NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3848 8.3044 120.3493 54.8183 33.4234 174.9181 2 I 3.6155 8.3793 125.9374 61.2754 38.7912 173.2432 3 Q 4.8886 8.3586 124.8205 54.1540 33.6211 173.8616 4 S 5.1110 8.5301 115.7384 56.8802 66.3561 173.2621 5 Q 4.7417 9.1121 120.8575 54.9133 30.0154 175.7459 6 I 4.3911 8.3843 111.6005 60.0194 39.1316 174.7610 7 N 4.8300 7.8547 119.7599 50.9843 40.3130 174.4902 8 R 3.9432 8.6205 124.2358 59.3825 29.1501 178.2414 9 N 4.3308 8.7223 117.4910 55.9571 38.3812 177.3720 10 I 3.6888 7.4459 121.4161 64.6123 37.2055 178.7217 11 R 3.9954 7.8840 118.3071 59.0345 29.8351 179.0009 12 L 3.9932 8.1961 119.1976 57.6954 41.7398 179.1180 13 D 4.3436 8.4356 119.3081 57.1963 40.7519 178.4266 14 L 3.9124 7.9283 120.5844 58.2367 42.0070 178.6069 15 A 4.2457 8.0673 122.0102 54.7712 18.1652 179.4381 16 D 4.2840 7.9853 116.5993 57.3960 40.9437 178.8283 17 A 3.9761 7.8872 120.8866 55.1691 18.3320 179.4811 18 I 3.6580 8.1590 118.7403 64.8270 37.2646 178.6531 19 L 4.0216 8.2623 119.9309 57.4820 41.3609 179.3340 20 L 3.9100 8.1126 120.4326 58.1768 41.9968 178.8212 21 S 4.0366 8.0453 112.9991 61.3256 62.3089 175.8075 22 K 3.7234 8.3404 122.3341 59.6650 31.8591 178.5329 23 A 3.9394 8.0049 120.6966 55.1096 18.1145 179.6210 24 K 3.8845 8.2175 116.3314 59.2528 32.2243 178.7188 25 K 4.2334 8.1838 115.8723 55.2334 32.7646 175.8579 26 D 4.3057 7.8117 118.0043 54.9383 40.2442 173.3860 27 L 4.6385 7.6880 116.2422 53.9673 43.1599 177.7154 28 S 4.5384 8.9488 117.1187 57.1725 66.1393 175.6079 29 F 4.2175 8.3334 121.3840 60.5184 38.6160 177.7031 30 A 4.1179 8.1667 120.3572 55.3209 18.0241 179.4017 31 E 4.0096 8.1141 114.6870 59.5057 29.8164 178.9795 32 I 3.8273 7.7591 119.8988 64.1473 37.5541 177.8402 33 A 4.2813 8.2990 121.5629 53.4026 18.2888 177.2601 34 D 4.4376 7.8509 117.4590 56.3616 41.4207 176.6902 35 G 4.0388 9.1596 114.5584 45.5349 0.0000 173.5667 36 T 4.1475 7.6850 112.6530 61.7211 67.9728 175.7736 37 G 3.9861 8.3811 107.8781 45.2182 0.0000 172.8564 38 L 4.6279 7.4285 118.7254 52.3357 43.9722 176.7600 39 A 4.1506 8.4104 124.1109 52.2750 20.2332 178.3072 40 E 3.8984 8.8988 122.6499 59.5107 29.6631 179.4668 41 A 3.9368 7.9811 120.2324 54.9181 18.5031 179.2153 42 F 3.8938 8.1832 118.6807 61.5241 39.6754 177.3720 43 V 3.6083 8.2034 118.0561 66.2276 31.2895 178.1690 44 T 3.7551 8.1029 115.3324 66.5150 68.2681 176.4615 45 A 3.8072 7.9958 122.6068 55.0221 18.3356 179.4937 46 A 4.1508 7.6252 120.4153 54.8389 18.1486 179.6486 47 L 3.9806 7.8578 117.3998 57.7675 41.4521 178.8579 48 L 4.6243 7.4679 115.9867 54.3459 41.7095 177.4212 49 G 3.9002 8.0531 106.9886 45.6451 0.0000 174.3895 50 Q 4.4944 8.1968 116.2273 55.4378 29.9520 174.9968 51 Q 4.3878 7.3836 115.9619 54.3543 33.0009 172.6462 52 A 4.8761 8.2603 120.9235 50.5248 20.6680 176.8167 53 L 4.4927 8.7852 123.6088 53.5130 43.2299 175.2969 54 P 4.6359 0.0000 0.0000 62.6664 32.4250 177.1658 55 A 3.9843 8.9138 123.5386 55.7967 18.1587 179.9669 56 D 4.3025 8.1212 116.4201 57.4777 40.9686 178.8324 57 A 3.9876 7.9840 120.5508 54.9929 18.4606 179.1904 58 A 3.9729 8.3393 119.6823 55.5528 18.4408 180.1374 59 R 3.8612 8.3860 116.8299 59.1261 30.1160 179.0169 60 L 3.9439 8.2204 120.4006 58.4899 42.1895 179.6072 61 V 3.8046 8.4653 112.7721 64.1712 31.4192 178.7932 62 G 3.6547 8.4048 105.6256 47.5834 0.0000 175.6671 63 A 3.9434 8.1821 122.9386 55.0435 18.2916 179.5768 64 K 3.8387 7.6711 115.5344 59.2753 32.2685 178.5386 65 L 4.4748 7.6556 115.0944 53.1874 42.7740 175.9933 66 D 4.3791 7.6943 117.5077 55.2589 38.7623 173.8103 67 L 4.4345 8.1407 118.0131 53.6975 43.3894 177.8583 68 D 4.7083 8.2396 122.0095 52.8539 41.9962 177.2562 69 E 4.0123 8.5442 118.1476 59.5475 29.2954 179.2526 70 D 4.3770 8.0339 118.6180 57.3822 41.0591 178.7943 71 S 