NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 V 4.0661 8.0544 120.3971 62.7140 32.3871 173.6722 10 F 4.7253 8.5218 120.2116 53.8167 41.9975 174.6540 11 S 4.2299 8.3301 123.4650 57.9867 65.8297 174.1138 12 E 3.8218 8.5973 123.3343 59.6853 29.3125 179.0197 13 E 3.8809 7.9564 117.8572 59.4456 29.5149 179.4347 14 K 3.7001 7.3798 118.5178 58.9588 31.9151 178.9809 15 E 3.9465 7.8678 119.5092 59.3828 29.6269 178.8568 16 A 4.0439 7.8870 120.6403 55.0382 18.2849 179.6400 17 L 3.9640 7.7764 117.6777 57.8546 41.6739 179.9137 18 V 3.2524 7.7626 118.2843 65.7660 31.3416 178.0515 19 L 4.1613 8.3375 119.4254 57.8467 41.6983 179.7600 20 K 4.0871 8.1640 118.7965 59.7465 32.4493 179.3895 21 S 4.4349 8.2512 115.3751 61.0741 63.2877 176.1528 22 W 4.7703 9.3818 132.3325 60.2987 30.1345 177.6076 23 A 3.8007 8.2118 120.1363 55.1082 17.9177 179.5522 24 I 3.8099 7.4431 116.9958 64.9887 37.2698 178.6985 25 M 4.1526 8.3110 119.5139 58.1126 31.5407 178.6100 26 K 3.1566 7.4292 119.3155 59.0346 32.1548 178.2794 27 K 4.2370 7.4275 116.7850 57.6163 32.1401 176.8626 28 D 4.8650 8.1689 118.7464 53.0160 42.5195 177.1023 29 S 4.4132 8.4553 115.6787 60.9733 62.8758 175.7437 30 A 3.9885 8.0272 123.8139 55.0443 18.1625 178.9290 31 N 4.2079 8.0490 114.8794 56.9349 39.1654 176.8957 32 L 3.8278 8.1817 120.7978 57.5245 41.5625 179.8217 33 G 3.5338 8.1975 106.1386 47.5563 0.0000 175.6097 34 L 3.9894 7.7589 122.3766 58.0404 42.1271 179.1215 35 R 3.8889 8.1662 118.2445 59.1837 29.8874 178.7990 36 F 4.4579 8.1546 121.6375 60.9937 39.4507 177.3231 37 F 3.0827 8.1926 117.3472 60.1181 38.6062 177.7184 38 L 4.1726 8.3159 119.0380 57.6455 41.3204 179.5830 39 K 3.9238 8.2223 119.7345 59.3767 32.1079 178.7047 40 I 3.5028 7.4274 120.1986 64.6811 36.5009 178.3281 41 F 4.7833 7.7861 117.6704 59.8440 38.5246 177.7023 42 E 4.0081 8.2825 119.0234 59.2619 29.5479 178.5634 43 I 4.0630 7.8182 118.4092 63.0364 38.5191 176.7601 44 A 4.6554 8.1522 124.2598 48.3068 19.2477 174.1186 45 P 4.5653 0.0000 0.0000 64.8541 31.4684 178.0072 46 S 4.1594 8.2130 112.3673 61.4456 62.7950 176.2470 47 A 4.1314 8.2402 124.1283 54.6928 18.0136 179.2339 48 R 3.2202 8.0013 117.7002 59.8452 29.7989 178.3551 49 Q 4.1189 7.6216 115.1838 58.0009 28.7344 177.6738 50 M 4.1956 7.7968 118.9749 56.1652 32.4654 175.4591 51 F 4.2367 7.5538 118.7021 54.8677 39.9991 174.3721 52 P 4.2155 0.0000 0.0000 65.6675 31.1842 178.4324 53 F 4.5109 7.9021 109.6298 58.3423 37.7769 175.3078 54 L 4.5948 7.4193 120.1499 54.4445 42.3271 176.4087 55 R 4.0084 7.4964 119.2759 56.5940 30.8216 175.2527 56 D 4.6410 8.7743 121.9526 54.1264 37.6950 175.2160 57 S 4.5484 8.3971 117.8605 58.9522 62.5676 175.2268 58 D 4.4585 8.2332 122.5718 55.2289 40.3779 179.5785 59 V 3.1222 7.0179 110.2331 61.3802 32.5914 175.4258 60 P 4.5054 0.0000 0.0000 62.8358 31.5830 176.6732 61 L 3.9819 8.6995 121.0345 58.2888 41.6067 179.9073 62 E 3.8611 8.2134 115.5811 58.7471 29.6127 177.7646 63 T 4.2196 7.1608 113.9089 64.0210 69.9737 173.5685 64 N 4.1167 8.1876 120.5580 53.0862 38.8787 173.1421 65 P 4.2331 0.0000 0.0000 66.0906 31.2698 178.5391 66 K 3.7344 7.9980 117.7525 58.7133 31.9318 178.8384 67 L 3.8604 7.8523 120.6155 58.0753 41.8734 179.1636 68 K 3.9014 7.7294 118.1870 59.7942 31.8679 179.5280 69 T 3.8105 7.4919 116.0020 66.7603 68.4133 176.4683 70 H 3.9496 8.0615 119.9371 58.9986 29.7909 176.9845 71 A 3.2700 7.9130 122.9650 55.1316 18.1102 179.7830 72 V 3.6953 7.5349 116.4260 66.0999 31.5761 178.1068 73 S 4.1088 7.8582 112.7167 61.5653 62.2560 176.4469 74 V 3.7677 7.9485 120.9138 65.8248 31.2238 177.7564 75 F 4.3856 8.9023 120.8761 61.3301 39.3100 177.3743 76 V 3.4262 8.3000 118.0903 66.0884 31.3398 177.3821 77 M 3.9368 8.1110 117.9858 