NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.8743 8.3049 120.2878 55.3839 33.7962 174.4380 2 R 4.4939 8.7951 120.0973 53.6986 34.3161 172.6651 3 I 4.6903 8.5962 124.0778 59.9928 40.6772 174.1264 4 G 4.9591 8.8480 114.0989 43.8611 0.0000 170.6704 5 H 5.5586 8.9919 121.9224 54.0054 32.7881 172.9735 6 G 4.3222 9.1848 111.5082 44.4293 0.0000 171.2026 7 F 5.5240 8.7146 124.1089 56.4153 42.2611 173.0825 8 D 4.6065 8.1960 123.9037 52.6606 45.2319 173.9499 9 V 4.6676 7.8044 121.7628 61.5789 34.8813 173.9150 10 H 4.9724 8.8573 123.6041 53.8529 32.7150 172.6687 11 A 4.6863 8.4452 123.9798 51.2342 20.0926 176.8988 12 F 5.0392 8.8666 120.1334 57.3315 39.8570 175.5344 13 G 4.1653 9.5226 111.4823 47.5134 0.0000 174.6454 14 G 4.1502 8.2100 112.5880 44.4509 0.0000 172.0381 15 E 4.8262 8.1487 116.8362 56.2463 29.8748 176.2646 16 G 3.9913 8.7166 109.4753 43.6693 0.0000 170.3603 17 P 4.8301 0.0000 0.0000 62.4480 32.6246 175.8088 18 I 4.4644 8.5097 114.2027 59.6748 40.4525 174.3690 19 I 4.9636 8.1665 122.8764 59.4525 40.7216 174.1879 20 I 4.6010 8.4558 130.6229 60.3757 39.6093 176.1130 21 G 3.6671 10.6006 114.8102 46.6679 0.0000 175.1374 22 G 3.8787 8.9257 107.1743 44.8416 0.0000 174.0986 23 V 4.5367 7.5260 120.7492 61.0059 33.6464 174.9009 24 R 4.6959 8.7537 127.4293 56.1824 30.8366 175.7591 25 I 4.4269 8.8012 125.7980 58.5291 39.8159 173.6197 26 P 4.7351 0.0000 0.0000 62.9538 31.5106 175.3025 27 Y 4.8297 8.3360 122.8602 56.2803 41.6160 175.1987 28 E 3.5460 7.7300 125.0261 58.3317 29.8044 177.2095 29 K 4.8364 6.6558 116.5596 54.4149 35.6619 176.4568 30 G 4.2383 8.8801 110.8275 44.6545 0.0000 172.4295 31 L 5.1201 8.3138 119.7504 52.9347 42.5451 177.3327 32 L 4.2236 8.6600 125.5749 54.8201 41.5950 176.1182 33 A 4.7884 8.1112 128.0008 50.8959 22.0139 175.2381 34 H 4.7313 8.5369 114.6320 55.0070 28.3577 174.4029 35 S 4.5048 7.9094 116.3959 57.1300 68.9812 175.3608 36 D 4.7007 8.3418 118.1040 51.9848 38.5806 174.1277 37 G 3.5132 7.7626 106.5731 46.7213 0.0000 175.2515 38 D 4.8303 7.7470 121.2420 52.1491 39.0754 174.8923 39 V 3.8023 8.2196 125.1356 64.8050 31.7196 176.9329 40 A 3.9155 7.8597 119.6490 55.2783 18.2919 179.4928 41 L 4.0005 7.9407 116.9452 57.9162 41.7754 179.2847 42 H 4.2738 8.2925 116.2367 58.8052 28.5976 177.7037 43 A 3.9707 7.9534 122.6207 54.9108 18.0946 179.4501 44 L 3.8462 7.8921 118.8832 58.5830 42.2012 179.2087 45 T 3.8995 8.2432 116.0516 66.9587 68.4149 176.3069 46 D 4.4163 8.3649 120.4636 57.1885 40.8343 178.6420 47 A 4.1334 8.2292 121.4698 55.1193 18.3768 179.7805 48 L 3.9420 8.2297 117.6618 58.0598 41.8269 179.6900 49 L 4.1128 8.4841 119.4710 57.8521 41.3397 179.9549 50 G 3.7461 8.6768 105.8388 47.5745 0.0000 175.6581 51 A 4.4143 8.1870 122.8451 53.7255 18.5804 178.3425 52 A 3.5855 7.3940 116.1625 50.7738 19.3229 176.7271 53 A 3.6960 7.2750 119.1532 53.4776 16.7262 178.0151 54 L 4.5910 8.6063 116.8943 55.7961 43.4514 177.5597 55 G 3.9566 9.6187 112.3180 44.9417 0.0000 176.4454 56 D 4.7558 8.5813 127.4296 50.5982 42.3691 175.5693 57 I 3.9504 9.1619 113.3120 64.5550 36.8391 178.4638 58 G 3.5812 8.0919 105.9726 47.3178 0.0000 175.2047 59 K 4.0724 8.3763 121.4030 59.0479 32.2782 178.3163 60 L 3.9567 7.4456 119.3160 55.9513 43.3306 176.7295 61 F 4.9583 7.7700 116.9686 54.7673 39.1097 172.8074 62 P 4.6660 0.0000 0.0000 61.9795 32.5942 178.1319 63 D 4.4475 8.7720 119.6815 57.5824 40.8812 177.2336 64 T 4.4009 7.6355 108.0271 61.7905 68.5423 174.5678 65 D 4.7096 8.0019 121.9804 52.8996 43.4695 173.8909 66 P 4.3715 0.0000 0.0000 64.9582 32.0249 178.4527 67 A 3.8904 7.5298 122.5830 54.8882 18.2924 178.3749 68 F 4.7082 8.1214 111.5949 56.9029 39.6762 174.8556 69 K 4.0923 7.6753 122.6314 57.6290 32.0411 177.4281 70 G 3.8835 9.0974 114.2972 