NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4304 8.3349 116.7937 58.1404 64.2885 173.1164 2 L 4.1695 8.3458 125.3072 52.3762 42.3950 176.1807 3 S 4.4520 9.6453 120.4168 57.8391 66.1240 175.3664 4 S 4.0838 8.4308 117.2754 61.3623 62.4927 176.5068 5 K 3.7969 8.0723 121.9011 59.8442 31.3235 178.2107 6 D 4.4390 8.1276 120.1893 56.7132 40.6711 178.9518 7 K 3.8674 8.0598 118.8139 59.6125 32.0868 179.1038 8 D 4.2820 8.3548 119.0974 57.2907 40.8168 178.7450 9 A 3.9847 8.0269 121.2071 55.0681 18.3938 179.9244 10 V 3.4294 8.0828 117.0547 66.1988 31.6430 178.4286 11 K 3.8848 8.1648 118.2649 59.3062 31.7531 179.2900 12 A 3.9662 8.1515 121.1809 54.8053 18.2920 179.1087 13 L 3.6991 7.7637 118.8123 58.2575 41.8399 179.0917 14 W 3.7787 8.0642 126.6518 60.2561 30.7541 177.7570 15 G 3.7388 8.2556 105.6539 47.8365 0.0000 175.8319 16 K 3.9450 7.7778 120.2711 58.7466 32.2981 178.8280 17 I 3.6166 7.5337 111.5606 61.3835 37.7572 177.4545 18 A 3.7548 7.2887 124.0815 55.7374 17.9151 178.7789 19 D 4.3369 8.0923 114.0436 56.9373 41.3172 177.2493 20 K 4.4427 8.0802 116.4254 56.2205 32.7608 177.9947 21 A 3.8199 8.0142 123.9598 55.3857 18.2152 180.4092 22 E 3.8916 8.0681 116.6038 59.3212 29.5085 178.7910 23 E 3.9112 8.1994 118.9171 59.5233 29.5456 178.8127 24 I 3.8084 7.9388 119.8142 64.2844 37.1583 178.6550 25 G 3.5993 8.3016 106.2616 47.7371 0.0000 175.2559 26 A 3.9704 7.9916 123.9104 55.0883 18.3988 179.5316 27 D 4.2638 8.4457 117.1496 57.4299 40.8261 178.8555 28 A 4.0459 8.3089 121.6033 55.1343 18.3861 179.4921 29 L 4.0228 8.1187 119.0173 58.0370 42.1603 179.2362 30 G 3.7228 8.2825 105.8540 47.9520 0.0000 175.6224 31 R 3.9229 8.4218 121.2297 59.1428 30.1500 178.6258 32 M 4.2497 8.3050 117.9371 58.9543 32.0929 178.2293 33 L 4.0505 8.0812 118.6568 57.7895 41.5720 179.4474 34 A 4.0346 7.8381 119.6159 55.0578 18.5745 179.5447 35 V 3.5944 8.1586 116.1258 64.5921 33.1216 175.9618 36 Y 4.7236 7.9879 115.6109 54.9317 38.0721 174.3031 37 P 4.7055 0.0000 0.0000 64.2138 31.4210 178.1870 38 Q 4.0650 8.3278 118.0862 59.6204 28.2918 178.3216 39 T 4.0713 8.5005 111.1587 63.7125 69.0207 176.6876 40 K 4.1435 8.1916 122.0450 59.6007 31.7598 178.8038 41 T 3.7187 7.1672 112.4798 65.0495 67.1867 175.2192 42 Y 3.9682 7.3852 116.8428 59.1176 38.0557 175.7923 43 F 4.1390 7.6239 119.5761 56.6791 39.8702 176.8617 44 S 4.2723 7.9082 115.7589 60.1731 63.3075 174.7753 45 H 4.3002 7.6742 116.9587 58.4479 28.2721 175.9079 46 W 4.4942 7.6646 121.2476 56.1874 28.8111 176.5588 47 K 4.0932 8.9460 124.1032 58.1761 31.8583 176.3855 48 D 4.7975 8.0658 117.5033 52.7231 41.7262 174.7479 49 L 4.7336 8.4645 125.8018 54.4228 42.2584 177.3645 50 S 4.3841 8.1959 115.3904 56.9909 63.7200 172.1923 51 P 4.4458 0.0000 0.0000 64.1458 31.5630 176.9350 52 G 3.9471 8.8750 108.8028 45.7720 0.0000 174.6212 53 S 4.2255 7.8944 115.6273 57.8377 64.8980 174.8887 54 A 3.8663 8.4409 126.1401 55.1671 18.2309 178.5383 55 P 3.8098 0.0000 0.0000 65.2564 31.1959 179.1024 56 V 2.8178 7.1041 117.1389 65.4592 31.5026 177.7555 57 N 4.2227 8.0882 116.4701 56.4141 38.3042 177.5819 58 K 3.9767 8.1249 120.0477 59.7254 32.1367 179.0285 59 H 4.4887 8.3630 118.5571 58.7203 29.7855 177.5781 60 G 3.6113 8.3250 108.1728 47.6514 0.0000 175.5739 61 K 3.9450 7.8868 120.7466 59.7050 32.0212 179.4946 62 T 3.9187 7.6519 115.6946 66.6638 68.3063 176.8699 63 I 3.7737 7.9280 121.7493 64.7535 37.1883 178.3920 64 M 4.4488 8.3500 119.6649 58.4236 31.6883 178.9963 65 G 3.8719 8.5834 106.2165 47.8306 0.0000 175.8657 66 G 3.7064 8.4861 108.4124 47.6848 0.0000 175.8171 67 L 3.9961 8.3214 121.6164 57.2721 41.5692 179.6273 68 V 3.5714 8.5930 118.7244 65.9602 31.5209 177.3205 69 D 4.3112 8.4230 117.7957 57.5453 40.8026 178.2120 70 A 3.9388 7.7270 119.5400 55.1409 18.4066 179.3883 71 V 3.4244 7.7703 115.7769 66.1248 31.6359 177.8996 72 A 4.1569 8.0572 119.2125 54.2462 18.3567 178.2264 73 S 4.6778 7.5418 112.3048 58.3527 63.3262 176.0862 74 I 3.8372 7.7446 122.5778 63.7177 37.8317 176.8007 75 D 4.5211 7.9758 118.9514 56.8277 41.2138 176.3018 76 D 4.6860 7.9956 118.5287 51.7441 42.3365 175.1270 77 L 3.9932 8.1846 124.5392 57.0328 