NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4007 0.0000 0.0000 63.7298 33.0043 174.2171 2 I 3.8726 7.8929 120.0803 61.7314 43.9157 170.4433 3 V 3.9700 7.9914 120.7899 62.9107 31.8110 176.6927 4 Q 4.1271 7.5295 120.8302 56.5844 29.6251 174.9566 5 N 4.8749 8.0687 110.7447 52.6103 39.7790 176.6870 6 L 3.7174 8.0779 115.8290 55.6017 40.3595 174.6507 7 Q 4.3690 7.8989 117.3278 55.2209 28.5251 176.9779 8 G 4.1974 7.5874 106.0985 45.7891 0.0000 172.1266 9 Q 4.7054 8.2358 130.2629 55.5514 27.2282 178.3584 10 M 4.1681 8.8222 127.2258 57.6553 31.9375 176.5865 11 V 3.7694 7.5113 119.5730 63.6965 32.2084 174.5084 12 H 5.0279 8.1313 118.3396 55.2341 30.6964 172.8322 13 Q 4.5159 8.5414 117.7055 54.1256 32.8902 174.7450 14 A 4.2342 8.4802 123.8711 51.2416 19.6181 177.2485 15 I 3.4927 8.5426 120.9219 61.1040 38.4307 176.3503 16 S 4.0983 8.7938 121.8860 58.5369 63.4081 173.0065 17 P 4.2841 0.0000 0.0000 65.5928 31.0556 178.9098 18 R 3.9083 7.9629 116.5943 59.6647 29.8638 178.9462 19 T 3.9055 7.7775 113.3641 66.4208 68.8220 176.1117 20 L 4.2123 8.1140 122.2145 58.5028 42.2309 178.6886 21 N 4.3694 8.7460 116.4381 56.3818 38.3667 177.2168 22 A 4.0694 8.1378 122.1567 54.8123 18.4479 179.4191 23 W 4.5865 8.2662 126.9245 61.1391 30.7146 177.7826 24 V 3.2594 8.0209 117.5313 65.8481 30.7895 177.2487 25 K 3.7122 8.2795 118.7790 59.7131 31.9729 178.7774 26 V 3.5950 7.9409 118.2513 66.3852 31.4114 178.3169 27 V 3.3435 7.3026 117.3598 65.2850 30.9670 177.6596 28 E 3.7643 7.9406 119.1722 59.0099 29.5716 177.9553 29 E 4.2567 8.6751 117.3691 57.4401 30.0548 177.7258 30 K 4.3394 8.2362 116.2315 56.4153 33.9318 177.0315 31 A 3.6307 8.0999 122.1184 52.9715 17.3884 177.3586 32 F 5.1634 8.2288 110.0556 58.4557 39.8534 176.4292 33 S 4.3816 7.6627 115.0856 57.0864 63.3092 173.1105 34 P 4.3970 0.0000 0.0000 65.6847 30.5233 177.3375 35 E 4.2272 8.1609 115.5628 56.9453 30.4167 178.6531 36 V 4.0067 8.4399 121.8534 64.9012 31.4638 178.4773 37 I 3.8074 7.4597 120.3257 63.8396 37.0559 176.3009 38 P 4.2663 0.0000 0.0000 66.1893 31.2880 178.6214 39 M 4.1642 7.8693 115.9516 58.1688 31.5725 178.5193 40 F 3.4506 7.8684 119.6685 61.3789 39.8797 176.9243 41 S 3.7304 8.0278 114.3398 61.3706 62.3685 176.7075 42 A 3.9556 7.6422 122.4013 54.9236 18.1665 178.7901 43 L 4.4344 7.3548 114.8475 54.6933 41.8421 177.0291 44 S 4.3286 7.4252 112.6218 57.6222 62.9055 171.4926 45 E 3.9690 8.4643 121.0975 56.5674 29.1289 177.3295 46 G 4.2404 8.4557 116.8315 44.1926 0.0000 170.1905 47 A 4.5534 7.3197 121.5482 50.9454 20.6370 177.3102 48 T 4.2750 8.1620 109.4358 60.6656 71.2420 173.7518 49 P 4.3983 0.0000 0.0000 66.1736 31.3067 178.7090 50 Q 3.9658 8.3717 117.9782 59.4019 29.0768 177.8278 51 D 4.4657 7.7688 118.8383 57.4703 40.8170 179.0511 52 L 4.0194 8.0526 119.2149 58.0531 41.6337 179.2484 53 N 4.5089 8.6634 116.6340 56.6195 38.4340 177.5921 54 T 3.9243 8.5087 117.4798 67.0072 68.7403 176.1263 55 M 4.2867 8.1735 120.3563 58.7716 31.8470 178.6066 56 L 4.2806 8.0718 117.6543 58.3045 42.0835 178.9263 57 N 4.5037 8.6084 116.8581 57.0389 38.5944 176.8717 58 T 4.0245 8.4106 116.8870 65.7252 68.8194 176.1918 59 V 4.3212 7.6266 118.8033 61.2065 30.7888 176.1715 60 G 3.9738 7.8811 107.3613 46.2944 0.0000 176.4906 61 G 4.0851 7.9929 110.2055 48.1296 0.0000 173.6441 62 H 4.8661 7.8268 115.2079 52.3258 31.0622 174.0864 63 Q 4.0196 9.1292 123.3575 59.8402 28.3477 178.1715 64 A 3.9224 8.0819 122.2709 55.4821 18.1935 179.2268 65 A 4.0474 7.7528 116.4590 55.1823 19.0473 179.5661 66 M 4.0288 8.1664 116.5592 58.2863 31.9177 178.7786 67 Q 3.9420 7.8633 119.5911 59.4277 29.3249 177.7405 68 M 4.2195 8.0008 119.2434 58.4126 32.0308 178.4280 69 L 3.9101 8.0923 120.4679 57.8167 42.2854 178.7754 70 