0.0000 173.6321 85 G 3.8810 7.8206 108.7536 43.4503 0.0000 173.6167 86 A 4.4635 7.9734 121.1065 49.1728 19.9597 174.1476 87 P 4.4820 0.0000 0.0000 62.8466 32.2573 176.6843 88 F 4.5769 8.0200 119.1438 59.0639 39.2686 176.7822 89 S 4.7554 8.7793 118.9066 57.2501 63.7442 174.5060 90 T 4.5129 6.9099 109.9439 59.6498 72.9486 173.7321 91 L 4.0250 8.2392 122.1810 57.8301 41.6520 179.5946 92 K 3.8073 7.9010 118.9274 59.6491 32.1991 178.3193 93 E 3.7148 7.6572 118.0743 59.3224 29.3657 179.3180 94 F 4.3723 7.5131 117.5325 61.0416 38.8346 178.0723 95 S 4.1949 8.2879 113.5124 61.5854 62.6620 176.3463 96 E 4.0766 8.4009 121.0025 58.7129 29.2826 178.1658 97 N 4.5607 7.6357 114.8343 53.2811 39.5989 175.8256 98 S 4.4140 7.5154 115.2910 58.4036 62.8336 173.9904 99 Q 4.1490 8.6606 125.4749 56.7760 28.7727 176.0749 100 L 4.3187 7.5530 118.7604 53.1051 43.1189 176.0123 101 K 4.6068 8.2170 120.4796 54.5606 34.6572 175.5348 102 E 4.7392 8.5394 121.4468 54.5861 32.2268 175.7776 103 V 4.5174 7.8218 114.1518 58.8317 35.4425 175.6086 104 L 3.9388 8.3967 121.5103 54.7365 41.9925 177.8795 105 G 2.4211 7.9870 110.9244 45.5990 0.0000 172.8901 106 D 4.2999 7.3981 121.4224 52.8589 43.1392 175.5661 107 Y 4.8521 8.5681 124.4910 59.9858 38.0871 176.8700 108 N 4.6526 8.9645 116.5164 54.0410 39.1843 175.8142 109 V 3.7654 7.2714 119.0365 62.8258 32.1951 176.4495 110 T 4.3058 9.6301 118.8694 60.9724 70.9212 175.8060 111 I 3.6902 8.2453 121.5940 64.8860 37.1246 178.6042 112 E 3.8621 8.0651 118.5868 59.1320 29.3030 179.1408 113 E 3.9144 8.0212 118.4330 59.3303 29.5507 179.2185 114 Q 3.9369 8.0648 118.0413 59.0575 28.7256 178.9953 115 L 3.6604 7.8774 119.7009 57.6333 41.5705 179.5248 116 A 3.8596 7.7966 120.6923 55.0348 18.2942 179.6993 117 R 3.7870 8.0577 117.3678 59.3445 30.0387 178.9860 118 V 3.2171 7.4438 118.2125 65.5575 31.3595 178.0143 119 V 3.4447 7.7132 118.2994 66.0402 31.2268 177.7293 120 E 3.9511 8.0435 118.0334 59.4457 29.2764 179.4090 121 V 3.6337 7.6493 117.9979 66.2232 31.6023 178.0348 122 F 4.4513 8.4912 117.7141 60.7804 38.7671 177.6859 123 R 3.9605 8.8451 118.2382 59.5543 29.8135 178.4665 124 Y 3.8991 8.3372 119.2671 60.6097 38.8115 178.0131 125 L 3.3458 8.2863 120.0323 57.4525 41.6820 179.3872 126 A 3.7851 8.2224 120.6770 55.0209 18.3417 179.5186 127 A 3.7910 7.6926 119.2513 55.1232 18.3402 179.5237 128 L 3.6071 7.5112 119.1511 58.3418 41.9802 179.3342 129 F 4.4313 8.1646 117.9411 60.2103 38.7234 177.5555 130 Q 3.9186 8.1324 119.6563 59.0464 28.8640 178.1273 131 K 3.9799 8.0178 120.8064 59.3124 32.1591 178.8628 132 G 2.1472 7.7784 106.1724 47.1334 0.0000 175.3202 133 F 4.0075 8.0951 123.4660 61.1383 39.4156 176.8874 134 D 4.4775 8.6600 118.8838 57.3915 40.6362 179.1115 135 V 3.5403 7.8742 118.9170 66.0560 31.5017 178.3174 136 S 4.4787 7.9250 115.3921 60.7574 62.7773 175.9397 137 D 4.1358 8.0605 124.1219 57.8793 40.7707 178.7598 138 E 4.0198 8.0902 117.4986 60.8590 29.7796 179.9668 139 E 4.5049 8.1246 116.4724 56.2944 29.8376 177.5390 140 G 3.7949 7.4767 106.4968 46.5130 0.0000 174.7539 141 D 4.5897 7.8745 121.5627 53.0143 39.7995 176.5274 142 S 4.1299 8.1283 120.8969 60.2940 63.6876 176.5784 143 V 3.4860 7.6144 121.7298 66.3451 31.5487 177.9263 144 T 3.7350 7.9356 115.0770 66.4505 68.3039 176.0030 145 N 4.5153 8.1845 120.3730 56.1860 38.8269 176.3772 146 D 4.3565 8.0705 119.2689 57.3012 41.3003 178.0735 147 I 3.5182 7.4434 119.8271 64.4846 37.0330 178.4228 148 F 3.9335 7.6888 118.0331 60.3283 38.6566 177.1667 149 N 4.3493 8.2976 116.5299 56.8109 38.6975 176.9605 150 V 3.5444 8.0138 119.4494 66.0649 31.6568 177.7793 151 A 3.5394 7.6331 121.7446 54.1561 17.9026 179.6002 152 K 4.0111 8.4610 118.3779 59.4686 32.3447 178.6038 153 A 3.9805 8.1675 121.4804 55.5701 18.3570 179.6802 154 S 4.0440 7.8507 111.2972 