NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 G 3.9413 8.2127 109.7386 45.3401 0.0000 175.5515 7 K 3.7162 7.8999 119.9923 58.4178 32.3250 177.6287 8 N 4.3988 8.4831 118.2769 56.1000 38.9847 176.7169 9 A 4.2339 7.9908 121.7555 55.1687 18.4762 179.3194 10 E 3.8952 8.1250 116.5760 59.8202 29.6259 179.8749 11 R 3.8734 8.0457 117.9479 59.0698 30.0470 178.8680 12 E 3.8953 8.2183 119.2669 59.1022 29.6282 178.5380 13 L 3.1330 7.9273 120.6902 57.8295 41.9488 178.8987 14 V 3.4018 7.8115 118.4566 66.2227 31.4401 177.9832 15 S 4.0210 7.9195 112.6011 61.3517 62.0659 176.2069 16 I 3.6943 7.7452 122.6215 64.1086 36.8179 178.3313 17 L 3.8816 8.0125 120.1338 57.9870 41.5618 179.8271 18 R 4.7783 7.6386 119.4916 58.7405 29.7595 179.2233 19 G 3.6704 7.8565 104.0265 46.7355 0.0000 174.5671 20 E 4.0975 7.4621 120.0406 56.3782 29.8077 176.7502 21 G 3.9710 7.6377 105.9639 45.4128 0.0000 173.4468 22 F 4.5568 8.2274 119.2287 56.4822 40.6747 174.9080 23 N 4.8502 8.9835 120.9616 53.2789 39.3156 174.1089 24 A 4.9584 8.3986 124.5067 50.1862 22.7970 175.2564 25 V 4.2262 7.9176 119.5394 61.2303 35.2726 174.4234 26 R 4.5487 8.5618 126.6941 56.1032 31.0605 175.6745 27 I 4.3769 8.5255 124.6753 59.1156 38.4203 173.8899 28 P 4.3155 0.0000 0.0000 65.3307 31.7198 177.4277 29 T 4.3944 7.5426 114.5730 62.2792 68.7174 173.8299 30 S 4.0504 7.9669 119.7178 58.8191 62.3026 173.2114 31 N 5.0202 8.2351 122.8006 50.9158 41.5740 175.3803 32 S 4.1533 8.9767 116.8977 60.9939 63.0411 174.7193 33 S 4.0537 7.3527 115.1451 55.4239 64.4239 172.7939 34 P 4.4582 0.0000 0.0000 64.8987 31.6298 176.8174 35 N 4.3848 7.6136 116.5878 52.8839 38.7673 174.4403 36 P 4.6533 0.0000 0.0000 61.9957 29.4550 174.0013 37 L 4.5975 7.6349 123.9379 52.7503 45.1259 175.0962 38 P 4.4916 0.0000 0.0000 62.0829 32.6344 176.0299 39 D 4.5589 8.6526 118.3760 57.0076 41.8647 177.1098 40 I 5.1720 7.5639 117.6026 59.3744 41.8351 174.4693 41 F 5.6021 8.6093 119.9423 55.2519 41.3700 173.8014 42 A 5.2930 8.7900 120.5922 51.0316 22.9757 175.2822 43 T 5.7808 9.1159 110.2185 59.0941 73.1696 173.2359 44 K 4.2157 8.4876 123.7896 55.2787 35.0086 175.1120 45 G 3.6409 8.6758 117.7400 47.3788 0.0000 173.1915 46 N 4.6890 8.6436 123.1822 53.5817 39.1002 173.3837 47 T 5.0336 7.7388 114.5606 62.2201 70.6852 173.2641 48 L 5.2107 9.4775 129.3826 53.3213 44.9015 174.9110 49 L 5.0407 9.4889 127.0329 53.6630 43.5940 175.6363 50 S 4.7488 9.0635 117.9460 56.7455 65.0160 172.4998 51 I 4.9068 8.4674 128.5749 59.4090 40.2436 174.3451 52 E 4.7967 9.0783 128.7640 55.1136 31.0164 174.0090 53 C 5.4093 9.1028 127.9535 57.6726 33.5736 173.0951 54 K 4.8371 9.1279 124.6094 54.8700 36.5219 175.2850 55 S 4.7977 8.3279 117.1717 57.0557 66.0868 172.8834 56 T 4.5085 7.9823 114.2525 61.3065 70.7482 173.9785 57 W 4.6567 8.8341 124.6113 56.8339 29.8882 176.4557 58 E 4.4415 7.9649 118.9078 55.9429 29.8000 176.0319 59 N 4.9656 8.5814 115.1123 52.6846 37.7528 174.4623 60 K 5.1649 7.5946 116.4513 56.3357 35.9369 175.3414 61 V 4.4350 8.7567 120.6327 61.3067 35.0845 173.5673 62 K 4.8941 8.7437 129.0988 55.2080 33.5026 175.4689 63 V 4.5133 8.7694 127.1467 61.0716 34.6099 174.6072 64 K 4.8135 8.4545 125.6933 55.3404 33.8729 177.1217 65 E 4.0312 9.1139 125.1976 59.3003 29.2512 179.0704 66 H 4.1548 8.1984 116.1500 59.4211 30.0458 176.7437 67 Q 4.1094 7.9048 119.3460 58.7230 28.6696 178.3196 68 V 3.6783 8.0086 119.4926 66.0651 31.4809 178.0378 69 R 3.9326 8.3800 118.7625 59.2949 29.8480 178.5030 70 K 3.9547 7.7082 116.9870 59.4285 32.1460 179.1072 71 L 4.1041 7.6460 120.1797 57.3074 41.5800 179.7191 72 L 4.0912 7.8767 118.2625 57.9778 41.5331 179.0840 73 D 4.4277 8.3545 118.1227 57.1016 41.1040 178.4246 74 F 4.4057 8.3623 121.2605 61.5278 