NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 20 P 4.4220 0.0000 0.0000 61.5627 32.6033 176.8828 21 S 3.9729 8.8604 116.7232 60.0373 62.5578 173.5140 22 L 4.8445 8.0522 120.3381 54.4139 42.9505 177.6046 23 A 4.0282 7.7756 124.7007 55.2736 18.0923 180.1343 24 D 4.3664 8.4526 117.1609 56.9730 40.8776 178.8007 25 S 4.1493 8.9965 116.1444 61.8690 62.9215 176.7852 26 K 3.8729 7.9722 120.3684 59.8416 31.8698 179.2064 27 A 4.0688 7.7509 120.7697 55.0236 18.2254 180.0469 28 V 3.7361 8.4486 118.1796 64.6402 31.5285 178.6735 29 L 4.2117 8.5162 120.2693 57.8943 41.5130 179.0106 30 N 4.3073 8.3163 116.9923 56.3794 38.7202 176.6227 31 Q 4.2069 8.5011 121.0573 59.2114 29.1080 178.2379 32 A 4.1966 8.5863 121.9856 55.3283 18.5920 179.3495 33 V 3.5727 8.2041 116.8096 66.4108 31.5301 178.0859 34 A 4.1759 8.4160 119.9255 55.5617 18.3481 179.4322 35 D 4.4161 8.6031 117.7318 57.4854 40.8364 179.0621 36 L 4.2227 8.8095 120.0061 57.7679 41.6685 179.7924 37 S 3.8788 7.8346 115.0718 61.3021 62.6627 176.8075 38 V 3.5466 7.8250 120.6352 66.0051 31.3370 177.6066 39 A 4.0201 8.5199 120.8317 55.6596 18.0983 178.9075 40 H 3.9874 8.4307 116.5279 59.4970 29.8825 177.2240 41 S 4.0699 7.8314 114.2109 61.6798 62.2559 176.2743 42 I 3.6930 7.8092 122.3021 64.3642 36.7560 178.4782 43 L 3.9970 7.8492 119.9222 57.6453 41.5321 178.9700 44 H 3.5955 8.0309 118.5669 58.9055 29.6680 176.9120 45 Q 4.2716 7.9992 121.4233 59.3540 28.7000 178.6431 46 V 3.6169 7.8491 118.9939 66.4080 31.3857 177.2114 47 H 4.1284 8.0387 116.5139 59.2134 29.6240 176.6514 48 W 4.8200 7.9042 118.9373 59.3713 29.3995 177.5230 49 Y 4.2544 8.2507 113.4362 57.2763 38.0581 175.6703 50 M 4.4127 7.5215 121.1378 55.8614 32.9908 175.6435 51 R 4.6896 8.6976 123.2620 55.2454 34.5728 173.7777 52 G 4.3368 9.1352 106.6142 42.7211 0.0000 173.2468 53 R 4.0992 8.3214 119.6817 58.0615 30.4724 177.5401 54 G 4.1945 9.4938 110.5002 45.2628 0.0000 174.9023 55 F 4.0859 8.6952 122.3281 62.0815 39.0314 177.0358 56 M 4.2295 8.2674 115.2346 58.0966 32.2239 177.2088 57 I 3.7946 7.5676 118.2504 63.1032 38.5337 177.3722 58 W 4.2532 8.3826 119.9456 59.2102 28.7780 177.9864 59 H 3.9248 8.3355 118.4145 58.8057 29.3344 175.1402 60 P 4.2426 0.0000 0.0000 65.6987 31.0734 177.9133 61 K 3.5121 7.6288 119.3291 59.5703 31.8279 178.4312 62 M 4.0799 8.0227 118.8118 58.4627 31.7458 178.3042 63 D 4.1777 7.6575 118.9006 57.4764 41.1255 178.7911 64 E 3.8818 7.8722 118.3416 59.6050 29.4323 178.9249 65 Y 4.4865 7.6687 116.7217 61.4500 37.8727 178.4726 66 M 4.1028 8.4099 119.9852 58.3509 32.0333 178.3832 67 E 3.8640 8.4288 119.7678 59.2075 29.7811 178.5847 68 E 3.6398 8.0633 118.9104 59.1158 29.6340 178.7002 69 I 3.8254 8.1126 120.2995 64.6197 37.2127 178.0687 70 D 4.4134 8.4280 119.9907 57.3659 40.6140 179.1979 71 G 3.4780 7.8145 106.1996 47.8890 0.0000 175.4881 72 Y 4.3303 7.6425 119.1180 60.6361 37.9019 178.0104 73 L 4.0055 8.3197 121.7252 58.1795 42.2130 178.5933 74 D 4.2556 8.1067 117.7496 57.3513 41.1712 177.5992 75 E 3.8954 8.0684 119.7699 59.6987 29.5394 178.8089 76 M 3.8913 8.3559 119.1598 58.3059 31.9412 178.8590 77 S 4.1106 8.1142 114.4511 61.6186 62.9938 176.3423 78 E 4.0047 8.3130 121.8711 58.4197 29.2591 179.0911 79 R 3.8016 8.1652 119.4140 59.2184 30.0657 178.0778 80 L 3.9011 8.0214 120.2507 58.2821 41.9590 178.8303 81 I 3.6534 7.9655 119.8010 65.0075 36.8961 178.2528 82 T 3.8532 7.8840 115.0824 66.7302 68.4079 175.6731 83 L 4.3644 7.6642 117.7006 54.9410 41.9004 177.5853 84 G 3.8557 8.2012 107.8904 45.3880 0.0000 173.9445 85 G 3.8040 7.9317 108.9794 44.0101 0.0000 174.3060 86 A 4.5121 7.9016 121.8335 48.8150 19.2335 173.8903 87 P 4.4126 0.0000 0.0000 62.8466 32.1196 177.0821 88 F 4.6451 8.2757 120.4359 58.9999 