45.2412 0.0000 173.1236 71 A 4.1701 7.3630 123.1283 51.4501 19.2835 177.9977 72 D 4.6786 8.5025 121.4458 53.0863 41.6426 178.1033 73 S 4.1352 8.8411 116.2327 61.5977 62.5638 177.3967 74 R 3.8853 7.9078 120.6336 59.1360 29.8482 178.6231 75 E 4.0215 8.6725 118.5944 59.4700 29.4257 179.4503 76 L 3.4082 7.6603 118.5502 57.2421 41.5074 179.3516 77 L 3.9832 8.0271 120.4543 58.3409 42.0594 179.1987 78 R 4.1174 8.3150 118.3462 59.2986 29.9894 178.7498 79 E 4.0023 8.4162 118.8754 59.1834 29.6793 178.6215 80 A 3.9889 8.3732 120.9579 55.0747 18.5028 179.3795 81 W 4.4908 8.8067 127.2982 60.6160 30.7302 178.0579 82 R 3.7518 8.2798 118.8314 59.6632 29.0993 178.8140 83 R 3.9653 8.0001 117.6059 58.9074 29.8884 179.1619 84 I 3.8258 7.8519 120.0019 64.5028 37.1157 178.4846 85 Q 3.8924 8.2951 120.3440 58.0516 28.1687 178.5412 86 A 3.9842 7.7945 121.1727 54.7467 18.4553 179.2062 87 K 4.1297 7.3720 114.2950 57.2662 32.2817 177.9879 88 G 3.8872 7.5282 107.7280 45.0823 0.0000 173.0131 89 Y 4.8172 7.5388 117.5781 57.3393 39.7029 174.8836 90 T 4.8281 9.6901 119.6218 61.5874 72.6978 172.8205 91 L 4.3228 8.8676 125.4764 55.7083 42.3884 175.1700 92 G 3.8126 9.4401 116.8684 47.4009 0.0000 173.3926 93 N 5.2645 8.4385 113.9482 51.4358 41.9331 174.8417 94 V 4.9445 9.0030 112.6725 59.6640 35.9966 174.4914 95 D 5.1571 8.9943 122.4389 52.6968 44.5686 174.0734 96 V 4.7476 9.1190 126.2596 61.3634 34.5870 174.2854 97 T 5.0076 9.3217 125.2790 61.7796 70.9280 173.2004 98 I 4.1983 9.0668 129.3282 60.9197 38.5804 175.4900 99 I 4.8311 8.9485 129.0803 59.9152 38.4689 174.5076 100 A 4.7234 8.6250 128.3185 50.5793 21.7753 176.0475 101 Q 3.9990 9.0016 123.5116 58.7493 29.5801 175.9659 102 A 4.6107 7.4172 117.2313 50.0609 21.9563 173.6566 103 P 4.5894 0.0000 0.0000 61.3226 32.6798 175.8519 104 K 4.0849 8.4266 119.9086 56.9164 32.5388 176.1921 105 M 4.3794 8.5692 125.0495 56.8194 33.3774 177.8894 106 L 3.9081 8.1861 120.3016 58.0402 41.8711 177.2626 107 P 4.3095 0.0000 0.0000 64.7625 31.4653 177.2466 108 H 4.7169 8.0766 114.1586 56.2922 29.1351 177.2228 109 I 3.7028 7.4610 122.4009 63.8566 36.9962 176.0925 110 P 4.1565 0.0000 0.0000 65.9570 31.1289 178.3043 111 Q 3.7112 7.8846 117.2187 58.6573 28.9561 177.8354 112 M 4.5017 7.5181 121.5483 58.0256 31.9900 178.7209 113 R 3.9103 8.0529 118.2468 59.1386 30.1879 179.2349 114 V 3.4976 7.5354 117.7961 66.1180 31.6545 178.1205 115 F 4.5889 7.9650 117.4166 60.7224 38.7050 177.8361 116 I 3.6980 8.3643 119.6325 64.4007 36.8676 178.4084 117 A 3.9298 8.1967 121.6750 54.9730 17.5809 179.5589 118 E 3.9213 8.2223 117.2416 59.9042 29.3936 179.3933 119 D 4.4800 7.8680 116.9652 56.5318 40.9902 177.8105 120 L 3.5052 7.8509 116.9952 52.9143 42.7874 176.2880 121 G 4.0033 7.6518 106.3951 46.5997 0.0000 171.8319 122 C 4.7045 8.1104 111.6517 56.5990 33.6838 173.2320 123 H 4.7548 8.1946 116.1163 54.7592 29.8303 176.3951 124 M 3.9956 8.7456 120.4023 58.9136 31.7904 178.7564 125 D 4.4246 7.9985 115.9640 56.6306 41.7999 176.2979 126 D 4.5168 8.0413 117.4507 55.0612 41.2747 175.4801 127 V 4.6034 7.6539 119.6507 60.9656 33.6503 174.0451 128 N 5.0381 8.9878 127.1180 51.7002 41.4946 173.2271 129 V 5.0120 8.4078 125.2402 60.9784 34.4873 174.3365 130 K 4.8726 9.4199 125.7675 55.2068 36.5382 174.6873 131 A 5.2963 8.3838 121.0245 50.8444 22.3169 175.0994 132 T 4.6829 8.9656 113.4421 61.2799 71.4397 172.8960 133 T 4.9563 8.4137 116.2650 60.1543 71.6619 174.0022 134 T 4.4364 8.1548 108.9625 61.3283 69.4131 174.3477 135 E 3.8494 8.4158 118.1890 58.5841 27.4561 175.4315 136 K 4.1920 8.4895 111.8439 56.5543 30.8923 176.0440 137 L 4.5261 7.7508 119.1386 54.0204 43.7881 177.7611 138 G 4.2634 8.4839 110.3037 44.9126 0.0000 174.3376 139 F 4.7892 8.7375 114.5245 59.5011 