4.1246 8.7174 116.0182 61.6791 62.6183 176.7873 72 I 3.7351 7.5047 121.3970 64.2237 37.1088 177.9780 73 L 4.2573 7.9778 121.2373 58.1880 41.9540 178.9530 74 L 4.0213 8.2826 119.3037 57.8329 41.4590 179.4666 75 L 4.1120 7.9614 118.2078 57.1325 41.2995 178.6807 76 Q 4.7358 7.5916 117.6553 55.6879 29.4027 176.0247 77 M 4.4824 7.2410 120.2701 54.9649 33.1356 176.4426 78 I 3.9902 8.8932 124.6432 60.8278 38.0667 174.2394 79 P 4.6532 0.0000 0.0000 62.2027 32.8042 176.2375 80 L 4.2869 8.3092 123.3369 54.2547 41.6949 176.5346 81 R 4.1421 8.3400 125.4973 55.7102 30.8175 175.2444 82 G 3.0913 7.9793 110.1496 44.9864 0.0000 172.8995 83 C 4.3184 8.0104 122.3725 58.3974 30.7253 174.3487 84 I 3.9935 7.5226 122.2050 60.5437 37.4706 174.7055 85 D 4.5172 8.9122 125.8014 57.1402 41.2539 176.9774 86 D 4.6395 7.4113 115.9618 53.3680 41.7799 174.1223 87 R 4.2686 8.3034 126.2400 56.1368 29.4823 177.0724 88 I 4.0863 7.1608 116.5945 58.2199 39.4328 173.6903 89 P 4.4026 0.0000 0.0000 62.9663 31.7537 176.5666 90 T 4.1485 8.3488 111.7212 63.3090 69.8305 175.2193 91 D 4.5222 7.9503 122.5220 53.0849 42.4768 174.4000 92 P 4.3165 0.0000 0.0000 66.3201 31.2029 178.7400 93 T 3.9730 7.9958 112.5846 67.0868 68.7172 176.2276 94 M 4.5397 8.2858 120.5344 58.2946 32.0401 178.0424 95 Y 4.0863 8.9397 120.4054 60.8514 38.9403 178.2991 96 R 3.9162 7.9984 118.4189 59.5001 29.5729 179.0234 97 F 4.0981 7.9341 117.1082 60.3255 38.8836 177.1442 98 Y 3.9590 7.9064 118.8423 60.6633 38.6902 177.4122 99 E 3.6685 8.0908 120.7197 59.4247 29.6355 178.5805 100 M 4.1159 7.9963 116.9218 58.4314 31.0498 178.6814 101 L 3.9233 7.4393 118.8360 57.7567 41.5947 179.5253 102 Q 3.8196 7.4757 116.5936 58.2206 28.5535 178.5993 103 V 3.6878 7.4563 118.4616 65.1254 32.2753 176.8537 104 Y 4.7232 8.1553 114.2027 57.5317 38.4720 177.7382 105 G 3.7277 8.1076 108.8288 48.2800 0.0000 176.0142 106 T 4.0434 7.8395 111.7363 64.4632 68.8917 176.8869 107 T 3.9328 7.9095 118.3835 66.3197 68.5338 176.3672 108 L 3.9853 8.4749 121.3786 57.7120 41.6796 179.4760 109 K 3.7950 8.0079 119.0274 59.4527 32.1856 178.5146 110 A 4.0191 8.1186 120.9912 55.4104 18.2594 179.6730 111 L 4.0357 8.3040 117.7391 57.5778 41.6971 179.7552 112 V 3.8311 8.1819 118.7765 66.5626 31.2758 177.9118 113 H 4.9763 8.2332 117.2515 58.2552 28.2868 177.4562 114 E 3.9536 8.0848 120.3404 59.3508 29.6306 178.7027 115 K 3.9737 8.2438 117.1588 57.8888 32.2446 178.1010 116 F 4.3017 8.2558 115.7388 60.9643 41.4893 173.8678 117 G 3.8351 7.5380 102.8452 43.8840 0.0000 171.7334 118 D 4.7533 8.8585 119.3440 53.0892 42.3885 176.7654 119 G 3.9030 7.7725 113.5894 46.0919 0.0000 171.3305 120 I 4.8143 7.9277 115.0603 59.3953 41.8977 174.5926 121 I 4.7677 8.1978 123.2635 59.7082 38.2636 175.5071 122 A 4.2026 8.9033 130.4106 51.4954 18.7827 176.9505 123 A 4.0609 8.6100 124.5394 52.2591 18.9324 176.9686 124 I 4.2519 7.6238 116.0338 63.6756 39.4226 176.7116 125 N 4.7723 7.8394 123.7230 52.4410 37.9653 172.2399 126 F 5.3780 8.1248 123.5889 56.5179 43.0480 172.7325 127 K 4.7528 7.9554 123.6314 54.9722 35.9375 174.7597 128 L 5.0857 8.6130 123.6370 54.0363 42.8627 175.3075 129 D 4.8493 8.6327 120.2131 51.7535 43.2290 174.0735 130 V 4.9019 8.4612 120.5537 61.1399 34.0698 174.6642 131 K 4.7083 8.9308 126.5130 54.3640 35.9309 175.4556 132 K 4.7279 8.7340 125.9017 56.3293 33.3975 176.3616 133 V 4.4667 8.7303 126.2604 61.2799 35.0447 173.5185 134 A 4.4889 8.7493 130.1708 52.0089 19.2152 176.5225 135 D 4.4331 9.4966 122.3837 53.2740 42.0581 175.4025 136 P 4.2295 0.0000 0.0000 65.9248 31.4130 176.7383 137 E 4.3601 8.3762 114.8666 55.9801 29.4436 176.6915 138 G 3.8843 7.6423 105.3798 47.1200 0.0000 175.1201 139 G 3.8637 8.5375 109.0866 44.6727 0.0000 171.5544 140 E 5.0008 8.3572 116.8992 54.6379 32.0252 176.0885 141 R 4.6929 