NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.9955 7.9127 120.3869 63.6570 32.9336 175.3761 2 H 3.8489 7.3919 127.9698 56.2673 27.9189 170.9042 3 L 4.7090 9.2810 122.6958 52.6978 44.8188 177.2552 4 T 4.0471 9.7088 121.9222 62.4161 70.2908 173.8129 5 P 4.3260 0.0000 0.0000 66.0227 31.4880 178.7716 6 E 4.1094 8.0215 116.6964 58.5753 29.5467 178.8913 7 E 3.8518 7.9002 119.3590 59.1194 29.6724 178.7900 8 K 3.7883 8.7156 119.9240 59.7831 32.2654 179.5703 9 S 4.1613 8.1940 113.7362 61.1179 62.6765 176.3559 10 A 4.0689 7.8747 124.7755 54.9319 18.0767 179.6051 11 V 3.2163 7.7795 116.7638 66.3164 31.3805 178.1231 12 T 3.9314 7.7028 113.9303 66.7944 68.7794 175.7766 13 A 4.1650 8.0848 122.3202 55.5239 18.3733 179.4046 14 L 3.7761 7.8185 118.1183 58.0364 42.2687 178.9970 15 W 4.3600 8.8517 128.4146 60.3911 30.3233 178.0167 16 G 3.8189 8.0529 104.6059 46.6110 0.0000 174.1557 17 K 4.4830 7.6516 118.0040 55.8807 32.8590 176.3241 18 V 3.5786 7.1871 120.3704 62.3771 31.8518 175.9955 19 N 4.4761 8.1901 125.6170 52.1828 38.6570 175.1313 20 V 3.4520 8.0950 128.0050 66.1894 31.4813 176.9702 21 D 4.3283 8.0960 117.6946 57.5029 40.7060 178.3469 22 E 3.8669 8.5746 118.6500 59.6534 29.5522 179.8062 23 V 3.5837 7.8967 118.2624 65.8779 31.6747 178.2716 24 G 3.6834 8.3941 105.8851 47.6306 0.0000 175.9185 25 G 3.5830 7.8589 107.8852 47.4710 0.0000 175.3930 26 E 3.8470 8.2816 121.9715 58.7792 29.5833 178.5994 27 A 3.9035 8.0563 120.7940 55.2072 18.5767 179.2924 28 L 3.9400 7.8320 118.2235 58.0856 42.0118 179.4077 29 G 3.5664 8.0397 105.5889 48.0163 0.0000 175.9198 30 R 3.8665 8.2765 121.4284 58.5345 30.0186 178.4348 31 L 3.9723 8.1852 120.5113 58.7689 41.8306 179.2943 32 L 4.0883 7.8694 119.4786 56.6787 41.2481 179.7124 33 V 3.6584 7.0432 117.6859 65.5301 31.8225 177.9287 34 V 3.5896 7.9374 116.9419 64.1579 32.7064 175.4830 35 Y 3.8384 7.4028 116.3263 53.8033 38.0339 173.7796 36 P 4.5352 0.0000 0.0000 64.3337 31.8240 177.6496 37 W 4.4111 7.9820 115.0692 59.3461 27.9203 178.1779 38 T 4.1830 7.7162 110.8010 64.4934 68.1624 176.2167 39 Q 4.2616 8.2558 121.3402 58.4521 28.4245 178.6952 40 R 3.8549 7.6499 116.3913 58.7885 29.3129 178.1148 41 F 4.3121 7.5383 116.3155 57.7849 39.6570 175.8604 42 F 4.6789 7.6316 118.4794 56.5912 39.5596 177.5952 43 E 4.0269 8.4141 122.4702 59.6467 29.5288 179.3920 44 S 4.5128 8.0199 110.1988 59.5655 63.3491 174.8659 45 F 4.5399 8.2814 120.2281 58.7446 39.9566 175.4194 46 G 4.1129 7.3005 104.4824 44.2938 0.0000 175.9119 47 D 4.6334 8.7743 126.9899 53.6040 41.1141 175.4888 48 L 4.9301 8.2564 126.5683 54.7240 43.3140 178.0870 49 S 4.3162 8.3243 117.6753 60.9794 63.1920 175.0479 50 T 4.7564 7.4200 109.1125 58.1923 73.0030 172.8170 51 P 4.1863 0.0000 0.0000 66.0598 31.3843 178.6497 52 D 4.2069 8.1100 116.7605 57.2592 40.6965 178.6309 53 A 3.9714 7.9719 121.2277 55.0752 18.1898 179.8609 54 V 3.5141 7.9024 115.7995 66.6191 31.7739 178.0623 55 M 4.2662 8.6378 117.7269 57.9124 31.7766 178.4743 56 G 3.8928 7.9197 105.1904 45.5286 0.0000 173.3259 57 N 4.2264 8.0280 120.4674 53.4122 39.1366 173.6560 58 P 4.3259 0.0000 0.0000 65.5544 31.5140 178.4975 59 K 3.6818 8.1583 118.6535 58.7312 31.7891 179.4952 60 V 3.7886 7.6766 118.3376 65.9928 31.6976 178.0484 61 K 3.9404 8.0013 118.0381 59.4085 31.7606 179.2246 62 A 3.9922 8.1905 121.2611 55.5084 18.2655 179.2398 63 H 4.4418 8.5451 116.8626 59.0195 29.8798 177.7444 64 G 3.5807 8.2749 107.9523 47.5614 0.0000 175.4569 65 K 3.9177 7.8940 121.8383 59.0442 32.2134 178.6731 66 K 3.9399 