39.2979 176.5210 89 S 4.8090 8.6628 117.2257 57.7871 64.1001 174.5948 90 T 4.4702 6.9186 110.2689 59.5495 72.8849 174.0419 91 L 3.9834 8.2579 122.4103 57.8500 41.5891 179.7590 92 K 3.8516 7.8221 119.0463 59.5277 32.2635 178.5496 93 E 3.6737 7.6667 118.4056 59.2085 29.2929 179.2550 94 F 4.3774 7.5695 117.7158 60.7002 38.8267 177.4174 95 S 4.1084 8.0072 111.1651 61.8372 62.3087 176.0668 96 E 4.0529 8.1811 119.4859 58.8078 29.2040 178.2967 97 N 4.5244 7.6190 115.0257 53.5852 39.5587 175.8424 98 S 4.4424 7.5919 114.8671 58.3598 62.9254 174.0041 99 Q 4.1826 8.8087 125.0975 56.8545 29.0175 176.4446 100 L 3.9907 7.7241 121.3102 54.3937 42.4642 176.8288 101 K 4.5483 8.2696 123.2349 52.7401 34.0967 174.9336 102 E 4.7125 8.5119 122.9425 53.9207 31.5255 175.5876 103 V 4.5184 7.7066 113.4579 58.9373 35.4418 175.7420 104 L 4.0586 8.2372 121.1807 54.5168 42.0573 177.8033 105 G 2.4373 7.9103 110.0765 45.2428 0.0000 172.9414 106 D 4.4560 7.3851 120.6305 52.6303 43.8379 175.7354 107 Y 4.7455 8.7878 124.2802 60.4573 38.2007 176.1668 108 N 4.7330 8.7672 116.2529 53.2776 39.0627 175.6099 109 V 3.8731 7.2152 118.4281 62.7236 32.2725 176.4701 110 T 4.2752 8.6022 117.5500 61.1785 70.9327 175.7589 111 I 3.6614 8.3679 123.0022 65.0692 37.1909 178.5630 112 E 3.8981 8.0820 118.4456 59.2285 29.4194 179.0587 113 E 4.0051 8.1217 118.8563 59.1455 29.6145 179.2912 114 Q 3.9401 8.1692 118.5883 58.9059 28.6941 178.6864 115 L 3.7092 7.9004 119.8246 57.3380 41.5716 179.2496 116 A 3.8687 7.9035 120.8743 55.1893 18.1736 179.9370 117 R 3.7588 7.7760 116.2678 59.2852 30.0424 179.4220 118 V 3.1354 7.3685 117.5937 65.7599 31.3843 178.1526 119 V 3.4716 7.8118 120.5780 66.6065 31.4080 178.5643 120 E 3.9807 7.9027 117.9481 61.0217 29.6152 181.0836 121 V 3.8292 7.9181 119.8203 66.0399 31.5186 178.2600 122 F 4.5679 8.3946 117.6812 60.5697 38.8172 177.9563 123 R 3.9303 8.5742 118.4455 59.2142 29.8605 178.3666 124 Y 3.9218 7.9818 119.0659 60.7659 38.7651 178.1389 125 L 3.4082 8.0541 119.5658 57.5385 41.6174 179.4412 126 A 3.7978 8.0372 120.6307 54.8806 18.2174 179.6374 127 A 3.7696 7.5099 118.9588 54.8961 18.4292 179.2438 128 L 3.5892 7.5815 119.2279 58.6547 41.9648 179.5219 129 F 4.4866 7.9054 117.4851 60.2374 38.6911 177.5197 130 Q 3.9317 8.1514 119.4962 59.1791 28.9149 178.4739 131 K 3.9539 8.0968 119.5822 59.4026 32.0207 179.3719 132 G 2.4580 7.9598 106.2580 47.2917 0.0000 175.2927 133 F 3.9653 8.0453 123.3502 61.0531 39.4258 176.9212 134 D 4.3456 8.3505 118.3749 57.3932 40.6278 178.8120 135 V 3.5379 8.1336 119.1887 66.2070 31.3934 178.2739 136 S 4.1613 8.1117 115.3285 60.8332 62.3436 175.8563 137 D 4.1134 8.0794 121.8999 56.9552 40.6545 178.0437 138 E 3.9752 8.2054 118.6135 59.4014 29.6731 178.5637 139 E 4.3228 8.2066 115.1739 55.9322 29.7678 177.1445 140 G 3.7914 7.4372 105.9743 46.9518 0.0000 175.0189 141 D 4.6211 7.9696 121.9243 52.6999 39.6406 176.2476 142 S 4.1166 8.0868 120.5556 60.4677 63.4813 176.5334 143 V 3.4992 7.6769 121.5282 66.3170 31.3925 177.8928 144 T 3.7253 7.8108 115.4077 66.4463 68.2741 175.7836 145 N 4.3827 8.1171 120.3227 56.0624 38.8343 176.2478 146 D 4.3443 8.0529 118.9197 57.4281 41.3807 177.8700 147 I 3.5225 7.5285 120.2925 64.7395 37.0428 178.3628 148 F 3.9659 7.8735 118.1401 60.3676 38.6865 177.2957 149 N 4.3488 8.4209 116.7717 56.7110 38.9509 177.0972 150 V 3.5386 8.2132 119.8276 65.8925 31.5289 177.8506 151 A 3.4149 7.5694 121.7508 54.1587 17.9280 179.4679 152 K 4.0307 8.2477 118.2265 59.6040 32.4178 178.5476 153 A 3.9698 7.8792 121.0523 55.4055 18.1897 179.6673 154 S 4.0077 7.9632 110.8332 61.6985 62.5966 176.1194 155 I 3.4786 8.0322 122.8293 64.6425 36.8029 178.2768 156 E 4.0425 8.4901 119.3835 59.1549 29.3790 179.1313 157 K 