NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.3980 8.3344 115.2896 58.3475 64.3792 174.7238 3 R 3.7805 8.0656 118.9788 58.1142 30.1622 174.6057 4 R 4.1026 8.0432 118.2215 56.2103 30.6198 173.3120 5 G 3.6225 8.8257 116.3639 45.7518 0.0000 171.2131 6 T 4.4475 8.1439 122.0894 61.1875 70.0455 174.4494 7 V 4.3362 8.1512 126.1568 60.9157 33.0706 174.4639 8 E 4.1898 8.2683 128.7808 57.2541 30.1414 176.1963 9 E 4.6203 7.5121 117.0761 55.2950 32.4614 174.7868 10 K 4.4337 8.4678 119.4525 55.4399 33.5397 175.4899 11 T 4.5792 8.3286 117.6006 59.9306 70.5883 173.3845 12 A 4.8910 8.1356 130.7387 51.0261 20.9981 176.2816 13 K 4.2060 8.4095 114.3849 56.0845 32.9162 177.2578 14 S 4.3693 8.2973 117.1332 57.6180 63.9268 172.9972 15 D 4.3811 9.0613 120.1332 55.4052 40.6590 176.4063 16 P 3.6841 0.0000 0.0000 63.8844 32.5003 176.1803 17 I 4.5711 7.8415 116.8008 61.1187 39.9156 176.4931 18 Y 3.9007 8.4720 116.3781 58.4225 38.0157 173.5499 19 R 3.7476 7.7958 121.4576 56.5392 28.5251 174.2242 20 N 4.7614 8.0785 118.1469 52.2442 42.4969 175.9943 21 R 4.2550 8.5416 119.1982 57.5074 30.8277 178.3210 22 L 3.8303 7.8100 118.5881 57.6013 41.1378 178.5671 23 V 3.7883 7.6725 118.2284 64.3821 31.5742 176.4525 24 N 4.6399 7.7260 117.0338 55.2727 39.0884 176.0262 25 M 3.9204 7.6124 116.5335 57.6023 32.7089 178.1356 26 L 4.0622 7.7521 121.2192 57.1912 43.0087 178.8334 27 V 3.9821 7.7274 117.4581 63.4559 32.0467 177.3701 28 N 4.3713 7.4394 116.6924 54.7744 38.6461 176.6185 29 R 4.3108 7.5957 118.3350 57.4478 30.8520 177.4550 30 I 4.2327 7.1149 114.6314 59.9031 38.2016 175.1099 31 L 3.8970 6.9136 119.8588 55.8480 41.6853 175.7960 32 K 4.3745 8.6558 128.0272 55.7657 33.2344 174.9704 33 H 4.0794 10.2957 120.3902 56.4003 27.4584 174.8673 34 G 3.9290 8.4902 104.7785 46.4675 0.0000 174.8528 35 K 4.3714 7.5029 120.3693 54.2086 31.5525 176.7222 36 K 4.2803 8.1077 124.2037 57.7784 32.9431 179.1362 37 S 4.0556 8.0625 114.1037 60.9959 62.6574 174.6002 38 L 4.5723 7.8256 119.9052 55.5912 42.5742 177.5229 39 A 4.1997 7.6544 118.7118 54.8543 18.3374 178.7281 40 Y 4.2752 7.6846 118.2652 60.5243 38.6913 176.9098 41 Q 4.0495 7.5742 115.8069 57.0440 29.0196 177.2630 42 I 4.1264 7.0373 119.4357 62.9813 37.8861 177.2791 43 L 4.1850 7.6662 120.4949 58.1912 42.4206 178.0808 44 Y 3.8773 8.0703 115.6467 59.7368 37.6829 177.1907 45 R 4.2153 7.8805 118.4944 57.2390 30.4423 176.8106 46 A 4.3310 7.3614 118.3227 53.2049 19.0315 178.3547 47 V 3.8207 7.2687 115.4143 64.2846 32.2498 177.1799 48 K 4.0947 7.3349 118.0246 58.6093 32.2014 178.1781 49 K 4.2826 7.6536 116.5499 57.3603 32.6738 178.0132 50 I 4.0051 7.6100 118.9373 62.9130 37.9374 176.9956 51 Q 4.1069 8.0590 117.1173 58.4998 28.4316 177.3312 52 Q 4.2123 7.8804 120.4532 58.2926 29.5659 177.0233 53 K 4.1971 8.0082 118.2993 58.2439 32.5888 175.8000 54 T 4.7270 7.7527 112.1788 60.2980 70.3544 172.0695 55 E 4.3980 8.6483 118.6138 58.2539 31.1285 176.8269 56 T 4.2570 7.5190 110.4285 60.7822 69.0757 173.1020 57 N 4.5057 8.4916 119.0843 52.8479 37.8638 174.7574 58 P 4.2584 0.0000 0.0000 64.8857 30.9023 178.4639 59 L 4.1170 7.5004 118.9939 57.2010 42.0843 178.4473 60 S 4.0835 7.8422 113.1363 61.2466 62.0064 176.4541 61 V 3.6449 7.6316 120.8146 63.9947 31.0842 177.8798 62 L 3.7510 7.2824 122.0099 58.0100 41.4188 178.5482 63 R 3.9596 7.6636 118.0027 59.0441 29.8706 178.1125 64 Q 4.1204 8.2589 116.5654 57.6574 28.8885 177.2978 65 A 4.4262 7.4489 121.6913 53.7928 19.7846 178.6866 66 I 3.9590 7.4535 110.2195 62.7170 37.6155 178.0556 67 R 4.2121 7.4290 116.5601 58.1327 30.0619 177.6759 68 G 3.9475 7.6423 103.8643 44.7865 0.0000 174.1137 69 V 4.3358 7.4180 118.6760 63.1381 33.5675 175.5224 70 T 4.1192 7.7945 117.4536 62.5331 68.4173 172.8282 71 P 4.8313 0.0000 0.0000 62.5501 33.0434 175.1856 72 D 4.9459 8.6588 117.0970 55.0086 43.9422 