39.5000 177.2180 75 L 4.1277 8.1397 118.5299 57.7646 41.2177 179.4133 76 S 4.3027 7.9658 112.6116 60.6265 63.1446 175.5500 77 M 4.0043 7.6679 120.8117 55.4495 32.2450 175.8455 78 F 4.8251 7.4440 117.9418 55.7851 41.5597 175.5804 79 T 4.3329 8.3940 112.5179 62.3189 69.4414 174.9965 80 M 4.3275 7.8040 121.8620 54.8750 33.1319 175.9788 81 K 3.8349 8.5825 122.5519 57.4351 33.3742 175.5846 82 G 4.5098 8.7886 113.9424 44.3665 0.0000 171.9225 83 V 4.6149 8.8887 126.0726 60.3777 33.6982 172.7762 84 P 5.1490 0.0000 0.0000 62.5183 33.2311 175.0942 85 L 5.0279 8.9654 121.5701 53.2744 46.4475 175.5641 86 I 4.6014 9.0790 124.8379 60.1122 38.5494 174.4986 87 A 5.1499 9.0869 131.0185 50.4070 20.8726 175.4637 88 I 4.7008 9.0125 124.0961 59.4436 40.5941 175.0981 89 K 3.6688 8.1823 129.5610 54.8783 32.5486 175.8007 90 F 4.4039 8.6558 128.2534 56.6503 38.1798 176.8558 91 K 3.5712 8.4762 124.9465 58.5414 32.1538 180.0245 92 Q 4.1472 8.0952 117.3589 58.6810 28.6188 177.7321 93 V 4.0405 7.5679 106.9351 60.4532 32.3360 175.1259 94 H 3.9897 7.3500 115.7033 57.0024 26.6257 174.8261 95 E 4.7373 7.9326 117.2049 54.3562 34.1367 176.2109 96 W 4.8094 8.8775 124.3672 56.3570 30.5775 175.5875 97 R 5.2698 9.4678 123.7050 54.5090 34.0427 174.9669 98 V 5.0775 8.8624 113.6740 59.5922 36.3098 174.3855 99 L 4.9390 8.6771 124.6982 53.2774 45.2460 175.3562 100 V 4.7765 8.6561 126.3204 60.0252 32.0871 173.7660 101 P 4.4589 0.0000 0.0000 62.6449 32.0326 176.4765 102 E 4.0875 8.8887 121.7562 59.1618 29.6234 176.5732 103 K 4.2355 7.3395 113.9780 55.7555 34.9017 174.4921 104 A 4.1901 8.4753 122.5115 52.2659 17.9281 176.2007 105 E 4.7713 8.1260 118.7727 55.8749 33.2675 174.1842 106 D 4.8041 8.6248 120.2034 54.6616 41.6937 176.3573 107 I 4.6050 8.7597 122.8188 59.7123 41.4554 174.3108 108 I 4.6466 8.4889 128.0044 59.9978 38.1911 175.2820 109 V 4.3690 9.0669 129.3469 62.2865 32.3029 175.1440 110 T 5.0133 9.1381 118.0317 59.7106 71.9405 174.9279 111 I 3.5632 7.8697 120.7005 64.4738 37.2550 178.5702 112 D 4.3759 7.8219 119.3373 56.6074 40.6544 176.8715 113 N 4.8036 7.5840 114.2630 52.2811 37.6045 174.0511 114 S 5.1337 7.4668 112.1567 56.8172 66.0315 173.0163 115 I 4.7143 8.3503 112.9570 58.0295 41.1327 173.1855 116 P 4.6602 0.0000 0.0000 62.9729 31.9666 177.5894 117 I 3.4335 8.4347 122.6168 64.0817 37.8633 178.3902 118 E 4.1016 8.0092 118.9911 59.1300 29.2619 178.8189 119 D 4.3513 7.9045 118.9288 57.0409 40.9281 178.2880 120 L 3.9043 7.6923 120.3516 58.3598 42.1856 178.8442 121 F 4.6389 7.7899 117.5568 60.7146 38.7046 177.9276 122 K 4.2404 8.1407 118.0615 59.5827 31.5056 179.3594 123 I 3.7280 7.9866 120.1405 64.4964 36.7637 178.5354 124 L 4.0908 7.8053 118.7702 57.6440 41.6517 178.7875 125 E 4.0976 8.2385 119.1577 59.3332 29.2285 179.0752 126 K 4.0129 8.4362 118.7281 59.3242 31.7874 179.3268 127 R 3.8403 7.5812 118.1510 59.2465 30.0592 177.9543 128 I 3.7047 7.4197 119.0730 62.7579 37.1764 175.7989 129 E 4.1312 7.5916 122.2953 56.8773 30.1357 174.2230 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 6 G 8.21 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 K 7.90 3.72 0.00 1.92 1.84 0.00 1.72 0.00 0.00 1.82 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.59 7.81 8 N 8.48 4.40 0.00 2.80 2.87 0.00 0.00 7.02 7.49 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 9 A 7.99 4.23 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 10 E 8.13 3.90 0.00 2.21 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 0.00 2.33 2.49 0.00 11 R 8.05 3.87 0.00 2.01 1.97 0.00 3.13 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.77 0.00 12 E 8.22 3.90 0.00 2.24 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 0.00 2.48 2.42 0.00 13 L 7.93 3.13 0.00 0.82 1.42 