NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 23 A 4.3280 8.2493 123.5850 51.5638 21.0686 175.5965 24 D 5.1279 7.3736 113.6378 49.4845 42.3435 174.3061 25 S 4.2016 9.9422 115.8835 62.0809 63.5567 178.1293 26 K 3.9601 8.1313 120.4261 59.4660 31.8032 179.0878 27 A 4.0579 8.2939 121.3123 54.9230 18.2395 180.1416 28 V 3.6540 7.7849 117.3316 64.8579 31.6222 178.3429 29 L 4.1542 8.5047 120.4706 57.8713 41.6056 179.2192 30 N 4.2887 8.2527 116.5712 56.5745 38.7168 176.6062 31 Q 4.2538 8.4079 120.9141 59.3133 29.2064 178.1917 32 A 4.1992 8.6984 122.2302 55.1008 18.5463 179.6331 33 V 3.5922 8.1144 116.6641 66.2123 31.7203 178.2322 34 A 4.1855 8.2594 120.2834 55.4301 18.3152 179.4482 35 D 4.3628 8.5041 117.6110 57.5219 40.9048 179.0036 36 L 4.2166 8.6651 119.8599 57.8331 41.4536 179.7850 37 S 3.8843 7.7643 114.7375 61.5465 62.6704 176.9582 38 V 3.6188 7.7198 120.3727 65.6495 31.1660 177.8534 39 A 3.9999 8.4973 121.0912 55.3826 18.1841 178.7579 40 H 3.9463 8.3870 116.8694 59.7275 29.8640 177.1022 41 S 4.0967 7.8929 114.3639 61.5816 62.1610 176.2750 42 I 3.6862 7.8342 122.3138 64.4134 36.8526 178.4438 43 L 3.9897 8.2056 120.1834 58.0224 41.5083 179.0988 44 H 3.7789 8.2446 118.3893 58.6964 29.5432 177.2264 45 Q 4.1996 7.8678 121.7468 59.0431 29.0655 178.0928 46 V 3.6243 7.7690 119.3231 66.4162 31.3384 177.0759 47 H 4.0379 7.9644 116.4208 59.4426 29.6056 176.6696 48 W 4.7429 7.8355 118.4390 59.6654 29.5523 177.6028 49 Y 4.3047 8.5954 114.8292 57.1804 37.6682 175.2574 50 M 4.2389 7.7230 120.6257 56.0550 32.8149 175.5978 51 R 4.6648 8.9898 123.7711 55.2197 34.5141 173.6022 52 G 4.0250 8.8696 106.0775 43.2856 0.0000 173.2911 53 R 4.2253 8.3283 119.2391 57.3181 30.3949 177.4210 54 G 4.2986 9.4581 110.1264 45.4657 0.0000 175.0446 55 F 4.1248 8.5961 122.1143 61.9855 39.0081 176.7737 56 M 4.3340 8.3642 116.0724 57.9082 32.1543 177.1680 57 I 3.9115 7.6012 112.3140 62.3566 38.7271 177.5349 58 W 4.2134 8.1764 120.3244 58.7575 28.8699 177.9440 59 H 3.8186 8.0848 118.5450 58.8043 29.3454 175.2792 60 P 4.4014 0.0000 0.0000 65.5494 31.1951 177.9603 61 K 3.5085 7.5352 119.4318 59.6338 31.8347 178.5346 62 M 4.0664 7.8605 118.6445 58.3247 31.8004 178.2698 63 D 4.1839 7.6742 118.9454 57.3923 40.9719 178.7720 64 E 3.8835 7.7996 118.2934 59.7002 29.4534 178.9105 65 Y 4.4777 7.8508 116.6355 61.5485 37.8640 178.5935 66 M 4.1508 8.6643 122.5075 58.9880 32.0140 179.3540 67 E 3.9492 8.2158 118.6434 60.7947 29.8671 181.1794 68 E 3.8142 8.1407 120.1604 59.1663 29.7440 178.7563 69 I 3.7921 7.8485 119.9516 64.8733 37.2925 178.2213 70 D 4.5445 8.4910 119.7438 56.9601 40.6517 179.0780 71 G 3.4760 7.8332 106.4172 48.0677 0.0000 175.3595 72 Y 4.2841 7.4391 119.8269 60.3901 37.8122 178.0406 73 L 4.0672 8.3672 121.7771 58.6594 42.1203 178.7251 74 D 4.2987 8.1816 117.5281 57.2058 41.1418 177.8538 75 E 3.9049 8.1042 119.5152 59.4706 29.6770 178.7868 76 M 3.8997 8.4706 119.1899 58.2471 32.0597 178.4745 77 S 4.1049 8.2075 113.4331 61.7706 62.5329 176.2756 78 E 4.0342 8.3686 120.8581 58.9688 29.1207 179.2636 79 R 3.8269 8.1045 119.2678 59.0651 30.0360 178.1759 80 L 3.8996 7.9007 120.1134 58.3093 42.1258 178.8347 81 I 3.8204 7.7653 119.5754 65.0337 36.8647 178.5341 82 T 3.8976 7.8389 115.0124 66.4084 68.3575 175.9022 83 L 4.3288 7.7699 118.3061 55.1458 41.8643 177.6648 84 G 3.8877 8.1353 107.8866 45.2669 0.0000 173.8676 85 G 3.8291 7.8133 109.1251 43.7590 0.0000 173.7798 86 A 4.4520 7.9731 121.2247 49.1400 19.9396 174.1700 87 P 4.4677 0.0000 0.0000 63.0181 32.1541 176.8957 88 F 4.5281 8.6136 120.1126 58.7552 39.2761 176.4187 89 S 4.7763 9.0056 117.6002 57.7801 64.1306 174.3336 90 T 4.5032 7.0306 110.3547 59.6633 72.9415 174.1567 91 L 4.1011 8.2036 