NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3540 8.2649 123.5830 52.3645 19.6239 176.5468 3 R 3.9976 7.8315 122.7460 57.9443 32.3758 176.9934 4 R 3.7688 9.1213 116.7492 57.7913 29.4408 178.5455 5 R 4.1601 8.9582 125.1645 57.2336 31.4334 175.9532 6 R 4.2253 7.8889 116.2227 61.6571 30.2442 178.2678 7 A 3.6462 7.4210 116.4665 52.3013 15.4803 177.1017 8 E 4.1898 8.2486 121.4518 56.5979 30.6168 177.1011 9 V 3.7926 8.0399 120.1801 62.2007 32.2496 176.1752 10 R 3.9473 8.5072 126.5216 56.4284 30.4131 175.7004 11 Q 4.3529 8.5429 124.0845 54.8787 30.0811 174.7278 12 L 4.5687 8.1739 124.9889 53.2115 43.3090 176.3146 13 Q 4.0993 8.5031 121.7149 54.8442 29.0728 174.5913 14 P 4.3386 0.0000 0.0000 62.3777 31.8615 175.2449 15 D 4.5708 8.2221 118.1249 54.6985 41.5406 176.1931 16 L 4.6176 8.6179 124.1700 54.9145 41.6991 177.0833 17 V 4.4087 9.0260 118.2748 64.0262 37.5124 174.8565 18 Y 4.4475 8.7711 114.5306 56.7971 39.0143 176.1105 19 G 4.5294 8.1315 106.9587 45.7746 0.0000 172.2243 20 D 4.8721 7.6437 117.6941 52.2581 42.5756 177.5460 21 V 3.6538 8.5713 120.4805 64.5620 31.6673 177.9436 22 L 3.9728 7.9956 119.8729 58.3640 41.6299 179.4525 23 V 3.1961 7.8974 117.4556 66.0961 31.6028 177.7024 24 T 3.7558 7.9613 114.7987 66.7211 68.2782 175.6281 25 A 3.9203 7.9940 122.3218 55.5929 18.1350 179.3563 26 F 4.0305 8.1894 118.4692 61.6380 39.3452 177.4911 27 I 3.4848 7.8332 119.6912 64.2295 36.6012 178.1757 28 N 4.3027 8.2233 117.0384 55.9302 38.4107 177.1921 29 K 4.0492 7.5550 118.6769 58.3848 32.2136 178.8253 30 I 3.7872 6.7175 119.5944 62.7162 37.7070 176.3262 31 M 4.0712 7.1258 118.2284 56.0279 32.5782 175.7456 32 R 4.4443 8.2153 119.2709 56.4279 32.1041 174.3802 33 D 4.3895 9.1602 121.9992 55.2688 37.6963 174.8686 34 G 4.0419 8.3068 103.6942 46.5899 0.0000 176.3213 35 K 4.3237 7.3532 118.5335 54.7955 28.7716 177.9401 36 K 3.9601 7.7885 121.1810 59.0063 32.5728 176.9259 37 N 4.3123 8.0362 117.1402 56.7994 39.1758 176.0161 38 L 3.9610 8.0570 120.9441 58.3488 41.8623 178.9442 39 A 3.9220 7.9282 119.6949 55.0385 18.4658 179.4860 40 A 3.7647 7.9378 119.2692 55.6495 18.5121 179.4289 41 R 3.9946 8.7482 116.6275 59.5797 30.1624 178.9792 42 I 3.6569 8.1043 118.9428 64.9088 37.3934 178.2403 43 F 4.2290 7.9997 120.7109 61.0445 39.1047 176.8273 44 Y 4.1459 7.5681 116.3554 60.8334 37.6662 177.2618 45 D 4.3969 8.4615 118.7995 57.4853 41.1660 178.5929 46 A 4.0768 7.9648 120.8848 55.5026 17.9117 179.4967 47 C 3.8390 7.5342 114.9219 62.5765 27.9850 176.0257 48 K 4.2276 8.0153 118.9802 57.9953 31.5266 178.6750 49 I 3.9673 7.8613 120.3690 63.1413 37.0547 177.6116 50 I 3.7417 7.4685 119.0866 63.2029 37.2346 177.7306 51 Q 4.2674 7.3727 117.6830 58.9980 29.0772 177.3701 52 E 3.9927 8.2669 120.1788 57.8249 28.9634 178.3557 53 K 3.9842 6.5837 126.9302 59.0867 33.6105 177.3721 54 T 4.5540 8.0953 116.4014 61.7687 71.7300 174.7504 55 G 3.8585 8.8892 113.5825 46.5844 0.0000 172.9693 56 Q 4.5132 7.4524 118.4533 53.9365 30.4529 175.3763 57 E 4.1661 8.5080 119.9069 55.6494 30.2744 175.8494 58 P 4.2281 0.0000 0.0000 66.3853 31.1452 177.9913 59 L 3.8302 8.2794 120.2406 57.8025 41.8009 178.7893 60 K 4.0957 8.0751 119.0374 58.9939 32.0536 179.1278 61 V 3.5863 7.6812 118.4622 66.0094 31.5718 177.1191 62 F 4.1635 8.4908 120.5156 61.4968 39.1768 176.9541 63 K 3.5025 8.2064 117.4890 59.4745 31.7187 179.0586 64 Q 3.8583 7.8225 118.5048 59.6030 29.3036 177.6019 65 A 3.9096 8.1411 121.5388 55.0204 18.2985 179.5988 66 V 3.2972 7.5736 114.8389 65.7964 31.5859 177.9829 67 E 3.8493 7.9347 118.8329 59.7847 29.2363 178.8044 68 N 4.4098 8.0271 114.1836 55.3996 38.6846 176.6349 69 V 4.2768 7.2566 117.1206 61.9485 31.9565 175.5427 70 K 4.2567 7.3025 118.7210 55.5926 32.2577 175.0093 71 P 4.6153 0.0000 0.0000 62.7037 31.9350 176.2155 72 R 4.5551 8.7604 116.0765 56.8414 31.2894 175.5877 73 M 5.2346 7.8977 118.5171 53.8374 36.1095 