4.2375 8.0558 119.4232 60.1466 32.1824 178.5241 158 H 4.4607 8.4183 116.5088 58.9600 28.5125 177.8939 159 I 3.8333 8.0679 121.7373 64.0042 36.9170 177.9344 160 W 4.4620 8.3545 129.3258 61.1557 30.3887 177.9858 161 M 3.3904 7.8271 117.9756 58.0584 31.3182 178.7070 162 L 4.0049 8.2361 119.3676 57.9981 41.7426 179.7085 163 Q 3.9665 8.4368 117.8712 58.6898 28.6013 178.3553 164 A 4.1471 8.3788 122.3094 55.4844 18.2208 179.3024 165 E 4.0442 8.2267 116.3067 59.3436 29.7952 178.2536 166 L 4.3222 7.8240 115.8796 54.6232 41.5764 177.4660 167 G 3.9490 8.2751 107.2901 46.1211 0.0000 173.5435 168 Q 4.6753 8.4218 117.0645 53.1615 32.1153 175.4353 169 A 4.3844 8.3002 122.2546 51.3620 19.2030 176.3166 170 P 4.4004 0.0000 0.0000 63.9414 31.7672 177.2992 171 K 3.8556 8.0822 115.2171 57.2678 29.5398 175.0487 172 L 4.1850 7.9543 122.0605 55.1881 41.5281 177.5810 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 20 P 0.00 4.42 0.00 2.01 1.99 0.00 3.71 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 1.92 1.59 0.00 21 S 8.86 3.97 0.00 3.89 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 22 L 8.05 4.84 0.00 1.72 1.61 0.91 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 23 A 7.78 4.03 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 24 D 8.45 4.37 0.00 2.99 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 S 9.00 4.15 0.00 3.99 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 26 K 7.97 3.87 0.00 2.08 1.87 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.72 7.81 27 A 7.75 4.07 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 V 8.45 3.74 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.80 0.00 0.00 29 L 8.52 4.21 0.00 1.98 1.79 0.94 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 30 N 8.32 4.31 0.00 2.88 2.68 0.00 0.00 6.87 7.07 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 31 Q 8.50 4.21 0.00 2.47 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.47 2.76 0.00 32 A 8.59 4.20 1.73 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 0.00 0.00 33 V 8.20 3.57 2.48 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 1.25 0.00 0.00 1.02 0.00 0.00 34 A 8.42 4.18 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 D 8.60 4.42 0.00 2.95 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 L 8.81 4.22 0.00 1.77 1.79 1.16 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 37 S 7.83 3.88 0.00 3.38 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 V 7.83 3.55 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 0.99 0.00 0.00 1.00 0.00 0.00 39 A 8.52 4.02 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 H 8.43 3.99 0.00 3.31 3.47 0.00 5.60 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 S 7.83 4.07 0.00 4.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.81 3.69 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 1.48 0.80 0.84 0.00 0.00 43 L 7.85 4.00 0.00 1.77 1.64 1.09 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 44 H 8.03 3.60 0.00 2.95 2.51 0.00 5.62 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 8.00 4.27 0.00 2.22 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.58 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 46 V 7.85 3.62 2.20 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 0.93 0.00 0.00 0.96 0.00 0.00 47 H 8.04 4.13 0.00 3.06 3.38 0.00 5.99 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 W 7.90 4.82 0.00 3.56 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 49 Y 8.25 4.25 0.00 3.10 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 M 7.52 4.41 0.00 2.24 2.41 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.80 0.00 51 R 8.70 4.69 0.00 1.93 1.81 0.00 3.35 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.82 