NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.1738 8.1749 117.3698 63.9048 70.8148 176.0283 3 T 3.0086 6.8107 115.1090 62.8379 63.8796 171.0682 4 F 4.4831 7.1855 120.5591 56.0391 40.4858 174.7072 5 R 4.4364 8.0793 119.1233 54.6360 33.0700 173.6341 6 F 5.1022 8.0337 119.5185 55.5871 41.5355 175.3417 7 C 3.8882 8.1200 117.4605 57.3541 30.8900 172.2245 8 R 4.6085 8.1769 117.9529 56.5962 31.2849 176.5287 9 D 4.3665 8.1198 113.9464 54.3496 40.9675 173.1620 10 C 4.5785 8.0508 115.2358 61.8045 30.7936 175.8281 11 N 4.3084 6.7061 119.0750 57.5595 36.5625 173.9227 12 N 4.8211 7.8924 126.5076 53.0920 39.6546 174.8191 13 M 4.4944 8.5225 125.9950 54.5882 34.4990 174.6759 14 L 5.7078 7.8609 121.9606 52.5847 44.1796 175.5433 15 Y 4.7319 9.0880 122.0328 56.0780 40.0336 173.4091 16 P 5.3452 0.0000 0.0000 62.7898 33.4499 174.8784 17 R 4.7816 8.9801 119.1136 55.2247 35.4698 173.1445 18 E 4.9388 8.5976 120.7825 54.5656 32.2940 175.0732 19 D 4.5223 8.9038 127.1622 53.3064 41.1496 177.1264 20 K 3.9358 8.7932 125.3747 59.5072 32.3933 178.7419 21 E 4.0343 8.2016 117.9129 58.4957 29.6396 176.9609 22 N 4.7407 7.9771 112.8343 52.0842 39.9060 173.7340 23 N 4.1391 8.0567 115.8578 52.5212 35.7815 172.7739 24 R 4.5055 7.1007 115.2638 55.3570 33.4122 174.3931 25 L 4.7672 8.1558 121.6456 53.6550 44.3572 174.9999 26 L 5.0390 8.3114 124.6161 53.2654 45.4453 176.7769 27 F 5.5486 8.6382 123.3193 57.7709 41.8105 173.2750 28 E 5.2277 8.0284 114.8583 57.0762 33.6866 174.5261 29 C 5.2220 8.9681 118.2999 57.5789 35.0426 174.4153 30 R 4.6507 8.3766 121.1807 56.4584 30.8723 176.7355 31 T 4.5278 8.1069 112.8120 65.0912 72.1755 174.3265 32 C 4.8178 7.5876 114.7618 58.1475 28.4875 175.3208 33 S 4.5996 8.6580 111.2884 57.6120 65.6025 172.7796 34 Y 4.2120 7.6998 121.5927 57.1648 39.5182 175.5366 35 V 4.9812 7.7042 121.2991 62.1023 34.6933 172.2026 36 E 5.0654 9.0306 124.8479 54.0034 33.0061 175.1925 37 E 4.4042 8.9963 119.4155 56.3617 30.5831 176.2355 38 A 3.5997 8.2517 123.2086 51.9076 18.2276 178.1743 39 G 3.7598 9.0497 112.6327 48.4119 0.0000 173.3577 40 S 4.6153 7.5265 111.4960 56.0375 65.1069 172.1216 41 P 4.3226 0.0000 0.0000 63.8880 31.3768 176.4783 42 L 4.2696 7.9194 122.0781 54.4942 40.8655 176.0373 43 V 4.0850 8.3799 126.4528 65.0331 32.1031 175.8192 44 Y 4.9954 7.6442 117.9137 56.0076 41.7382 173.5239 45 R 4.3149 7.6852 124.8952 54.7618 33.5565 173.3848 46 H 4.2663 8.5224 121.7946 57.2067 31.3606 171.9109 47 E 3.5011 7.9669 125.5956 56.2400 28.3454 173.4602 48 L 4.1462 8.3788 125.0938 56.9566 42.4129 178.5796 49 I 4.0927 7.3168 124.6046 60.4033 35.8500 175.8816 50 T 4.2780 7.9200 121.2976 63.3247 68.9513 174.7354 51 N 4.9637 8.4278 117.6587 52.4189 40.9965 173.9771 52 I 4.2857 7.6856 113.0969 60.6279 38.1117 175.2011 53 G 3.8595 9.1260 112.3456 45.1761 0.0000 175.0565 54 E 3.5191 7.5899 119.5923 59.2854 30.1393 177.7369 55 T 4.4957 7.1695 113.4704 62.0069 69.3876 173.5903 56 A 3.8328 7.8138 124.6134 52.7714 19.6611 179.3836 57 G 3.6246 8.0652 102.5766 47.0522 0.0000 175.1432 58 V 4.5272 7.7478 131.4106 60.5456 31.8958 175.5385 59 V 3.6366 7.6769 120.5998 63.2644 32.2533 175.9824 60 Q 4.1822 8.6869 124.0575 57.7474 28.8949 176.2348 61 D 4.7538 7.7717 115.8013 55.0097 41.8052 177.4713 62 I 3.8001 7.9716 119.5422 62.4447 37.9090 176.1639 63 G 3.9415 7.8405 107.1960 47.0639 0.0000 174.7429 64 S 4.3269 8.7920 114.0512 58.5351 63.7774 173.5807 65 D 4.6251 7.8202 122.7107 52.4659 