61.5363 62.4934 176.2964 155 I 3.5118 7.8173 122.5144 64.4450 36.8029 178.3153 156 E 4.0136 8.4179 119.4835 59.0934 29.2700 179.1385 157 K 4.1741 8.1068 119.7625 60.1961 32.1845 178.5808 158 H 4.5069 8.1385 115.9838 58.7892 28.5142 177.7993 159 I 3.8099 8.2275 121.9500 64.1489 36.9288 177.9497 160 W 4.4183 8.2924 129.0378 61.0614 30.5238 177.8924 161 M 3.3076 7.8254 118.1908 58.1078 31.3873 178.8173 162 L 4.0282 8.2325 119.3087 57.9896 41.7469 179.6057 163 Q 3.9996 8.5560 118.1700 58.8611 28.6255 178.8131 164 A 4.0370 8.1306 122.0651 55.0805 18.1876 179.1972 165 E 4.0012 8.1227 116.9114 59.3472 29.8191 178.2904 166 L 4.3278 7.5657 115.8215 54.5933 41.7467 177.4937 167 G 3.9171 7.9931 107.0574 45.9956 0.0000 173.3526 168 Q 4.6730 8.1582 117.1036 53.0644 32.0730 175.3810 169 A 4.3683 8.2834 122.0395 51.4728 19.1738 176.3050 170 P 4.4298 0.0000 0.0000 64.2360 31.6138 177.6607 171 K 3.8690 8.1252 114.8054 56.7940 29.5119 175.2382 172 L 4.1651 8.2162 122.6972 55.3957 41.4955 177.5715 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 22 L 8.04 4.44 0.00 1.72 1.74 0.94 0.38 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 23 A 8.21 3.82 1.35 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 0.00 0.00 24 D 9.18 4.32 0.00 2.93 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 25 S 8.78 4.17 0.00 4.03 3.96 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 26 K 8.24 3.97 0.00 1.95 1.85 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.45 1.53 7.81 27 A 8.22 4.02 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 28 V 8.11 3.75 2.05 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 1.04 0.00 0.00 0.78 0.00 0.00 29 L 8.17 4.23 0.00 1.97 1.81 0.92 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 30 N 8.20 4.36 0.00 2.89 2.63 0.00 0.00 6.89 6.45 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 31 Q 8.43 4.22 0.00 2.38 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.48 2.77 0.00 32 A 8.62 4.23 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 0.00 0.00 0.00 0.00 0.00 33 V 8.12 3.58 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 1.09 0.00 0.00 34 A 8.40 4.17 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 D 8.63 4.42 0.00 2.89 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 36 L 8.83 4.30 0.00 1.78 1.81 1.14 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 37 S 7.86 3.88 0.00 3.27 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 38 V 7.66 3.63 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 1.06 0.00 0.00 0.96 0.00 0.00 39 A 8.49 4.00 1.49 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 0.00 0.00 40 H 8.49 4.00 0.00 3.32 3.53 0.00 5.79 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 41 S 7.96 4.17 0.00 4.01 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 42 I 8.06 3.75 1.99 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.86 0.86 0.00 0.00 43 L 7.93 4.05 0.00 1.76 1.68 1.09 1.01 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 44 H 7.85 3.68 0.00 3.09 2.70 0.00 5.60 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 45 Q 7.78 4.25 0.00 2.26 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.53 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 46 V 7.80 3.63 2.24 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 0.95 0.00 0.00 1.03 0.00 0.00 47 H 8.19 4.13 0.00 3.07 3.22 0.00 5.99 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 48 W 8.10 4.83 0.00 3.64 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 49 Y 8.77 4.40 0.00 3.20 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 50 M 7.54 4.49 0.00 2.45 2.43 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.78 0.00 51 R 8.55 4.52 0.00 1.93 1.82 0.00 3.29 0.00 0.00 3.14 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.63 