NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 L 4.3385 8.1849 120.6280 53.5465 43.1079 176.3963 4 P 4.2552 0.0000 0.0000 60.9457 31.8521 175.7475 5 T 4.1988 9.1935 115.3765 60.8734 71.8959 175.3204 6 A 4.0132 8.4816 122.3203 55.6647 18.2865 179.8394 7 Q 3.9255 7.9816 115.8186 59.1731 28.7750 178.7592 8 E 3.8950 7.9659 119.2795 59.1516 29.3607 179.5403 9 V 3.0302 7.9456 118.7340 65.8895 31.5731 178.0162 10 Q 4.0573 8.0445 117.9262 58.9741 28.5375 179.2799 11 G 3.5299 7.9445 106.5165 47.7109 0.0000 175.8147 12 L 3.9768 7.9073 121.7158 57.8529 41.5259 179.6195 13 M 4.1957 8.3018 118.5575 58.2455 31.9595 178.7376 14 A 4.0194 8.0559 121.1329 55.0539 18.5518 179.6359 15 R 4.0817 8.1504 118.6896 59.0657 30.1104 177.9478 16 Y 4.0321 8.1755 119.3600 60.9633 38.6912 178.3732 17 I 3.3967 7.6336 120.2305 64.2878 37.1382 178.2615 18 E 3.8997 8.0347 119.1894 59.4105 29.2903 179.4703 19 L 4.0139 7.9067 119.0401 57.5741 41.6178 179.7000 20 V 3.4106 7.5286 118.3223 65.9686 31.2194 177.5239 21 D 4.3489 8.0307 116.7867 56.7420 41.0838 177.6840 22 V 4.2181 7.2957 109.8587 59.9512 32.1558 175.9699 23 G 3.8559 7.7333 106.7330 47.1034 0.0000 175.5262 24 D 4.5936 7.8108 120.2446 52.3792 38.4917 175.4172 25 I 3.6465 7.7364 125.0098 64.0674 37.6598 177.1842 26 E 3.9389 8.2053 118.4695 59.5407 29.1227 179.2524 27 A 4.0425 8.0822 119.4891 54.9582 18.7129 179.5057 28 I 3.7651 7.7528 118.3943 64.6171 37.3094 178.7302 29 V 3.7709 7.9681 119.1833 66.2889 31.1123 177.9564 30 Q 4.1982 7.8539 115.8178 58.5717 28.8338 178.0224 31 M 4.2273 8.1548 119.8901 56.8657 32.0561 175.9807 32 Y 4.5903 7.1592 115.7965 56.6666 39.3436 175.3638 33 A 4.3187 8.8995 126.3628 51.8138 19.3940 178.6890 34 D 4.4974 8.8638 119.7771 55.6945 39.4602 177.5961 35 D 4.7108 7.8558 117.4842 52.5990 39.9049 175.7842 36 A 4.6247 7.9748 121.9406 53.1552 20.0047 177.2720 37 T 5.4826 8.6181 108.5452 58.9808 72.3003 173.2775 38 V 4.8746 8.0124 122.0451 61.2120 35.2387 173.8257 39 E 4.6631 9.1194 126.7898 54.8425 32.3171 175.1286 40 D 4.9224 8.2594 125.7991 52.4517 43.4247 172.9834 41 P 4.6138 0.0000 0.0000 61.9378 32.9846 175.4692 42 F 4.0980 8.5884 124.7054 59.3648 38.9695 174.3904 43 G 3.4158 7.8489 114.7705 45.6582 0.0000 174.0865 44 Q 4.3008 7.3044 118.1430 53.4629 30.1675 173.8403 45 P 4.2305 0.0000 0.0000 62.3117 31.8891 174.7910 46 P 4.6790 0.0000 0.0000 62.6939 32.4520 175.4621 47 I 4.4422 8.2479 115.1771 59.7860 40.3285 174.0191 48 H 5.1869 9.0006 120.3287 55.2303 31.8391 174.4935 49 G 4.1483 9.2043 108.1937 46.1297 0.0000 174.7283 50 R 3.8872 8.3915 119.9174 58.9136 29.9685 179.3474 51 E 3.9177 8.1219 118.6249 59.5350 29.8268 178.7794 52 Q 4.0507 8.0329 117.5587 59.0154 28.7966 178.7328 53 I 3.7644 8.0931 120.8746 64.1845 37.0489 178.3069 54 A 4.1226 8.6604 121.8814 55.2331 18.2712 179.5260 55 A 3.9862 8.2671 119.3274 55.1260 18.4210 179.6416 56 F 4.0867 8.3858 119.1282 61.9066 39.5156 177.1333 57 Y 3.8670 8.3679 116.2825 60.8690 37.5167 178.6313 58 R 4.0011 8.3443 119.3918 59.4241 29.9448 179.1123 59 Q 4.0577 7.9285 117.0172 58.5678 28.7524 178.4218 60 G 3.5699 7.5953 106.0509 46.3334 0.0000 174.8732 61 L 4.7436 8.2879 119.0209 53.8212 42.7640 178.4396 62 G 3.9965 8.1069 108.9965 48.7246 0.0000 175.0268 63 G 3.7186 8.0295 107.6497 48.6505 0.0000 174.0651 64 G 4.0220 7.4708 104.9514 44.8332 0.0000 174.2636 65 K 4.4011 7.9625 117.8231 56.0147 32.3840 175.6248 66 V 4.4526 7.5618 119.6454 61.8225 32.5611 175.3278 67 R 5.0000 8.8574 126.0928 54.5866 33.5751 174.6677 68 A 5.3947 9.2160 122.9288 51.0033 22.7122 175.4478 69 C 4.7807 8.9732 114.6161 56.6604 33.4089 173.5671 70 L 4.7677 8.7122 121.8202 