42.0498 178.0525 78 N 4.2297 8.1796 115.8541 56.4552 38.3327 177.0297 79 A 4.0956 8.5127 122.0125 55.2500 18.3002 180.0037 80 G 3.5981 8.0608 102.9346 46.7773 0.0000 174.9818 81 L 4.6641 7.7970 119.8013 54.2577 42.1754 177.9915 82 L 3.9300 7.5942 123.3643 58.3267 41.9864 178.9610 83 A 4.0085 7.9445 119.9814 55.3572 18.3832 179.5200 84 L 4.0734 7.8951 117.0085 57.6716 41.6701 179.5057 85 S 4.2597 8.4714 113.6434 61.5456 62.3414 175.8206 86 E 4.1628 8.3807 121.3455 59.5670 29.2393 179.3067 87 L 3.9737 8.0873 119.9362 58.7022 42.3125 178.8566 88 H 4.2981 8.6322 115.6459 58.1350 28.4475 177.8409 89 A 2.5800 7.9822 123.1478 54.2001 17.9867 178.9641 90 F 4.4803 7.8860 113.9305 59.0067 40.6305 177.8251 91 T 4.0202 7.8169 113.9076 66.4431 68.6110 175.2039 92 L 4.4220 7.4711 119.3878 54.0451 43.1496 176.4729 93 R 4.9398 7.9304 116.4903 53.7640 30.1207 176.0628 94 V 3.1125 7.5860 116.8956 63.1498 32.2593 174.5962 95 D 4.3298 8.9765 127.0303 53.6463 40.8787 174.9997 96 P 3.0114 0.0000 0.0000 64.1775 30.9839 177.9245 97 A 3.9260 7.9997 120.3687 55.3727 18.2460 179.2928 98 N 4.2316 8.5962 115.5581 55.8423 38.4845 177.5628 99 F 4.3688 7.3204 119.7021 60.5875 39.0245 177.4155 100 K 3.9498 8.1125 118.5833 59.4546 31.8514 178.8123 101 I 3.3465 6.9057 121.8329 64.0538 36.9465 177.9148 102 L 3.9052 7.6479 120.8159 58.3044 41.8216 179.0556 103 S 3.5592 7.8972 114.8932 61.7668 62.7208 176.2297 104 H 4.1175 8.0975 120.5631 59.6416 29.5895 177.0652 105 C 4.1380 8.2273 118.4957 62.7552 27.7807 176.3124 106 I 3.7101 7.9757 121.8313 64.2658 36.6214 178.3769 107 L 4.2074 7.8665 119.8941 57.8545 41.6108 179.7078 108 V 3.3740 7.9465 118.4453 65.9409 31.0511 177.7200 109 Q 3.9386 8.1749 119.2348 59.3222 28.9155 178.3324 110 L 4.1054 8.3331 119.9696 57.9215 41.4811 179.3510 111 A 3.6195 7.7115 119.7996 55.0730 18.2014 179.8794 112 V 3.6359 7.5550 109.6720 63.4307 31.5854 177.5939 113 K 4.1604 7.3441 117.6044 56.1430 34.6886 176.1799 114 F 5.0623 8.6737 117.0669 55.7205 39.4601 174.5234 115 P 4.4962 0.0000 0.0000 65.6786 31.9237 179.4492 116 K 4.1841 8.1571 117.2304 58.9590 32.0844 177.2498 117 D 4.6949 8.3235 116.8823 55.0697 41.3995 176.6810 118 F 4.6834 7.8602 119.9834 57.0073 38.7944 176.6188 119 T 4.2286 7.4479 111.6851 60.9647 71.1580 172.7411 120 P 4.2642 0.0000 0.0000 66.0987 31.4721 178.8695 121 E 3.9217 8.0392 116.7717 58.9941 29.3976 179.3913 122 V 3.1360 7.2608 117.1623 65.8984 31.4796 177.3972 123 H 3.9325 8.0560 118.1702 59.1552 29.6438 176.7043 124 L 3.9194 8.0124 122.1237 58.4276 41.7300 179.1987 125 S 4.3298 7.4677 115.6723 61.3420 62.6805 176.4020 126 Y 4.3920 7.8214 119.5158 61.2048 37.5362 178.0346 127 D 4.6297 8.8713 119.5156 57.3403 41.3158 178.4158 128 K 3.9956 8.2827 119.1474 59.2643 32.0140 179.0207 129 F 4.1160 8.2885 120.8745 61.5506 39.2691 177.3316 130 F 4.0637 8.3470 117.3532 60.3712 38.5640 177.9793 131 S 4.1079 8.4909 115.0772 61.5719 62.5672 176.5710 132 A 3.8917 8.1022 123.5761 54.7776 17.9488 179.8035 133 V 3.1516 7.7516 117.0215 65.9864 31.5620 177.8633 134 A 3.5782 7.9878 120.6585 55.4057 17.9615 179.8416 135 R 3.7888 7.8275 114.8282 59.2448 30.2882 178.8595 136 A 4.6305 8.0377 122.2346 54.7400 18.1568 179.7454 137 L 3.8363 7.7119 116.3753 57.2552 41.9728 178.8365 138 A 4.1165 7.6580 119.6043 53.3758 18.3298 179.0520 139 E 4.0306 7.6910 116.9221 58.9101 29.5742 177.9170 140 K 4.5980 7.8580 115.6225 56.6076 32.3047 177.3544 141 Y 3.8170 8.1854 119.4647 60.6586 38.0381 176.1631 142 R 4.2758 7.8536 119.7005 56.6234 29.1421 174.4943 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 S 8.33 4.43 0.00 3.87 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 2 L 8.35 4.17 0.00 1.72 1.61 1.