174.0229 74 E 4.7843 9.3063 119.6302 55.0097 33.8926 173.8229 75 V 4.6180 8.3000 120.5453 61.6066 33.3144 175.0293 76 R 4.5783 8.8872 126.7014 53.9925 32.8193 175.6160 77 S 4.6281 8.9385 118.5869 58.7281 63.9111 172.9827 78 R 4.4716 8.0215 117.9103 55.9579 34.1385 173.5353 79 R 4.4450 8.6742 125.5395 55.2455 30.6834 176.2838 80 V 3.8510 7.7432 122.6950 61.4027 33.2856 175.0090 81 G 3.8065 9.6156 111.8662 46.2460 0.0000 173.5421 82 G 3.5287 8.7729 117.0093 45.9026 0.0000 173.2820 83 A 4.0465 8.7943 122.4822 52.7655 19.6573 177.7463 84 N 5.4683 7.9455 117.3696 50.8753 38.3169 173.3990 85 Y 4.2334 7.7192 120.2876 57.9977 39.5847 175.1369 86 Q 4.5335 8.5305 123.5850 55.1175 28.8036 174.9942 87 V 4.1446 8.7591 125.5714 61.7731 32.8428 173.1895 88 P 5.0948 0.0000 0.0000 62.8958 32.4345 175.0795 89 M 4.6207 8.8980 118.6467 54.1395 34.9420 173.6942 90 E 4.6540 8.7311 119.5844 56.2091 30.6417 176.4048 91 V 4.4842 7.9435 119.4443 60.8226 34.2694 175.4956 92 S 4.3013 8.7933 122.2285 57.7740 63.5045 173.4867 93 P 4.2051 0.0000 0.0000 65.9620 30.8576 178.5870 94 R 3.8570 7.8721 117.9793 59.3613 30.1114 178.3845 95 R 3.8290 9.0715 119.3623 59.2244 29.8957 178.3311 96 Q 3.8431 8.0416 118.0645 59.0068 28.6538 178.5697 97 Q 3.8222 7.7032 120.2094 59.2349 29.1381 178.1090 98 S 4.0019 7.7011 115.7909 61.8714 62.9173 177.2237 99 L 3.2053 7.6823 120.8296 57.3407 41.1405 179.0141 100 A 3.9803 7.7541 120.9068 55.3216 18.2829 179.5145 101 L 4.1237 8.0494 116.8836 57.9868 41.7751 179.6514 102 R 3.8236 7.7651 118.3798 59.4630 29.9241 178.3241 103 W 4.5627 8.5831 118.7883 60.1250 29.0702 178.0940 104 L 4.1292 8.5003 118.9490 58.1149 41.1478 179.4939 105 V 3.6511 8.1199 117.7085 66.3935 31.1476 178.3173 106 Q 3.9858 8.1993 116.3351 59.1214 28.9087 178.3693 107 A 4.1409 8.5428 121.9014 54.9522 18.4723 179.4738 108 A 4.0281 8.7051 119.7469 55.3866 18.3073 178.8058 109 N 4.7145 8.1086 111.3889 54.0928 38.7546 176.4018 110 Q 4.4688 7.9140 119.6335 55.4716 29.8229 175.9281 111 R 4.2760 7.1295 118.8043 55.2192 31.0591 175.0983 112 P 4.3866 0.0000 0.0000 65.7687 31.6342 176.3925 113 E 3.7730 7.9326 117.5992 55.3152 29.3251 177.7866 114 R 3.6176 8.8556 123.8134 58.9381 30.5667 177.1169 115 R 4.2168 7.6134 117.3673 55.0751 30.7926 176.4708 116 A 3.9496 8.9808 125.4957 55.6834 18.4068 179.0795 117 A 3.9915 8.1135 118.1192 55.2338 18.1873 180.0139 118 V 3.4332 7.7271 116.7323 66.2928 31.7212 178.1911 119 R 3.8716 8.1214 117.3035 59.7075 29.7756 178.9342 120 I 3.8756 7.7603 118.7122 64.2381 37.1824 178.0246 121 A 3.9846 7.7520 121.1000 55.8558 18.2380 179.4693 122 H 4.2964 8.9587 114.7675 58.7589 28.6772 177.8089 123 E 3.9670 8.4725 121.2054 59.2543 29.4804 178.5640 124 L 4.0300 8.1333 119.1086 58.3642 41.7523 179.2710 125 M 4.0371 7.8710 117.6205 58.7468 31.8946 178.2773 126 D 4.3994 8.3059 118.4458 57.6824 41.2121 179.1492 127 A 4.1712 8.6575 122.2804 54.4759 18.1537 179.4057 128 A 3.9338 7.8771 118.1986 55.6000 18.6137 179.6582 129 E 4.1007 8.0965 115.3358 57.8985 29.4870 178.3096 130 G 4.0589 7.7910 106.1781 44.7894 0.0000 172.6422 131 K 4.5131 8.7018 119.3581 54.3298 35.7207 175.8252 132 G 4.0983 8.7868 104.7277 45.1481 0.0000 174.7847 133 G 3.7510 8.8606 106.7891 47.7710 0.0000 175.6718 134 A 4.0855 8.2039 122.7667 55.2548 18.4512 179.9009 135 V 3.6238 7.7541 115.6153 65.9513 31.5738 177.2245 136 K 3.8125 7.9103 119.6793 58.7833 31.7844 178.3234 137 K 3.4473 7.7025 117.9718 59.3772 32.1224 178.8269 138 K 3.6978 7.2395 118.8972 59.8454 32.1451 178.6850 139 E 4.2044 8.3121 118.4506 59.1529 29.2106 179.1173 140 D 4.2966 8.2944 119.8888 57.0966 40.7922 178.6822 141 V 3.5447 7.9202 119.0484 66.1479 31.3970 177.7134 142 E 3.9734 7.7774 116.7289 59.6127 29.4174 179.4256 143 R 4.0613 7.7532 116.7992 59.5452 30.4910 178.4205 144 M 4.1670 8.2375 118.5091 57.7674 32.3276 177.1018 145 A 4.4244 7.9476 120.9919 