55.1852 41.8820 177.0068 71 T 4.5049 8.3727 111.8612 60.6799 69.1608 173.5769 72 G 3.9910 7.3514 109.3038 44.6373 0.0000 171.6335 73 P 4.4272 0.0000 0.0000 62.2521 31.9525 176.0389 74 V 3.9264 8.1136 119.9490 62.8489 32.3091 175.3410 75 R 4.5685 9.1022 127.5386 55.2490 31.5699 175.3947 76 A 5.2138 8.4486 124.5073 50.2728 22.4435 175.6450 77 S 4.5018 8.8732 116.1929 57.4474 65.2151 173.7858 78 H 4.8138 8.5366 115.4221 55.8820 28.6523 175.3939 79 N 4.9303 7.8609 117.7364 52.5804 37.6388 175.3532 80 G 3.9648 8.4681 104.1728 47.4181 0.0000 173.1667 81 C 5.4670 7.6943 116.1423 58.0768 32.0820 172.8951 82 G 4.5600 8.8721 106.3250 45.6286 0.0000 171.8496 83 A 5.4962 9.2104 121.7722 50.3472 22.9639 175.2348 84 M 5.2422 9.2048 118.1572 53.0900 35.3669 172.0474 85 P 5.4902 0.0000 0.0000 61.6507 33.9245 174.2209 86 F 5.5520 8.9045 117.4076 55.9945 42.2267 172.6207 87 R 4.9788 9.2088 118.4450 54.5885 33.4375 174.1298 88 V 5.0449 8.6786 118.2383 59.5983 35.3438 174.2891 89 E 5.1602 9.2877 124.1977 55.0757 32.3568 175.0228 90 M 4.8723 8.5317 121.0896 54.7404 34.8606 173.0227 91 V 4.7021 8.5178 117.6257 61.1884 33.9475 175.6785 92 W 4.9425 8.8347 135.0000 56.4077 32.7736 174.5063 93 N 3.6440 8.9102 125.5145 54.5433 36.5029 173.5185 94 G 3.9052 8.3040 99.3754 45.7744 0.0000 173.7897 95 Q 4.4983 7.7895 119.0705 53.2332 32.4362 171.5952 96 P 4.8295 0.0000 0.0000 63.7206 32.0564 175.1054 97 C 5.2262 9.3915 118.1636 56.4972 33.9879 172.5295 98 A 5.1169 8.9397 119.7046 50.1089 22.6040 174.8654 99 L 5.0259 8.8320 122.4890 53.3384 45.3059 174.9439 100 D 4.9993 8.6125 126.6286 53.4403 41.9409 176.1697 101 V 4.6872 8.3463 122.1856 61.1633 35.9699 173.9313 102 I 5.1361 8.5292 124.7532 59.7811 40.2674 174.0181 103 D 5.6365 9.3180 127.0936 52.7227 43.5647 175.4846 104 V 4.8837 8.9975 123.0855 61.4504 34.0954 174.2345 105 M 5.2439 9.1945 126.9287 53.4233 36.3673 174.2354 106 R 4.9688 8.4837 122.0548 54.6640 32.8532 174.4811 107 F 5.1175 9.3808 125.5970 56.0714 41.4371 175.6344 108 D 4.7958 8.9062 122.1339 51.9786 41.3055 176.8493 109 E 4.1544 8.6209 117.0635 58.5074 29.2698 177.3482 110 H 4.7552 8.7382 115.7142 55.1524 29.2713 175.1179 111 G 3.9536 8.3064 107.2253 45.9978 0.0000 173.9086 112 R 4.8029 7.9091 117.8443 53.9682 32.5097 175.4149 113 I 3.4931 8.3916 122.2179 61.5043 37.4104 176.6713 114 Q 4.2827 9.2461 130.1308 58.2469 30.5157 175.6782 115 T 5.2922 7.5210 107.4574 60.1918 72.6654 172.5919 116 M 5.3137 9.0495 123.1305 54.0112 36.1357 173.9312 117 Q 5.0453 9.2164 123.4215 54.2310 33.1886 173.8140 118 A 5.4745 9.1475 126.8563 49.8848 21.3776 175.0916 119 Y 4.7450 9.5145 122.1322 57.8100 39.0718 175.2477 120 W 4.9343 8.3617 120.0434 56.9899 30.6404 173.5033 121 S 4.2603 8.3889 114.6713 57.5032 65.4136 175.0062 122 E 3.9657 8.7088 117.1208 59.4221 29.1672 179.1459 123 V 3.7846 7.4685 112.0867 63.3888 31.8536 176.2258 124 N 4.8646 8.4512 116.9351 52.7852 39.8359 173.6857 125 L 4.9597 7.6559 122.3905 53.7408 43.2543 175.8932 126 S 4.8225 9.0963 122.2042 56.6491 66.9241 174.6883 127 V 3.9583 8.3172 120.9496 63.1332 31.3605 175.6574 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 3 L 8.18 4.34 0.00 1.66 1.70 0.96 0.82 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 4 P 0.00 4.26 0.00 1.86 1.75 0.00 3.71 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.05 0.00 5 T 9.19 4.20 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 1.24 0.00 0.00 6 A 8.48 4.01 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 7 Q 7.98 3.93 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.85 0.00 0.00 0.00 0.00 0.00 2.43 2.44 0.00 8 E 7.97 3.90 0.00 2.18 1.84 