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.65 4.45 0.00 4.04 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 4 S 8.43 4.08 0.00 3.87 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 5 K 8.07 3.80 0.00 1.79 1.79 0.00 1.69 0.00 0.00 1.77 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.52 7.81 6 D 8.13 4.44 0.00 2.86 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 K 8.06 3.87 0.00 1.92 1.80 0.00 1.64 0.00 0.00 1.69 0.00 0.00 3.09 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.42 1.67 7.81 8 D 8.35 4.28 0.00 2.85 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.03 3.98 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 10 V 8.08 3.43 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 -0.30 0.00 0.00 0.82 0.00 0.00 11 K 8.16 3.88 0.00 1.80 1.80 0.00 1.72 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.40 7.81 12 A 8.15 3.97 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 13 L 7.76 3.70 0.00 1.66 1.79 0.50 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 14 W 8.06 3.78 0.00 3.45 3.06 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 15 G 8.26 3.74 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 0.00 0.00 0.00 16 K 7.78 3.95 0.00 1.66 1.62 0.00 1.63 0.00 0.00 1.83 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.48 7.81 17 I 7.53 3.62 1.39 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.41 -0.07 0.00 0.00 18 A 7.29 3.75 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 19 D 8.09 4.34 0.00 2.69 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 20 K 8.08 4.44 0.00 1.99 1.82 0.00 1.86 0.00 0.00 1.52 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.39 1.45 7.81 21 A 8.01 3.82 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 22 E 8.07 3.89 0.00 2.06 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 2.43 0.00 23 E 8.20 3.91 0.00 2.01 2.21 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 2.37 2.40 0.00 24 I 7.94 3.81 2.01 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.63 0.92 0.00 0.00 25 G 8.30 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 26 A 7.99 3.97 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 D 8.45 4.26 0.00 2.82 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 28 A 8.31 4.05 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 29 L 8.12 4.02 0.00 1.97 1.96 0.89 1.34 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 30 G 8.28 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 R 8.42 3.92 0.00 2.05 2.06 0.00 3.15 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.87 0.00 32 M 8.30 4.25 0.00 2.25 2.14 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.72 0.00 33 L 8.08 4.05 0.00 1.80 1.76 0.99 0.63 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 34 A 7.84 4.03 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 35 V 8.16 3.59 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 0.24 0.00 0.00 0.95 0.00 0.00 36 Y 7.99 4.72 0.00 3.21 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 37 P 0.00 4.71 0.00 2.27 2.32 0.00 3.90 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.87 0.00 38 Q 8.33 4.06 0.00 2.33 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.98 0.00 0.00 0.00 0.00 0.00 2.53 2.53 0.00 39 T 8.50 4.07 4.50 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 1.35 0.00 0.00 40 K 8.19 4.14 0.00 1.95 1.92 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.51 1.58 7.81 41 T 7.17 3.72 4.03 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 0.00 0.00 0.62 0.00 0.00 42 Y 7.39 3.97 0.00 2.44 2.24 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 43 F 7.62 4.14 0.00 2.39 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 44 S 7.91 4.27 0.00 3.91 3.91 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 0.00 0.00 0.00 45 H 7.67 4.30 0.00 3.45 3.56 0.00 5.73 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 W 7.66 4.49 0.00 3.35 3.07 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 47 K 8.95 4.09 0.00 1.82 1.92 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.48 7.81 48 D 8.07 4.80 0.00 2.62 2.56 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 49 L 8.46 4.73 0.00 1.74 1.77 1.15 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 50 S 8.20 4.38 0.00 4.02 4.11 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 51 P 0.00 4.45 0.00 2.27 2.09 0.00 3.79 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 1.98 1.96 0.00 52 G 8.87 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 53 S 7.89 4.23 0.00 3.99 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 