K 3.9246 8.0920 119.8246 59.5191 32.1939 178.2221 71 E 3.9625 8.6489 118.1931 60.1985 29.1483 179.4032 72 T 3.8355 7.7756 116.0039 66.1187 68.4628 176.7439 73 I 3.8025 7.8281 121.7314 64.5134 37.1310 178.1028 74 N 4.3004 8.1936 117.0880 56.5342 38.4452 177.2950 75 E 3.8770 8.2244 119.8075 59.5159 29.5366 179.4049 76 E 3.5227 8.1713 118.4683 58.9393 29.2236 179.2253 77 A 3.3539 7.8925 121.0642 54.8083 18.4382 179.5999 78 A 3.9540 8.0913 119.5668 55.0002 18.4098 179.4325 79 E 3.8080 8.1053 117.9214 59.0940 29.4892 178.5490 80 W 4.2834 7.7886 127.0901 60.9837 30.9395 177.2475 81 D 4.6166 8.0609 118.6368 57.2403 39.9975 178.4757 82 R 3.8288 7.7130 119.0051 59.4722 30.0091 177.0632 83 L 4.3618 7.4711 114.3675 56.0359 40.9945 177.0674 84 H 4.6768 7.9999 116.2637 53.4514 29.0591 172.5335 85 P 4.2927 0.0000 0.0000 63.2683 31.7064 178.0169 86 V 3.1456 7.6792 117.8155 65.2701 30.6661 173.8014 87 H 3.6493 8.1436 114.7041 58.5462 26.3328 173.4888 88 A 3.6722 8.3720 124.1854 51.4172 16.1629 177.8720 89 G 4.1663 8.2898 106.3611 46.1656 0.0000 173.5849 90 P 4.6170 0.0000 0.0000 60.7915 29.8833 175.6981 91 I 3.4323 7.4738 114.7502 62.7399 37.8589 172.4588 92 A 3.6127 8.8820 135.0000 50.4097 16.7952 175.0309 93 P 4.5437 0.0000 0.0000 62.7242 31.5619 177.2429 94 G 4.9376 8.3165 125.4636 46.4952 0.0000 172.3650 95 Q 4.2594 6.8883 115.4080 55.4400 29.5457 175.8110 96 M 3.8631 8.6307 120.0381 56.7610 32.3976 175.8645 97 R 4.3460 7.9686 114.9120 55.1467 30.1314 175.1196 98 E 4.2849 8.6956 120.2549 54.9101 30.3183 174.7963 99 P 3.7785 0.0000 0.0000 62.9300 31.7613 176.3490 100 R 4.7370 8.1669 121.7798 54.4568 33.1081 176.9463 101 G 3.9591 9.1747 110.4209 48.3750 0.0000 176.2872 102 S 4.1645 8.0850 116.1677 60.6784 62.8641 176.2517 103 D 4.2204 7.7161 122.3411 57.4966 40.5999 178.4612 104 I 3.1437 7.5018 118.8118 64.0256 36.9950 177.9802 105 A 2.5800 7.5912 120.3254 52.6952 18.3349 178.2819 106 G 3.9309 7.8360 105.9520 45.2360 0.0000 175.2498 107 T 4.0202 7.7452 109.3476 64.2010 68.8620 175.3288 108 T 4.6630 7.8496 110.9270 60.6787 69.0030 173.6067 109 S 5.0116 7.9067 115.8452 56.9311 66.0183 173.2740 110 T 4.2190 8.6474 114.5244 60.7844 71.2687 175.5072 111 L 3.9078 8.5010 123.9249 58.8276 41.8778 179.5486 112 Q 3.8955 7.9200 117.0905 58.8261 28.7003 178.1940 113 E 3.3985 7.7039 119.1060 59.5160 29.4927 179.3204 114 Q 4.4809 8.0865 117.7297 59.3374 28.5762 179.3572 115 I 3.7556 7.4063 119.1577 64.3272 37.5917 178.1790 116 G 3.6577 7.9008 106.5996 47.8248 0.0000 175.7177 117 W 4.3623 7.8574 121.3649 59.4966 28.8723 177.7717 118 M 4.5532 7.9042 115.9450 55.7736 32.8920 177.0291 119 T 4.7123 7.5136 108.5300 59.6140 68.9244 171.9254 120 H 4.7956 7.7326 122.5824 55.1218 33.4959 172.3358 121 N 4.1523 8.4015 119.9723 54.7812 38.6552 173.3559 122 P 3.9860 0.0000 0.0000 62.0167 28.1927 170.2229 123 P 4.3304 0.0000 0.0000 62.8746 31.4234 177.2602 124 I 4.1121 8.2619 126.0272 59.6592 37.2617 176.2167 125 P 4.5981 0.0000 0.0000 61.9127 28.5086 177.4607 126 V 3.2368 7.6156 115.0265 65.4646 31.9518 178.6867 127 G 3.5993 7.8472 105.8318 47.1331 0.0000 175.2310 128 E 3.8430 7.9460 121.3920 58.9141 29.7290 178.7926 129 I 3.4608 7.8787 120.1450 64.4856 37.1378 177.7456 130 Y 3.4541 7.5128 120.4562 60.4069 38.0937 178.1106 131 K 3.8594 8.2247 120.7001 59.0019 32.1409 179.1726 132 R 4.0049 7.7851 118.7086 58.9359 30.2365 178.6256 133 W 4.4317 8.0265 118.2165 60.0008 29.0777 178.3279 134 I 3.5922 7.7595 119.5091 64.5807 36.5221 178.4904 135 I 3.7032 7.4180 119.2013 64.4501 36.6300 178.5079 136 L 4.2322 8.0381 119.9484 57.5304 41.2998 179.9212 137 G 3.5340 7.9201 105.7099 47.6495 0.0000 175.8785 138 L 3.7268 8.1452 122.4194 57.3770 41.6809 179.3535 139 N 4.3812 