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 2.26 2.25 0.00 9 V 7.95 3.03 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.82 0.00 0.00 10 Q 8.04 4.06 0.00 2.29 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.49 2.57 0.00 11 G 7.94 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 L 7.91 3.98 0.00 1.37 1.64 0.25 0.85 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 13 M 8.30 4.20 0.00 2.11 2.21 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.93 2.77 0.00 14 A 8.06 4.02 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 15 R 8.15 4.08 0.00 1.98 2.15 0.00 3.17 0.00 0.00 3.19 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.49 0.00 16 Y 8.18 4.03 0.00 3.10 3.14 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 17 I 7.63 3.40 1.96 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.60 0.82 0.00 0.00 18 E 8.03 3.90 0.00 2.17 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 2.30 2.57 0.00 19 L 7.91 4.01 0.00 1.64 1.57 0.89 0.63 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 20 V 7.53 3.41 1.93 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 0.97 0.00 0.00 0.28 0.00 0.00 21 D 8.03 4.35 0.00 2.87 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 22 V 7.30 4.22 2.05 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 0.82 0.00 0.00 0.95 0.00 0.00 23 G 7.73 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 24 D 7.81 4.59 0.00 2.70 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 0.00 0.00 0.00 0.00 25 I 7.74 3.65 1.88 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.76 0.97 0.00 0.00 26 E 8.21 3.94 0.00 2.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.39 0.00 27 A 8.08 4.04 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 28 I 7.75 3.77 1.76 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.83 0.39 0.00 0.00 29 V 7.97 3.77 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 1.09 0.00 0.00 1.03 0.00 0.00 30 Q 7.85 4.20 0.00 2.24 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.62 2.56 0.00 31 M 8.15 4.23 0.00 2.03 2.26 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.61 0.00 32 Y 7.16 4.59 0.00 3.21 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 33 A 8.90 4.32 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 34 D 8.86 4.50 0.00 2.86 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 D 7.86 4.71 0.00 2.79 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 36 A 7.97 4.62 1.61 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 37 T 8.62 5.48 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 1.16 0.00 0.00 38 V 8.01 4.87 1.76 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 0.84 0.00 0.00 0.77 0.00 0.00 39 E 9.12 4.66 0.00 2.00 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 2.11 2.15 0.00 40 D 8.26 4.92 0.00 2.76 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 0.00 0.00 0.00 0.00 41 P 0.00 4.61 0.00 1.38 0.49 0.00 3.68 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.20 0.00 42 F 8.59 4.10 0.00 2.33 2.33 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 43 G 7.85 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.30 4.30 0.00 2.01 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.75 0.00 0.00 0.00 0.00 0.00 2.13 2.32 0.00 45 P 0.00 4.23 0.00 1.96 1.93 0.00 3.58 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 1.96 2.00 0.00 46 P 0.00 4.68 0.00 1.85 1.94 0.00 3.67 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.91 0.00 47 I 8.25 4.44 1.84 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.42 0.72 0.00 0.00 48 H 9.00 5.19 0.00 2.99 3.19 0.00 5.67 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 