NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5652 8.1633 120.6245 55.3259 33.5888 174.7994 2 R 4.5487 8.7251 125.4996 55.6468 31.6075 171.4664 3 V 4.3815 8.7900 120.8045 62.1014 35.7857 172.0662 4 E 4.8569 9.0036 129.5865 54.6814 31.8584 174.6084 5 L 4.5300 8.7039 126.9769 52.7451 43.8275 175.5785 6 L 4.2355 7.7280 124.9185 54.1678 43.2113 176.4455 7 F 5.2057 8.2717 120.3876 54.6583 42.4867 175.3094 8 E 4.1017 9.1900 118.9128 60.2117 29.2635 179.4275 9 S 4.2986 7.7182 113.3690 61.2089 63.7748 174.8498 10 G 4.0728 7.6966 108.7621 45.9033 0.0000 171.4511 11 K 5.1767 8.5993 120.6721 56.6922 35.6106 174.3074 12 C 4.9237 9.0665 115.5489 57.2698 34.0296 172.6214 13 V 5.0163 8.3815 116.6065 61.2323 34.9504 173.8591 14 I 5.1494 9.0878 119.9204 59.2001 41.4632 173.5993 15 D 5.3693 9.1965 123.0921 52.6438 44.3419 173.9935 16 L 5.3417 8.7834 125.7037 52.6554 44.7159 175.8729 17 N 4.4207 8.9515 123.1061 53.4331 40.0202 175.2394 18 E 4.3898 8.8205 123.8923 57.3067 29.4210 177.9277 19 E 4.0604 7.2840 118.5889 57.3315 30.0456 176.1493 20 Y 4.9712 7.1230 117.1896 55.7200 40.4737 176.0584 21 E 3.9481 9.1691 125.2768 59.5081 29.6042 179.2908 22 V 3.4572 7.8327 118.5070 64.9966 30.9244 178.3904 23 V 3.6265 7.6040 117.5876 65.6129 31.7410 177.7974 24 K 4.1499 8.0549 117.7578 59.5525 31.8176 179.0947 25 L 4.1381 8.2934 119.2692 57.3225 41.5390 179.2965 26 L 4.0136 8.3586 119.4188 57.3389 41.2522 179.2003 27 K 4.3782 7.7222 118.3150 59.0330 32.1830 177.9447 28 E 4.3829 7.9288 117.2993 57.4415 29.5867 177.0188 29 K 4.6740 8.0765 118.4268 55.8459 33.2074 175.6775 30 I 4.9408 7.6868 118.1331 58.5378 40.4947 173.8324 31 P 4.6856 0.0000 0.0000 63.2860 32.2185 174.9028 32 F 5.0754 8.6506 114.6521 56.0346 41.7935 172.5301 33 E 5.0361 8.4700 117.8938 54.9610 33.2718 174.8309 34 S 4.6149 8.1884 113.5695 57.4089 66.6788 174.3213 35 V 3.9265 8.3995 123.9250 62.8894 32.1083 175.9336 36 V 3.9654 8.3836 128.1047 62.2328 31.7716 174.6036 37 N 4.8121 8.6858 126.1774 52.6196 40.0720 174.5226 38 T 5.1339 8.4170 110.6557 60.1081 72.4312 174.2519 39 W 4.9544 9.4197 133.6299 56.8968 31.8916 174.5687 40 G 3.8709 8.7368 116.4194 45.7110 0.0000 171.6207 41 E 4.8107 7.8878 114.9982 55.2669 32.7249 175.0668 42 E 4.4669 8.3545 115.9912 54.5620 33.7625 174.1589 43 I 5.3380 8.6826 120.3596 60.0100 41.3106 174.2763 44 Y 5.1262 8.6337 122.7606 56.1745 42.1004 173.3062 45 F 5.0820 8.0484 112.8956 55.9657 41.4441 173.8532 46 S 4.9774 8.9161 117.5344 57.3173 61.3892 174.0516 47 T 4.1780 8.3457 114.5521 61.0537 69.1307 173.7244 48 P 4.3368 0.0000 0.0000 64.3314 32.0002 176.8388 49 V 3.7913 7.3303 118.7039 62.5271 32.1275 175.2699 50 N 4.8798 8.2581 120.8232 51.4995 38.2982 173.8021 51 V 4.4952 8.1125 121.8659 61.3057 34.7380 174.8102 52 Q 4.5853 8.4169 121.4729 55.0597 30.7414 176.0119 53 K 4.0401 7.8922 119.4035 56.5180 32.7636 176.3227 54 M 4.5326 8.1002 121.7771 53.9022 32.3129 174.5169 55 E 4.1467 8.5814 124.8504 58.6349 30.5316 177.0548 56 N 5.1265 7.4219 116.6749 50.8837 38.5026 171.7572 57 P 4.9248 0.0000 0.0000 62.7887 33.2826 176.5486 58 R 4.7562 9.1508 119.7250 54.9370 35.2248 175.2630 59 E 4.6586 8.3913 115.8393 55.6296 30.8277 176.0665 60 V 4.4276 7.1146 115.7542 61.4078 33.7841 172.3678 61 V 4.4599 7.7418 114.1775 60.3993 35.7007 174.2412 62 E 4.4598 8.9952 121.2478 55.4655 31.2022 177.6814 63 I 4.2320 8.3822 118.4567 62.6734 37.2607 177.4847 64 G 4.2221 8.1169 107.9460 46.1892 0.0000 172.2809 65 D 5.5135 8.5967 119.1444 52.1074 45.2462 175.1561 66 V 4.7075 8.9172 118.6379 61.4621 35.1993 174.3154 67 G 4.9083 8.6799 112.3158 43.8022 0.0000 169.9881 68 Y 4.8092 8.9234 120.5560 55.6107 41.1746 175.8106 69 W 