59.1924 32.0542 178.4097 78 T 3.8014 7.9790 115.5093 66.9346 68.6004 176.6705 79 C 4.0410 7.6520 118.7907 62.5662 27.9477 176.0508 80 E 3.6819 8.0939 120.4039 58.9382 28.7394 179.1516 81 A 3.9542 7.8070 120.1878 54.9901 18.5781 179.2866 82 A 3.6273 7.6640 118.8131 55.1609 18.2525 179.8173 83 A 3.9330 7.8585 117.9262 54.2706 18.6805 178.7002 84 Q 4.4170 7.6570 114.6489 55.4775 29.6873 177.1313 85 L 3.9206 7.2030 122.9302 58.3809 41.8215 178.9160 86 R 3.9511 7.8668 116.4374 59.2552 30.2614 177.1795 87 K 3.9608 8.0692 118.0717 59.1680 32.0189 177.0988 88 A 4.2343 8.5940 120.5325 51.7325 19.2995 178.5075 89 G 4.1815 8.4928 103.0083 45.3774 0.0000 173.2800 90 K 4.3946 7.1261 116.2812 55.3364 35.4510 175.3687 91 I 3.7537 8.1478 121.3672 61.5147 37.4611 175.9469 92 T 4.6348 8.1836 114.2423 59.6772 71.8167 173.6388 93 V 4.2250 7.9313 115.8757 59.1810 34.0181 174.9902 94 R 3.8760 8.7095 124.4003 57.9947 29.9171 175.4385 95 E 3.8562 9.2578 122.3764 57.1729 27.4582 173.9740 96 T 4.5107 7.4553 111.9805 60.8651 70.0737 173.0414 97 T 4.7659 8.1565 114.8081 61.0838 73.8533 174.6487 98 L 3.9899 8.4621 123.7415 57.8637 41.6613 179.8768 99 K 4.0062 7.9958 119.1180 59.5399 32.1427 178.9885 100 R 3.9571 7.9427 117.8998 59.1394 30.0850 178.8225 101 L 4.1955 8.2532 119.0206 57.7166 41.5835 179.6311 102 G 3.8904 8.1626 107.4640 47.3488 0.0000 175.2962 103 G 3.9736 8.2573 108.6375 48.2222 0.0000 175.5247 104 T 4.0302 8.3702 118.4863 66.5800 68.6393 176.6374 105 H 4.2802 8.5433 117.9456 58.4531 28.6935 177.6412 106 L 4.0101 8.3352 122.5844 58.2857 41.7546 179.2719 107 K 3.9579 7.9585 116.9496 59.2555 31.9957 177.9621 108 Y 4.2983 7.9600 114.4001 57.1735 37.9400 175.7042 109 G 3.8322 7.8177 107.7903 46.3843 0.0000 174.1542 110 V 3.6000 7.9348 119.6126 61.9793 32.2634 175.1670 111 A 4.9417 8.4736 128.6659 49.8813 22.2820 176.4820 112 D 4.8076 8.8597 118.9320 57.8112 40.7268 179.6671 113 G 3.6503 8.0918 105.6790 47.9786 0.0000 175.3374 114 H 4.2157 7.9813 118.1303 58.8988 28.6992 177.9852 115 F 4.5177 8.1556 118.9588 60.4044 38.8600 177.5553 116 E 4.1037 8.2971 118.4068 59.3635 29.2408 179.4329 117 V 3.6413 7.9051 118.2470 66.4510 31.5649 178.2329 118 T 3.8713 8.1337 115.4772 66.4717 68.2504 176.5793 119 R 2.8597 8.2668 120.7694 59.1961 30.0221 178.4020 120 F 4.0638 8.2059 119.8576 61.2142 39.4016 176.9789 121 A 4.0153 8.4575 120.7142 54.8588 18.0719 179.3988 122 L 3.3655 8.3036 119.4033 58.1677 42.0476 179.2941 123 L 3.9093 7.6707 118.9459 57.7151 41.5281 179.3451 124 E 3.5946 7.9420 118.7159 59.4020 29.1534 179.5280 125 T 3.7109 7.7373 115.8109 66.5770 68.4971 176.8610 126 I 3.4903 7.6057 121.8648 63.9460 36.7384 178.0741 127 K 2.4800 7.3495 120.5838 59.2297 31.5417 178.1139 128 E 3.9749 7.3800 114.8261 57.5128 29.6651 177.7768 129 A 4.3107 7.4579 119.6816 51.4946 19.5128 176.7851 130 L 4.8367 6.6064 116.4859 51.5608 45.1750 174.8824 131 P 4.3341 0.0000 0.0000 62.5239 32.2097 177.5359 132 A 4.0977 8.7366 124.3968 55.3674 18.5894 179.4379 133 D 4.4231 8.2022 114.4090 57.7040 41.3650 177.2960 134 M 4.2733 8.0293 117.2519 56.6992 32.3058 176.2245 135 W 4.7072 8.1395 128.2350 55.2636 32.3980 175.6820 136 G 3.8211 6.1936 109.5136 44.0124 0.0000 171.2413 137 P 4.0891 0.0000 0.0000 65.4495 31.0777 178.3112 138 E 3.8680 7.8369 117.2626 59.2765 29.9205 178.5080 139 M 3.9230 7.5908 118.7041 58.2321 32.2664 177.8649 140 R 3.6699 6.9756 118.6969 59.5964 30.0997 178.2987 141 N 4.3441 8.1747 115.9034 55.9319 38.4795 177.4033 142 A 3.9726 8.1325 122.3921 55.0219 18.4334 179.7695 143 W 4.2243 8.2084 117.1822 59.8012 29.0633 178.9017 144 G 3.8094 8.6127 106.0069 48.0923 0.0000 175.5669 145 E 4.0479 8.7636 121.3720 58.9517 29.4918 179.2789 146 A 3.5390 