0.09 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 14 V 7.81 3.40 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 0.91 0.00 0.00 0.86 0.00 0.00 15 S 7.92 4.02 0.00 3.92 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 I 7.75 3.69 1.74 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.69 0.91 0.00 0.00 17 L 8.01 3.88 0.00 1.72 1.59 0.71 0.83 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 18 R 7.64 4.78 0.00 1.95 1.94 0.00 3.07 0.00 0.00 3.22 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.53 0.00 19 G 7.86 3.67 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 0.00 0.00 0.00 0.00 20 E 7.46 4.10 0.00 1.33 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 1.47 2.01 0.00 21 G 7.64 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 22 F 8.23 4.56 0.00 3.01 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 23 N 8.98 4.85 0.00 2.66 2.72 0.00 0.00 6.46 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 24 A 8.40 4.96 1.04 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 25 V 7.92 4.23 1.11 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 0.86 0.00 0.00 0.66 0.00 0.00 26 R 8.56 4.55 0.00 1.69 1.81 0.00 3.27 0.00 0.00 3.19 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 27 I 8.53 4.38 2.06 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 1.46 0.74 0.94 0.00 0.00 28 P 0.00 4.32 0.00 2.19 2.14 0.00 3.78 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 2.00 2.01 0.00 29 T 7.54 4.39 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 30 S 7.97 4.05 0.00 3.84 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 31 N 8.24 5.02 0.00 2.88 2.65 0.00 0.00 7.07 8.13 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 32 S 8.98 4.15 0.00 3.91 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 33 S 7.35 4.05 0.00 3.98 3.90 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 0.00 0.00 0.00 34 P 0.00 4.46 0.00 2.23 2.25 0.00 3.80 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 2.00 2.00 0.00 35 N 7.61 4.38 0.00 2.78 2.84 0.00 0.00 7.02 7.90 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 36 P 0.00 4.65 0.00 2.29 2.14 0.00 3.74 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.02 0.00 37 L 7.63 4.60 0.00 1.57 1.50 0.94 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 38 P 0.00 4.49 0.00 2.28 1.83 0.00 3.01 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.87 0.00 39 D 8.65 4.56 0.00 2.74 2.87 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 40 I 7.56 5.17 1.77 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 1.29 0.98 0.80 0.00 0.00 41 F 8.61 5.60 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 42 A 8.79 5.29 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 43 T 9.12 5.78 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 1.33 0.00 0.00 44 K 8.49 4.22 0.00 0.79 0.74 0.00 1.05 0.00 0.00 1.13 0.00 0.00 2.63 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.00 1.01 7.81 45 G 8.68 3.64 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 0.00 0.00 0.00 46 N 8.64 4.69 0.00 2.76 2.77 0.00 0.00 6.84 7.22 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 47 T 7.74 5.03 4.46 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 1.39 0.00 0.00 48 L 9.48 5.21 0.00 1.61 1.63 0.92 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 49 L 9.49 5.04 0.00 1.57 1.52 0.46 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 50 S 9.06 4.75 0.00 4.11 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 51 I 8.47 4.91 1.92 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.56 0.85 0.00 0.00 52 E 9.08 4.80 0.00 2.02 1.81 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 2.24 2.41 0.00 53 C 9.10 5.41 0.00 