51.8781 19.6049 177.4711 146 E 3.8012 8.8981 115.1747 57.2288 27.2953 175.2389 147 A 4.7320 7.9806 118.4646 51.6648 20.6682 176.4936 148 N 5.2119 7.7496 109.8460 52.9575 40.2218 175.7140 149 R 3.9782 8.2726 114.7275 57.0404 29.4105 176.7657 150 A 4.1373 8.0227 121.9528 54.0313 19.6504 179.1149 151 Y 4.0283 7.6169 111.1535 58.1532 37.7782 176.6149 152 A 4.3555 7.4936 121.3800 53.6627 18.4025 178.2630 153 H 4.8164 7.9122 110.9230 55.7045 29.0824 175.1143 154 Y 5.0540 7.3620 117.2115 61.5972 38.4773 180.2347 155 R 3.5307 7.7408 120.3143 58.1988 30.9046 176.1265 156 W 3.9129 7.9785 129.8340 57.7997 32.2085 173.3872 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 A 8.26 4.35 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 3 R 7.83 4.00 0.00 1.90 2.00 0.00 3.20 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 4 R 9.12 3.77 0.00 1.80 1.70 0.00 3.22 0.00 0.00 3.22 7.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 5 R 8.96 4.16 0.00 1.80 1.93 0.00 3.15 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 6 R 7.89 4.23 0.00 1.73 1.86 0.00 3.24 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.59 0.00 7 A 7.42 3.65 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 E 8.25 4.19 0.00 2.07 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 2.27 2.35 0.00 9 V 8.04 3.79 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 0.80 0.00 0.00 0.92 0.00 0.00 10 R 8.51 3.95 0.00 1.83 1.86 0.00 3.24 0.00 0.00 3.14 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 11 Q 8.54 4.35 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.83 0.00 0.00 0.00 0.00 0.00 2.30 2.43 0.00 12 L 8.17 4.57 0.00 1.65 1.57 0.94 0.97 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 13 Q 8.50 4.10 0.00 2.06 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.92 0.00 0.00 0.00 0.00 0.00 2.37 2.30 0.00 14 P 0.00 4.34 0.00 2.20 2.20 0.00 3.79 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.02 0.00 15 D 8.22 4.57 0.00 2.97 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 L 8.62 4.62 0.00 1.79 1.70 0.96 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17 V 9.03 4.41 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.47 0.00 0.00 18 Y 8.77 4.45 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 19 G 8.13 4.53 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 20 D 7.64 4.87 0.00 2.88 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 V 8.57 3.65 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 0.89 0.00 0.00 0.95 0.00 0.00 22 L 8.00 3.97 0.00 1.82 2.02 0.92 0.77 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 23 V 7.90 3.20 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 0.60 0.00 0.00 0.78 0.00 0.00 24 T 7.96 3.76 4.35 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 1.20 0.00 0.00 25 A 7.99 3.92 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 F 8.19 4.03 0.00 3.28 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 27 I 7.83 3.48 1.86 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.23 0.78 0.00 0.00 28 N 8.22 4.30 0.00 2.77 2.82 0.00 0.00 7.08 7.58 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 29 K 7.56 4.05 0.00 1.64 1.65 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.54 7.81 30 I 6.72 3.79 1.81 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 -0.04 0.83 0.00 0.00 31 M 7.13 4.07 0.00 2.07 1.93 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.46 0.00 32 R 8.22 4.44 0.00 1.89 1.82 0.00 3.15 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.63 0.00 33 D 9.16 4.39 0.00 2.90 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 34 G 8.31 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 0.00 0.00 0.00 35 K 7.35 4.32 0.00 1.85 1.78 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.59 7.81 36 K 7.79 3.96 0.00 1.81 1.82 0.00 1.71 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.49 7.81 37 N 8.04 4.31 0.00 2.85 2.80 0.00 0.00 6.82 6.66 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 38 L 8.06 3.96 0.00 1.80 1.84 0.93 0.93 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 39 A 7.93 3.92 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 40 A 7.94 3.76 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 R 8.75 3.99 0.00 2.04 2.17 0.00 3.21 0.00 0.00 3.20 7.