8.5536 116.7512 55.2783 37.2870 177.3430 140 K 4.0508 7.7352 121.2667 59.3710 31.9206 178.8978 141 I 3.7128 7.3723 119.3568 63.9078 37.0959 177.8770 142 V 3.8239 7.6139 120.4462 65.6360 31.4255 177.9300 143 R 4.0400 7.6858 116.4920 59.4620 30.1964 178.6307 144 M 4.8077 8.0615 116.8268 53.1610 33.4603 176.3464 145 Y 5.6564 7.3758 133.3408 58.7652 40.3536 170.5151 146 S 4.3252 7.7335 123.7541 58.0167 70.0800 175.0272 147 P 4.6753 0.0000 0.0000 61.8076 33.0612 173.9713 148 T 4.2090 7.6625 107.8620 62.3969 69.7430 177.8496 149 S 4.4899 7.3649 122.1978 57.3643 66.8310 175.1235 150 I 4.1020 8.1780 111.2826 60.9404 35.6906 175.7820 151 L 4.2761 7.8016 127.5085 55.6193 41.7083 176.6166 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 P 0.00 4.40 0.00 2.16 2.25 0.00 3.55 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.03 0.00 2 I 7.89 3.87 1.98 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 1.31 0.70 0.92 0.00 0.00 3 V 7.99 3.97 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 0.85 0.00 0.00 0.92 0.00 0.00 4 Q 7.53 4.13 0.00 2.02 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 7.21 0.00 0.00 0.00 0.00 0.00 2.46 2.29 0.00 5 N 8.07 4.87 0.00 2.91 2.73 0.00 0.00 7.23 6.22 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 6 L 8.08 3.72 0.00 1.79 1.78 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 7 Q 7.90 4.37 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.55 0.00 0.00 0.00 0.00 0.00 2.34 2.45 0.00 8 G 7.59 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 0.00 0.00 0.00 9 Q 8.24 4.71 0.00 2.17 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.89 0.00 0.00 0.00 0.00 0.00 2.42 2.43 0.00 10 M 8.82 4.17 0.00 1.97 2.13 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.59 0.00 11 V 7.51 3.77 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.95 0.00 0.00 12 H 8.13 5.03 0.00 3.15 3.19 0.00 5.54 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 13 Q 8.54 4.52 0.00 1.89 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.92 0.00 0.00 0.00 0.00 0.00 2.21 2.25 0.00 14 A 8.48 4.23 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 15 I 8.54 3.49 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 1.31 0.83 0.97 0.00 0.00 16 S 8.79 4.10 0.00 3.92 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 17 P 0.00 4.28 0.00 2.21 2.12 0.00 3.66 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 18 R 7.96 3.91 0.00 1.83 1.99 0.00 3.30 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.68 0.00 19 T 7.78 3.91 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 20 L 8.11 4.21 0.00 1.77 1.72 0.98 0.62 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 21 N 8.75 4.37 0.00 2.91 2.89 0.00 0.00 7.00 7.38 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 22 A 8.14 4.07 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 23 W 8.27 4.59 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 24 V 8.02 3.26 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 1.00 0.00 0.00 1.07 0.00 0.00 25 K 8.28 3.71 0.00 1.83 1.83 0.00 1.74 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.62 7.81 26 V 7.94 3.60 2.47 0.00 0.00 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 1.15 0.00 0.00 27 V 7.30 3.34 1.53 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 0.53 0.00 0.00 -0.39 0.00 0.00 28 E 7.94 3.76 0.00 1.99 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 2.25 2.27 0.00 29 E 8.68 4.26 0.00 2.08 1.96 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 2.28 2.46 0.00 30 K 8.24 4.34 0.00 1.96 1.79 0.00 1.69 0.00 0.00 1.66 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.75 1.45 7.81 31 A 8.10 3.63 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 32 F 