4.7372 8.2244 135.0000 54.8800 30.1090 174.4112 70 P 4.3933 0.0000 0.0000 64.6988 31.1038 177.8129 71 P 4.0158 0.0000 0.0000 64.1149 31.3064 176.9887 72 G 3.9006 6.9497 105.5808 44.0331 0.0000 172.6892 73 K 3.7356 7.7226 117.4060 57.1525 30.5467 174.3103 74 A 4.9011 7.5073 118.0363 50.0662 22.3565 177.3805 75 L 4.2111 7.5279 121.9157 54.6867 43.5920 175.1303 76 C 4.7985 7.8786 115.2414 58.2978 32.8102 175.0209 77 L 4.2416 7.8992 120.4593 54.1562 44.7785 174.7316 78 F 5.1030 8.0392 120.7820 55.8070 39.8407 176.2888 79 F 5.0646 7.4088 115.3549 55.0740 39.5140 173.7276 80 G 3.8580 6.9914 107.8733 44.8388 0.0000 172.6775 81 K 4.0278 8.3186 121.1876 55.1277 31.3439 176.5550 82 T 3.7330 8.0054 117.1936 60.7438 69.0662 173.0571 83 P 4.2277 0.0000 0.0000 64.0133 31.8235 176.4754 84 M 4.4508 6.7619 119.9739 53.6123 31.1680 173.1802 85 S 4.5209 6.9948 112.8813 58.2240 66.0491 173.0891 86 D 4.5785 7.8125 115.0361 56.1124 43.1643 176.3853 87 D 4.5061 8.1473 118.1324 56.6206 41.2373 176.6565 88 K 4.6068 7.3508 114.4558 55.4758 35.4080 176.5729 89 I 4.0031 7.8700 121.3792 60.5466 35.4417 174.8026 90 Q 4.1925 7.8000 122.2346 54.5839 30.0683 174.5448 91 P 4.7040 0.0000 0.0000 61.1494 33.1469 176.4073 92 A 4.1847 8.4717 120.4812 54.8447 18.1378 176.6949 93 S 4.5336 7.3484 106.8502 57.3587 65.8598 176.0031 94 A 5.0066 8.2058 124.6961 51.6877 15.3305 177.2646 95 V 4.2461 7.8867 114.8314 59.9148 34.0768 175.6729 96 N 4.8158 8.8268 120.7968 53.2420 38.8751 174.1210 97 V 4.5883 8.4419 120.9513 61.6163 32.1197 174.7054 98 I 4.5015 8.5555 121.1041 60.5700 40.3473 174.9072 99 G 4.7426 8.5072 109.3497 44.3547 0.0000 171.1613 100 K 4.9475 8.7134 119.6596 54.5028 35.7223 175.6579 101 I 4.3917 8.5104 128.3493 61.4991 35.6809 176.1792 102 V 3.9415 8.4167 121.1957 63.5713 31.9096 175.8216 103 E 4.5377 8.4828 119.6891 55.2141 33.5854 175.8304 104 G 4.0921 8.9633 111.1554 45.5515 0.0000 175.0099 105 L 4.1339 7.8163 120.4323 56.7101 42.4539 177.5008 106 E 4.4542 7.8853 117.1263 58.3168 30.8752 177.4415 107 D 4.4008 7.8582 117.8077 56.5781 40.4652 178.4191 108 L 3.4509 7.3309 120.1104 57.1609 41.1552 179.3606 109 K 4.0992 7.4407 117.4446 58.0961 31.9843 178.3019 110 K 4.3726 7.1151 117.0306 55.8289 33.1157 176.5752 111 I 3.8318 6.4881 119.9302 61.2775 37.6711 174.8913 112 K 4.5506 7.8767 120.9352 54.5474 34.4334 176.2863 113 D 4.8038 7.9563 117.0484 53.2489 40.9484 176.0890 114 G 4.9059 7.2228 108.7411 46.2608 0.0000 173.5785 115 E 4.4459 7.4402 113.3150 55.4481 30.3831 176.2487 116 K 3.9966 8.0773 115.4568 57.0853 29.0850 173.7775 117 V 3.7564 8.0777 121.6050 61.3698 32.9939 175.5468 118 A 4.7069 8.4721 125.4269 49.5863 20.6823 175.0922 119 V 3.5514 7.9915 121.6267 63.7989 33.0947 175.1373 120 R 4.9510 8.8752 125.0536 54.6544 35.0092 175.6023 121 F 4.3417 9.0377 116.4132 57.6196 39.3481 177.2980 122 A 3.5758 8.1765 123.6956 53.7772 17.2900 176.9992 123 S 3.8054 8.9917 110.9314 59.2899 62.2947 172.4179 124 S 4.2970 8.0688 120.8578 59.5174 62.5139 174.1267 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 M 8.16 4.57 0.00 2.33 2.27 0.00 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.80 0.00 2 R 8.73 4.55 0.00 1.99 1.91 0.00 3.31 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.74 0.00 3 V 8.79 4.38 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 1.00 0.00 0.00 0.95 0.00 0.00 4 E 9.00 4.86 0.00 2.08 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 2.11 2.38 0.00 5 L 8.70 4.53 0.00 1.33 0.69 0.92 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 6 L 7.73 4.24 0.00 1.46 1.37 0.82 0.79 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 7 F 8.27 5.21 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 