NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.7782 8.0549 120.2940 61.4956 32.5152 175.2701 2 D 4.5088 7.9946 123.8803 51.7605 40.5082 173.9374 3 W 4.6815 8.1120 123.9989 56.3280 31.1283 177.0243 4 T 4.4507 9.1007 113.5620 60.9108 70.8273 175.6378 5 D 4.3861 8.7852 122.2797 57.8075 40.7897 179.1065 6 A 4.0081 8.0811 120.3141 55.3436 18.3247 179.2940 7 E 3.9941 8.2919 116.8278 59.6644 29.6376 179.6599 8 R 3.6516 8.2539 118.2397 59.4253 30.2063 179.0407 9 S 4.0385 8.3527 112.7022 61.3027 62.2904 175.9957 10 A 4.0137 8.2829 123.7294 55.1715 18.0507 179.7795 11 I 3.5983 7.8850 118.3744 64.4113 37.1953 178.7910 12 V 3.5917 7.7246 119.1415 65.9251 31.1438 178.1337 13 G 3.6434 8.2501 104.3656 47.8411 0.0000 175.0324 14 L 4.0720 8.1859 123.3424 57.5532 41.9993 178.8636 15 W 4.1619 8.5479 128.6930 60.2961 30.3668 178.1641 16 G 3.7663 8.1402 105.3909 46.8561 0.0000 174.7189 17 K 4.3436 7.4809 117.9784 55.6488 33.4377 176.1293 18 I 4.2190 6.4249 112.0089 59.0951 39.8985 175.6323 19 S 4.3004 8.0896 116.9119 57.2256 63.2353 175.1950 20 V 3.3817 8.0239 129.3981 65.9793 31.1259 177.3261 21 D 4.4395 7.5139 116.6797 56.0906 40.6824 177.4370 22 E 4.2762 7.8015 119.2886 58.4538 30.3882 177.8248 23 I 3.8622 7.6440 119.9635 64.0009 37.1509 178.4566 24 G 3.6745 7.9407 106.6445 47.6367 0.0000 173.8474 25 P 4.2622 0.0000 0.0000 65.0333 31.3750 178.7951 26 Q 3.9237 7.7583 115.2311 58.8978 28.6554 178.7024 27 A 3.9763 8.1141 121.8568 54.9692 18.3305 179.5328 28 L 3.7885 7.8673 118.4777 58.0259 41.8945 178.7197 29 A 3.8570 7.7736 120.8015 55.3513 18.2015 179.6001 30 R 3.7667 7.9944 116.9403 59.2639 30.0577 178.2613 31 L 3.8147 7.7530 120.0866 58.3808 42.2249 179.1432 32 L 3.7997 7.9185 119.7678 56.4715 41.1653 179.2974 33 I 3.8671 6.8640 118.6247 63.5138 37.8060 177.8676 34 V 3.7643 7.8109 118.0582 64.2009 33.0025 176.3638 35 S 3.3619 8.0082 114.9318 55.4744 62.5844 172.8352 36 P 4.7031 0.0000 0.0000 63.6151 31.7556 178.2631 37 W 4.3887 7.4661 116.9956 59.3877 27.4671 177.6601 38 T 4.1987 7.5718 110.5614 64.0662 68.2796 176.3190 39 Q 4.1707 8.0682 121.3726 58.4740 28.3873 178.0188 40 R 3.8600 7.5250 119.0957 59.5077 30.0058 176.9901 41 H 4.6124 7.8387 112.3901 55.5365 29.5052 175.4549 42 F 4.7550 7.7959 119.5967 56.9455 39.5857 177.3606 43 S 4.2935 8.2994 117.8937 61.1921 62.7085 175.2882 44 T 4.2095 8.0842 110.2765 63.2859 69.0798 175.5319 45 F 4.5659 8.4194 120.5174 57.7311 40.0179 174.9605 46 G 4.1551 6.9974 107.4261 44.5314 0.0000 176.4380 47 N 4.8305 8.9010 124.5235 52.0448 39.4735 174.1711 48 L 4.8261 8.3580 123.1126 54.6215 44.2203 177.3473 49 S 4.2442 8.4332 115.4234 61.1817 62.9032 175.0154 50 T 4.6573 7.4325 110.5737 58.0540 72.6856 172.8143 51 P 4.1780 0.0000 0.0000 65.6380 30.7077 178.3908 52 A 3.9183 8.1518 118.7492 55.3378 17.9770 178.9961 53 A 3.9395 7.3814 117.2757 55.6412 18.7283 179.6418 54 I 3.7855 7.5243 117.3889 64.9834 37.0194 178.7677 55 M 4.2201 7.8103 117.5883 57.5103 31.8010 178.0389 56 G 4.1311 7.1888 103.6327 43.2213 0.0000 173.0332 57 N 4.4475 7.7915 121.5006 52.7875 39.0194 173.8662 58 P 4.4308 0.0000 0.0000 65.0085 31.5259 178.3629 59 A 3.9823 8.3091 121.4501 55.3340 18.4414 179.4329 60 V 3.4568 8.3512 116.0495 66.1615 31.3648 177.8703 61 A 3.9630 8.4265 120.6218 55.1326 18.3141 179.5113 62 K 3.9181 8.3297 118.5121 60.0658 32.2492 178.5303 63 H 4.4904 8.8970 118.7167 58.7704 29.6134 177.5129 64 G 3.5746 8.2970 107.9571 47.8916 0.0000 175.9015 65 K 4.0168 8.4389 121.9157 59.1744 32.0517 179.6202 66 T 3.9714 8.0631 116.2891 66.5006 68.3335 176.7360 