37.7046 177.6069 140 T 4.2071 6.2215 111.5089 64.1599 68.6102 176.8593 141 G 3.6558 7.8348 108.2241 46.9030 0.0000 174.9020 142 R 4.5400 7.9127 117.9410 55.5404 30.2265 176.7025 143 G 4.1293 7.8343 106.6412 46.7897 0.0000 175.1767 144 E 4.3899 8.6297 121.9953 58.2271 30.0258 176.3467 145 G 3.8061 7.4281 103.9473 45.8707 0.0000 171.9152 146 I 4.7513 7.7358 119.8745 59.3017 40.1051 175.5616 147 A 5.0205 8.7743 128.3036 50.7522 22.2871 175.0481 148 C 5.0854 8.4558 118.5742 58.1472 35.5870 172.5768 149 E 5.4741 9.4628 125.1673 54.6921 32.4759 174.8911 150 A 5.1543 9.0371 124.3374 50.4701 23.0699 175.4123 151 V 5.0214 8.7886 114.1303 59.5917 35.6388 174.7749 152 A 5.0837 8.7737 123.9764 50.2812 22.9347 174.6114 153 L 5.1519 9.0870 124.3219 53.3302 44.4523 175.2745 154 L 5.3307 8.9736 125.9945 53.1250 45.0817 175.2832 155 I 4.8730 8.7979 122.1750 59.4130 40.3682 176.0784 156 K 4.2274 8.5938 125.7221 56.6106 32.3864 175.6000 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 8.30 4.87 0.00 1.96 2.10 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.63 0.00 2 R 8.80 4.49 0.00 1.68 1.85 0.00 3.30 0.00 0.00 3.27 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.76 0.00 3 I 8.60 4.69 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.29 0.92 0.00 0.00 4 G 8.85 4.96 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 0.00 5 H 8.99 5.56 0.00 3.14 3.16 0.00 5.68 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 6 G 9.18 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 F 8.71 5.52 0.00 3.01 2.95 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 8 D 8.20 4.61 0.00 2.67 2.35 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 9 V 7.80 4.67 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 0.81 0.00 0.00 0.86 0.00 0.00 10 H 8.86 4.97 0.00 2.97 3.01 0.00 5.66 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 11 A 8.45 4.69 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 12 F 8.87 5.04 0.00 3.08 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 G 9.52 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 0.00 0.00 0.00 14 G 8.21 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 0.00 0.00 0.00 15 E 8.15 4.83 0.00 2.08 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 2.25 2.19 0.00 16 G 8.72 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 P 0.00 4.83 0.00 2.11 2.09 0.00 3.77 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 18 I 8.51 4.46 1.92 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 1.25 0.93 1.17 0.00 0.00 19 I 8.17 4.96 1.85 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.67 0.89 0.00 0.00 20 I 8.46 4.60 1.85 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.75 0.88 0.00 0.00 21 G 10.60 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 22 G 8.93 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 23 V 7.53 4.54 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 1.02 0.00 0.00 1.18 0.00 0.00 24 R 8.75 4.70 0.00 1.76 1.88 0.00 3.22 0.00 0.00 3.23 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 25 I 8.80 4.43 1.81 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 0.87 0.45 0.83 0.00 0.00 26 P 0.00 4.74 0.00 1.97 2.02 0.00 3.71 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.10 0.00 27 Y 8.34 4.83 0.00 2.92 2.90 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 28 E 7.73 3.55 0.00 1.34 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 0.00 2.09 2.19 0.00 29 K 6.66 4.84 0.00 1.21 1.73 0.00 1.37 0.00 0.00 1.69 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.27 1.06 7.81 30 G 8.88 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 0.00 0.00 0.00 0.00 31 L 8.31 5.12 0.00 1.54 1.58 0.90 0.60 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 