121.9838 57.6293 41.6865 179.9027 92 K 3.8992 7.8194 118.4343 60.1089 32.5167 178.9304 93 E 3.6892 7.5555 119.8674 58.7225 29.4019 179.3550 94 F 4.3525 7.5817 117.6833 60.7886 38.8341 177.6781 95 S 4.1348 8.3886 111.5350 61.4227 62.2541 175.7998 96 E 4.0678 7.9553 120.1736 59.4741 29.4195 178.6752 97 N 4.4323 7.7007 114.3145 54.1241 39.1079 175.7758 98 S 4.4949 7.1889 114.7987 58.1422 63.0094 173.9773 99 Q 4.1932 8.7914 125.0712 57.0704 29.0789 176.5962 100 L 3.9068 7.3250 120.5413 54.5597 42.2952 176.9025 101 K 4.5010 8.2682 123.6238 52.7582 33.6681 174.7844 102 E 4.5019 8.5391 123.7802 54.3064 30.7970 175.7325 103 V 4.4755 7.7608 114.2084 58.9230 35.2137 175.3756 104 L 4.1269 8.1274 120.6200 54.1801 42.0532 177.7361 105 G 2.5634 8.0704 110.9097 45.2986 0.0000 172.7282 106 D 4.4882 7.4554 122.0692 52.5297 43.9765 175.6052 107 Y 4.4734 8.6827 123.4525 60.0006 38.1665 176.3176 108 N 4.6872 9.2257 116.4410 53.7076 39.1051 175.7437 109 V 3.8648 7.1229 119.1091 62.8277 32.2481 176.2962 110 T 4.4018 8.3819 116.7795 60.7007 71.1997 176.1130 111 I 3.6598 8.2164 122.0090 64.9064 37.1484 178.5693 112 E 3.8577 8.0965 118.5471 59.3712 29.2515 179.1878 113 E 3.9728 8.0997 118.4450 59.2454 29.5001 179.3300 114 Q 3.9230 8.2627 118.5770 58.8820 28.6946 178.7136 115 L 3.6541 8.0597 120.1861 57.5310 41.5419 179.3160 116 A 3.8541 7.8134 120.7716 55.0512 18.2408 179.6927 117 R 3.6965 7.8317 117.1532 59.4626 30.1055 178.8516 118 V 3.1895 7.4806 118.0065 65.8223 31.3981 177.9645 119 V 3.4819 7.7615 120.4832 66.6509 31.2829 178.2823 120 E 3.9584 7.9803 117.8739 61.2315 29.4607 181.0799 121 V 3.8337 7.6866 119.4284 65.9506 31.5622 178.1885 122 F 4.4226 8.5778 117.9182 60.5205 38.6900 177.7467 123 R 3.9243 8.7897 118.1480 59.5267 29.8747 178.2011 124 Y 3.9553 8.1479 119.0832 60.8436 38.6494 178.3503 125 L 3.3941 8.2123 119.5105 57.5095 41.6246 179.3315 126 A 3.8648 8.1769 120.8452 54.9163 18.2816 179.4390 127 A 3.7564 7.8064 119.1990 55.2351 18.3798 179.5014 128 L 3.6157 7.3198 118.8337 58.3724 42.0206 179.2933 129 F 4.4284 7.9294 117.8825 60.4227 38.7175 177.3703 130 Q 4.0195 8.4016 121.9234 59.7679 28.8172 179.2248 131 K 4.0049 7.9932 124.7522 59.7016 31.6729 181.0408 132 G 2.5370 7.8336 107.4871 47.0008 0.0000 175.4564 133 F 4.0186 8.2743 123.6246 61.0697 39.3930 176.9590 134 D 4.3579 8.5147 118.7078 57.4230 40.6973 178.8758 135 V 3.5442 8.0624 119.3125 66.1339 31.4942 178.2592 136 S 4.2299 8.1184 115.2897 60.6941 62.7122 175.9266 137 D 4.1473 8.0472 124.2232 57.6250 40.6976 178.7167 138 E 4.0005 7.7937 117.6066 61.2151 29.8658 180.3501 139 E 4.4324 8.2415 118.0519 56.0817 29.1963 178.0373 140 G 3.8046 7.3171 107.0761 46.8515 0.0000 175.2325 141 D 4.6175 7.7930 121.7296 52.5755 38.9967 176.4076 142 S 4.1129 8.0126 119.6514 60.5253 63.4777 176.6798 143 V 3.5104 7.6433 121.5465 66.3464 31.4443 177.9557 144 T 3.7469 7.9864 114.9451 66.4179 68.3019 175.7597 145 N 4.5879 8.2488 122.8066 56.9421 38.8875 177.2496 146 D 4.4594 8.2518 122.2537 58.3514 39.8227 180.3615 147 I 3.7573 7.5247 120.8742 64.4516 37.1182 178.6650 148 F 4.0166 8.0043 118.5602 60.3152 38.7183 177.3686 149 N 4.3642 8.5877 116.9835 56.5421 38.5560 177.1937 150 V 3.4971 7.9305 119.4610 65.9152 31.6938 177.7724 151 A 3.2882 7.3846 121.7882 54.1034 17.8827 179.4384 152 K 4.0061 7.8691 117.8107 59.5743 32.3119 178.5664 153 A 3.9616 7.8266 120.9248 55.3816 18.2757 179.6613 154 S 3.9856 7.7663 111.1248 61.6758 62.5666 176.3308 155 I 3.5402 7.7698 122.5023 64.3971 36.7866 178.3171 156 E 4.0395 8.4548 119.5551 59.2142 29.3714 179.1552 157 K 4.2365 8.0939 119.6120 60.1185 32.2307 178.4927 158 H 4.4371 8.3083 116.3542 58.9626 28.5171 177.8294 159 I 3.8335 8.0648 