9.2681 121.8594 54.4121 33.1825 174.9754 142 A 4.8934 8.6038 125.2833 50.6904 20.3429 176.4289 143 V 4.1753 8.5425 123.6527 62.0992 33.1124 174.7068 144 I 5.0069 8.4389 128.6535 59.8176 39.6736 175.0203 145 T 4.5897 8.6906 123.4492 61.6686 71.2845 173.0253 146 L 4.6046 8.5693 126.3618 53.0596 43.6623 175.3171 147 D 4.7712 8.0661 124.1692 52.3160 43.3826 174.9511 148 G 4.5527 8.4152 111.8811 44.1921 0.0000 171.5634 149 K 4.3469 8.7341 123.3309 56.2363 33.6275 175.1356 150 Y 4.8251 8.5579 128.0232 56.9096 40.0126 174.3078 151 L 4.4169 8.5178 127.4560 51.8898 43.9812 174.3892 152 P 4.6400 0.0000 0.0000 62.9479 32.3919 175.8345 153 T 4.5978 9.0529 118.7135 62.0137 70.2855 174.0336 154 K 4.6628 8.5544 125.2888 53.3922 35.4903 174.3765 155 P 4.3605 0.0000 0.0000 63.0643 31.9026 176.6025 156 F 4.5578 7.9334 115.0279 57.1148 37.9870 174.6289 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 8.30 4.38 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 2 I 8.38 3.62 1.88 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 1.42 1.05 0.91 0.00 0.00 3 Q 8.36 4.89 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.59 0.00 0.00 0.00 0.00 0.00 2.49 2.26 0.00 4 S 8.53 5.11 0.00 3.80 3.77 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 5 Q 9.11 4.74 0.00 1.98 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.74 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 6 I 8.38 4.39 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.66 0.90 0.00 0.00 7 N 7.85 4.83 0.00 2.76 2.68 0.00 0.00 6.94 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 8 R 8.62 3.94 0.00 2.05 2.32 0.00 3.13 0.00 0.00 3.32 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 9 N 8.72 4.33 0.00 2.85 2.90 0.00 0.00 6.84 7.62 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 10 I 7.45 3.69 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.82 0.91 0.00 0.00 11 R 7.88 4.00 0.00 1.80 1.95 0.00 3.28 0.00 0.00 3.52 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.64 0.00 12 L 8.20 3.99 0.00 1.67 1.70 0.91 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 13 D 8.44 4.34 0.00 2.90 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 14 L 7.93 3.91 0.00 1.77 1.84 0.92 1.23 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 15 A 8.07 4.25 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 16 D 7.99 4.28 0.00 2.86 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 17 A 7.89 3.98 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 18 I 8.16 3.66 2.08 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 1.54 0.78 0.96 0.00 0.00 19 L 8.26 4.02 0.00 1.84 1.75 0.98 0.57 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 20 L 8.11 3.91 0.00 1.75 1.83 0.92 0.69 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 21 S 8.05 4.04 0.00 3.93 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 22 K 8.34 3.72 0.00 1.81 1.88 0.00 1.16 0.00 0.00 1.21 0.00 0.00 2.25 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.28 1.24 7.81 23 A 8.00 3.94 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 24 K 8.22 3.88 0.00 1.86 1.89 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.62 7.81 25 K 8.18 4.23 0.00 1.71 1.81 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.52 7.81 26 D 7.81 4.31 0.00 2.73 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 27 L 7.69 4.64 0.00 1.69 1.44 0.92 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.95 4.54 0.00 3.99 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 F 8.33 4.22 0.00 3.30 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 30 A 8.17 4.12 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 31 E 8.11 4.01 0.00 2.15 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 0.00 2.47 2.33 0.00 32 I 7.76 3.83 1.95 