8 E 9.19 4.10 0.00 2.13 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 2.37 2.42 0.00 9 S 7.72 4.30 0.00 3.61 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 10 G 7.70 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 0.00 0.00 0.00 11 K 8.60 5.18 0.00 1.77 1.70 0.00 1.52 0.00 0.00 1.72 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.32 1.42 7.81 12 C 9.07 4.92 0.00 3.29 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 13 V 8.38 5.02 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 0.99 0.00 0.00 0.96 0.00 0.00 14 I 9.09 5.15 1.97 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.78 1.01 0.00 0.00 15 D 9.20 5.37 0.00 2.75 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 16 L 8.78 5.34 0.00 1.63 1.67 1.03 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 17 N 8.95 4.42 0.00 2.97 2.74 0.00 0.00 5.94 7.77 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 18 E 8.82 4.39 0.00 2.04 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 0.00 2.43 2.35 0.00 19 E 7.28 4.06 0.00 1.16 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 2.18 2.03 0.00 20 Y 7.12 4.97 0.00 3.12 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 21 E 9.17 3.95 0.00 2.10 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 2.37 2.44 0.00 22 V 7.83 3.46 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 0.81 0.00 0.00 0.37 0.00 0.00 23 V 7.60 3.63 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 0.99 0.00 0.00 1.16 0.00 0.00 24 K 8.05 4.15 0.00 1.99 1.86 0.00 1.72 0.00 0.00 1.82 0.00 0.00 3.09 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.55 1.77 7.81 25 L 8.29 4.14 0.00 1.70 1.67 0.89 0.89 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 26 L 8.36 4.01 0.00 1.98 1.77 0.98 0.87 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 27 K 7.72 4.38 0.00 1.94 2.01 0.00 1.72 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.58 1.65 7.81 28 E 7.93 4.38 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 29 K 8.08 4.67 0.00 1.50 1.46 0.00 1.58 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.29 1.38 7.81 30 I 7.69 4.94 0.89 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.72 -0.05 0.00 0.00 31 P 0.00 4.69 0.00 2.02 2.06 0.00 3.85 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.01 0.00 32 F 8.65 5.08 0.00 3.06 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 33 E 8.47 5.04 0.00 1.83 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 2.09 2.21 0.00 34 S 8.19 4.61 0.00 3.95 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 35 V 8.40 3.93 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.95 0.00 0.00 36 V 8.38 3.97 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 0.73 0.00 0.00 1.02 0.00 0.00 37 N 8.69 4.81 0.00 1.44 1.92 0.00 0.00 6.06 6.63 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 38 T 8.42 5.13 4.33 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 1.21 0.00 0.00 39 W 9.42 4.95 0.00 3.34 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 40 G 8.74 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 41 E 7.89 4.81 0.00 1.63 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 2.25 2.17 0.00 42 E 8.35 4.47 0.00 2.14 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 2.70 2.49 0.00 43 I 8.68 5.34 2.10 0.00 0.00 0.60 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 1.48 1.02 0.00 0.00 44 Y 8.63 5.13 0.00 2.93 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 F 8.05 5.08 0.00 3.11 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 S 8.92 4.98 0.00 3.90 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 T 8.35 4.18 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 