32 L 8.66 4.22 0.00 1.71 1.68 0.96 0.72 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 33 A 8.11 4.79 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 34 H 8.54 4.73 0.00 3.10 3.23 0.00 5.92 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 7.91 4.50 0.00 3.91 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 36 D 8.34 4.70 0.00 2.92 2.92 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 37 G 7.76 3.51 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 0.00 38 D 7.75 4.83 0.00 2.79 2.35 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 39 V 8.22 3.80 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 0.93 0.00 0.00 40 A 7.86 3.92 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 41 L 7.94 4.00 0.00 1.60 1.68 0.91 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 42 H 8.29 4.27 0.00 3.28 3.31 0.00 5.64 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 43 A 7.95 3.97 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 44 L 7.89 3.85 0.00 1.85 1.87 0.85 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 45 T 8.24 3.90 4.44 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 46 D 8.36 4.42 0.00 2.92 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 47 A 8.23 4.13 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.23 3.94 0.00 1.91 1.87 0.86 0.71 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 49 L 8.48 4.11 0.00 1.69 1.71 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 50 G 8.68 3.75 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 0.00 0.00 0.00 51 A 8.19 4.41 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 52 A 7.39 3.59 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 53 A 7.27 3.70 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 54 L 8.61 4.59 0.00 1.68 1.64 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 55 G 9.62 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 0.00 0.00 0.00 56 D 8.58 4.76 0.00 3.02 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 57 I 9.16 3.95 1.97 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 1.86 0.75 1.03 0.00 0.00 58 G 8.09 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 K 8.38 4.07 0.00 1.73 1.91 0.00 1.78 0.00 0.00 1.59 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.41 7.81 60 L 7.45 3.96 0.00 1.44 0.73 0.70 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 61 F 7.77 4.96 0.00 3.09 2.92 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 62 P 0.00 4.67 0.00 2.24 2.19 0.00 3.77 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.99 0.00 63 D 8.77 4.45 0.00 2.70 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 64 T 7.64 4.40 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 1.22 0.00 0.00 65 D 8.00 4.71 0.00 2.76 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 66 P 0.00 4.37 0.00 2.25 2.30 0.00 3.80 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 1.97 0.00 67 A 7.53 3.89 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 68 F 8.12 4.71 0.00 3.21 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 69 K 7.68 4.09 0.00 1.87 1.76 0.00 1.84 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.40 7.81 70 G 9.10 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 71 A 7.36 4.17 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 72 D 8.50 4.68 0.00 3.06 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 73 S 8.84 4.14 0.00 3.81 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 74 R 7.91 3.89 0.00 1.95 1.98 0.00 2.77 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.60 0.00 75 E 8.67 4.02 0.00 2.24 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 2.39 2.36 0.00 76 L 7.66 3.41 0.00 1.63 1.09 0.70 -0.51 