176.3561 73 I 4.9144 7.6266 116.9509 59.4260 40.9743 174.0090 74 A 4.8875 8.5544 128.6004 50.1661 23.1484 174.4724 75 V 4.2164 8.3024 118.7514 61.6583 32.8212 175.3745 76 K 4.7206 8.2972 125.9613 54.4705 35.6618 175.9746 77 A 4.4426 8.6041 125.5393 51.1283 19.4246 176.7451 78 R 4.6338 8.4126 119.9357 55.0506 33.8073 175.1920 79 R 4.7248 8.5898 123.3543 54.4759 32.1258 175.8456 80 V 4.2102 7.9504 122.9967 62.0880 33.9147 174.3199 81 G 4.0077 8.4257 114.3711 44.5248 0.0000 172.9347 82 G 3.7846 7.6327 113.8779 45.5880 0.0000 173.6953 83 S 4.5159 7.5356 116.0063 56.8954 64.4577 173.5122 84 T 4.2225 8.3095 120.3663 63.2080 67.5884 174.0397 85 H 4.5071 8.6262 124.7552 55.5008 30.0805 176.6398 86 Q 4.3848 7.5129 125.5556 54.5715 27.3995 176.2464 87 V 3.8610 7.1706 119.1203 61.0330 33.3548 175.1948 88 P 4.8264 0.0000 0.0000 61.6098 31.8526 175.3427 89 I 4.5615 8.0182 126.1801 59.1303 39.7333 174.9753 90 E 4.3544 8.6436 124.8678 56.4273 30.1254 176.3467 91 I 4.0326 8.2315 125.9819 60.7745 38.2549 176.9858 92 G 3.9493 8.3118 115.4758 45.1443 0.0000 173.3891 93 S 4.2435 8.4941 111.5546 60.5092 62.3043 176.8748 94 T 3.7430 7.8431 114.8280 64.4787 67.6852 175.4561 95 Q 4.4064 7.9467 118.6075 57.0799 29.6777 177.9800 96 G 3.5731 7.7697 107.3105 47.2135 0.0000 175.5446 97 K 4.0984 7.6813 120.8648 58.4770 32.0072 178.5359 98 A 4.2072 7.6229 119.8908 54.4340 18.5710 178.7840 99 L 3.5697 7.6236 116.4667 56.6555 40.9011 179.1858 100 A 3.7126 7.2810 120.4169 54.3415 18.1524 178.7310 101 I 3.7783 7.0244 107.5322 62.0638 37.9799 177.9098 102 R 4.1084 7.1672 120.3589 58.1448 29.9079 177.9039 103 W 4.7522 7.7382 116.7530 57.6136 29.5959 177.2773 104 L 4.4150 7.4283 120.4137 55.9936 42.3732 178.2417 105 L 4.0501 7.5794 120.6090 58.2136 42.1112 178.8987 106 G 3.6239 7.9908 105.4484 47.7162 0.0000 175.5567 107 A 4.1129 7.6666 120.5436 54.4426 18.4065 179.1878 108 A 4.1225 7.3434 118.8498 55.0934 18.7199 179.5887 109 R 4.1653 7.6662 115.3993 57.9379 30.4516 176.9582 110 K 4.5596 7.8761 117.6954 56.2561 32.7059 177.9189 111 R 4.6574 7.5069 117.9709 54.5248 30.5555 172.9303 112 P 4.6191 0.0000 0.0000 61.6860 29.6641 176.5137 113 G 3.8805 7.8899 113.7781 45.9379 0.0000 174.3318 114 R 4.5184 8.0343 116.6856 56.0094 31.2843 179.3448 115 N 4.9116 8.6942 126.9700 52.9032 40.0994 175.1198 116 M 4.3509 8.4150 117.5754 57.1460 31.6283 178.2858 117 A 4.2295 8.0035 121.3593 53.9487 18.9807 178.5506 118 F 4.5655 8.0770 118.1527 59.9702 40.0710 178.0497 119 K 3.9379 8.0196 117.8739 58.8757 30.9140 178.5498 120 L 4.0435 7.5976 119.0364 57.2885 40.6196 178.4926 121 S 4.3076 7.4615 110.2651 60.5115 62.1332 176.2237 122 S 4.0654 7.5891 117.2453 61.1268 62.8376 175.5943 123 E 4.2493 7.3409 118.3606 56.7842 29.3229 177.8009 124 L 4.2135 7.1499 121.5083 56.9474 42.2917 177.9570 125 V 4.0811 7.1172 109.1201 61.9800 32.0953 177.3770 126 D 4.4502 7.8761 118.0881 55.7965 41.0220 177.8193 127 A 4.1998 7.8337 120.5784 53.4478 19.2651 178.1858 128 A 4.2637 7.5811 117.8662 53.9084 19.1478 178.6187 129 K 4.1073 7.8290 113.6020 57.8301 34.2016 177.2421 130 G 4.2786 8.7537 107.8273 45.7441 0.0000 171.9826 131 S 4.4573 8.5512 113.6516 58.0700 67.5868 175.6233 132 G 4.0008 8.6251 106.4895 45.5324 0.0000 173.8725 133 D 4.1638 8.3361 116.3644 55.5040 41.7316 178.1129 134 A 4.3673 7.6866 121.5398 55.6036 18.3040 179.2139 135 V 3.9346 7.6424 114.3789 63.7928 32.2952 178.4769 136 R 3.9311 7.4748 119.9625 58.5756 29.2955 178.1079 137 K 3.7682 7.3825 117.7411 57.7745 30.8215 178.5321 138 K 4.0412 7.6158 119.5333 59.4731 32.0412 177.9216 139 E 4.0225 7.9068 116.2806 57.7276 29.7139 177.5692 140 E 4.0898 7.6419 119.9621 58.5394 29.8686 177.7095 141 T 4.0034 7.5103 111.9757 63.9116 67.7028 175.2810 142 H 4.5680 7.5247 116.7859 57.0210 29.1955 176.2985 143 R 4.2576 7.3866 117.8336 58.1742 