8.1368 120.8297 55.1208 18.3343 179.0105 147 Y 3.9519 8.3856 118.2571 61.0977 38.8843 177.9528 148 D 4.4476 8.6315 120.0118 57.6227 40.8887 179.0530 149 Q 3.8831 7.9549 118.5339 58.4908 28.6951 178.0911 150 L 3.7441 7.7509 121.4370 58.2496 42.1149 179.2968 151 V 3.0283 7.6324 118.0748 65.7193 31.3476 177.7265 152 A 3.8962 7.9417 120.3236 55.0197 17.9200 179.5631 153 A 3.8565 7.5665 118.3718 55.2223 18.8041 179.5486 154 I 3.7592 7.6808 118.3680 64.6050 37.1170 178.7955 155 K 3.9417 8.3536 119.4589 59.5971 31.5637 179.3816 156 Q 4.0013 7.8774 117.5823 58.4910 28.7650 177.0673 157 E 4.4321 7.9687 117.7757 56.6961 29.5206 177.1050 158 M 4.7634 8.1432 117.5894 54.8991 33.1287 175.5560 159 K 4.7321 7.5230 117.0705 53.3203 36.0059 174.3102 160 P 4.4215 0.0000 0.0000 63.2749 31.2115 176.5574 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 V 8.05 4.07 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 0.98 0.00 0.00 0.94 0.00 0.00 10 F 8.52 4.73 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 11 S 8.33 4.23 0.00 4.13 3.83 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 0.00 0.00 0.00 12 E 8.60 3.82 0.00 2.00 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 2.33 2.38 0.00 13 E 7.96 3.88 0.00 1.94 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 2.32 2.39 0.00 14 K 7.38 3.70 0.00 0.79 0.83 0.00 1.17 0.00 0.00 1.21 0.00 0.00 2.76 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.14 1.09 7.81 15 E 7.87 3.95 0.00 2.05 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 0.00 2.32 2.39 0.00 16 A 7.89 4.04 1.34 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 17 L 7.78 3.96 0.00 1.75 1.74 0.85 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.76 3.25 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 0.37 0.00 0.00 0.16 0.00 0.00 19 L 8.34 4.16 0.00 1.75 1.78 0.95 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 20 K 8.16 4.09 0.00 2.08 2.12 0.00 1.36 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.70 1.55 7.81 21 S 8.25 4.43 0.00 4.40 4.50 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 22 W 9.38 4.77 0.00 3.67 3.34 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 23 A 8.21 3.80 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 24 I 7.44 3.81 2.08 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.80 0.98 0.00 0.00 25 M 8.31 4.15 0.00 2.44 2.50 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.95 2.64 0.00 26 K 7.43 3.16 0.00 0.79 1.26 0.00 1.55 0.00 0.00 1.54 0.00 0.00 2.13 0.00 0.00 2.52 0.00 0.00 0.00 0.00 1.01 0.21 7.81 27 K 7.43 4.24 0.00 1.80 1.80 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.32 7.81 28 D 8.17 4.87 0.00 2.66 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 S 8.46 4.41 0.00 4.51 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 30 A 8.03 3.99 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 31 N 8.05 4.21 0.00 2.82 3.21 0.00 0.00 7.12 6.66 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 32 L 8.18 3.83 0.00 1.38 0.96 1.07 0.98 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 33 G 8.20 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 34 L 7.76 3.99 0.00 1.79 1.81 0.94 0.99 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 35 R 8.17 3.89 0.00 1.93 1.91 0.00 3.09 0.00 0.00 3.02 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.74 0.00 36 F 8.15 4.46 0.00 2.84 3.26 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 37 F 8.19 3.08 0.00 3.06 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 38 L 8.32 4.17 0.00 1.70 1.77 0.95 1.17 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 39 K 8.22 3.92 0.00 1.92 2.02 0.00 1.60 0.00 0.00 1.69 0.00 0.00 3.26 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.56 