7.8632 119.5977 59.5347 32.1893 178.7591 67 V 3.6636 7.8959 118.5163 66.2960 31.4963 178.0828 68 L 4.4089 8.3706 118.6709 57.3377 41.2633 179.5864 69 G 3.7913 8.4480 106.1607 48.0055 0.0000 175.5517 70 A 4.1229 8.2634 123.7255 54.6346 18.4353 179.3622 71 F 4.0529 8.5267 119.2048 61.6303 39.2263 177.3589 72 S 4.0793 8.7090 113.8733 61.9497 62.9055 176.1228 73 D 4.5932 8.0304 121.5973 57.3589 40.4698 179.1423 74 G 3.4117 7.7368 105.7781 47.7186 0.0000 175.6549 75 L 3.9607 7.3014 119.1154 56.2807 41.5712 178.2493 76 A 4.5755 7.2107 118.8416 51.9297 19.2833 176.5626 77 H 4.8097 8.1698 115.1993 55.6270 30.4108 175.5253 78 L 3.4428 8.2030 122.1845 58.0143 41.3835 177.9674 79 D 4.6255 7.8908 115.3433 54.6764 41.6865 176.4337 80 N 4.8530 8.7241 118.4953 50.8908 40.2949 175.4022 81 L 3.9831 7.9566 121.8189 57.9757 42.0322 179.4311 82 K 4.0527 8.0702 117.9359 59.5781 31.8627 179.4742 83 G 3.5624 7.8495 103.9035 48.1141 0.0000 175.7394 84 T 3.8032 7.6878 116.9021 65.0965 68.6143 175.6227 85 F 4.9150 7.7932 116.7086 56.4107 40.0213 176.5921 86 A 4.0854 7.8350 122.5900 55.7599 18.1516 180.0690 87 T 4.0042 7.8875 107.3698 65.1367 68.8917 176.5068 88 L 4.1297 7.9970 121.4052 57.1950 41.6807 179.3641 89 S 4.3189 8.1421 114.6990 60.9566 62.4419 175.8242 90 E 3.8615 8.1281 121.3190 59.4573 29.2359 179.3050 91 L 3.9161 7.9604 120.0986 58.5505 42.1180 178.7615 92 H 4.1730 8.3281 116.1348 58.4934 28.5974 177.2868 93 C 3.6954 7.7304 120.4738 62.1297 31.2566 175.3600 94 D 4.4106 8.1131 119.3540 56.7542 40.6196 177.8781 95 K 4.1497 7.7445 116.9284 58.1594 32.8076 177.6891 96 L 4.1945 7.7632 116.5591 54.4910 42.6985 176.0966 97 H 4.0688 7.1929 113.3708 56.6306 26.4988 175.3748 98 V 3.6422 7.9540 118.3610 60.8671 32.4521 174.7630 99 D 4.2658 8.6602 127.2631 53.8236 41.4835 175.0966 100 P 2.9916 0.0000 0.0000 64.9215 31.2178 177.9492 101 E 3.8276 8.2529 118.1533 59.0472 29.2803 178.5281 102 N 4.3254 8.0409 116.8630 56.0100 38.4045 177.2544 103 F 4.4644 7.6129 119.6331 60.7081 39.0279 177.8535 104 R 3.9635 7.9869 117.1883 59.1254 29.9376 178.8805 105 L 3.7639 7.5869 118.2990 57.6634 41.5229 179.3112 106 L 4.0706 8.2307 120.5028 58.0053 41.9852 178.9618 107 G 3.8642 8.2986 105.7852 48.1486 0.0000 175.2571 108 N 4.3912 8.0994 119.2333 55.8752 38.6113 177.6401 109 V 3.6223 7.9108 119.5677 65.9567 31.6251 177.5589 110 L 3.8605 8.5046 120.7678 58.4153 41.6885 179.2602 111 V 3.5512 7.9290 118.0167 66.1265 31.4049 177.8586 112 C 4.1523 8.1314 116.6591 62.4389 27.8795 176.2847 113 V 3.4697 7.7827 119.9639 66.0199 31.1059 177.9774 114 L 3.8806 7.6715 118.4656 57.7112 41.2704 179.5899 115 A 3.7924 7.1904 120.5616 55.3381 18.1490 179.0041 116 H 3.9030 8.0045 115.6143 59.6282 29.8909 176.6934 117 H 4.0337 8.0832 118.9230 58.9410 30.1499 176.6388 118 F 4.6643 8.5415 117.9487 55.7795 39.5384 177.8327 119 G 3.8713 8.9525 108.3956 45.9424 0.0000 175.4969 120 K 3.8540 9.2824 121.5135 59.4519 31.7370 177.3332 121 E 4.0813 8.2730 117.8419 58.3341 30.0974 177.0725 122 F 4.5781 7.9959 123.5090 57.1147 37.9498 175.4715 123 T 4.1748 7.2540 115.2202 60.2684 71.4048 173.5240 124 P 4.1358 0.0000 0.0000 65.6215 31.2062 177.0794 125 P 4.1909 0.0000 0.0000 65.5646 31.2499 178.8611 126 V 3.5283 7.3074 117.1392 65.7170 31.3037 177.7658 127 Q 3.5066 8.1117 119.3752 59.0376 28.6352 177.8591 128 A 3.9833 7.9990 121.5881 55.5390 18.4149 179.5406 129 A 3.9063 7.7603 118.7820 55.5844 18.4238 179.5322 130 Y 4.1025 8.1726 115.0845 61.0289 37.8932 178.5936 131 Q 4.1536 8.4945 119.7216 