1.40 0.00 0.00 48 P 0.00 4.34 0.00 2.04 2.08 0.00 2.88 0.00 0.00 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.18 0.00 49 V 7.33 3.79 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 0.68 0.00 0.00 0.81 0.00 0.00 50 N 8.26 4.88 0.00 2.79 2.79 0.00 0.00 5.75 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 51 V 8.11 4.50 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 0.80 0.00 0.00 0.83 0.00 0.00 52 Q 8.42 4.59 0.00 2.01 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.64 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 53 K 7.89 4.04 0.00 1.69 1.69 0.00 1.74 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.42 7.81 54 M 8.10 4.53 0.00 2.09 1.99 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 2.44 2.53 0.00 55 E 8.58 4.15 0.00 2.00 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 2.39 2.42 0.00 56 N 7.42 5.13 0.00 2.84 2.52 0.00 0.00 7.35 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 P 0.00 4.92 0.00 2.11 2.03 0.00 3.76 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 1.98 1.99 0.00 58 R 9.15 4.76 0.00 1.66 1.95 0.00 3.22 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.74 0.00 59 E 8.39 4.66 0.00 1.89 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.25 0.00 60 V 7.11 4.43 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.91 0.00 0.00 61 V 7.74 4.46 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 0.70 0.00 0.00 0.32 0.00 0.00 62 E 9.00 4.46 0.00 2.09 1.92 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 2.29 2.30 0.00 63 I 8.38 4.23 1.92 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 1.35 1.11 0.98 0.00 0.00 64 G 8.12 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 0.00 0.00 0.00 0.00 65 D 8.60 5.51 0.00 2.74 2.71 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 66 V 8.92 4.71 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 1.02 0.00 0.00 67 G 8.68 4.91 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 68 Y 8.92 4.81 0.00 2.96 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 69 W 8.22 4.74 0.00 3.07 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 70 P 0.00 4.39 0.00 2.22 2.43 0.00 3.58 0.00 0.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.00 0.00 71 P 0.00 4.02 0.00 1.61 1.85 0.00 2.71 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.31 0.00 72 G 6.95 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 0.00 0.00 0.00 73 K 7.72 3.74 0.00 2.02 1.90 0.00 1.53 0.00 0.00 1.63 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.56 1.50 7.81 74 A 7.51 4.90 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 75 L 7.53 4.21 0.00 0.49 0.73 0.99 0.95 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 76 C 7.88 4.80 0.00 2.40 1.31 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 77 L 7.90 4.24 0.00 1.80 1.77 1.20 1.35 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 78 F 8.04 5.10 0.00 3.01 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 79 F 7.41 5.06 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 80 G 6.99 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 81 K 8.32 4.03 0.00 1.66 1.68 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.77 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.30 1.32 7.81 82 T 8.01 3.73 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 1.21 0.00 0.00 83 P 0.00 4.23 0.00 1.96 1.95 0.00 2.67 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.38 0.00 84 M 6.76 4.45 0.00 2.07 1.89 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.54 0.00 85 S 6.99 4.52 0.00 3.98 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 D 7.81 4.58 0.00 2.64 