7.81 40 I 7.43 3.50 0.94 0.00 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 -0.11 0.57 0.00 0.00 41 F 7.79 4.78 0.00 3.11 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 42 E 8.28 4.01 0.00 2.09 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 2.36 2.38 0.00 43 I 7.82 4.06 2.02 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.82 0.89 0.00 0.00 44 A 8.15 4.66 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 P 0.00 4.57 0.00 2.19 2.15 0.00 3.92 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.18 0.00 46 S 8.21 4.16 0.00 4.07 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 47 A 8.24 4.13 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 R 8.00 3.22 0.00 1.76 1.78 0.00 2.92 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.97 0.00 49 Q 7.62 4.12 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.79 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 50 M 7.80 4.20 0.00 1.32 2.03 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.31 0.00 51 F 7.55 4.24 0.00 2.70 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 P 0.00 4.22 0.00 2.29 2.20 0.00 3.49 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.25 0.00 53 F 7.90 4.51 0.00 3.09 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 L 7.42 4.59 0.00 1.62 1.42 0.36 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 55 R 7.50 4.01 0.00 1.73 1.82 0.00 3.12 0.00 0.00 3.39 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 0.00 56 D 8.77 4.64 0.00 3.08 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 57 S 8.40 4.55 0.00 3.86 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 58 D 8.23 4.46 0.00 2.77 2.80 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 0.00 0.00 0.00 59 V 7.02 3.12 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 0.64 0.00 0.00 0.94 0.00 0.00 60 P 0.00 4.51 0.00 2.17 1.95 0.00 3.61 0.00 0.00 3.85 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 L 8.70 3.98 0.00 1.72 1.78 0.90 0.65 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 62 E 8.21 3.86 0.00 1.94 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 2.33 2.42 0.00 63 T 7.16 4.22 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 1.21 0.00 0.00 64 N 8.19 4.12 0.00 2.88 2.80 0.00 0.00 6.82 7.29 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 65 P 0.00 4.23 0.00 2.25 2.26 0.00 3.74 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.04 0.00 66 K 8.00 3.73 0.00 1.68 1.13 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.35 1.39 7.81 67 L 7.85 3.86 0.00 1.81 1.81 0.90 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 68 K 7.73 3.90 0.00 1.93 1.80 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.56 7.81 69 T 7.49 3.81 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 1.14 0.00 0.00 70 H 8.06 3.95 0.00 2.87 3.14 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 A 7.91 3.27 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 V 7.53 3.70 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 1.24 0.00 0.00 1.00 0.00 0.00 73 S 7.86 4.11 0.00 3.97 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 74 V 7.95 3.77 2.45 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 1.34 0.00 0.00 0.95 0.00 0.00 75 F 8.90 4.39 0.00 3.56 3.32 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 76 V 8.30 3.43 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 1.09 0.00 0.00 1.28 0.00 0.00 77 M 8.11 3.94 0.00 2.30 2.09 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.61 0.00 78 T 7.98 3.80 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 1.32 0.00 0.00 79 C 7.65 4.04 0.00 1.23 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 80 E 8.09 3.68 0.00 