67 V 3.6175 7.9506 120.2781 66.4519 31.5833 178.1000 68 M 4.4514 7.9286 118.2807 58.7918 31.9266 178.5278 69 H 4.6208 8.2918 116.4618 58.5928 28.5815 177.9123 70 G 3.9416 7.8262 108.3716 47.1879 0.0000 175.2171 71 L 4.5931 8.1253 121.4989 55.9006 41.7716 178.6245 72 D 4.5651 8.1282 119.6438 57.7000 40.6062 179.0314 73 R 4.3157 8.2292 115.6036 57.9465 30.0794 178.2670 74 A 4.1163 7.8631 121.5111 55.2055 18.3096 179.6127 75 V 3.2845 7.3335 115.3884 65.9069 31.5070 177.7495 76 Q 4.2808 7.9490 118.0131 57.8785 29.4678 175.6323 77 N 5.0712 7.7913 117.8224 51.6582 39.5360 174.3328 78 L 4.1145 8.0702 122.5170 56.5079 42.0472 177.7439 79 D 4.9758 7.9654 116.3854 54.5322 41.3220 176.0388 80 D 4.9115 8.1398 119.2835 53.1615 42.4789 177.4846 81 I 3.7917 8.2476 120.5917 63.8257 36.8326 177.5538 82 K 3.9274 8.1870 118.8404 59.9562 31.7272 178.7653 83 N 4.4039 7.6240 113.0231 55.9424 38.5660 177.4101 84 T 3.8542 7.3971 116.4593 65.7571 68.5356 175.2264 85 Y 4.7359 6.9993 116.3876 57.6117 38.2215 177.5143 86 V 3.6198 7.7092 121.4599 66.5679 31.5659 177.9364 87 T 3.8461 7.8843 114.5376 66.8347 68.3330 176.3397 88 L 4.0983 8.0349 120.2103 57.8460 41.7281 179.4511 89 S 4.3998 8.6453 114.6028 61.2004 62.4036 176.8100 90 V 3.5475 7.8559 114.9342 64.1748 31.1700 178.4152 91 M 3.8930 7.9722 118.2555 59.0800 32.2054 178.0916 92 H 4.1339 8.5665 116.4825 58.4650 28.2755 177.8509 93 S 3.5309 7.6025 114.8752 60.8733 62.0444 175.5723 94 E 4.0135 7.9247 119.0700 56.7383 29.8901 177.1735 95 K 3.9321 7.3411 118.3260 57.7697 33.0514 177.0610 96 L 4.1892 7.3740 115.9939 54.1638 42.5919 176.4159 97 F 4.0623 7.0611 115.1984 57.1763 36.2887 175.7383 98 V 3.8511 8.2795 119.8229 61.5215 32.2896 174.6466 99 D 4.3163 8.7894 127.2263 53.7932 41.3269 174.9760 100 P 3.0675 0.0000 0.0000 64.5183 31.5998 177.8051 101 D 4.3088 8.1535 118.9137 57.3052 40.8675 177.6327 102 N 4.5253 8.2617 117.1798 55.6863 38.3094 177.3181 103 F 4.4515 7.4846 119.9027 60.4490 38.8964 177.3262 104 R 3.9047 8.0881 117.8370 59.6490 29.9217 178.3640 105 L 4.0229 7.8071 118.2132 57.6266 41.5246 179.3488 106 L 3.9349 8.3821 120.3986 58.0015 42.0120 178.6093 107 A 3.9961 8.3038 121.1061 55.5821 18.3125 179.2996 108 D 4.3482 8.4280 117.4202 57.7942 40.7972 178.9587 109 C 4.1794 8.2059 117.1768 62.7059 28.0234 176.0043 110 I 3.7375 8.1601 121.8316 64.8486 36.7221 178.2801 111 T 4.0935 8.1879 116.5085 66.9264 68.3792 176.5909 112 V 3.5788 7.8732 119.7334 66.3065 31.5251 177.8572 113 C 4.0950 8.2655 116.5293 62.7715 27.8648 176.3233 114 V 3.3369 7.9958 119.9211 65.6473 30.9549 177.9064 115 A 3.5531 7.6536 120.3553 55.0573 18.0187 179.5110 116 A 3.8825 7.6652 117.9682 54.9354 18.4682 179.5737 117 K 3.9445 7.8609 117.2780 59.6231 32.4750 178.5863 118 L 4.2994 7.9729 117.2071 53.8521 42.3965 178.0730 119 G 4.0834 8.0863 105.0700 44.2419 0.0000 172.5672 120 P 4.3590 0.0000 0.0000 65.0481 31.7937 178.7841 121 A 4.0700 8.0400 121.5589 55.0986 18.9670 178.7202 122 V 3.6832 7.9427 113.6646 65.9450 32.1154 176.8958 123 F 4.6152 7.8922 122.9349 56.8790 37.5848 174.7992 124 S 4.6373 7.6604 121.6537 56.8503 65.8186 174.9965 125 A 3.8864 8.2767 122.8014 55.4127 18.1575 179.5239 126 D 4.3172 7.9372 116.9413 57.6310 40.8700 178.9700 127 T 3.8298 7.7004 116.1743 66.6770 68.4616 176.5511 128 Q 3.6425 7.8978 121.8075 58.7180 28.9041 177.9461 129 E 3.9033 8.1462 120.3002 59.1481 29.7310 178.5899 130 A 4.1647 7.9346 120.4717 55.3094 18.4768 179.3237 131 F 4.6041 8.6888 119.4358 61.6519 39.4602 177.0698 132 Q 3.9213 8.8355 119.6048 59.0163 28.9139 177.9252 