30.5154 177.7130 144 M 4.0837 8.0093 116.2344 57.0420 32.6660 176.3889 145 A 4.3931 7.6978 120.6593 51.5554 20.3401 178.2930 146 E 3.8699 8.6326 115.8818 57.1568 28.2469 175.5858 147 A 4.5230 7.8347 120.0180 52.6737 19.9775 177.3776 148 N 5.2424 7.7888 113.1935 53.0028 39.1752 176.7673 149 R 3.8674 8.2049 121.1143 59.1959 30.3708 178.0146 150 A 4.1977 7.9840 119.0835 54.0897 18.6434 178.2102 151 F 4.1651 8.1334 113.8958 58.7585 39.3530 175.6183 152 A 4.7461 7.5052 121.9713 50.3048 21.1495 175.1537 153 H 4.6715 8.5445 121.6955 54.7695 31.2785 174.9887 154 F 4.2824 8.5237 122.5000 57.1874 39.6111 175.9455 155 R 4.1894 8.6312 120.5228 56.7508 29.9295 176.8008 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 2 S 8.33 4.40 0.00 3.84 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 3 R 8.07 3.78 0.00 1.89 1.93 0.00 3.28 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.71 0.00 4 R 8.04 4.10 0.00 1.83 1.88 0.00 3.29 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 5 G 8.83 3.62 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 0.00 0.00 0.00 6 T 8.14 4.45 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 7 V 8.15 4.34 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 0.84 0.00 0.00 0.93 0.00 0.00 8 E 8.27 4.19 0.00 2.00 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 2.31 2.29 0.00 9 E 7.51 4.62 0.00 2.02 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 2.18 2.28 0.00 10 K 8.47 4.43 0.00 1.85 1.85 0.00 1.52 0.00 0.00 1.62 0.00 0.00 2.72 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.30 1.32 7.81 11 T 8.33 4.58 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 12 A 8.14 4.89 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.41 4.21 0.00 1.74 1.73 0.00 1.76 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.34 7.81 14 S 8.30 4.37 0.00 4.01 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 D 9.06 4.38 0.00 3.03 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 16 P 0.00 3.68 0.00 1.96 1.75 0.00 3.75 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.93 0.00 17 I 7.84 4.57 1.93 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.74 1.12 0.00 0.00 18 Y 8.47 3.90 0.00 3.31 3.05 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 19 R 7.80 3.75 0.00 1.94 2.00 0.00 3.32 0.00 0.00 3.25 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 20 N 8.08 4.76 0.00 2.88 2.67 0.00 0.00 6.74 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 R 8.54 4.26 0.00 1.99 2.19 0.00 2.96 0.00 0.00 3.39 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 22 L 7.81 3.83 0.00 1.83 1.95 0.91 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 23 V 7.67 3.79 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 0.95 0.00 0.00 0.90 0.00 0.00 24 N 7.73 4.64 0.00 3.02 2.90 0.00 0.00 7.01 7.53 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 25 M 7.61 3.92 0.00 2.23 2.22 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.45 0.00 26 L 7.75 4.06 0.00 1.66 1.87 0.91 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 27 V 7.73 3.98 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 0.85 0.00 0.00 1.05 0.00 0.00 28 N 7.44 4.37 0.00 2.66 2.91 0.00 0.00 6.95 7.54 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 29 R 7.60 4.31 0.00 1.70 1.96 0.00 3.10 0.00 0.00 3.09 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.80 0.00 30 I 7.11 4.23 2.04 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 1.42 1.05 1.00 0.00 0.00 31 L 6.91 3.90 0.00 1.87 1.67 0.95 0.55 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 32 K 8.66 4.37 0.00 1.81 1.62 0.00 1.96 0.00 0.00 1.90 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.44 7.81 33 H 10.30 4.08 0.00 3.40 3.39 0.00 5.55 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 G 8.49 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 