121.6918 64.0532 36.9274 177.9405 160 W 4.4558 8.3453 129.1897 61.1412 30.4931 177.9056 161 M 3.3310 7.6461 117.9591 58.0500 31.3635 178.8151 162 L 4.0339 8.4047 119.5088 57.9827 41.7442 179.5890 163 Q 4.0008 8.4537 118.0323 58.9233 28.6657 178.8003 164 A 4.0447 8.2040 121.8638 55.1493 18.1945 179.2171 165 E 4.0346 8.2098 116.9452 59.1952 29.7271 178.0712 166 L 4.4740 7.6766 116.5919 54.1227 41.6952 177.1183 167 G 3.9570 7.9614 106.1812 46.3506 0.0000 173.7404 168 Q 4.6496 8.2111 116.9547 53.0922 32.3361 175.3049 169 A 4.3675 8.3140 122.1042 51.3938 19.2344 176.2290 170 P 4.3862 0.0000 0.0000 64.7367 31.8687 177.7115 171 K 3.8372 8.0691 114.2671 57.3913 29.3934 175.1114 172 L 4.1896 7.8012 121.4919 55.1876 41.5217 177.7587 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 23 A 8.25 4.33 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 24 D 7.37 5.13 0.00 3.13 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 25 S 9.94 4.20 0.00 3.90 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 26 K 8.13 3.96 0.00 1.94 1.84 0.00 1.64 0.00 0.00 1.92 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.51 7.81 27 A 8.29 4.06 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 28 V 7.78 3.65 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 1.09 0.00 0.00 0.77 0.00 0.00 29 L 8.50 4.15 0.00 1.94 1.81 0.92 0.26 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 30 N 8.25 4.29 0.00 2.76 2.58 0.00 0.00 6.93 6.36 0.00 0.00 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 Q 8.41 4.25 0.00 2.46 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.47 2.73 0.00 32 A 8.70 4.20 1.72 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 33 V 8.11 3.59 2.50 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 1.28 0.00 0.00 1.09 0.00 0.00 34 A 8.26 4.19 1.54 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 0.00 0.00 35 D 8.50 4.36 0.00 2.95 2.94 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 36 L 8.67 4.22 0.00 1.78 1.80 1.20 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 37 S 7.76 3.88 0.00 3.47 3.28 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 38 V 7.72 3.62 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 0.98 0.00 0.00 0.99 0.00 0.00 39 A 8.50 4.00 1.47 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 0.00 0.00 40 H 8.39 3.95 0.00 3.26 3.51 0.00 5.80 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 41 S 7.89 4.10 0.00 3.94 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 42 I 7.83 3.69 1.98 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.55 0.86 0.00 0.00 43 L 8.21 3.99 0.00 1.75 1.70 1.16 1.13 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 44 H 8.24 3.78 0.00 2.94 2.68 0.00 5.60 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 45 Q 7.87 4.20 0.00 2.26 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.55 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 46 V 7.77 3.62 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 0.94 0.00 0.00 0.97 0.00 0.00 47 H 7.96 4.04 0.00 3.08 3.33 0.00 6.00 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 48 W 7.84 4.74 0.00 3.68 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 49 Y 8.60 4.30 0.00 3.12 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 50 M 7.72 4.24 0.00 2.34 2.38 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.84 0.00 51 R 8.99 4.66 0.00 1.89 1.80 0.00 3.33 0.00 0.00 3.19 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 2.00 0.00 52 G 8.87 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 0.00 0.00 0.00 0.00 53 R 8.33 4.23 0.00 1.87 1.96 0.00 3.38 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 54 G 9.46 4.30 