133 K 3.8709 8.1575 120.6924 59.5526 32.2212 178.2179 134 F 4.6774 8.7312 120.7296 61.6628 39.3347 177.0358 135 L 3.5388 8.2518 118.5671 57.5627 41.3347 179.3107 136 A 3.9179 8.2795 121.0690 55.1720 18.2030 179.8282 137 V 3.4500 7.7687 116.5858 66.1552 31.5453 178.4424 138 V 3.3597 7.4733 117.9224 65.7760 31.3673 178.1317 139 V 3.3308 7.9406 118.4224 65.8658 31.1395 177.8753 140 S 4.0179 7.9069 111.4648 61.3984 62.6478 175.5276 141 A 4.1774 8.1700 123.6535 55.4211 17.8841 179.6743 142 L 3.9308 8.0772 117.4552 57.0083 41.2919 178.9344 143 G 4.0554 7.9248 103.8605 45.2478 0.0000 175.5579 144 R 4.0434 7.8457 120.8089 58.7448 30.1233 176.7668 145 Q 4.5374 8.1238 115.5644 55.6248 28.9716 174.8779 146 Y 4.1217 8.0326 117.8346 57.9867 38.1449 175.5549 147 H 4.5864 8.4566 119.7499 55.7237 28.8373 173.1618 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 V 8.05 3.78 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 0.96 0.00 0.00 -0.15 0.00 0.00 2 D 7.99 4.51 0.00 2.65 2.62 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 0.00 3 W 8.11 4.68 0.00 3.30 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 4 T 9.10 4.45 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 5 D 8.79 4.39 0.00 2.73 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 6 A 8.08 4.01 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 7 E 8.29 3.99 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 2.63 2.48 0.00 8 R 8.25 3.65 0.00 1.97 1.87 0.00 3.14 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.96 0.00 9 S 8.35 4.04 0.00 3.99 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 10 A 8.28 4.01 1.42 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 11 I 7.88 3.60 1.70 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.66 0.21 0.00 0.00 12 V 7.72 3.59 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 0.98 0.00 0.00 0.84 0.00 0.00 13 G 8.25 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.19 4.07 0.00 1.79 1.85 0.88 0.67 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 15 W 8.55 4.16 0.00 3.41 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 16 G 8.14 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 17 K 7.48 4.34 0.00 1.90 1.87 0.00 1.55 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.58 1.35 7.81 18 I 6.42 4.22 1.58 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.04 0.68 0.00 0.00 19 S 8.09 4.30 0.00 3.81 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 20 V 8.02 3.38 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 0.64 0.00 0.00 0.46 0.00 0.00 21 D 7.51 4.44 0.00 2.76 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 22 E 7.80 4.28 0.00 1.96 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 2.25 2.33 0.00 23 I 7.64 3.86 1.73 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.52 0.86 0.00 0.00 24 G 7.94 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 4.26 0.00 2.14 2.10 0.00 3.65 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.38 0.00 26 Q 7.76 3.92 0.00 2.24 2.11 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 2.34 2.49 0.00 27 A 8.11 3.98 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 L 7.87 3.79 0.00 1.73 1.55 0.70 0.68 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 29 A 7.77 3.86 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 30 R 7.99 3.77 0.00 2.05 2.04 0.00 3.09 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 31 L 7.75 3.81 0.00 1.86 1.79 0.86 0.48 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 32 L 7.92 3.80 0.00 1.77 1.60 0.69 