58.7494 28.7167 178.8537 132 K 3.9925 7.8676 119.4947 59.2746 32.1089 179.5024 133 V 3.4840 7.6646 118.3214 66.0375 31.4921 177.9769 134 V 3.8029 8.1275 117.7483 66.3197 31.3471 177.8804 135 A 4.1459 8.2198 120.4511 54.9641 18.1162 179.9038 136 G 3.4799 8.2948 104.4207 47.8693 0.0000 176.0364 137 V 3.3555 8.1476 121.2320 65.4921 31.3437 177.9355 138 A 3.8680 7.9427 120.3083 55.3830 18.0654 179.4217 139 N 4.3089 8.4383 113.7916 56.3527 38.7135 177.2730 140 A 4.1530 8.3243 122.6940 55.0439 18.5425 179.5865 141 L 3.8453 7.8868 116.8440 56.8175 41.5636 178.5864 142 A 4.6169 7.6724 119.8894 53.0257 18.8992 178.3989 143 H 4.1715 7.7256 116.8505 59.1104 29.9162 175.8845 144 K 4.4765 7.7468 117.0201 56.4697 31.9306 176.5066 145 Y 4.0670 8.0998 117.7992 58.2594 38.3738 175.7396 146 H 4.5038 8.1979 117.9110 56.0018 28.6305 173.1113 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 V 7.91 4.00 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 0.92 0.00 0.00 0.90 0.00 0.00 2 H 7.39 3.85 0.00 3.22 3.17 0.00 5.77 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 9.28 4.71 0.00 1.61 1.48 0.89 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 4 T 9.71 4.05 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 1.22 0.00 0.00 5 P 0.00 4.33 0.00 2.12 2.12 0.00 3.57 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 6 E 8.02 4.11 0.00 2.13 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 2.18 0.00 7 E 7.90 3.85 0.00 2.16 1.94 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 2.34 2.34 0.00 8 K 8.72 3.79 0.00 1.87 1.82 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.39 1.39 7.81 9 S 8.19 4.16 0.00 4.05 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 10 A 7.87 4.07 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 11 V 7.78 3.22 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 0.60 0.00 0.00 0.56 0.00 0.00 12 T 7.70 3.93 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 1.25 0.00 0.00 13 A 8.08 4.17 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 L 7.82 3.78 0.00 1.76 1.93 0.12 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.85 4.36 0.00 3.79 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.05 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 0.00 0.00 0.00 17 K 7.65 4.48 0.00 1.94 1.97 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.37 7.81 18 V 7.19 3.58 1.19 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 -0.14 0.00 0.00 0.77 0.00 0.00 19 N 8.19 4.48 0.00 2.68 2.56 0.00 0.00 6.82 7.71 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 20 V 8.10 3.45 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 1.14 0.00 0.00 0.94 0.00 0.00 21 D 8.10 4.33 0.00 2.92 2.67 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 22 E 8.57 3.87 0.00 1.93 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 2.29 2.27 0.00 23 V 7.90 3.58 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 0.98 0.00 0.00 0.70 0.00 0.00 24 G 8.39 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 7.86 3.