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 F 8.60 4.12 0.00 3.38 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 56 M 8.36 4.33 0.00 2.08 2.22 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.71 0.00 57 I 7.60 3.91 1.53 0.00 0.00 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 1.10 -0.36 0.80 0.00 0.00 58 W 8.18 4.21 0.00 3.49 3.21 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 59 H 8.08 3.82 0.00 1.54 2.75 0.00 5.95 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 60 P 0.00 4.40 0.00 2.17 2.22 0.00 3.61 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 2.05 1.97 0.00 61 K 7.54 3.51 0.00 1.59 1.88 0.00 1.05 0.00 0.00 1.25 0.00 0.00 2.63 0.00 0.00 2.51 0.00 0.00 0.00 0.00 1.06 0.55 7.81 62 M 7.86 4.07 0.00 2.05 2.22 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 3.01 0.00 63 D 7.67 4.18 0.00 2.78 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 64 E 7.80 3.88 0.00 1.94 1.91 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 2.31 2.26 0.00 65 Y 7.85 4.48 0.00 3.22 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 66 M 8.66 4.15 0.00 1.93 2.10 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.34 0.00 67 E 8.22 3.95 0.00 1.99 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 2.24 2.18 0.00 68 E 8.14 3.81 0.00 2.01 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 0.00 2.05 1.84 0.00 69 I 7.85 3.79 2.06 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 1.87 0.85 1.02 0.00 0.00 70 D 8.49 4.54 0.00 2.63 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 71 G 7.83 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 72 Y 7.44 4.28 0.00 3.18 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 73 L 8.37 4.07 0.00 1.84 1.87 0.88 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 74 D 8.18 4.30 0.00 2.94 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.10 3.90 0.00 2.19 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 2.23 2.31 0.00 76 M 8.47 3.90 0.00 1.98 2.15 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.08 0.00 77 S 8.21 4.10 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 78 E 8.37 4.03 0.00 2.11 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 0.00 2.33 2.42 0.00 79 R 8.10 3.83 0.00 1.95 2.00 0.00 3.11 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.63 0.00 80 L 7.90 3.90 0.00 1.88 1.91 0.94 0.84 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 81 I 7.77 3.82 1.99 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 1.52 0.75 0.91 0.00 0.00 82 T 7.84 3.90 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 1.19 0.00 0.00 83 L 7.77 4.33 0.00 1.82 1.70 0.96 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 84 G 8.14 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 85 G 7.81 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 0.00 0.00 0.00 86 A 7.97 4.45 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 87 P 0.00 4.47 0.00 2.27 2.08 0.00 3.78 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 88 F 8.61 4.53 0.00 3.40 2.94 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 89 S 9.01 4.78 0.00 4.00 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 90 T 7.03 4.50 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 1.13 0.00 0.00 91 L 8.20 4.10 0.00 1.71 1.82 1.00 1.06 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 92 K 7.82 3.90 0.00 1.92 2.01 0.00 1.47 0.00 0.00 1.77 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.44 7.81 93 E 7.56 3.69 0.00 1.82 1.63 0.00 0.00 0.00 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 2.25 0.00 94 F 7.58 4.35 0.00 3.21 2.94 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 95 S 8.39 4.13 0.00 3.96 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 