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 33 I 6.86 3.87 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 1.35 0.51 0.86 0.00 0.00 34 V 7.81 3.76 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 0.79 0.00 0.00 0.89 0.00 0.00 35 S 8.01 3.36 0.00 3.53 2.77 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 36 P 0.00 4.70 0.00 2.20 2.25 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 2.05 1.79 0.00 37 W 7.47 4.39 0.00 3.58 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 38 T 7.57 4.20 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 1.22 0.00 0.00 39 Q 8.07 4.17 0.00 2.27 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.71 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 40 R 7.53 3.86 0.00 1.92 1.91 0.00 3.24 0.00 0.00 3.14 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.66 0.00 41 H 7.84 4.61 0.00 2.62 2.69 0.00 5.65 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 F 7.80 4.75 0.00 2.90 2.65 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 43 S 8.30 4.29 0.00 4.03 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 44 T 8.08 4.21 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 45 F 8.42 4.57 0.00 3.35 3.25 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 46 G 7.00 4.16 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 0.00 47 N 8.90 4.83 0.00 2.69 2.75 0.00 0.00 6.59 7.78 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 48 L 8.36 4.83 0.00 1.63 1.58 1.04 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.43 4.24 0.00 3.96 4.02 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 50 T 7.43 4.66 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 1.21 0.00 0.00 51 P 0.00 4.18 0.00 2.16 2.12 0.00 3.61 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.14 0.00 52 A 8.15 3.92 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 53 A 7.38 3.94 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 I 7.52 3.79 1.97 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 0.79 0.88 0.00 0.00 55 M 7.81 4.22 0.00 1.97 2.11 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 2.60 2.52 0.00 56 G 7.19 4.13 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 0.00 0.00 0.00 57 N 7.79 4.45 0.00 2.98 2.82 0.00 0.00 6.93 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 P 0.00 4.43 0.00 2.32 2.30 0.00 3.77 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.04 0.00 59 A 8.31 3.98 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 60 V 8.35 3.46 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 0.87 0.00 0.00 0.84 0.00 0.00 61 A 8.43 3.96 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 62 K 8.33 3.92 0.00 1.99 1.90 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.49 7.81 63 H 8.90 4.49 0.00 3.75 3.49 0.00 5.84 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 64 G 8.30 3.57 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 0.00 0.00 0.00 65 K 8.44 4.02 0.00 2.07 1.96 0.00 1.71 0.00 0.00 1.86 0.00 0.00 3.14 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.67 7.81 66 T 8.06 3.97 4.40 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 1.31 0.00 0.00 67 V 7.95 3.62 2.22 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 1.08 0.00 0.00 0.95 0.00 0.00 68 M 7.93 4.45 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.87 0.00 69 H 8.29 4.62 0.00 3.23 3.43 0.00 5.63 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 70 G 7.83 3.94 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 0.00 0.00 0.00 71 L 8.13 4.59 0.00 2.14 1.61 0.80 1.24 