K 7.50 4.37 0.00 1.85 1.71 0.00 1.66 0.00 0.00 1.40 0.00 0.00 2.89 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.32 1.23 7.81 36 K 8.11 4.28 0.00 1.78 1.77 0.00 1.70 0.00 0.00 1.79 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.46 7.81 37 S 8.06 4.06 0.00 3.91 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 38 L 7.83 4.57 0.00 1.69 1.65 0.94 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 39 A 7.65 4.20 1.43 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 0.00 0.00 40 Y 7.68 4.28 0.00 3.08 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 41 Q 7.57 4.05 0.00 2.28 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 42 I 7.04 4.13 2.00 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 1.63 0.81 0.92 0.00 0.00 43 L 7.67 4.18 0.00 1.81 1.76 0.92 1.08 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 44 Y 8.07 3.88 0.00 2.78 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.88 4.22 0.00 2.06 1.90 0.00 3.16 0.00 0.00 3.33 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 46 A 7.36 4.33 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 47 V 7.27 3.82 1.84 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 0.57 0.00 0.00 0.70 0.00 0.00 48 K 7.33 4.09 0.00 2.03 1.95 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.18 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.52 7.81 49 K 7.65 4.28 0.00 1.80 1.89 0.00 1.79 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.53 1.62 7.81 50 I 7.61 4.01 2.04 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 1.64 1.21 0.91 0.00 0.00 51 Q 8.06 4.11 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.78 0.00 0.00 0.00 0.00 0.00 2.50 2.42 0.00 52 Q 7.88 4.21 0.00 2.07 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 7.16 0.00 0.00 0.00 0.00 0.00 2.31 2.44 0.00 53 K 8.01 4.20 0.00 1.89 1.84 0.00 1.65 0.00 0.00 1.80 0.00 0.00 3.20 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.57 7.81 54 T 7.75 4.73 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 55 E 8.65 4.40 0.00 1.96 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 2.21 2.20 0.00 56 T 7.52 4.26 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 1.20 0.00 0.00 57 N 8.49 4.51 0.00 2.82 2.79 0.00 0.00 6.85 8.03 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 58 P 0.00 4.26 0.00 1.89 1.93 0.00 3.62 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.09 0.00 59 L 7.50 4.12 0.00 1.36 1.53 0.97 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 60 S 7.84 4.08 0.00 3.94 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 61 V 7.63 3.64 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 0.90 0.00 0.00 62 L 7.28 3.75 0.00 1.99 1.80 0.86 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 63 R 7.66 3.96 0.00 2.04 1.87 0.00 3.13 0.00 0.00 3.15 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 64 Q 8.26 4.12 0.00 2.04 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.59 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 65 A 7.45 4.43 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 66 I 7.45 3.96 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.59 0.91 0.00 0.00 67 R 7.43 4.21 0.00 1.85 2.04 0.00 3.31 0.00 0.00 3.23 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.78 0.00 68 G 7.64 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 V 7.42 4.34 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 1.14 0.00 0.00 0.97 0.00 0.00 70 T 7.79 4.12 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 1.25 0.00 0.00 71 P 0.00 4.83 0.00 2.35 2.41 0.00 3.86 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 72 D 8.66 4.95 0.00 2.65 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 73 I 7.63 4.91 1.83 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.87 0.80 0.00 0.00 74 A 8.55 4.89 