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.28 3.85 0.00 2.10 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 2.20 2.24 0.00 27 A 8.06 3.90 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 28 L 7.83 3.94 0.00 1.76 1.62 0.84 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.04 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.28 3.87 0.00 1.98 1.93 0.00 3.08 0.00 0.00 3.02 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.70 0.00 31 L 8.19 3.97 0.00 1.83 1.88 0.96 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.87 4.09 0.00 1.84 1.69 0.67 0.79 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 33 V 7.04 3.66 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 0.73 0.00 0.00 0.94 0.00 0.00 34 V 7.94 3.59 1.48 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 -0.06 0.00 0.00 0.78 0.00 0.00 35 Y 7.40 3.84 0.00 2.56 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 36 P 0.00 4.54 0.00 2.29 2.15 0.00 3.75 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 1.99 0.00 37 W 7.98 4.41 0.00 3.55 3.45 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 38 T 7.72 4.18 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 1.12 0.00 0.00 39 Q 8.26 4.26 0.00 2.29 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.82 0.00 0.00 0.00 0.00 0.00 2.43 2.45 0.00 40 R 7.65 3.85 0.00 1.74 2.01 0.00 2.93 0.00 0.00 2.45 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.60 0.00 41 F 7.54 4.31 0.00 2.18 2.45 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 42 F 7.63 4.68 0.00 2.89 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.41 4.03 0.00 2.01 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 2.51 2.23 0.00 44 S 8.02 4.51 0.00 4.10 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 45 F 8.28 4.54 0.00 3.23 3.18 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 46 G 7.30 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 0.00 0.00 0.00 47 D 8.77 4.63 0.00 2.65 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 48 L 8.26 4.93 0.00 1.65 1.61 1.06 1.03 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 49 S 8.32 4.32 0.00 3.88 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 50 T 7.42 4.76 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 51 P 0.00 4.19 0.00 2.15 2.11 0.00 3.59 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 2.09 2.15 0.00 52 D 8.11 4.21 0.00 2.67 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 53 A 7.97 3.97 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 54 V 7.90 3.51 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 0.89 0.00 0.00 0.95 0.00 0.00 55 M 8.64 4.27 0.00 1.94 2.08 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.87 0.00 56 G 7.92 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 0.00 0.00 0.00 57 N 8.03 4.23 0.00 2.91 2.87 0.00 0.00 6.85 7.24 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 58 P 0.00 4.33 0.00 2.24 2.25 0.00 3.71 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 2.00 2.01 0.00 59 K 8.16 3.68 0.00 1.54 0.74 0.00 1.39 0.00 0.00 1.11 0.00 0.00 2.78 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.13 1.20 7.81 60 V 7.68 3.79 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 1.05 0.00 0.00 1.11 0.00 0.00 61 K 8.00 3.94 0.00 1.95 1.82 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.43 7.81 62 A 8.19 3.99 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 63 H 8.55 4.44 0.00 3.62 3.59 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 64 G 8.27 3.