0.00 52 G 9.09 4.19 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 0.00 0.00 0.00 53 R 8.38 4.21 0.00 1.87 1.96 0.00 3.38 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.62 0.00 54 G 9.31 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 55 F 8.58 4.09 0.00 3.38 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 56 M 8.33 4.04 0.00 2.08 2.23 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.70 0.00 57 I 7.58 3.76 1.65 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.43 0.48 0.00 0.00 58 W 8.23 4.35 0.00 3.52 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 59 H 8.17 3.90 0.00 1.90 2.57 0.00 5.78 0.00 0.00 0.00 0.00 6.80 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 4.07 0.00 2.16 2.21 0.00 3.60 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 2.05 1.92 0.00 61 K 7.42 3.59 0.00 1.60 1.88 0.00 0.89 0.00 0.00 1.02 0.00 0.00 2.65 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.10 0.84 7.81 62 M 7.76 4.11 0.00 1.99 2.22 0.00 0.00 0.00 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 3.06 0.00 63 D 7.35 4.17 0.00 2.68 2.61 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 64 E 7.62 3.88 0.00 1.83 1.87 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 2.22 2.19 0.00 65 Y 7.78 4.49 0.00 3.26 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 66 M 8.82 4.12 0.00 1.85 2.16 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.18 0.00 67 E 8.35 3.94 0.00 1.97 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 0.00 2.24 2.19 0.00 68 E 8.09 3.86 0.00 2.15 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 1.66 2.03 0.00 69 I 8.01 3.83 2.11 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 1.95 1.01 1.04 0.00 0.00 70 D 8.46 4.46 0.00 2.78 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 71 G 8.00 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 72 Y 7.58 4.35 0.00 3.20 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 L 8.60 4.03 0.00 1.83 1.88 0.95 1.12 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 74 D 8.45 4.33 0.00 2.87 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 75 E 8.32 3.91 0.00 2.11 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 2.20 2.29 0.00 76 M 8.18 3.99 0.00 2.06 2.15 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.07 0.00 77 S 8.02 4.11 0.00 4.12 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 E 7.90 3.88 0.00 2.26 2.05 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 2.33 2.46 0.00 79 R 7.97 3.74 0.00 1.91 1.99 0.00 3.10 0.00 0.00 3.02 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.63 0.00 80 L 7.89 3.91 0.00 1.86 1.87 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 81 I 8.21 3.85 2.01 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 1.52 0.91 0.90 0.00 0.00 82 T 8.44 3.93 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 1.19 0.00 0.00 83 L 7.55 4.42 0.00 1.77 1.69 0.95 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 84 G 8.10 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 85 G 7.82 3.88 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 0.00 0.00 0.00 86 A 7.97 4.46 1.18 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 87 P 0.00 4.48 0.00 2.27 2.07 0.00 3.80 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 2.02 2.01 0.00 88 F 8.02 4.58 0.00 3.41 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 89 S 8.78 4.76 0.00 4.02 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 0.00 90 T 6.91 4.51 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 1.18 0.00 0.00 91 L 8.24 4.03 0.00 1.71 1.82 1.