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.91 0.00 42 I 8.10 3.66 2.03 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 1.42 1.21 0.97 0.00 0.00 43 F 8.00 4.23 0.00 2.99 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 44 Y 7.57 4.15 0.00 3.29 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 D 8.46 4.40 0.00 2.74 2.75 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 46 A 7.96 4.08 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 47 C 7.53 3.84 0.00 3.02 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 48 K 8.02 4.23 0.00 1.96 1.84 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.68 7.81 49 I 7.86 3.97 1.98 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 1.50 1.13 0.87 0.00 0.00 50 I 7.47 3.74 2.00 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 1.63 0.73 0.92 0.00 0.00 51 Q 7.37 4.27 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 7.02 0.00 0.00 0.00 0.00 0.00 2.55 2.55 0.00 52 E 8.27 3.99 0.00 1.96 1.80 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 2.33 2.53 0.00 53 K 6.58 3.98 0.00 1.80 1.92 0.00 1.74 0.00 0.00 1.79 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.51 1.46 7.81 54 T 8.10 4.55 4.59 0.00 0.00 0.00 0.00 0.00 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 55 G 8.89 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 56 Q 7.45 4.51 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.71 6.77 0.00 0.00 0.00 0.00 0.00 2.35 2.33 0.00 57 E 8.51 4.17 0.00 2.10 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 2.43 2.33 0.00 58 P 0.00 4.23 0.00 2.20 2.55 0.00 3.84 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 2.33 2.19 0.00 59 L 8.28 3.83 0.00 1.99 1.97 0.95 0.58 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 60 K 8.08 4.10 0.00 1.87 1.94 0.00 1.71 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.46 7.81 61 V 7.68 3.59 2.27 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 1.08 0.00 0.00 1.01 0.00 0.00 62 F 8.49 4.16 0.00 3.07 3.21 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 63 K 8.21 3.50 0.00 1.85 1.79 0.00 1.76 0.00 0.00 1.57 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.80 7.81 64 Q 7.82 3.86 0.00 2.14 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.92 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 65 A 8.14 3.91 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 66 V 7.57 3.30 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 0.82 0.00 0.00 0.23 0.00 0.00 67 E 7.93 3.85 0.00 2.15 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.39 0.00 68 N 8.03 4.41 0.00 2.75 2.87 0.00 0.00 7.04 7.09 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 69 V 7.26 4.28 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 1.19 0.00 0.00 1.03 0.00 0.00 70 K 7.30 4.26 0.00 1.77 1.72 0.00 1.71 0.00 0.00 1.86 0.00 0.00 2.99 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.55 1.60 7.81 71 P 0.00 4.62 0.00 2.34 2.47 0.00 3.64 0.00 0.00 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.04 0.00 72 R 8.76 4.56 0.00 1.94 2.20 0.00 2.73 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.55 0.00 73 M 7.90 5.23 0.00 1.86 1.95 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.47 0.00 74 E 9.31 4.78 0.00 2.01 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 2.11 2.19 0.00 75 V 8.30 4.62 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 0.82 0.00 0.00 0.94 0.00 0.00 76 R 8.89 4.58 0.00 1.02 1.13 0.00 2.44 