0.00 52 G 9.14 4.34 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 0.00 53 R 8.32 4.10 0.00 1.87 1.97 0.00 3.37 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.63 0.00 54 G 9.49 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 F 8.70 4.09 0.00 3.35 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 M 8.27 4.23 0.00 2.10 2.25 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.72 0.00 57 I 7.57 3.79 1.67 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.38 0.71 0.00 0.00 58 W 8.38 4.25 0.00 3.51 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 H 8.34 3.92 0.00 1.76 2.64 0.00 5.96 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 60 P 0.00 4.24 0.00 2.17 2.22 0.00 3.69 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 2.08 1.98 0.00 61 K 7.63 3.51 0.00 1.56 1.95 0.00 1.06 0.00 0.00 1.23 0.00 0.00 2.63 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.10 0.73 7.81 62 M 8.02 4.08 0.00 2.03 2.23 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 3.01 0.00 63 D 7.66 4.18 0.00 2.75 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 E 7.87 3.88 0.00 1.86 1.90 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 2.30 2.23 0.00 65 Y 7.67 4.49 0.00 3.23 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 66 M 8.41 4.10 0.00 1.92 2.10 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.30 0.00 67 E 8.43 3.86 0.00 2.17 1.90 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 2.26 2.31 0.00 68 E 8.06 3.64 0.00 2.07 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 1.72 2.02 0.00 69 I 8.11 3.83 2.09 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.00 1.02 0.00 0.00 70 D 8.43 4.41 0.00 2.95 2.66 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 71 G 7.81 3.48 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 0.00 72 Y 7.64 4.33 0.00 3.21 2.81 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 73 L 8.32 4.01 0.00 1.74 1.83 0.86 1.03 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 74 D 8.11 4.26 0.00 2.91 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 75 E 8.07 3.90 0.00 2.17 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 2.21 2.31 0.00 76 M 8.36 3.89 0.00 1.99 2.14 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 1.99 0.00 77 S 8.11 4.11 0.00 4.09 4.20 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 78 E 8.31 4.00 0.00 2.15 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 2.32 2.31 0.00 79 R 8.17 3.80 0.00 1.91 1.98 0.00 3.11 0.00 0.00 3.03 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 80 L 8.02 3.90 0.00 1.76 1.89 0.93 1.01 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 81 I 7.97 3.65 2.02 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 1.51 0.64 0.90 0.00 0.00 82 T 7.88 3.85 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 1.19 0.00 0.00 83 L 7.66 4.36 0.00 1.76 1.69 0.95 1.01 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 84 G 8.20 3.86 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 0.00 0.00 0.00 85 G 7.93 3.80 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 0.00 0.00 0.00 86 A 7.90 4.51 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 87 P 0.00 4.41 0.00 2.25 2.07 0.00 3.78 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 88 F 8.28 4.65 0.00 3.40 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 89 S 8.66 4.81 0.00 4.05 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 T 6.92 4.47 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 91 L 8.26 3.98 0.00 1.70 1.82 1.00 1.08 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 92 K 7.82 3.85 0.00 1.75 1.71 0.00 1.69 0.00 0.00 1.78 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.49 