40.8865 174.7556 66 P 4.2467 0.0000 0.0000 65.8918 31.4220 177.9170 67 T 3.9173 7.2225 105.7926 63.5423 68.6879 174.3654 68 L 4.3222 7.5046 121.7659 53.3220 42.9393 174.2646 69 P 4.7988 0.0000 0.0000 62.2638 33.3512 174.8078 70 R 6.0300 8.9540 119.2937 53.7818 32.9844 175.1052 71 S 4.8565 8.6612 115.9868 56.2367 66.9869 173.5728 72 D 4.8175 8.4582 118.5467 53.3055 39.8184 176.7856 73 R 4.3090 7.7551 120.1099 56.0996 31.4035 174.6279 74 E 5.6355 8.4062 115.8193 53.5686 31.2119 175.0336 75 C 2.8476 8.0568 116.4697 53.8825 42.4772 172.7399 76 P 4.0369 0.0000 0.0000 64.8001 30.8092 176.2763 77 K 4.2503 6.7456 115.3629 56.8868 35.0304 175.7029 78 C 3.7995 8.0710 113.9171 57.4167 41.7213 174.2499 79 H 3.8661 7.8160 114.3181 56.4936 26.9818 174.5287 80 S 4.5107 7.6539 116.1966 57.8458 64.4291 174.0251 81 R 5.1128 8.0869 117.6049 55.2688 30.4771 177.2386 82 E 4.6219 8.2747 118.6212 54.7782 32.8012 174.9137 83 N 6.1176 9.0721 120.3605 50.3154 43.4115 174.5450 84 V 5.5823 8.5691 120.4495 59.1895 33.7838 174.6894 85 F 4.9723 9.6974 121.5694 55.4630 40.2230 174.3215 86 F 4.6378 7.4932 111.0124 56.7136 40.3421 172.7981 87 Q 4.6277 8.4979 116.2916 53.7443 32.1247 174.8241 88 S 3.5381 8.4279 113.1013 59.1504 62.1443 174.4418 89 Q 3.8255 8.0473 125.3953 56.7533 28.5671 176.1909 90 Q 4.0615 7.2222 119.1085 55.2690 28.4165 176.8647 91 R 4.2198 8.1617 128.3257 55.9169 27.9315 175.8932 92 R 4.6276 7.2124 118.5620 54.1068 32.9033 175.7988 93 K 4.1210 8.3210 120.5739 59.3905 32.3782 179.3520 94 D 4.4855 7.9858 117.3283 55.4862 39.4516 176.9179 95 T 3.9030 7.1146 116.0018 64.0874 68.9259 173.7833 96 S 4.6369 8.3438 118.7467 58.0816 64.6623 173.5538 97 M 4.6703 8.2031 118.2221 54.9471 32.3222 176.6979 98 V 4.1834 7.7949 117.2272 62.1824 33.3437 174.6137 99 L 5.1953 8.2863 124.4251 53.0710 44.1419 175.4230 100 F 4.9968 8.9285 120.5541 56.0717 41.5865 175.1121 101 F 4.7796 9.3505 123.2847 56.0512 42.0460 175.1715 102 V 5.2703 7.7702 118.2312 60.8098 35.1311 173.5878 103 C 4.8785 9.0030 128.7723 59.5612 32.0901 173.7910 104 L 4.3030 8.6872 125.8345 55.5148 41.7416 177.3592 105 S 4.8513 8.4514 114.0850 55.8563 63.3005 174.1429 106 C 5.9718 8.6136 127.9895 59.4077 27.7403 175.8144 107 S 4.2489 7.7560 113.9790 58.9975 60.1877 168.2703 108 H 4.8386 8.1493 118.2755 55.1509 32.1323 173.7118 109 I 5.2045 7.8699 123.3187 58.7210 36.2884 174.4766 110 F 4.7597 8.6812 120.1103 56.1419 40.4384 176.2541 111 T 4.7972 8.3114 117.4673 62.0069 71.1831 173.8993 112 S 4.6029 8.2421 114.4279 58.4765 63.1278 175.1497 113 D 4.6966 8.0852 120.1056 53.9584 38.0587 176.9204 114 Q 4.0560 8.2765 121.8632 57.8657 29.1599 178.0015 115 K 4.1289 7.9666 116.0485 56.7038 32.5747 176.4559 116 N 4.3081 8.1464 115.1545 54.1785 36.2722 174.4160 117 K 4.1686 8.1587 122.3546 56.8190 32.1936 177.2163 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 T 8.17 4.17 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 1.33 0.00 0.00 3 T 6.81 3.01 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 4 F 7.19 4.48 0.00 2.78 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.08 4.44 0.00 1.71 1.75 0.00 3.22 0.00 0.00 3.71 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.54 0.00 6 F 8.03 5.10 0.00 3.03 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 7 C 8.12 3.89 0.00 1.99 2.59 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 0.00 8 R 8.18 4.61 0.00 2.05 2.06 0.00 3.41 0.00 0.00 3.57 