96 E 7.96 4.07 0.00 1.95 1.91 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 2.30 2.42 0.00 97 N 7.70 4.43 0.00 2.31 2.75 0.00 0.00 7.05 7.72 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 98 S 7.19 4.49 0.00 4.09 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 99 Q 8.79 4.19 0.00 1.85 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.64 0.00 0.00 0.00 0.00 0.00 2.45 2.69 0.00 100 L 7.33 3.91 0.00 1.51 1.43 0.86 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.27 4.50 0.00 1.75 1.57 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.26 0.99 7.81 102 E 8.54 4.50 0.00 1.93 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 2.24 2.30 0.00 103 V 7.76 4.48 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 0.70 0.00 0.00 0.85 0.00 0.00 104 L 8.13 4.13 0.00 1.55 1.48 0.90 0.85 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 0.00 105 G 8.07 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 0.00 0.00 0.00 106 D 7.46 4.49 0.00 2.57 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 0.00 107 Y 8.68 4.47 0.00 3.13 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 0.00 108 N 9.23 4.69 0.00 2.98 2.90 0.00 0.00 6.91 7.61 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 0.00 109 V 7.12 3.86 2.10 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 0.82 0.00 0.00 0.95 0.00 0.00 110 T 8.38 4.40 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 0.00 111 I 8.22 3.66 1.88 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.19 0.83 0.00 0.00 112 E 8.10 3.86 0.00 1.97 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 2.36 0.00 113 E 8.10 3.97 0.00 2.19 1.95 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 2.29 2.32 0.00 114 Q 8.26 3.92 0.00 2.12 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.58 2.58 0.00 115 L 8.06 3.65 0.00 1.35 1.28 0.01 -0.52 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 0.00 116 A 7.81 3.85 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 0.00 117 R 7.83 3.70 0.00 1.96 2.08 0.00 3.08 0.00 0.00 3.02 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 118 V 7.48 3.19 1.86 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 -0.01 0.00 0.00 0.82 0.00 0.00 119 V 7.76 3.48 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 0.98 0.00 0.00 0.87 0.00 0.00 120 E 7.98 3.96 0.00 2.03 1.95 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 2.25 2.20 0.00 121 V 7.69 3.83 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 1.16 0.00 0.00 0.90 0.00 0.00 122 F 8.58 4.42 0.00 3.13 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 0.00 123 R 8.79 3.92 0.00 2.04 2.01 0.00 3.16 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.91 0.00 124 Y 8.15 3.96 0.00 3.10 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 0.00 125 L 8.21 3.39 0.00 1.69 1.01 1.02 0.76 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 0.00 126 A 8.18 3.86 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 0.00 127 A 7.81 3.76 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 0.00 128 L 7.32 3.62 0.00 1.12 1.26 0.87 1.31 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 0.00 129 F 7.93 4.43 0.00 3.15 3.16 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 0.00 130 Q 8.40 4.02 0.00 2.10 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.80 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 131 K 7.99 4.00 0.00 1.82 1.81 0.00 1.87 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.37 1.33 7.81 132 G 7.83 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 0.00 0.00 0.00 133 F 8.27 4.02 0.00 3.24 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 0.00 134 D 8.51 4.36 