7.81 93 E 7.67 3.67 0.00 1.88 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.26 0.00 94 F 7.57 4.38 0.00 3.21 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 95 S 8.01 4.11 0.00 4.11 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 96 E 8.18 4.05 0.00 1.93 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 0.00 2.30 2.41 0.00 97 N 7.62 4.52 0.00 2.41 2.71 0.00 0.00 6.95 7.39 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 98 S 7.59 4.44 0.00 4.03 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 99 Q 8.81 4.18 0.00 1.77 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.62 0.00 0.00 0.00 0.00 0.00 2.46 2.71 0.00 100 L 7.72 3.99 0.00 1.49 1.43 0.92 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.27 4.55 0.00 1.74 1.56 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.25 0.99 7.81 102 E 8.51 4.71 0.00 1.92 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 2.21 2.28 0.00 103 V 7.71 4.52 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.85 0.00 0.00 104 L 8.24 4.06 0.00 1.56 1.50 0.90 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 105 G 7.91 2.44 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 0.00 106 D 7.39 4.46 0.00 2.57 2.34 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 0.00 107 Y 8.79 4.75 0.00 3.15 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 0.00 108 N 8.77 4.73 0.00 2.87 2.89 0.00 0.00 6.91 7.26 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 0.00 109 V 7.22 3.87 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 0.81 0.00 0.00 0.97 0.00 0.00 110 T 8.60 4.28 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 111 I 8.37 3.66 1.90 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.16 0.86 0.00 0.00 112 E 8.08 3.90 0.00 1.97 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 2.34 2.37 0.00 113 E 8.12 4.01 0.00 2.14 1.95 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 2.29 2.32 0.00 114 Q 8.17 3.94 0.00 2.13 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.60 2.58 0.00 115 L 7.90 3.71 0.00 1.38 1.29 -0.06 -0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 116 A 7.90 3.87 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 R 7.78 3.76 0.00 1.94 1.89 0.00 3.07 0.00 0.00 3.03 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.73 0.00 118 V 7.37 3.14 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 0.12 0.00 0.00 0.79 0.00 0.00 119 V 7.81 3.47 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 1.02 0.00 0.00 0.90 0.00 0.00 120 E 7.90 3.98 0.00 2.04 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 2.24 2.18 0.00 121 V 7.92 3.83 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 1.07 0.00 0.00 0.93 0.00 0.00 122 F 8.39 4.57 0.00 3.21 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 0.00 123 R 8.57 3.93 0.00 2.01 2.00 0.00 3.14 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.87 0.00 124 Y 7.98 3.92 0.00 3.14 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 0.00 125 L 8.05 3.41 0.00 1.66 0.89 1.05 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 126 A 8.04 3.80 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 0.00 127 A 7.51 3.77 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 0.00 128 L 7.58 3.59 0.00 1.13 1.30 1.04 1.02 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 0.00 129 F 7.91 4.49 0.00 3.01 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 0.00 130 Q 8.15 3.93 0.00 2.21 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.79 0.00 0.00 0.00 0.00 0.00 2.30 2.41 0.00 131 K 8.10 3.95 0.00 1.87 1.75 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.40 1.53 7.81 132 G 7.96 2.46 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 0.00 0.00 