49 G 9.20 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 0.00 0.00 0.00 50 R 8.39 3.89 0.00 1.93 2.04 0.00 3.18 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.84 0.00 51 E 8.12 3.92 0.00 2.05 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 2.40 2.43 0.00 52 Q 8.03 4.05 0.00 2.40 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.69 0.00 0.00 0.00 0.00 0.00 2.46 2.46 0.00 53 I 8.09 3.76 1.79 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.65 0.71 0.00 0.00 54 A 8.66 4.12 1.44 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 0.00 0.00 55 A 8.27 3.99 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 F 8.39 4.09 0.00 3.16 3.22 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 0.00 57 Y 8.37 3.87 0.00 3.20 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 R 8.34 4.00 0.00 2.05 2.00 0.00 3.22 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 1.69 1.90 0.00 59 Q 7.93 4.06 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.99 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 60 G 7.60 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 61 L 8.29 4.74 0.00 1.72 1.68 1.03 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.11 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 0.00 0.00 0.00 63 G 8.03 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 64 G 7.47 4.02 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 0.00 0.00 0.00 65 K 7.96 4.40 0.00 1.75 1.82 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.34 7.81 66 V 7.56 4.45 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.91 0.00 0.00 67 R 8.86 5.00 0.00 1.75 1.86 0.00 3.31 0.00 0.00 3.17 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.69 0.00 68 A 9.22 5.39 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 C 8.97 4.78 0.00 3.02 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 L 8.71 4.77 0.00 1.60 1.85 0.94 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 71 T 8.37 4.50 4.27 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 1.32 0.00 0.00 72 G 7.35 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 73 P 0.00 4.43 0.00 2.20 2.07 0.00 3.78 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 1.99 1.96 0.00 74 V 8.11 3.93 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 0.86 0.00 0.00 0.96 0.00 0.00 75 R 9.10 4.57 0.00 1.97 1.81 0.00 3.26 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 76 A 8.45 5.21 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 77 S 8.87 4.50 0.00 3.93 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 78 H 8.54 4.81 0.00 3.17 3.34 0.00 5.64 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 79 N 7.86 4.93 0.00 2.83 2.87 0.00 0.00 6.90 7.03 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 80 G 8.47 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 C 7.69 5.47 0.00 2.88 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 G 8.87 4.56 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 83 A 9.21 5.50 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 84 M 9.20 5.24 0.00 2.12 2.22 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.59 0.00 85 P 0.00 5.49 0.00 2.17 2.24 0.00 3.79 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.98 0.00 86 F 8.90 5.55 0.00 3.36 3.14 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 87 R 9.21 4.98 0.00 1.86 1.78 0.00 3.03 0.00 0.00 3.16 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.68 0.00 88 V 8.68 5.04 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.76 0.00 0.00 89 E 9.29 5.16 0.00 1.84 1.82 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 2.21 2.22 0.00 