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.24 0.00 77 S 8.94 4.63 0.00 3.94 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 78 R 8.02 4.47 0.00 2.53 2.11 0.00 2.97 0.00 0.00 3.36 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.26 0.00 79 R 8.67 4.44 0.00 1.72 1.74 0.00 3.14 0.00 0.00 3.13 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.55 0.00 80 V 7.74 3.85 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 0.12 0.00 0.00 0.55 0.00 0.00 81 G 9.62 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 82 G 8.77 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 83 A 8.79 4.05 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 84 N 7.95 5.47 0.00 2.60 2.77 0.00 0.00 7.31 7.46 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 85 Y 7.72 4.23 0.00 3.03 2.60 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 86 Q 8.53 4.53 0.00 1.90 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.94 0.00 0.00 0.00 0.00 0.00 2.34 2.29 0.00 87 V 8.76 4.14 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 1.21 0.00 0.00 1.48 0.00 0.00 88 P 0.00 5.09 0.00 2.13 2.06 0.00 3.97 0.00 0.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.12 0.00 89 M 8.90 4.62 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.28 0.00 90 E 8.73 4.65 0.00 1.85 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 2.31 2.16 0.00 91 V 7.94 4.48 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 0.76 0.00 0.00 0.96 0.00 0.00 92 S 8.79 4.30 0.00 4.01 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 93 P 0.00 4.21 0.00 2.26 2.33 0.00 3.68 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 2.05 2.00 0.00 94 R 7.87 3.86 0.00 1.91 1.93 0.00 3.19 0.00 0.00 3.24 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 95 R 9.07 3.83 0.00 1.70 1.83 0.00 3.09 0.00 0.00 3.17 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.57 0.00 96 Q 8.04 3.84 0.00 2.31 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.58 0.00 0.00 0.00 0.00 0.00 2.54 2.42 0.00 97 Q 7.70 3.82 0.00 2.03 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.66 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 98 S 7.70 4.00 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 99 L 7.68 3.21 0.00 1.11 0.13 0.68 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 100 A 7.75 3.98 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 0.00 101 L 8.05 4.12 0.00 1.71 1.89 1.02 1.11 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 0.00 102 R 7.77 3.82 0.00 1.86 1.90 0.00 3.05 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.68 0.00 103 W 8.58 4.56 0.00 3.61 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 0.00 104 L 8.50 4.13 0.00 2.26 2.07 0.95 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 105 V 8.12 3.65 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 0.99 0.00 0.00 0.54 0.00 0.00 106 Q 8.20 3.99 0.00 2.36 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.75 0.00 0.00 0.00 0.00 0.00 2.45 2.68 0.00 107 A 8.54 4.14 1.46 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 0.00 108 A 8.71 4.03 1.47 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 0.00 0.00 0.00 0.00 0.00 0.00 109 N 8.11 4.71 0.00 2.80 2.87 0.00 0.00 7.02 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 0.00 110 Q 7.91 4.47 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.48 6.94 0.00 0.00 0.00 0.00 0.00 2.58 2.52 0.00 111 R 7.13 4.28 0.00 1.99 2.17 0.00 3.36 0.00 0.00 3.45 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.81 0.00 112 P 0.00 4.39 0.00 2.19 2.17 0.00 3.83 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 1.98 1.95 0.00 113 E 7.93 3.77 0.00 2.17 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 0.00 2.41 2.38 0.00 114 R 8.86 3.62 0.00 1.83 2.07 0.00 3.20 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 115 R 7.61 4.22 0.00 1.78 1.86 0.00 3.16 0.00 0.00 3.17 