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 K 7.89 3.92 0.00 1.87 2.07 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.48 7.81 66 K 7.86 3.94 0.00 2.09 1.83 0.00 1.78 0.00 0.00 1.66 0.00 0.00 3.12 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.52 1.51 7.81 67 V 7.90 3.66 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 1.03 0.00 0.00 0.93 0.00 0.00 68 L 8.37 4.41 0.00 2.01 1.92 0.90 0.81 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 69 G 8.45 3.79 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 0.00 0.00 0.00 70 A 8.26 4.12 1.59 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 0.00 0.00 71 F 8.53 4.05 0.00 3.32 3.29 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 72 S 8.71 4.08 0.00 4.25 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 D 8.03 4.59 0.00 2.70 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 G 7.74 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.30 3.96 0.00 1.47 1.49 -0.20 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.21 4.58 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.17 4.81 0.00 3.08 3.11 0.00 5.84 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 78 L 8.20 3.44 0.00 1.54 1.68 0.79 0.94 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 79 D 7.89 4.63 0.00 2.62 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 80 N 8.72 4.85 0.00 2.68 2.63 0.00 0.00 7.16 5.12 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 81 L 7.96 3.98 0.00 1.74 1.84 0.90 0.71 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 82 K 8.07 4.05 0.00 1.78 1.80 0.00 1.48 0.00 0.00 1.72 0.00 0.00 2.73 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.16 1.43 7.81 83 G 7.85 3.56 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 0.00 0.00 0.00 84 T 7.69 3.80 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 0.32 0.00 0.00 85 F 7.79 4.91 0.00 3.18 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 86 A 7.84 4.09 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 87 T 7.89 4.00 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 1.21 0.00 0.00 88 L 8.00 4.13 0.00 2.08 1.86 1.02 1.13 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 89 S 8.14 4.32 0.00 3.97 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 90 E 8.13 3.86 0.00 2.26 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 2.32 2.33 0.00 91 L 7.96 3.92 0.00 1.76 1.65 0.89 1.02 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 92 H 8.33 4.17 0.00 3.72 3.73 0.00 5.85 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.73 3.70 0.00 1.23 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 94 D 8.11 4.41 0.00 2.68 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 95 K 7.74 4.15 0.00 1.73 1.79 0.00 1.59 0.00 0.00 1.68 0.00 0.00 3.06 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.48 7.81 96 L 7.76 4.19 0.00 1.71 1.61 0.73 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.19 4.07 0.00 3.47 3.41 0.00 5.64 0.00 0.00 0.00 0.00 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.95 3.64 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 0.10 0.00 0.00 0.40 0.00 0.00 99 D 8.66 4.27 0.00 2.75 2.73 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 0.00 100 P 0.00 2.99 0.00 1.90 1.81 0.00 3.34 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.59 0.00 101 E 8.25 3.83 0.00 2.01 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 0.00 2.30 2.39 0.00 102 N 8.04 4.33 0.00 2.50 2.71 0.00 0.00 6.84 8.82 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 0.00 103 F 7.61 4.46 0.00 3.08 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 0.00 104 R 7.99 3.96 0.00 2.01 1.98 0.00 3.29 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.76 0.00 105 L 7.59 3.76 0.00 1.72 1.32 0.65 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.23 4.07 0.00 1.90 1.90 0.93 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.30 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 0.00 108 N 8.10 4.39 0.00 2.96 2.96 0.00 0.00 6.73 