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.61 0.97 0.00 0.00 33 A 8.30 4.28 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 34 D 7.85 4.44 0.00 2.73 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 G 9.16 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.68 4.15 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 1.39 0.00 0.00 37 G 8.38 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 38 L 7.43 4.63 0.00 1.72 1.72 1.07 0.67 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 39 A 8.41 4.15 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 40 E 8.90 3.90 0.00 2.09 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 2.43 2.63 0.00 41 A 7.98 3.94 1.35 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 0.00 0.00 0.00 42 F 8.18 3.89 0.00 3.19 3.25 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 43 V 8.20 3.61 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 1.05 0.00 0.00 1.17 0.00 0.00 44 T 8.10 3.76 4.04 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 0.00 0.00 0.32 0.00 0.00 45 A 8.00 3.81 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 46 A 7.63 4.15 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 L 7.86 3.98 0.00 1.93 1.83 1.14 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 48 L 7.47 4.62 0.00 1.65 1.62 0.74 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 49 G 8.05 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 50 Q 8.20 4.49 0.00 1.86 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.43 6.63 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 51 Q 7.38 4.39 0.00 1.46 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.90 0.00 0.00 0.00 0.00 0.00 2.06 1.65 0.00 52 A 8.26 4.88 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 53 L 8.79 4.49 0.00 1.64 1.65 0.94 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.64 0.00 2.10 2.00 0.00 3.74 0.00 0.00 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.15 0.00 55 A 8.91 3.98 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 56 D 8.12 4.30 0.00 2.71 2.74 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 57 A 7.98 3.99 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 58 A 8.34 3.97 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 59 R 8.39 3.86 0.00 2.01 2.00 0.00 3.14 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.76 0.00 60 L 8.22 3.94 0.00 2.04 1.73 0.93 1.14 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 61 V 8.47 3.80 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 0.79 0.00 0.00 1.00 0.00 0.00 62 G 8.40 3.65 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 0.00 0.00 0.00 63 A 8.18 3.94 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 64 K 7.67 3.84 0.00 2.02 1.91 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.08 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.51 7.81 65 L 7.66 4.47 0.00 1.71 1.67 0.93 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 66 D 7.69 4.38 0.00 2.84 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 67 L 8.14 4.43 0.00 1.59 1.59 0.93 0.98 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 68 D 8.24 4.71 0.00 2.95 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 69 E 8.54 4.01 0.00 2.00 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 2.40 2.34 0.00 70 D 8.03 4.38 0.00 2.72 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 71 S 8.72 4.12 0.00 4.06 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 72 I 7.50 3.74 1.88 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 1.59 0.47 0.92 0.00 0.00 73 L 7.98 4.26 0.00 1.90 1.85 0.92 0.72 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 74 L 8.28 4.02 0.00 1.86 1.70 0.92 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.96 4.11 0.00 1.89 1.72 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 