0.00 0.00 133 F 8.05 3.97 0.00 3.27 3.24 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 0.00 134 D 8.35 4.35 0.00 2.87 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 0.00 135 V 8.13 3.54 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 1.10 0.00 0.00 0.93 0.00 0.00 136 S 8.11 4.16 0.00 4.22 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 D 8.08 4.11 0.00 2.30 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 0.00 138 E 8.21 3.98 0.00 2.12 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 2.32 2.54 0.00 139 E 8.21 4.32 0.00 1.91 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 0.00 2.31 2.52 0.00 140 G 7.44 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 D 7.97 4.62 0.00 2.69 2.55 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 0.00 142 S 8.09 4.12 0.00 4.05 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 0.00 143 V 7.68 3.50 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.90 0.00 0.00 144 T 7.81 3.73 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 1.35 0.00 0.00 145 N 8.12 4.38 0.00 2.73 2.93 0.00 0.00 6.43 7.83 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 0.00 146 D 8.05 4.34 0.00 2.87 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 0.00 147 I 7.53 3.52 1.66 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.69 0.48 0.00 0.00 148 F 7.87 3.97 0.00 3.29 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 0.00 149 N 8.42 4.35 0.00 3.32 3.04 0.00 0.00 6.83 7.08 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 0.00 150 V 8.21 3.54 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 1.00 0.00 0.00 1.05 0.00 0.00 151 A 7.57 3.41 -0.07 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 0.00 0.00 152 K 8.25 4.03 0.00 2.05 1.98 0.00 1.63 0.00 0.00 1.53 0.00 0.00 3.12 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.52 1.50 7.81 153 A 7.88 3.97 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 0.00 154 S 7.96 4.01 0.00 4.05 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 I 8.03 3.48 2.01 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.97 0.69 0.00 0.00 156 E 8.49 4.04 0.00 2.17 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.49 0.00 157 K 8.06 4.24 0.00 2.10 1.99 0.00 1.77 0.00 0.00 1.92 0.00 0.00 3.03 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.79 2.03 7.81 158 H 8.42 4.46 0.00 3.38 3.46 0.00 5.67 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 I 8.07 3.83 2.13 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.98 1.00 0.00 0.00 160 W 8.35 4.46 0.00 3.42 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 0.00 161 M 7.83 3.39 0.00 1.96 2.14 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.16 0.00 162 L 8.24 4.00 0.00 1.89 1.61 0.87 1.05 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 0.00 163 Q 8.44 3.97 0.00 2.37 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.52 2.73 0.00 164 A 8.38 4.15 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 0.00 165 E 8.23 4.04 0.00 2.23 2.28 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 2.49 2.50 0.00 166 L 7.82 4.32 0.00 1.75 1.66 0.83 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 167 G 8.28 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 0.00 168 Q 8.42 4.68 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.89 0.00 0.00 0.00 0.00 0.00 2.29 2.42 0.00 169 A 8.30 4.38 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 P 0.00 4.40 0.00 2.13 2.30 0.00 3.90 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.41 0.00 171 K 8.08 3.86 0.00 1.90 1.88 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.56 7.81 172 L 7.95 4.19 0.00 1.64 1.58 0.95 0.94 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