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 87 D 8.15 4.51 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 88 K 7.35 4.61 0.00 1.76 1.69 0.00 1.54 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.27 1.41 7.81 89 I 7.87 4.00 1.75 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 1.33 0.66 0.75 0.00 0.00 90 Q 7.80 4.19 0.00 2.18 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.91 0.00 0.00 0.00 0.00 0.00 2.50 2.46 0.00 91 P 0.00 4.70 0.00 2.29 2.02 0.00 3.72 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 1.76 0.00 92 A 8.47 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 S 7.35 4.53 0.00 4.08 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 0.00 94 A 8.21 5.01 1.25 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 0.00 0.00 0.00 95 V 7.89 4.25 2.39 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 1.08 0.00 0.00 1.12 0.00 0.00 96 N 8.83 4.82 0.00 2.78 2.88 0.00 0.00 5.48 7.65 0.00 0.00 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 V 8.44 4.59 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 0.99 0.00 0.00 0.97 0.00 0.00 98 I 8.56 4.50 1.95 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.66 0.25 0.00 0.00 99 G 8.51 4.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.71 4.95 0.00 1.94 1.67 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.38 1.50 7.81 101 I 8.51 4.39 2.08 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.94 1.03 0.00 0.00 102 V 8.42 3.94 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 0.83 0.00 0.00 0.99 0.00 0.00 103 E 8.48 4.54 0.00 2.08 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.41 0.00 104 G 8.96 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 0.00 0.00 0.00 105 L 7.82 4.13 0.00 1.68 1.74 1.08 0.99 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 0.00 106 E 7.89 4.45 0.00 2.00 1.92 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 2.31 2.36 0.00 107 D 7.86 4.40 0.00 2.72 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.33 3.45 0.00 1.03 0.13 0.81 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 109 K 7.44 4.10 0.00 1.78 1.89 0.00 1.73 0.00 0.00 1.87 0.00 0.00 3.31 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.59 1.55 7.81 110 K 7.12 4.37 0.00 1.78 1.83 0.00 1.55 0.00 0.00 1.65 0.00 0.00 3.13 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.30 1.35 7.81 111 I 6.49 3.83 1.55 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 1.03 -0.05 0.53 0.00 0.00 112 K 7.88 4.55 0.00 1.67 1.70 0.00 1.74 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.30 1.30 7.81 113 D 7.96 4.80 0.00 2.61 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 0.00 114 G 7.22 4.91 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 0.00 115 E 7.44 4.45 0.00 1.94 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 2.28 2.21 0.00 116 K 8.08 4.00 0.00 1.88 1.73 0.00 1.65 0.00 0.00 1.84 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.38 7.81 117 V 8.08 3.76 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 -0.05 0.00 0.00 0.10 0.00 0.00 118 A 8.47 4.71 1.06 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 0.00 0.00 119 V 7.99 3.55 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 -0.11 0.00 0.00 120 R 8.88 4.95 0.00 1.64 1.75 0.00 3.14 0.00 0.00 3.10 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.46 0.00 121 F 9.04 4.34 0.00 3.15 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 0.00 122 A 8.18 3.58 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 0.00 123 S 8.99 3.81 0.00 4.11 4.01 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 0.00 124 S 8.07 4.30 0.00 3.89 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00