90 M 8.53 4.87 0.00 2.03 2.14 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.65 0.00 91 V 8.52 4.70 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 0.84 0.00 0.00 0.95 0.00 0.00 92 W 8.83 4.94 0.00 3.31 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 93 N 8.91 3.64 0.00 1.44 2.16 0.00 0.00 7.21 7.98 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 94 G 8.30 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 0.00 0.00 0.00 95 Q 7.79 4.50 0.00 1.98 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.23 6.86 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 96 P 0.00 4.83 0.00 1.99 2.03 0.00 3.69 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 97 C 9.39 5.23 0.00 3.12 3.15 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 98 A 8.94 5.12 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 0.00 0.00 0.00 0.00 0.00 0.00 99 L 8.83 5.03 0.00 1.46 1.20 0.84 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 100 D 8.61 5.00 0.00 2.58 2.52 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 0.00 0.00 0.00 0.00 101 V 8.35 4.69 0.67 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 1.18 0.00 0.00 0.53 0.00 0.00 102 I 8.53 5.14 1.91 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.54 0.90 0.00 0.00 103 D 9.32 5.64 0.00 2.94 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 0.00 104 V 9.00 4.88 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 0.97 0.00 0.00 0.88 0.00 0.00 105 M 9.19 5.24 0.00 1.38 1.79 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.17 0.00 106 R 8.48 4.97 0.00 1.85 1.69 0.00 3.07 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.59 0.00 107 F 9.38 5.12 0.00 2.98 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 D 8.91 4.80 0.00 2.84 2.99 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 0.00 0.00 0.00 109 E 8.62 4.15 0.00 1.80 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 2.30 0.00 110 H 8.74 4.76 0.00 3.28 3.30 0.00 5.72 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 G 8.31 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 0.00 112 R 7.91 4.80 0.00 2.11 1.94 0.00 3.18 0.00 0.00 3.55 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 113 I 8.39 3.49 1.00 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 0.04 0.25 0.45 0.00 0.00 114 Q 9.25 4.28 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.76 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 115 T 7.52 5.29 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 0.00 116 M 9.05 5.31 0.00 2.27 2.00 0.00 0.00 0.00 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.65 0.00 117 Q 9.22 5.05 0.00 2.05 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.54 0.00 0.00 0.00 0.00 0.00 2.52 2.34 0.00 118 A 9.15 5.47 1.69 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 0.00 0.00 119 Y 9.51 4.74 0.00 3.08 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 W 8.36 4.93 0.00 3.32 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 0.00 121 S 8.39 4.26 0.00 3.82 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 0.00 122 E 8.71 3.97 0.00 2.07 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.26 0.00 123 V 7.47 3.78 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 0.69 0.00 0.00 0.96 0.00 0.00 124 N 8.45 4.86 0.00 2.94 2.94 0.00 0.00 6.39 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 L 7.66 4.96 0.00 1.54 1.59 0.75 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 126 S 9.10 4.82 0.00 3.73 3.69 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 0.00 127 V 8.32 3.96 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 0.88 0.00 0.00 1.08 0.00 0.00