8.23 5.16 0.00 2.74 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 33 S 7.66 4.38 0.00 3.99 3.98 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 0.00 0.00 0.00 34 P 0.00 4.40 0.00 2.25 2.39 0.00 3.69 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 35 E 8.16 4.23 0.00 2.22 2.26 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 2.39 2.35 0.00 36 V 8.44 4.01 2.51 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 0.94 0.00 0.00 1.33 0.00 0.00 37 I 7.46 3.81 1.93 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 0.56 0.97 0.00 0.00 38 P 0.00 4.27 0.00 2.21 2.14 0.00 3.77 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.23 0.00 39 M 7.87 4.16 0.00 2.29 2.38 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.89 0.00 40 F 7.87 3.45 0.00 2.75 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 41 S 8.03 3.73 0.00 3.97 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 42 A 7.64 3.96 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 43 L 7.35 4.43 0.00 1.42 1.59 1.21 0.61 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 44 S 7.43 4.33 0.00 2.91 3.23 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 45 E 8.46 3.97 0.00 1.91 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 2.48 0.00 46 G 8.46 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 47 A 7.32 4.55 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 48 T 8.16 4.27 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 1.23 0.00 0.00 49 P 0.00 4.40 0.00 2.25 2.10 0.00 3.84 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.15 0.00 50 Q 8.37 3.97 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.76 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 51 D 7.77 4.47 0.00 2.93 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 52 L 8.05 4.02 0.00 2.13 1.80 0.89 0.58 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 53 N 8.66 4.51 0.00 3.06 2.97 0.00 0.00 7.10 7.81 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 54 T 8.51 3.92 4.54 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 1.28 0.00 0.00 55 M 8.17 4.29 0.00 1.92 2.38 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.63 0.00 56 L 8.07 4.28 0.00 1.90 1.87 0.93 0.82 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 57 N 8.61 4.50 0.00 2.90 3.17 0.00 0.00 7.30 8.05 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 58 T 8.41 4.02 4.67 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 1.27 0.00 0.00 59 V 7.63 4.32 1.66 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 0.34 0.00 0.00 0.58 0.00 0.00 60 G 7.88 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 G 7.99 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 0.00 0.00 0.00 62 H 7.83 4.87 0.00 3.37 3.36 0.00 5.50 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 9.13 4.02 0.00 2.23 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.10 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 64 A 8.08 3.92 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 65 A 7.75 4.05 1.68 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 0.00 0.00 66 M 8.17 4.03 0.00 2.07 2.17 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.76 0.00 67 Q 7.86 3.94 0.00 2.30 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.79 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 68 M 8.00 4.22 0.00 2.09 2.24 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.60 0.00 69 L 8.09 3.91 0.00 1.64 1.64 0.78 0.24 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 70 K 8.09 3.92 0.00 2.05 1.98 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.49 7.81 71 E 8.65 3.96 0.00 2.17 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 0.00 2.52 2.36 0.00 72 T 7.78 3.84 