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 75 V 8.30 4.22 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 0.75 0.00 0.00 0.88 0.00 0.00 76 K 8.30 4.72 0.00 1.59 1.64 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.35 7.81 77 A 8.60 4.44 1.21 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 78 R 8.41 4.63 0.00 1.74 1.79 0.00 3.26 0.00 0.00 3.09 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.68 0.00 79 R 8.59 4.72 0.00 1.73 1.77 0.00 3.54 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.52 0.00 80 V 7.95 4.21 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 0.58 0.00 0.00 0.92 0.00 0.00 81 G 8.43 4.01 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 0.00 0.00 0.00 82 G 7.63 3.78 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 0.00 0.00 0.00 83 S 7.54 4.52 0.00 4.09 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 T 8.31 4.22 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 1.20 0.00 0.00 85 H 8.63 4.51 0.00 3.39 3.27 0.00 5.62 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.51 4.38 0.00 1.53 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.97 0.00 0.00 0.00 0.00 0.00 2.09 2.08 0.00 87 V 7.17 3.86 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 0.81 0.00 0.00 1.02 0.00 0.00 88 P 0.00 4.83 0.00 1.90 1.99 0.00 3.65 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 2.06 2.14 0.00 89 I 8.02 4.56 1.86 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 1.28 1.08 0.90 0.00 0.00 90 E 8.64 4.35 0.00 1.96 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 2.26 2.28 0.00 91 I 8.23 4.03 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.85 0.89 0.00 0.00 92 G 8.31 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 S 8.49 4.24 0.00 3.90 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 T 7.84 3.74 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 95 Q 7.95 4.41 0.00 2.09 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.69 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 96 G 7.77 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 97 K 7.68 4.10 0.00 1.92 1.76 0.00 1.49 0.00 0.00 1.62 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.45 7.81 98 A 7.62 4.21 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 99 L 7.62 3.57 0.00 1.35 0.73 0.84 0.38 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 0.00 100 A 7.28 3.71 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 0.00 101 I 7.02 3.78 1.82 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 1.63 0.78 0.86 0.00 0.00 102 R 7.17 4.11 0.00 1.43 1.86 0.00 2.81 0.00 0.00 3.05 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.67 0.00 103 W 7.74 4.75 0.00 3.44 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 L 7.43 4.41 0.00 2.10 1.65 0.92 0.44 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 0.00 105 L 7.58 4.05 0.00 1.94 1.82 0.95 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 106 G 7.99 3.62 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 0.00 0.00 0.00 107 A 7.67 4.11 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 0.00 108 A 7.34 4.12 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 0.00 109 R 7.67 4.17 0.00 1.80 2.02 0.00 3.17 0.00 0.00 3.24 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.87 0.00 110 K 7.88 4.56 0.00 1.84 1.82 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.53 1.52 7.81 111 R 7.51 4.66 0.00 1.82 1.78 0.00 3.21 0.00 0.00 3.24 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 112 P 0.00 4.62 0.00 2.23 2.09 0.00 3.81 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 113 G 7.89 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 0.00 114 R 8.03 4.52 0.00 1.84 0.91 0.00 3.34 0.00 0.00 3.17 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.39 0.00 115 N 8.69 4.91 0.00 2.86 2.76 0.00 0.00 6.85 