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 92 K 7.90 3.81 0.00 1.76 1.72 0.00 1.70 0.00 0.00 1.78 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.50 7.81 93 E 7.66 3.71 0.00 1.88 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 2.33 2.28 0.00 94 F 7.51 4.37 0.00 3.25 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 95 S 8.29 4.19 0.00 3.98 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 96 E 8.40 4.08 0.00 1.85 1.94 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 2.30 2.46 0.00 97 N 7.64 4.56 0.00 2.25 2.67 0.00 0.00 6.96 7.50 0.00 0.00 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 S 7.52 4.41 0.00 4.08 3.74 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 99 Q 8.66 4.15 0.00 1.65 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.51 0.00 0.00 0.00 0.00 0.00 2.49 2.71 0.00 100 L 7.55 4.32 0.00 1.48 1.44 0.92 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.22 4.61 0.00 1.63 1.63 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.28 1.34 7.81 102 E 8.54 4.74 0.00 1.90 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 2.18 2.26 0.00 103 V 7.82 4.52 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 0.70 0.00 0.00 0.85 0.00 0.00 104 L 8.40 3.94 0.00 1.53 1.50 0.89 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 105 G 7.99 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.40 4.30 0.00 2.48 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 0.00 0.00 0.00 0.00 107 Y 8.57 4.85 0.00 3.12 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 0.00 108 N 8.96 4.65 0.00 2.84 2.90 0.00 0.00 6.90 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 0.00 109 V 7.27 3.77 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 0.86 0.00 0.00 0.95 0.00 0.00 110 T 9.63 4.31 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 0.00 111 I 8.25 3.69 1.88 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.97 0.90 0.00 0.00 112 E 8.07 3.86 0.00 1.97 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 0.00 2.32 2.35 0.00 113 E 8.02 3.91 0.00 2.18 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 0.00 2.30 2.32 0.00 114 Q 8.06 3.94 0.00 2.19 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.80 0.00 0.00 0.00 0.00 0.00 2.65 2.61 0.00 115 L 7.88 3.66 0.00 1.52 1.30 -0.29 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 116 A 7.80 3.86 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 0.00 117 R 8.06 3.79 0.00 1.86 2.09 0.00 3.07 0.00 0.00 3.03 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 118 V 7.44 3.22 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 -0.04 0.00 0.00 0.82 0.00 0.00 119 V 7.71 3.44 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 0.96 0.00 0.00 0.82 0.00 0.00 120 E 8.04 3.95 0.00 2.17 1.97 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 2.42 2.42 0.00 121 V 7.65 3.63 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 1.25 0.00 0.00 0.94 0.00 0.00 122 F 8.49 4.45 0.00 3.18 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 R 8.85 3.96 0.00 2.03 2.01 0.00 3.14 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.90 0.00 124 Y 8.34 3.90 0.00 3.08 3.13 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 0.00 125 L 8.29 3.35 0.00 1.62 0.94 1.04 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 126 A 8.22 3.79 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 0.00 127 A 7.69 3.79 1.19 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 0.00 0.00 128 L 7.51 3.61 0.00 1.04 1.30 0.88 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 129 F 8.16 4.43 0.00 3.12 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 0.00 130 Q 8.13 3.92 0.00 2.11 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.80 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 131 K 8.02 3.98 0.00 1.78 1.80 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.37 7.81 132 G 7.78 2.15 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 0.00 133 F 8.10 4.01 0.00 