76 Q 7.59 4.74 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.86 0.00 0.00 0.00 0.00 0.00 2.55 2.40 0.00 77 M 7.24 4.48 0.00 1.92 2.09 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.52 0.00 78 I 8.89 3.99 1.87 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 1.30 0.70 0.91 0.00 0.00 79 P 0.00 4.65 0.00 2.10 2.03 0.00 3.74 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.98 0.00 80 L 8.31 4.29 0.00 1.81 1.64 0.90 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 81 R 8.34 4.14 0.00 1.81 1.79 0.00 3.24 0.00 0.00 3.18 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 82 G 7.98 3.09 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 83 C 8.01 4.32 0.00 3.05 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 84 I 7.52 3.99 1.85 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.52 0.92 0.00 0.00 85 D 8.91 4.52 0.00 2.62 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 86 D 7.41 4.64 0.00 2.60 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 R 8.30 4.27 0.00 1.98 2.05 0.00 3.19 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 88 I 7.16 4.09 1.72 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.75 0.35 0.00 0.00 89 P 0.00 4.40 0.00 2.19 2.05 0.00 3.39 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.09 0.00 90 T 8.35 4.15 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 1.19 0.00 0.00 91 D 7.95 4.52 0.00 2.85 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 92 P 0.00 4.32 0.00 2.24 2.14 0.00 3.69 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.20 0.00 93 T 8.00 3.97 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 94 M 8.29 4.54 0.00 2.11 2.21 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.59 0.00 95 Y 8.94 4.09 0.00 3.20 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 96 R 8.00 3.92 0.00 1.49 1.69 0.00 3.34 0.00 0.00 3.28 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.78 0.00 97 F 7.93 4.10 0.00 3.32 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 98 Y 7.91 3.96 0.00 2.94 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 99 E 8.09 3.67 0.00 1.81 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 2.27 2.32 0.00 100 M 8.00 4.12 0.00 2.40 2.37 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 2.80 2.71 0.00 101 L 7.44 3.92 0.00 1.53 1.58 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 102 Q 7.48 3.82 0.00 1.95 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.88 0.00 0.00 0.00 0.00 0.00 1.70 2.27 0.00 103 V 7.46 3.69 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 0.11 0.00 0.00 0.80 0.00 0.00 104 Y 8.16 4.72 0.00 3.24 2.88 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 0.00 105 G 8.11 3.73 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 0.00 0.00 0.00 106 T 7.84 4.04 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 1.21 0.00 0.00 107 T 7.91 3.93 4.61 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 1.32 0.00 0.00 108 L 8.47 3.99 0.00 1.84 1.74 0.96 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.01 3.79 0.00 1.84 1.98 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.42 1.45 7.81 110 A 8.12 4.02 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 0.00 111 L 8.30 4.04 0.00 1.79 1.76 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 112 V 8.18 3.83 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 0.93 0.00 0.00 113 H 8.23 4.98 0.00 3.25 3.36 0.00 5.68 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 E 8.08 3.95 0.00 2.06 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 0.00 2.29 2.33 0.00 115 K 8.24 3.97 0.00 1.56 1.22 0.00 1.70 0.00 0.00 1.55 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.31 1.55 7.81 116 F 8.26 4.30 0.00 2.40 1.45 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 