4.37 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 1.19 0.00 0.00 73 I 7.83 3.80 2.11 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.98 1.29 0.00 0.00 74 N 8.19 4.30 0.00 2.99 2.86 0.00 0.00 7.10 6.94 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 75 E 8.22 3.88 0.00 2.06 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 2.29 2.57 0.00 76 E 8.17 3.52 0.00 1.40 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 2.32 2.27 0.00 77 A 7.89 3.35 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 78 A 8.09 3.95 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 79 E 8.11 3.81 0.00 2.08 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 2.26 2.35 0.00 80 W 7.79 4.28 0.00 3.68 3.40 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 81 D 8.06 4.62 0.00 2.93 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 82 R 7.71 3.83 0.00 1.77 2.03 0.00 3.22 0.00 0.00 3.39 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.57 0.00 83 L 7.47 4.36 0.00 1.57 1.62 0.62 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 84 H 8.00 4.68 0.00 3.07 3.13 0.00 5.63 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 P 0.00 4.29 0.00 2.17 2.27 0.00 3.76 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.95 0.00 86 V 7.68 3.15 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 0.87 0.00 0.00 0.99 0.00 0.00 87 H 8.14 3.65 0.00 3.30 3.55 0.00 5.81 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 88 A 8.37 3.67 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 89 G 8.29 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 90 P 0.00 4.62 0.00 2.24 2.16 0.00 3.81 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 91 I 7.47 3.43 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.61 0.99 0.00 0.00 92 A 8.88 3.61 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 93 P 0.00 4.54 0.00 2.20 2.10 0.00 3.91 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 1.99 1.97 0.00 94 G 8.32 4.94 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 95 Q 6.89 4.26 0.00 2.25 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.88 0.00 0.00 0.00 0.00 0.00 2.55 2.33 0.00 96 M 8.63 3.86 0.00 1.96 2.04 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.36 0.00 97 R 7.97 4.35 0.00 2.25 2.26 0.00 3.22 0.00 0.00 3.26 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.88 0.00 98 E 8.70 4.28 0.00 2.04 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 0.00 2.40 2.49 0.00 99 P 0.00 3.78 0.00 1.34 0.49 0.00 3.83 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.49 0.00 100 R 8.17 4.74 0.00 1.96 2.15 0.00 3.26 0.00 0.00 3.38 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.94 0.00 101 G 9.17 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 0.00 102 S 8.08 4.16 0.00 4.06 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 0.00 103 D 7.72 4.22 0.00 2.78 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 0.00 104 I 7.50 3.14 1.31 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 0.63 -0.18 0.00 0.00 0.00 105 A 7.59 2.58 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 0.00 106 G 7.84 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 0.00 107 T 7.75 4.02 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 1.22 0.00 0.00 108 T 7.85 4.66 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 1.23 0.00 0.00 109 S 7.91 5.01 0.00 4.34 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 0.00 110 T 8.65 4.22 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 1.24 0.00 0.00 111 L 8.50 3.91 0.00 1.69 1.70 0.86 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 112 Q 7.92 3.90 0.00 2.