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 0.00 109 V 7.91 3.62 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 1.16 0.00 0.00 110 L 8.50 3.86 0.00 1.73 1.80 0.81 -0.23 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 0.00 111 V 7.93 3.55 2.30 0.00 0.00 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 1.14 0.00 0.00 112 C 8.13 4.15 0.00 3.15 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 0.00 113 V 7.78 3.47 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 0.85 0.00 0.00 114 L 7.67 3.88 0.00 0.90 1.21 0.51 0.68 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 0.00 115 A 7.19 3.79 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 0.00 116 H 8.00 3.90 0.00 3.19 3.43 0.00 5.95 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.08 4.03 0.00 3.14 2.52 0.00 5.79 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.54 4.66 0.00 3.29 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 0.00 119 G 8.95 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 0.00 120 K 9.28 3.85 0.00 1.81 1.98 0.00 1.79 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.50 7.81 121 E 8.27 4.08 0.00 2.13 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 2.34 2.29 0.00 122 F 8.00 4.58 0.00 3.09 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 0.00 123 T 7.25 4.17 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 124 P 0.00 4.14 0.00 2.15 2.14 0.00 3.57 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 2.11 2.19 0.00 125 P 0.00 4.19 0.00 2.10 2.06 0.00 3.45 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 126 V 7.31 3.53 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 0.98 0.00 0.00 0.89 0.00 0.00 127 Q 8.11 3.51 0.00 1.73 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.46 0.00 0.00 0.00 0.00 0.00 2.44 2.63 0.00 128 A 8.00 3.98 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 A 7.76 3.91 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 Y 8.17 4.10 0.00 3.50 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 Q 8.49 4.15 0.00 2.29 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.82 0.00 0.00 0.00 0.00 0.00 2.70 2.62 0.00 132 K 7.87 3.99 0.00 1.97 1.83 0.00 1.62 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.44 7.81 133 V 7.66 3.48 2.25 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 0.90 0.00 0.00 0.79 0.00 0.00 134 V 8.13 3.80 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 1.16 0.00 0.00 135 A 8.22 4.15 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 0.00 136 G 8.29 3.48 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 0.00 137 V 8.15 3.36 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 0.55 0.00 0.00 0.49 0.00 0.00 138 A 7.94 3.87 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 0.00 139 N 8.44 4.31 0.00 2.82 2.91 0.00 0.00 7.08 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 A 8.32 4.15 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 0.00 141 L 7.89 3.85 0.00 0.90 0.47 -0.01 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.67 4.62 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 0.00 143 H 7.73 4.17 0.00 3.33 3.49 0.00 5.75 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 7.75 4.48 0.00 1.83 1.82 0.00 1.81 0.00 0.00 1.81 0.00 0.00 3.03 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.53 1.60 7.81 145 Y 8.10 4.07 0.00 3.09 2.92 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 0.00 146 H 8.20 4.50 0.00 3.18 3.23 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00