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 77 L 8.03 3.98 0.00 1.84 1.86 0.90 0.99 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 78 R 8.32 4.12 0.00 2.10 2.09 0.00 3.25 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.88 0.00 79 E 8.42 4.00 0.00 2.23 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 1.94 2.32 0.00 80 A 8.37 3.99 1.54 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 0.00 0.00 81 W 8.81 4.49 0.00 3.45 3.31 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 82 R 8.28 3.75 0.00 2.16 2.14 0.00 3.18 0.00 0.00 3.40 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 83 R 8.00 3.97 0.00 1.88 1.91 0.00 3.06 0.00 0.00 3.11 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.85 0.00 84 I 7.85 3.83 1.96 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.81 0.89 0.00 0.00 85 Q 8.30 3.89 0.00 1.78 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 1.59 1.16 0.00 86 A 7.79 3.98 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 87 K 7.37 4.13 0.00 2.15 1.88 0.00 1.73 0.00 0.00 1.92 0.00 0.00 3.13 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.48 1.69 7.81 88 G 7.53 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 89 Y 7.54 4.82 0.00 3.04 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 T 9.69 4.83 4.36 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 1.33 0.00 0.00 91 L 8.87 4.32 0.00 1.66 1.64 0.66 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 92 G 9.44 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 93 N 8.44 5.26 0.00 2.86 2.88 0.00 0.00 5.72 7.68 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 94 V 9.00 4.94 2.02 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 0.64 0.00 0.00 0.85 0.00 0.00 95 D 8.99 5.16 0.00 2.74 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 0.00 0.00 0.00 0.00 96 V 9.12 4.75 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 0.89 0.00 0.00 0.90 0.00 0.00 97 T 9.32 5.01 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 98 I 9.07 4.20 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.69 0.88 0.00 0.00 99 I 8.95 4.83 1.94 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 1.17 0.97 0.86 0.00 0.00 100 A 8.62 4.72 1.20 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 0.00 0.00 101 Q 9.00 4.00 0.00 2.19 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.68 0.00 0.00 0.00 0.00 0.00 2.51 2.44 0.00 102 A 7.42 4.61 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 0.00 103 P 0.00 4.59 0.00 2.20 2.15 0.00 3.51 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.72 0.00 104 K 8.43 4.08 0.00 1.74 1.80 0.00 1.66 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.52 7.81 105 M 8.57 4.38 0.00 2.09 2.08 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 2.62 2.60 0.00 106 L 8.19 3.91 0.00 1.73 1.65 0.90 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 107 P 0.00 4.31 0.00 1.76 1.99 0.00 3.56 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.10 0.00 108 H 8.08 4.72 0.00 3.26 3.32 0.00 5.62 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 I 7.46 3.70 2.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.77 0.92 0.00 0.00 110 P 0.00 4.16 0.00 2.08 2.06 0.00 3.56 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.12 0.00 111 Q 7.88 3.71 0.00 1.99 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.91 0.00 0.00 0.00 0.00 0.00 2.16 1.46 0.00 112 M 7.52 4.50 0.00 2.06 2.24 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.88 2.78 0.00 113 R 8.05 3.91 0.00 1.96 1.94 0.00 3.10 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.79 0.00 114 V 7.54 3.50 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 0.90 0.00 0.00 0.87 0.00 0.00 115 F 7.97 4.59 0.00 3.24 2.92 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 