1.89 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 2.39 2.57 0.00 81 A 7.81 3.95 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 A 7.66 3.63 0.96 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 0.00 0.00 83 A 7.86 3.93 1.29 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 0.00 0.00 84 Q 7.66 4.42 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.70 0.00 0.00 0.00 0.00 0.00 2.47 2.46 0.00 85 L 7.20 3.92 0.00 1.55 1.35 0.80 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 86 R 7.87 3.95 0.00 2.11 2.02 0.00 3.51 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.75 0.00 87 K 8.07 3.96 0.00 1.76 1.97 0.00 1.83 0.00 0.00 1.87 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.46 7.81 88 A 8.59 4.23 1.34 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 89 G 8.49 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 0.00 0.00 0.00 0.00 90 K 7.13 4.39 0.00 1.71 1.72 0.00 1.59 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.52 1.34 7.81 91 I 8.15 3.75 1.78 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.80 0.82 0.00 0.00 92 T 8.18 4.63 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 1.18 0.00 0.00 93 V 7.93 4.23 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 0.90 0.00 0.00 0.89 0.00 0.00 94 R 8.71 3.88 0.00 1.77 1.92 0.00 3.43 0.00 0.00 3.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.72 0.00 95 E 9.26 3.86 0.00 2.18 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 2.23 2.30 0.00 96 T 7.46 4.51 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 1.29 0.00 0.00 97 T 8.16 4.77 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 98 L 8.46 3.99 0.00 1.67 1.70 0.88 0.75 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 99 K 8.00 4.01 0.00 1.83 1.81 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.54 7.81 100 R 7.94 3.96 0.00 2.07 2.00 0.00 3.21 0.00 0.00 3.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.74 0.00 101 L 8.25 4.20 0.00 1.88 1.82 0.96 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 0.00 102 G 8.16 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 G 8.26 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 T 8.37 4.03 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 1.29 0.00 0.00 105 H 8.54 4.28 0.00 3.41 3.50 0.00 5.82 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 0.00 106 L 8.34 4.01 0.00 2.01 1.84 1.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 107 K 7.96 3.96 0.00 1.88 1.63 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.65 7.81 108 Y 7.96 4.30 0.00 2.86 2.83 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 0.00 0.00 0.00 109 G 7.82 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 110 V 7.93 3.60 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 0.88 0.00 0.00 111 A 8.47 4.94 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 0.00 112 D 8.86 4.81 0.00 2.77 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 0.00 113 G 8.09 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 H 7.98 4.22 0.00 3.19 3.20 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 0.00 115 F 8.16 4.52 0.00 3.32 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 0.00 116 E 8.30 4.10 0.00 2.29 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 2.44 2.69 0.00 117 V 7.91 3.64 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.98 0.00 0.00 118 T 8.13 3.87 4.