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.64 0.00 0.00 0.00 0.00 0.00 2.39 2.33 0.00 113 E 7.70 3.40 0.00 2.11 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 2.03 2.21 0.00 114 Q 8.09 4.48 0.00 2.29 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.80 0.00 0.00 0.00 0.00 0.00 2.57 2.73 0.00 115 I 7.41 3.76 1.96 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 1.72 0.60 0.85 0.00 0.00 116 G 7.90 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 0.00 117 W 7.86 4.36 0.00 3.63 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 0.00 118 M 7.90 4.55 0.00 2.04 2.23 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 2.82 2.57 0.00 119 T 7.51 4.71 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 0.00 120 H 7.73 4.80 0.00 3.36 3.24 0.00 5.75 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 N 8.40 4.15 0.00 2.70 2.74 0.00 0.00 7.09 8.02 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 0.00 122 P 0.00 3.99 0.00 2.20 2.09 0.00 3.70 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 1.97 2.07 0.00 123 P 0.00 4.33 0.00 2.21 2.14 0.00 3.79 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 2.02 2.02 0.00 124 I 8.26 4.11 2.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.93 0.71 0.00 0.00 125 P 0.00 4.60 0.00 2.20 2.22 0.00 3.76 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.05 0.00 126 V 7.62 3.24 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.21 0.00 0.00 1.00 0.00 0.00 127 G 7.85 3.60 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 0.00 128 E 7.95 3.84 0.00 2.02 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 129 I 7.88 3.46 1.33 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.43 0.08 0.00 0.00 130 Y 7.51 3.45 0.00 2.69 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 0.00 131 K 8.22 3.86 0.00 1.90 1.84 0.00 1.53 0.00 0.00 1.35 0.00 0.00 2.80 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.36 1.26 7.81 132 R 7.79 4.00 0.00 2.09 2.05 0.00 3.24 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.88 0.00 133 W 8.03 4.43 0.00 3.49 3.15 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 0.00 134 I 7.76 3.59 1.72 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 -0.04 0.47 0.00 0.00 135 I 7.42 3.70 2.07 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.89 0.94 0.00 0.00 136 L 8.04 4.23 0.00 2.02 1.73 1.09 1.02 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 0.00 137 G 7.92 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 L 8.15 3.73 0.00 1.65 1.55 0.41 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 139 N 8.55 4.38 0.00 2.89 3.06 0.00 0.00 7.08 6.37 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 0.00 140 K 7.74 4.05 0.00 1.90 1.88 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.74 1.60 7.81 141 I 7.37 3.71 1.81 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.61 0.91 0.00 0.00 142 V 7.61 3.82 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 0.97 0.00 0.00 0.94 0.00 0.00 143 R 7.69 4.04 0.00 1.94 2.11 0.00 3.31 0.00 0.00 3.23 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 144 M 8.06 4.81 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.55 0.00 145 Y 7.38 5.66 0.00 3.05 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 0.00 146 S 7.73 4.33 0.00 3.82 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 0.00 147 P 0.00 4.68 0.00 2.22 2.08 0.00 3.83 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 1.97 1.95 0.00 148 T 7.66 4.21 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 1.23 0.00 0.00 149 S 7.36 4.49 0.00 3.84 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 I 8.18 4.10 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 1.42 0.53 0.92 0.00 0.00 151 L 7.80 4.28 0.00 1.65 1.61 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00