0.00 117 G 7.54 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 0.00 0.00 0.00 118 D 8.86 4.75 0.00 2.75 2.76 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 0.00 119 G 7.77 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 0.00 120 I 7.93 4.81 1.88 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.26 0.93 0.00 0.00 121 I 8.20 4.77 1.85 0.00 0.00 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 1.13 0.68 0.96 0.00 0.00 122 A 8.90 4.20 1.27 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 0.00 0.00 0.00 123 A 8.61 4.06 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 0.00 124 I 7.62 4.25 1.87 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.96 0.92 0.00 0.00 125 N 7.84 4.77 0.00 2.80 2.75 0.00 0.00 6.49 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 0.00 126 F 8.12 5.38 0.00 3.23 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 0.00 127 K 7.96 4.75 0.00 1.75 1.76 0.00 1.26 0.00 0.00 1.62 0.00 0.00 2.83 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.16 1.13 7.81 128 L 8.61 5.09 0.00 1.71 1.98 0.90 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 129 D 8.63 4.85 0.00 2.63 2.69 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 0.00 130 V 8.46 4.90 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 0.90 0.00 0.00 0.94 0.00 0.00 131 K 8.93 4.71 0.00 1.71 1.64 0.00 1.71 0.00 0.00 1.57 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.50 7.81 132 K 8.73 4.73 0.00 1.79 1.71 0.00 1.79 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.45 7.81 133 V 8.73 4.47 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 0.84 0.00 0.00 0.94 0.00 0.00 134 A 8.75 4.49 1.24 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 0.00 0.00 135 D 9.50 4.43 0.00 2.75 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 P 0.00 4.23 0.00 2.08 2.13 0.00 3.72 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 137 E 8.38 4.36 0.00 1.96 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 2.28 2.30 0.00 138 G 7.64 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 0.00 0.00 0.00 139 G 8.54 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 0.00 140 E 8.36 5.00 0.00 1.86 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 2.23 2.32 0.00 141 R 9.27 4.69 0.00 1.86 1.81 0.00 3.31 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.63 0.00 142 A 8.60 4.89 1.27 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 0.00 0.00 0.00 143 V 8.54 4.18 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 0.95 0.00 0.00 0.94 0.00 0.00 144 I 8.44 5.01 2.00 0.00 0.00 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 1.48 0.88 1.01 0.00 0.00 145 T 8.69 4.59 4.36 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 0.00 0.00 0.00 1.17 0.00 0.00 146 L 8.57 4.60 0.00 1.55 1.75 1.03 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 147 D 8.07 4.77 0.00 2.59 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 G 8.42 4.55 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 0.00 0.00 0.00 149 K 8.73 4.35 0.00 1.95 1.70 0.00 1.56 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.45 7.81 150 Y 8.56 4.83 0.00 2.56 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 L 8.52 4.42 0.00 1.42 1.39 0.87 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 152 P 0.00 4.64 0.00 2.04 1.99 0.00 3.42 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.89 0.00 153 T 9.05 4.60 4.29 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 1.27 0.00 0.00 154 K 8.55 4.66 0.00 1.75 1.73 0.00 1.79 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.44 7.81 155 P 0.00 4.36 0.00 2.03 1.94 0.00 3.65 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.08 0.00 156 F 7.93 4.56 0.00 3.07 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