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 119 R 8.27 2.86 0.00 1.85 2.09 0.00 3.22 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.14 0.00 120 F 8.21 4.06 0.00 3.23 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 0.00 121 A 8.46 4.02 1.45 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 0.00 0.00 122 L 8.30 3.37 0.00 1.28 1.47 0.08 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 123 L 7.67 3.91 0.00 1.55 1.78 0.95 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 124 E 7.94 3.59 0.00 1.73 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 0.00 1.47 2.10 0.00 125 T 7.74 3.71 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 1.00 0.00 0.00 126 I 7.61 3.49 1.57 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.57 0.64 0.00 0.00 127 K 7.35 2.48 0.00 0.79 1.28 0.00 1.10 0.00 0.00 1.26 0.00 0.00 2.71 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.76 0.21 7.81 128 E 7.38 3.97 0.00 1.80 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 2.17 2.15 0.00 129 A 7.46 4.31 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 0.00 130 L 6.61 4.84 0.00 1.65 1.66 1.22 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 131 P 0.00 4.33 0.00 2.22 2.00 0.00 3.67 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 2.16 2.12 0.00 132 A 8.74 4.10 1.34 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 0.00 133 D 8.20 4.42 0.00 2.67 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 0.00 134 M 8.03 4.27 0.00 2.23 2.39 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.55 0.00 135 W 8.14 4.71 0.00 3.40 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 0.00 136 G 6.19 3.82 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 0.00 0.00 0.00 137 P 0.00 4.09 0.00 2.20 2.25 0.00 3.58 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 138 E 7.84 3.87 0.00 2.08 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 2.26 2.23 0.00 139 M 7.59 3.92 0.00 1.62 2.12 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.88 2.96 0.00 140 R 6.98 3.67 0.00 1.20 1.75 0.00 3.16 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 141 N 8.17 4.34 0.00 2.77 2.83 0.00 0.00 6.95 7.35 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 0.00 142 A 8.13 3.97 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 0.00 143 W 8.21 4.22 0.00 3.55 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 0.00 144 G 8.61 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 E 8.76 4.05 0.00 2.27 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 2.40 2.56 0.00 146 A 8.14 3.54 0.96 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 0.00 0.00 147 Y 8.39 3.95 0.00 3.15 3.22 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 0.00 148 D 8.63 4.45 0.00 2.96 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 0.00 149 Q 7.95 3.88 0.00 2.08 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.77 0.00 0.00 0.00 0.00 0.00 2.32 2.49 0.00 150 L 7.75 3.74 0.00 1.57 1.58 0.82 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 151 V 7.63 3.03 1.69 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 -0.17 0.00 0.00 0.15 0.00 0.00 152 A 7.94 3.90 1.30 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 0.00 153 A 7.57 3.86 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 0.00 154 I 7.68 3.76 1.79 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.82 0.96 0.00 0.00 155 K 8.35 3.94 0.00 1.81 1.79 0.00 1.53 0.00 0.00 1.60 0.00 0.00 3.13 0.00 0.00 2.52 0.00 0.00 0.00 0.00 1.37 1.13 7.81 156 Q 7.88 4.00 0.00 2.18 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.14 0.00 0.00 0.00 0.00 0.00 2.36 2.51 0.00 157 E 7.97 4.43 0.00 2.16 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 2.28 2.43 0.00 158 M 8.14 4.76 0.00 2.04 2.23 0.00 0.00 0.00 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.77 0.00 159 K 7.52 4.73 0.00 1.69 1.67 0.00 1.93 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.43 7.81 160 P 0.00 4.42 0.00 2.04 1.99 0.00 3.71 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00