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 0.00 135 V 8.06 3.54 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 1.07 0.00 0.00 0.94 0.00 0.00 136 S 8.12 4.23 0.00 4.26 4.17 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 0.00 137 D 8.05 4.15 0.00 2.55 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 0.00 138 E 7.79 4.00 0.00 2.13 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 2.26 2.22 0.00 139 E 8.24 4.43 0.00 2.00 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 2.31 2.57 0.00 140 G 7.32 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 0.00 0.00 0.00 141 D 7.79 4.62 0.00 2.79 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 0.00 142 S 8.01 4.11 0.00 4.05 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 0.00 143 V 7.64 3.51 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 1.02 0.00 0.00 0.91 0.00 0.00 144 T 7.99 3.75 4.43 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 1.29 0.00 0.00 145 N 8.25 4.59 0.00 2.67 2.84 0.00 0.00 6.94 7.83 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 0.00 146 D 8.25 4.46 0.00 2.73 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 0.00 147 I 7.52 3.76 1.68 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.45 0.47 0.00 0.00 148 F 8.00 4.02 0.00 3.28 3.20 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 0.00 149 N 8.59 4.36 0.00 3.33 2.91 0.00 0.00 6.80 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 0.00 150 V 7.93 3.50 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 0.98 0.00 0.00 0.95 0.00 0.00 151 A 7.38 3.29 -0.31 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 0.00 152 K 7.87 4.01 0.00 2.08 1.95 0.00 1.65 0.00 0.00 1.54 0.00 0.00 3.13 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.52 7.81 153 A 7.83 3.96 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 0.00 154 S 7.77 3.99 0.00 3.97 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 0.00 155 I 7.77 3.54 1.89 0.00 0.00 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 1.79 0.88 0.75 0.00 0.00 156 E 8.45 4.04 0.00 2.10 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 2.35 2.47 0.00 157 K 8.09 4.24 0.00 2.09 2.02 0.00 1.77 0.00 0.00 1.76 0.00 0.00 3.11 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.85 1.87 7.81 158 H 8.31 4.44 0.00 3.44 3.48 0.00 5.68 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 I 8.06 3.83 2.14 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.12 1.00 0.00 0.00 160 W 8.35 4.46 0.00 3.45 3.55 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 0.00 161 M 7.65 3.33 0.00 1.91 2.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.10 0.00 162 L 8.40 4.03 0.00 1.74 1.63 0.79 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 163 Q 8.45 4.00 0.00 2.38 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.50 2.74 0.00 164 A 8.20 4.04 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 0.00 165 E 8.21 4.03 0.00 2.21 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 2.50 2.48 0.00 166 L 7.68 4.47 0.00 1.77 1.63 0.83 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 167 G 7.96 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 0.00 168 Q 8.21 4.65 0.00 2.11 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.89 0.00 0.00 0.00 0.00 0.00 2.29 2.47 0.00 169 A 8.31 4.37 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 0.00 170 P 0.00 4.39 0.00 2.12 2.29 0.00 3.90 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.40 0.00 171 K 8.07 3.84 0.00 1.90 1.87 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.16 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.58 7.81 172 L 7.80 4.19 0.00 1.64 1.59 0.98 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00