2.99 2.80 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 54 K 9.13 4.84 0.00 1.59 1.49 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.32 1.35 7.81 55 S 8.33 4.80 0.00 3.41 3.44 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 56 T 7.98 4.51 4.08 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 0.00 0.00 0.94 0.00 0.00 57 W 8.83 4.66 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 58 E 7.96 4.44 0.00 2.06 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 2.41 2.43 0.00 59 N 8.58 4.97 0.00 2.78 2.93 0.00 0.00 5.78 7.13 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 60 K 7.59 5.16 0.00 1.81 1.83 0.00 1.56 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.48 7.81 61 V 8.76 4.44 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 0.67 0.00 0.00 0.71 0.00 0.00 62 K 8.74 4.89 0.00 1.81 1.69 0.00 1.78 0.00 0.00 1.64 0.00 0.00 2.69 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.43 7.81 63 V 8.77 4.51 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 1.00 0.00 0.00 0.92 0.00 0.00 64 K 8.45 4.81 0.00 1.74 1.72 0.00 1.97 0.00 0.00 1.75 0.00 0.00 2.82 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.38 7.81 65 E 9.11 4.03 0.00 2.06 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 0.00 2.34 2.32 0.00 66 H 8.20 4.15 0.00 3.14 3.35 0.00 5.97 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 67 Q 7.90 4.11 0.00 2.27 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.67 0.00 0.00 0.00 0.00 0.00 2.47 2.36 0.00 68 V 8.01 3.68 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 1.01 0.00 0.00 1.01 0.00 0.00 69 R 8.38 3.93 0.00 2.06 2.04 0.00 3.18 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.69 0.00 70 K 7.71 3.95 0.00 2.02 1.92 0.00 1.68 0.00 0.00 1.77 0.00 0.00 3.12 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.50 1.62 7.81 71 L 7.65 4.10 0.00 1.84 1.76 1.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 72 L 7.88 4.09 0.00 1.83 1.75 0.93 1.14 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 73 D 8.35 4.43 0.00 2.74 2.78 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 74 F 8.36 4.41 0.00 3.38 3.35 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 75 L 8.14 4.13 0.00 2.02 1.78 1.01 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 76 S 7.97 4.30 0.00 4.04 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 77 M 7.67 4.00 0.00 1.48 1.55 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.39 0.00 78 F 7.44 4.83 0.00 2.83 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 T 8.39 4.33 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 80 M 7.80 4.33 0.00 2.11 2.05 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 2.66 2.57 0.00 81 K 8.58 3.83 0.00 1.90 1.88 0.00 1.60 0.00 0.00 1.69 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.49 1.46 7.81 82 G 8.79 4.51 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 0.00 83 V 8.89 4.61 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.99 0.00 0.00 84 P 0.00 5.15 0.00 2.19 2.20 0.00 3.72 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 2.08 2.03 0.00 85 L 8.97 5.03 0.00 1.51 1.50 0.83 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 86 I 9.08 4.60 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 1.31 1.26 0.90 0.00 0.00 87 A 9.09 5.15 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 88 I 9.01 4.70 1.43 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 1.03 0.81 -0.50 0.00 0.00 89 K 8.18 3.67 0.00 0.79 0.74 0.00 0.84 0.00 0.00 1.10 0.00 0.00 2.48 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.61 0.21 7.81 90 F 8.66 4.40 0.00 2.97 2.80 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 91 K 8.48 3.57 0.00 0.79 0.74 0.00 0.96 