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 M 8.42 4.35 0.00 2.04 2.12 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 2.71 2.57 0.00 117 A 8.00 4.23 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 0.00 118 F 8.08 4.57 0.00 3.13 3.09 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 0.00 119 K 8.02 3.94 0.00 1.85 1.97 0.00 1.74 0.00 0.00 2.00 0.00 0.00 3.20 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.57 1.76 7.81 120 L 7.60 4.04 0.00 1.90 1.62 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 121 S 7.46 4.31 0.00 4.08 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 S 7.59 4.07 0.00 3.82 3.42 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 0.00 123 E 7.34 4.25 0.00 2.05 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 2.41 2.43 0.00 124 L 7.15 4.21 0.00 1.97 1.73 0.88 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 125 V 7.12 4.08 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 0.87 0.00 0.00 0.95 0.00 0.00 126 D 7.88 4.45 0.00 2.76 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 0.00 127 A 7.83 4.20 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 0.00 128 A 7.58 4.26 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 0.00 129 K 7.83 4.11 0.00 1.86 1.93 0.00 1.54 0.00 0.00 1.70 0.00 0.00 3.10 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.52 1.41 7.81 130 G 8.75 4.28 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 0.00 131 S 8.55 4.46 0.00 3.86 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 G 8.63 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 0.00 133 D 8.34 4.16 0.00 2.75 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 0.00 134 A 7.69 4.37 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 0.00 135 V 7.64 3.93 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 0.91 0.00 0.00 0.96 0.00 0.00 136 R 7.47 3.93 0.00 1.60 1.94 0.00 3.24 0.00 0.00 3.05 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.73 0.00 137 K 7.38 3.77 0.00 1.54 1.25 0.00 1.10 0.00 0.00 1.17 0.00 0.00 2.50 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.30 0.21 7.81 138 K 7.62 4.04 0.00 1.91 1.86 0.00 1.55 0.00 0.00 1.61 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.80 7.81 139 E 7.91 4.02 0.00 1.92 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 2.23 2.26 0.00 140 E 7.64 4.09 0.00 2.00 1.75 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 2.20 2.34 0.00 141 T 7.51 4.00 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 1.39 0.00 0.00 142 H 7.52 4.57 0.00 3.41 3.35 0.00 5.89 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 R 7.39 4.26 0.00 1.98 1.96 0.00 3.25 0.00 0.00 3.20 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.79 0.00 144 M 8.01 4.08 0.00 1.94 2.08 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.54 0.00 145 A 7.70 4.39 1.24 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 0.00 146 E 8.63 3.87 0.00 2.15 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 0.00 2.22 2.27 0.00 147 A 7.83 4.52 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 0.00 148 N 7.79 5.24 0.00 2.67 2.72 0.00 0.00 6.80 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 R 8.20 3.87 0.00 1.95 1.99 0.00 3.36 0.00 0.00 3.62 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.60 0.00 150 A 7.98 4.20 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 0.00 151 F 8.13 4.17 0.00 3.06 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 0.00 152 A 7.51 4.75 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 0.00 153 H 8.54 4.67 0.00 3.16 3.22 0.00 5.73 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 0.00 154 F 8.52 4.28 0.00 3.09 3.02 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 0.00 155 R 8.63 4.19 0.00 1.87 1.90 0.00 3.49 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00