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.27 0.00 9 D 8.12 4.37 0.00 2.93 2.72 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 10 C 8.05 4.58 0.00 3.10 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 11 N 6.71 4.31 0.00 2.62 2.81 0.00 0.00 6.94 7.67 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 12 N 7.89 4.82 0.00 2.67 2.32 0.00 0.00 6.98 7.66 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 13 M 8.52 4.49 0.00 1.81 1.69 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.83 0.00 14 L 7.86 5.71 0.00 1.37 1.53 0.85 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 15 Y 9.09 4.73 0.00 2.89 2.90 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 16 P 0.00 5.35 0.00 2.24 2.57 0.00 3.88 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.17 0.00 17 R 8.98 4.78 0.00 1.78 1.84 0.00 3.21 0.00 0.00 3.11 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.71 0.00 18 E 8.60 4.94 0.00 1.95 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 2.18 2.25 0.00 19 D 8.90 4.52 0.00 2.75 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 20 K 8.79 3.94 0.00 1.78 1.85 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.43 7.81 21 E 8.20 4.03 0.00 1.92 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 2.29 2.34 0.00 22 N 7.98 4.74 0.00 2.90 2.80 0.00 0.00 7.04 9.09 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 23 N 8.06 4.14 0.00 2.89 2.86 0.00 0.00 6.75 7.02 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 24 R 7.10 4.51 0.00 1.79 1.95 0.00 2.92 0.00 0.00 3.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 25 L 8.16 4.77 0.00 1.69 1.39 0.87 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 26 L 8.31 5.04 0.00 1.61 1.51 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 27 F 8.64 5.55 0.00 3.14 2.95 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 28 E 8.03 5.23 0.00 2.19 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 2.35 2.21 0.00 29 C 8.97 5.22 0.00 2.96 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 30 R 8.38 4.65 0.00 1.36 1.62 0.00 2.21 0.00 0.00 2.72 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.12 0.00 31 T 8.11 4.53 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 1.20 0.00 0.00 32 C 7.59 4.82 0.00 3.13 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 S 8.66 4.60 0.00 3.85 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 34 Y 7.70 4.21 0.00 2.99 2.82 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 35 V 7.70 4.98 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 0.89 0.00 0.00 1.06 0.00 0.00 36 E 9.03 5.07 0.00 2.29 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 2.52 2.51 0.00 37 E 9.00 4.40 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 2.32 2.35 0.00 38 A 8.25 3.60 1.10 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 39 G 9.05 3.76 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 0.00 0.00 0.00 40 S 7.53 4.62 0.00 3.83 3.76 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 41 P 0.00 4.32 0.00 2.24 2.16 0.00 3.84 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 42 L 7.92 4.27 0.00 1.64 1.72 1.