0.00 0.00 0.61 0.00 0.00 2.53 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.73 0.84 7.81 92 Q 8.10 4.15 0.00 2.07 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 7.02 0.00 0.00 0.00 0.00 0.00 2.62 2.65 0.00 93 V 7.57 4.04 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 0.67 0.00 0.00 0.99 0.00 0.00 94 H 7.35 3.99 0.00 3.24 3.31 0.00 5.60 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 95 E 7.93 4.74 0.00 1.86 1.81 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 2.24 2.26 0.00 96 W 8.88 4.81 0.00 3.29 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 R 9.47 5.27 0.00 2.01 1.98 0.00 3.13 0.00 0.00 3.02 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.75 0.00 98 V 8.86 5.08 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.86 0.00 0.00 99 L 8.68 4.94 0.00 1.74 1.49 1.01 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 100 V 8.66 4.78 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 1.00 0.00 0.00 0.94 0.00 0.00 101 P 0.00 4.46 0.00 2.23 2.05 0.00 3.96 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 2.01 2.00 0.00 102 E 8.89 4.09 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 103 K 7.34 4.24 0.00 1.82 1.77 0.00 1.58 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 1.30 1.41 7.81 104 A 8.48 4.19 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 0.00 105 E 8.13 4.77 0.00 2.02 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 2.48 2.35 0.00 106 D 8.62 4.80 0.00 2.60 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 0.00 107 I 8.76 4.61 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 1.24 1.08 0.93 0.00 0.00 108 I 8.49 4.65 1.89 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 1.25 0.54 0.94 0.00 0.00 109 V 9.07 4.37 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.96 0.00 0.00 110 T 9.14 5.01 4.18 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 1.23 0.00 0.00 111 I 7.87 3.56 1.58 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.53 0.76 0.00 0.00 112 D 7.82 4.38 0.00 2.63 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 0.00 113 N 7.58 4.80 0.00 2.99 2.89 0.00 0.00 6.84 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 S 7.47 5.13 0.00 4.10 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 0.00 115 I 8.35 4.71 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.06 0.90 0.00 0.00 116 P 0.00 4.66 0.00 2.08 2.02 0.00 3.72 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 2.22 2.09 0.00 117 I 8.43 3.43 1.79 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.94 0.78 0.00 0.00 118 E 8.01 4.10 0.00 2.05 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 2.46 2.42 0.00 119 D 7.90 4.35 0.00 2.86 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 0.00 120 L 7.69 3.90 0.00 1.62 1.53 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 121 F 7.79 4.64 0.00 3.32 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 0.00 122 K 8.14 4.24 0.00 2.05 1.90 0.00 1.71 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 1.74 7.81 123 I 7.99 3.73 2.07 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 1.54 1.02 0.94 0.00 0.00 124 L 7.81 4.09 0.00 1.96 1.85 1.22 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 125 E 8.24 4.10 0.00 2.10 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 2.33 2.37 0.00 126 K 8.44 4.01 0.00 2.07 1.87 0.00 1.73 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.59 7.81 127 R 7.58 3.84 0.00 1.82 2.16 0.00 3.35 0.00 0.00 3.24 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.73 0.00 128 I 7.42 3.70 2.01 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 1.82 0.90 0.90 0.00 0.00 129 E 7.59 4.13 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 2.45 0.00