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 72 D 8.13 4.57 0.00 3.19 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 73 R 8.23 4.32 0.00 1.85 2.03 0.00 2.64 0.00 0.00 3.95 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.31 0.00 74 A 7.86 4.12 1.60 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 0.00 0.00 75 V 7.33 3.28 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 0.56 0.00 0.00 -0.40 0.00 0.00 76 Q 7.95 4.28 0.00 2.25 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.56 0.00 0.00 0.00 0.00 0.00 2.38 2.51 0.00 77 N 7.79 5.07 0.00 2.62 2.59 0.00 0.00 7.18 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 78 L 8.07 4.11 0.00 1.33 0.98 0.17 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.97 4.98 0.00 2.86 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 80 D 8.14 4.91 0.00 2.71 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 0.00 0.00 0.00 0.00 81 I 8.25 3.79 2.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.01 1.09 0.00 0.00 82 K 8.19 3.93 0.00 1.82 1.90 0.00 1.67 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.56 1.58 7.81 83 N 7.62 4.40 0.00 2.87 2.85 0.00 0.00 7.14 7.42 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 84 T 7.40 3.85 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 0.57 0.00 0.00 85 Y 7.00 4.74 0.00 3.00 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 86 V 7.71 3.62 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 1.09 0.00 0.00 1.03 0.00 0.00 87 T 7.88 3.85 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 1.22 0.00 0.00 88 L 8.03 4.10 0.00 1.98 1.82 1.13 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.65 4.40 0.00 4.00 4.12 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 90 V 7.86 3.55 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 0.76 0.00 0.00 0.89 0.00 0.00 91 M 7.97 3.89 0.00 2.24 2.03 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.46 0.00 92 H 8.57 4.13 0.00 3.59 3.76 0.00 5.86 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 S 7.60 3.53 0.00 2.72 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 94 E 7.92 4.01 0.00 1.90 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.34 0.00 95 K 7.34 3.93 0.00 1.55 1.82 0.00 1.71 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.24 1.35 7.81 96 L 7.37 4.19 0.00 1.69 1.58 0.71 0.67 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 97 F 7.06 4.06 0.00 3.26 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 98 V 8.28 3.85 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 0.44 0.00 0.00 0.69 0.00 0.00 99 D 8.79 4.32 0.00 2.72 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 0.00 100 P 0.00 3.07 0.00 1.96 1.42 0.00 3.48 0.00 0.00 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.16 0.00 101 D 8.15 4.31 0.00 2.74 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 0.00 102 N 8.26 4.53 0.00 2.69 2.87 0.00 0.00 6.89 7.84 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 0.00 103 F 7.48 4.45 0.00 3.14 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 0.00 104 R 8.09 3.90 0.00 1.89 2.15 0.00 3.20 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.74 0.00 105 L 7.81 4.02 0.00 1.94 1.74 1.33 0.96 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 0.00 106 L 8.38 3.93 0.00 1.90 1.90 0.93 1.55 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 0.00 107 A 8.30 4.00 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 0.00 108 D 8.43 4.35 0.00 2.87 2.77 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 0.00 109 C 8.21 4.18 0.00 3.15 