54 A 8.44 3.87 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 55 P 0.00 3.81 0.00 1.02 1.39 0.00 3.31 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 1.95 1.97 0.00 56 V 7.10 2.82 1.99 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 1.07 0.00 0.00 0.81 0.00 0.00 57 N 8.09 4.22 0.00 2.93 2.79 0.00 0.00 7.04 7.56 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 58 K 8.12 3.98 0.00 1.66 1.84 0.00 1.66 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.57 1.55 7.81 59 H 8.36 4.49 0.00 3.46 3.42 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 G 8.32 3.61 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 0.00 0.00 0.00 61 K 7.89 3.95 0.00 2.06 1.91 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.71 7.81 62 T 7.65 3.92 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 63 I 7.93 3.77 1.95 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.96 1.03 0.00 0.00 64 M 8.35 4.45 0.00 2.18 2.21 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.95 0.00 65 G 8.58 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 66 G 8.49 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 0.00 0.00 0.00 67 L 8.32 4.00 0.00 2.19 1.55 1.41 1.02 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 68 V 8.59 3.57 2.37 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 1.20 0.00 0.00 1.53 0.00 0.00 69 D 8.42 4.31 0.00 2.96 2.91 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 0.00 0.00 0.00 70 A 7.73 3.94 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 71 V 7.77 3.42 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 0.63 0.00 0.00 -0.11 0.00 0.00 72 A 8.06 4.16 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 73 S 7.54 4.68 0.00 3.94 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 74 I 7.74 3.84 1.99 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 1.44 0.93 0.86 0.00 0.00 75 D 7.98 4.52 0.00 2.69 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 D 8.00 4.69 0.00 2.62 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 0.00 0.00 0.00 0.00 77 L 8.18 3.99 0.00 1.65 1.58 0.79 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 78 N 8.18 4.23 0.00 2.92 2.86 0.00 0.00 7.03 8.12 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 79 A 8.51 4.10 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 80 G 8.06 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 81 L 7.80 4.66 0.00 1.68 1.58 0.76 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 82 L 7.59 3.93 0.00 1.92 1.68 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 83 A 7.94 4.01 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 84 L 7.90 4.07 0.00 1.84 1.78 0.95 0.91 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 85 S 8.47 4.26 0.00 4.06 4.05 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 86 E 8.38 4.16 0.00 2.36 2.12 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 2.52 2.53 0.00 87 L 8.09 3.97 0.00 1.90 1.92 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 88 H 8.63 4.30 0.00 3.55 3.73 0.00 5.86 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 A 7.98 2.58 -0.14 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 0.00 0.00 90 F 7.89 4.48 0.00 2.92 3.03 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 0.00 0.00 0.00 91 T 7.82 4.02 4.38 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 1.22 0.00 0.00 92 L 7.47 4.42 0.00 1.60 1.57 0.73 0.89 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 93 R 7.93 4.94 0.00 1.65 1.83 0.00 3.07 0.00 0.00 2.25 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.59 0.00 94 V 7.59 3.11 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 -0.02 0.00 0.00 0.59 0.00 0.00 95 D 8.98 4.33 0.00 2.76 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 96 P 0.00 3.01 0.00 1.92 1.94 0.00 3.42 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.90 0.00 97 A 8.00 3.93 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 98 N 8.60 4.23 0.00 2.33 2.65 0.00 0.00 6.90 5.35 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 99 F 7.32 4.37 0.00 2.92 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 