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 43 V 8.38 4.08 2.23 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 0.99 0.00 0.00 1.10 0.00 0.00 44 Y 7.64 5.00 0.00 2.86 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 45 R 7.69 4.31 0.00 1.62 1.55 0.00 3.19 0.00 0.00 3.09 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.45 0.00 46 H 8.52 4.27 0.00 2.92 3.20 0.00 6.13 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 7.97 3.50 0.00 2.03 1.85 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 2.15 2.26 0.00 48 L 8.38 4.15 0.00 1.66 1.68 0.95 0.90 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 49 I 7.32 4.09 1.86 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 1.41 0.48 0.91 0.00 0.00 50 T 7.92 4.28 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 1.28 0.00 0.00 51 N 8.43 4.96 0.00 2.77 2.91 0.00 0.00 6.59 7.32 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 52 I 7.69 4.29 1.86 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 1.32 0.54 0.90 0.00 0.00 53 G 9.13 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 54 E 7.59 3.52 0.00 1.99 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 0.00 2.40 2.45 0.00 55 T 7.17 4.50 4.39 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 1.46 0.00 0.00 56 A 7.81 3.83 1.14 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 57 G 8.07 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 V 7.75 4.53 2.17 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 0.97 0.00 0.00 1.18 0.00 0.00 59 V 7.68 3.64 2.11 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 1.05 0.00 0.00 0.95 0.00 0.00 60 Q 8.69 4.18 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.47 0.00 61 D 7.77 4.75 0.00 2.75 2.68 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 62 I 7.97 3.80 2.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.83 1.03 0.00 0.00 63 G 7.84 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 64 S 8.79 4.33 0.00 3.90 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 65 D 7.82 4.63 0.00 2.71 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 P 0.00 4.25 0.00 2.22 2.17 0.00 3.83 0.00 0.00 3.86 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 67 T 7.22 3.92 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 1.20 0.00 0.00 68 L 7.50 4.32 0.00 1.67 1.58 0.99 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.80 0.00 1.84 1.86 0.00 3.48 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.93 0.00 70 R 8.95 6.03 0.00 1.76 1.92 0.00 3.42 0.00 0.00 4.01 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.42 0.00 71 S 8.66 4.86 0.00 3.76 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 D 8.46 4.82 0.00 2.79 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 73 R 7.76 4.31 0.00 1.88 1.88 0.00 2.62 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.53 0.00 74 E 8.41 5.64 0.00 1.99 1.87 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 2.11 2.13 0.00 75 C 8.06 2.85 0.00 2.66 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 76 P 0.00 4.04 0.00 1.89 2.04 0.00 3.18 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.94 0.00 77 K 6.75 4.25 0.00 1.78 1.57 0.00 1.50 0.00 0.00 1.58 0.00 0.00 2.85 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.20 1.13 7.81 78 C 8.07 3.80 0.00 3.19 3.31 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 79 H 7.82 3.87 0.00 3.22 3.28 0.00 5.65 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 S 7.65 4.51 0.00 3.79 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 R 8.09 5.11 0.00 1.65 1.89 0.00 3.20 0.00 0.00 3.88 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.45 0.00 82 E 8.27 4.62 0.00 1.89 1.88 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 2.31 2.34 0.00 83 N 9.07 6.12 