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 0.00 110 I 8.16 3.74 2.15 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 1.62 0.91 1.25 0.00 0.00 111 T 8.19 4.09 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 112 V 7.87 3.58 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 1.02 0.00 0.00 0.97 0.00 0.00 113 C 8.27 4.09 0.00 3.09 2.91 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 0.00 114 V 8.00 3.34 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 0.40 0.00 0.00 0.83 0.00 0.00 115 A 7.65 3.55 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 0.00 116 A 7.67 3.88 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 0.00 117 K 7.86 3.94 0.00 1.73 1.93 0.00 1.61 0.00 0.00 1.64 0.00 0.00 3.05 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.34 1.42 7.81 118 L 7.97 4.30 0.00 1.68 1.71 0.85 1.21 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 0.00 119 G 8.09 4.08 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 0.00 120 P 0.00 4.36 0.00 2.27 2.37 0.00 3.72 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.99 0.00 121 A 8.04 4.07 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 0.00 122 V 7.94 3.68 2.30 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 0.81 0.00 0.00 0.94 0.00 0.00 123 F 7.89 4.62 0.00 2.92 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 0.00 124 S 7.66 4.64 0.00 4.04 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 0.00 125 A 8.28 3.89 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 0.00 126 D 7.94 4.32 0.00 2.67 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.70 3.83 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 1.22 0.00 0.00 128 Q 7.90 3.64 0.00 1.22 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.60 0.00 129 E 8.15 3.90 0.00 2.16 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 2.34 2.49 0.00 130 A 7.93 4.16 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 F 8.69 4.60 0.00 3.39 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 Q 8.84 3.92 0.00 2.30 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.54 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 133 K 8.16 3.87 0.00 2.13 2.29 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.13 0.00 0.00 2.55 0.00 0.00 0.00 0.00 1.12 1.33 7.81 134 F 8.73 4.68 0.00 3.28 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 8.25 3.54 0.00 1.65 1.51 0.61 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 136 A 8.28 3.92 1.32 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 0.00 137 V 7.77 3.45 2.30 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 1.16 0.00 0.00 0.89 0.00 0.00 138 V 7.47 3.36 1.71 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 0.41 0.00 0.00 0.29 0.00 0.00 139 V 7.94 3.33 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 0.97 0.00 0.00 0.91 0.00 0.00 140 S 7.91 4.02 0.00 3.86 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 0.00 141 A 8.17 4.18 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.08 3.93 0.00 1.04 0.40 0.04 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 143 G 7.92 4.06 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 0.00 0.00 0.00 144 R 7.85 4.04 0.00 2.14 2.08 0.00 3.28 0.00 0.00 3.26 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 145 Q 8.12 4.54 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.64 0.00 0.00 0.00 0.00 0.00 2.39 2.64 0.00 146 Y 8.03 4.12 0.00 3.07 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 0.00 147 H 8.46 4.59 0.00 3.22 3.24 0.00 5.56 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00