0.00 116 I 8.36 3.70 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.72 0.82 0.00 0.00 117 A 8.20 3.93 1.38 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 0.00 0.00 118 E 8.22 3.92 0.00 2.35 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 2.38 2.59 0.00 119 D 7.87 4.48 0.00 2.78 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 0.00 120 L 7.85 3.51 0.00 1.23 0.85 0.52 -0.14 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 0.00 121 G 7.65 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.11 4.70 0.00 3.14 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 0.00 123 H 8.19 4.75 0.00 3.28 3.25 0.00 5.84 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 M 8.75 4.00 0.00 2.03 2.13 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.49 0.00 125 D 8.00 4.42 0.00 2.61 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 0.00 126 D 8.04 4.52 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 0.00 127 V 7.65 4.60 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 0.70 0.00 0.00 0.86 0.00 0.00 128 N 8.99 5.04 0.00 2.85 2.78 0.00 0.00 6.16 7.25 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 0.00 129 V 8.41 5.01 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 0.89 0.00 0.00 0.91 0.00 0.00 130 K 9.42 4.87 0.00 1.76 1.83 0.00 1.30 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.49 1.36 7.81 131 A 8.38 5.30 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 0.00 132 T 8.97 4.68 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 0.00 133 T 8.41 4.96 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 134 T 8.15 4.44 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 1.12 0.00 0.00 135 E 8.42 3.85 0.00 2.07 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.39 0.00 136 K 8.49 4.19 0.00 1.91 1.92 0.00 1.65 0.00 0.00 1.57 0.00 0.00 3.03 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.36 7.81 137 L 7.75 4.53 0.00 1.78 1.55 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 138 G 8.48 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 0.00 0.00 0.00 0.00 139 F 8.74 4.79 0.00 3.41 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 0.00 140 T 6.22 4.21 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 0.58 0.00 0.00 141 G 7.83 3.66 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 0.00 0.00 0.00 142 R 7.91 4.54 0.00 1.91 2.05 0.00 3.33 0.00 0.00 3.27 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.85 0.00 143 G 7.83 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 0.00 144 E 8.63 4.39 0.00 2.41 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.50 0.00 145 G 7.43 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 0.00 146 I 7.74 4.75 1.67 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 1.12 0.38 0.88 0.00 0.00 147 A 8.77 5.02 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 0.00 148 C 8.46 5.09 0.00 2.88 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 0.00 149 E 9.46 5.47 0.00 1.98 1.91 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 2.63 2.39 0.00 150 A 9.04 5.15 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 V 8.79 5.02 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 0.78 0.00 0.00 0.99 0.00 0.00 152 A 8.77 5.08 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 0.00 153 L 9.09 5.15 0.00 1.74 1.54 0.94 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 154 L 8.97 5.33 0.00 1.55 1.63 0.59 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 155 I 8.80 4.87 1.97 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 1.18 1.07 0.97 0.00 0.00 156 K 8.59 4.23 0.00 1.57 1.60 0.00 0.61 0.00 0.00 1.46 0.00 0.00 2.80 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.12 1.22 7.81