0.00 100 K 8.11 3.95 0.00 1.78 1.77 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.81 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.45 7.81 101 I 6.91 3.35 1.82 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.17 0.12 0.00 0.00 102 L 7.65 3.91 0.00 1.83 1.71 0.97 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 103 S 7.90 3.56 0.00 4.04 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 H 8.10 4.12 0.00 3.26 3.40 0.00 5.79 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 0.00 105 C 8.23 4.14 0.00 3.14 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 0.00 106 I 7.98 3.71 1.61 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 1.58 0.79 1.10 0.00 0.00 107 L 7.87 4.21 0.00 1.87 1.90 1.20 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 108 V 7.95 3.37 2.12 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 0.93 0.00 0.00 0.76 0.00 0.00 109 Q 8.17 3.94 0.00 2.25 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.57 0.00 0.00 0.00 0.00 0.00 2.58 2.49 0.00 110 L 8.33 4.11 0.00 2.20 2.13 1.08 1.10 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 0.00 111 A 7.71 3.62 0.48 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 0.00 112 V 7.56 3.64 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 0.72 0.00 0.00 1.00 0.00 0.00 113 K 7.34 4.16 0.00 1.55 1.50 0.00 1.55 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.30 1.05 7.81 114 F 8.67 5.06 0.00 3.29 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 0.00 115 P 0.00 4.50 0.00 2.27 2.42 0.00 3.80 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.00 0.00 116 K 8.16 4.18 0.00 1.88 2.00 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.50 1.53 7.81 117 D 8.32 4.69 0.00 3.05 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 0.00 118 F 7.86 4.68 0.00 3.35 3.19 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 0.00 119 T 7.45 4.23 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 1.25 0.00 0.00 120 P 0.00 4.26 0.00 2.18 2.17 0.00 3.61 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 2.14 2.23 0.00 121 E 8.04 3.92 0.00 1.96 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 2.36 2.33 0.00 122 V 7.26 3.14 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 0.63 0.00 0.00 0.86 0.00 0.00 123 H 8.06 3.93 0.00 3.44 3.46 0.00 5.67 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 0.00 124 L 8.01 3.92 0.00 1.79 1.87 0.91 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 125 S 7.47 4.33 0.00 3.81 3.83 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 0.00 126 Y 7.82 4.39 0.00 3.26 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 0.00 127 D 8.87 4.63 0.00 3.09 2.79 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 0.00 128 K 8.28 4.00 0.00 2.06 1.88 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.65 7.81 129 F 8.29 4.12 0.00 2.93 3.03 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 0.00 0.00 0.00 130 F 8.35 4.06 0.00 3.21 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 0.00 131 S 8.49 4.11 0.00 4.03 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 0.00 132 A 8.10 3.89 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 V 7.75 3.15 1.89 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 0.85 0.00 0.00 -0.12 0.00 0.00 134 A 7.99 3.58 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 0.00 135 R 7.83 3.79 0.00 1.85 1.95 0.00 3.15 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.76 0.00 136 A 8.04 4.63 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 0.00 137 L 7.71 3.84 0.00 0.64 0.82 0.36 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 138 A 7.66 4.12 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 0.00 139 E 7.69 4.03 0.00 2.12 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 2.52 2.61 0.00 140 K 7.86 4.60 0.00 1.88 2.20 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.38 0.00 0.00 0.00 0.00 1.51 1.64 7.81 141 Y 8.19 3.82 0.00 3.07 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 0.00 142 R 7.85 4.28 0.00 1.93 1.91 0.00 3.11 0.00 0.00 3.31 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.67 0.00