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.57 0.00 116 A 8.98 3.95 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 0.00 117 A 8.11 3.99 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 0.00 118 V 7.73 3.43 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 0.85 0.00 0.00 0.90 0.00 0.00 119 R 8.12 3.87 0.00 2.08 2.19 0.00 3.43 0.00 0.00 3.44 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.02 0.00 120 I 7.76 3.88 2.12 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 1.60 0.82 1.27 0.00 0.00 121 A 7.75 3.98 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 0.00 122 H 8.96 4.30 0.00 3.19 3.36 0.00 5.65 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.47 3.97 0.00 2.33 2.18 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 2.63 2.50 0.00 124 L 8.13 4.03 0.00 2.05 1.79 1.03 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 125 M 7.87 4.04 0.00 2.09 2.31 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.63 0.00 126 D 8.31 4.40 0.00 3.04 2.94 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 0.00 127 A 8.66 4.17 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 0.00 128 A 7.88 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 0.00 129 E 8.10 4.10 0.00 2.11 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 2.35 2.47 0.00 130 G 7.79 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 K 8.70 4.51 0.00 1.88 1.92 0.00 1.27 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.44 1.35 7.81 132 G 8.79 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 0.00 0.00 0.00 133 G 8.86 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 0.00 134 A 8.20 4.09 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 0.00 135 V 7.75 3.62 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 1.17 0.00 0.00 0.95 0.00 0.00 136 K 7.91 3.81 0.00 1.83 1.82 0.00 1.61 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.59 1.42 7.81 137 K 7.70 3.45 0.00 0.88 0.74 0.00 1.34 0.00 0.00 1.13 0.00 0.00 2.77 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.13 1.36 7.81 138 K 7.24 3.70 0.00 2.04 1.98 0.00 1.68 0.00 0.00 1.75 0.00 0.00 3.37 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.64 1.88 7.81 139 E 8.31 4.20 0.00 2.08 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 2.31 2.60 0.00 140 D 8.29 4.30 0.00 2.65 2.60 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 0.00 141 V 7.92 3.54 2.32 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 1.23 0.00 0.00 0.98 0.00 0.00 142 E 7.78 3.97 0.00 1.97 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 0.00 2.37 2.41 0.00 143 R 7.75 4.06 0.00 1.99 1.98 0.00 3.15 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.96 0.00 144 M 8.24 4.17 0.00 2.00 2.39 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 2.62 2.71 0.00 145 A 7.95 4.42 1.27 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 0.00 0.00 0.00 146 E 8.90 3.80 0.00 2.31 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 2.21 2.23 0.00 147 A 7.98 4.73 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 0.00 148 N 7.75 5.21 0.00 2.85 3.01 0.00 0.00 6.54 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 0.00 149 R 8.27 3.98 0.00 1.77 1.89 0.00 3.19 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 150 A 8.02 4.14 0.78 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 0.00 151 Y 7.62 4.03 0.00 3.10 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 0.00 152 A 7.49 4.36 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 0.00 153 H 7.91 4.82 0.00 3.28 3.29 0.00 5.49 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 7.36 5.05 0.00 3.27 2.98 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 0.00 155 R 7.74 3.53 0.00 1.95 2.13 0.00 3.52 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.68 0.00 156 W 7.98 3.91 0.00 3.88 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