3.31 3.20 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 0.00 134 D 8.66 4.48 0.00 2.71 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 0.00 135 V 7.87 3.54 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 1.05 0.00 0.00 0.90 0.00 0.00 136 S 7.92 4.48 0.00 4.30 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 0.00 137 D 8.06 4.14 0.00 2.45 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 E 8.09 4.02 0.00 2.10 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 2.26 2.23 0.00 139 E 8.12 4.50 0.00 1.92 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 0.00 2.30 2.54 0.00 140 G 7.48 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 0.00 141 D 7.87 4.59 0.00 2.71 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 S 8.13 4.13 0.00 4.05 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 0.00 143 V 7.61 3.49 2.04 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 1.01 0.00 0.00 0.90 0.00 0.00 144 T 7.94 3.74 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 145 N 8.18 4.52 0.00 2.64 2.87 0.00 0.00 6.47 8.10 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 0.00 146 D 8.07 4.36 0.00 3.01 2.61 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 0.00 147 I 7.44 3.52 1.64 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 1.38 0.46 0.46 0.00 0.00 148 F 7.69 3.93 0.00 3.27 3.30 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 0.00 149 N 8.30 4.35 0.00 3.31 3.04 0.00 0.00 6.88 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 V 8.01 3.54 2.04 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 1.00 0.00 0.00 0.95 0.00 0.00 151 A 7.63 3.54 0.08 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 0.00 152 K 8.46 4.01 0.00 2.08 1.99 0.00 1.66 0.00 0.00 1.59 0.00 0.00 3.14 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.52 1.50 7.81 153 A 8.17 3.98 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 0.00 154 S 7.85 4.04 0.00 3.95 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 0.00 155 I 7.82 3.51 1.85 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 1.74 0.71 0.70 0.00 0.00 156 E 8.42 4.01 0.00 2.11 2.04 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 2.34 2.41 0.00 157 K 8.11 4.17 0.00 2.08 2.01 0.00 1.74 0.00 0.00 1.85 0.00 0.00 3.05 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.79 1.90 7.81 158 H 8.14 4.51 0.00 3.46 3.48 0.00 5.68 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 0.00 159 I 8.23 3.81 2.14 0.00 0.00 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 1.57 1.03 1.00 0.00 0.00 160 W 8.29 4.42 0.00 3.42 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 M 7.83 3.31 0.00 1.96 2.06 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.43 0.00 162 L 8.23 4.03 0.00 1.90 1.61 0.79 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 163 Q 8.56 4.00 0.00 2.34 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.50 2.75 0.00 164 A 8.13 4.04 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 0.00 165 E 8.12 4.00 0.00 2.21 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 0.00 2.46 2.46 0.00 166 L 7.57 4.33 0.00 1.80 1.65 0.81 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 167 G 7.99 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 0.00 168 Q 8.16 4.67 0.00 2.10 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.89 0.00 0.00 0.00 0.00 0.00 2.28 2.36 0.00 169 A 8.28 4.37 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 0.00 170 P 0.00 4.43 0.00 2.13 2.31 0.00 3.90 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 2.08 2.42 0.00 171 K 8.13 3.87 0.00 1.92 1.90 0.00 1.78 0.00 0.00 1.72 0.00 0.00 3.28 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.53 7.81 172 L 8.22 4.17 0.00 1.63 1.60 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00