0.00 2.81 2.93 0.00 0.00 6.34 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 84 V 8.57 5.58 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 0.59 0.00 0.00 0.91 0.00 0.00 85 F 9.70 4.97 0.00 2.42 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 F 7.49 4.64 0.00 2.81 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 87 Q 8.50 4.63 0.00 1.93 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.87 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 88 S 8.43 3.54 0.00 3.69 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 89 Q 8.05 3.83 0.00 2.08 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.96 0.00 0.00 0.00 0.00 0.00 1.70 1.85 0.00 90 Q 7.22 4.06 0.00 1.98 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 7.50 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 91 R 8.16 4.22 0.00 1.79 1.84 0.00 3.31 0.00 0.00 3.06 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.50 0.00 92 R 7.21 4.63 0.00 1.71 1.76 0.00 3.21 0.00 0.00 3.26 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.59 0.00 93 K 8.32 4.12 0.00 1.85 1.80 0.00 1.72 0.00 0.00 1.86 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.41 7.81 94 D 7.99 4.49 0.00 2.78 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 95 T 7.11 3.90 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 1.19 0.00 0.00 96 S 8.34 4.64 0.00 4.02 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 97 M 8.20 4.67 0.00 2.04 2.13 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 2.52 2.50 0.00 98 V 7.79 4.18 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 0.92 0.00 0.00 1.03 0.00 0.00 99 L 8.29 5.20 0.00 1.25 1.44 1.09 1.41 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 0.00 100 F 8.93 5.00 0.00 3.20 3.12 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 0.00 0.00 0.00 101 F 9.35 4.78 0.00 1.51 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 V 7.77 5.27 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 1.35 0.00 0.00 0.89 0.00 0.00 103 C 9.00 4.88 0.00 3.11 2.93 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 0.00 104 L 8.69 4.30 0.00 1.65 1.74 1.02 0.69 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 S 8.45 4.85 0.00 3.81 3.78 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 0.00 106 C 8.61 5.97 0.00 3.17 3.10 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 0.00 107 S 7.76 4.25 0.00 4.09 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 0.00 108 H 8.15 4.84 0.00 3.26 3.20 0.00 5.81 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 I 7.87 5.20 1.89 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 1.14 1.82 1.07 0.00 0.00 110 F 8.68 4.76 0.00 3.08 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 0.00 111 T 8.31 4.80 4.13 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 1.14 0.00 0.00 112 S 8.24 4.60 0.00 4.23 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 0.00 113 D 8.09 4.70 0.00 2.71 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 Q 8.28 4.06 0.00 2.05 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 7.06 0.00 0.00 0.00 0.00 0.00 2.37 2.73 0.00 115 K 7.97 4.13 0.00 1.75 1.87 0.00 1.88 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.46 7.81 116 N 8.15 4.31 0.00 2.86 2.93 0.00 0.00 7.02 8.17 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 0.00 117 K 8.16 4.17 0.00 1.75 1.72 0.00 1.79 0.00 0.00 1.75 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.43 7.81