NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4853 8.3049 120.3264 55.2302 33.9175 176.8218 2 D 4.8111 8.0636 115.3010 53.3158 41.5808 174.2671 3 K 4.7058 7.4137 117.8818 55.0218 36.4001 176.2193 4 L 4.6214 7.9815 116.4091 54.8921 41.1951 173.2191 5 Q 4.6949 7.9026 118.1308 57.9042 36.8953 176.4229 6 L 4.3101 7.5665 118.9509 53.2760 40.1497 174.7452 7 K 4.1665 8.1982 118.7081 58.6370 31.6979 174.9548 8 G 3.4991 10.0633 109.2858 45.0870 0.0000 172.1293 9 M 3.1847 8.5500 125.1147 56.7340 30.5763 175.5108 10 S 4.8660 7.5584 110.4949 57.0971 66.1893 171.7295 11 Y 4.7459 7.7233 119.6679 58.0721 45.4672 176.6358 12 S 4.6903 7.2847 117.2922 57.1777 63.5378 177.4645 13 M 4.3622 8.4498 113.8392 54.4859 30.8986 174.7672 14 C 4.1963 9.9064 123.9957 57.9173 38.5308 173.9848 15 T 4.2129 8.3001 118.0148 62.3644 68.5962 177.4518 16 G 4.2882 7.9103 109.3792 45.8092 0.0000 174.1257 17 K 5.0140 10.2835 129.7525 54.3426 36.0153 173.4424 18 F 4.9580 8.8198 118.6071 55.4611 42.9936 174.5481 19 K 4.5487 8.9372 124.0747 54.2477 34.2425 175.4347 20 V 3.8453 8.6283 128.1624 63.7987 31.2550 175.5365 21 V 4.1805 9.5124 128.9228 64.1327 32.6466 175.9568 22 K 4.6606 7.6466 120.3369 54.3819 35.5551 175.1451 23 E 4.0988 8.9753 127.7083 56.2732 30.4964 176.3329 24 I 3.6716 8.4346 124.0895 62.4122 37.2229 175.2765 25 A 4.5585 9.7647 128.0470 50.0289 22.2732 174.5781 26 E 4.8043 8.2758 116.5500 54.7537 31.8091 177.1466 27 T 4.0879 8.3606 112.6347 62.0526 69.0683 175.1674 28 Q 3.7421 7.8503 118.7644 57.1179 26.7966 173.3415 29 H 5.0033 8.3205 112.2683 55.3862 30.1572 174.0576 30 G 4.2035 8.6432 109.1008 45.5527 0.0000 174.1156 31 T 4.8221 7.7565 109.9579 60.8411 71.9504 173.3427 32 I 4.8384 8.3574 113.0690 59.9614 40.8388 173.9131 33 V 4.6484 9.4289 123.0573 61.0163 34.6723 173.9060 34 I 4.5640 8.4383 128.0599 59.2840 40.0882 173.8527 35 R 5.0182 8.3015 130.7405 55.3588 31.4663 175.5417 36 V 4.8513 8.8573 118.2862 60.4567 37.1354 172.9847 37 Q 4.8469 9.3048 124.6645 54.3282 30.9159 174.1298 38 Y 3.5955 8.6886 128.0427 58.0231 39.6048 174.5322 39 E 4.2584 9.5760 127.0807 55.1991 32.3363 175.0168 40 G 3.9627 8.7429 105.7851 44.2063 0.0000 172.6928 41 D 4.6644 8.1292 121.4425 52.5493 43.8982 174.6023 42 G 4.4332 9.0065 115.7767 45.3438 0.0000 174.6016 43 S 3.4417 8.3853 113.7263 57.9615 61.7602 169.4929 44 P 5.0593 0.0000 0.0000 62.5861 30.3379 174.1577 45 C 4.9148 7.9205 118.1761 53.5249 44.5075 173.2750 46 K 4.9309 8.4960 117.8175 56.0512 34.0490 175.9516 47 I 4.6192 8.9273 123.7867 58.9561 39.1988 174.0241 48 P 4.6671 0.0000 0.0000 63.0133 32.3948 175.0798 49 F 5.3134 8.3584 123.1787 57.7544 43.0010 173.3565 50 E 4.6488 8.1624 123.9798 55.4526 32.5342 174.8151 51 I 4.7672 8.0811 120.3068 61.0387 38.1186 172.6777 52 M 4.7389 8.4557 125.9757 55.0627 35.0988 177.7046 53 D 4.6459 8.0305 115.4523 55.0906 45.0770 177.7140 54 L 3.6139 8.4413 125.0751 57.1643 41.4929 176.1971 55 E 4.9465 9.4687 109.9725 56.4886 29.5424 176.8904 56 K 4.3805 8.1022 119.3296 55.8508 32.8776 177.7967 57 R 4.4696 7.6330 117.2861 57.0406 29.8301 175.2871 58 H 5.2019 7.6247 116.2442 55.7186 30.3678 174.5262 59 V 4.2841 8.2494 104.3785 61.6873 36.0765 175.2338 60 L 5.3686 6.8010 120.3645 54.9254 42.8653 173.3504 61 G 4.1123 8.8873 111.5893 44.3492 0.0000 169.3712 62 R 4.8438 9.3396 120.3041 54.2071 34.4368 173.3277 63 L 4.7500 8.1936 123.0633 53.3228 43.4161 176.0435 64 I 3.9896 9.0772 128.3942 62.3863 38.1195 176.8514 65 T 4.4906 7.0620 118.3461 64.1904 68.9748 174.4114 66 V 2.9676 7.9187 119.0812 64.2124 32.6428 176.1797 67 N 4.7962 8.6418 118.8185 52.4029 35.5419 171.8704 68 P 4.6144 0.0000 0.0000 63.8333 33.2146 175.6666 69 I 5.0225 8.0471 118.1553 60.3386 41.1281 175.1927 70 V 4.3688 8.6327 125.3034 62.0946 33.3680 176.3493 71 T 4.2965 8.5679 119.6134 63.8243 70.4230 175.2290 72 E 4.5374 7.6241 118.3879 55.3243 31.1339 177.0691 73 K 4.0356 8.5781 118.2179 56.9010 31.2421 175.3156 74 D 4.6813 7.6914 113.8728 54.1422 43.2970 174.9130 75 S 4.2624 8.1545 112.7786 58.0853 62.8824 171.4814 76 P 4.3924 0.0000 0.0000 63.5239 31.8899 175.8360 77 V 4.3535 9.4345 126.4072 61.3443 33.4569 174.2824 78 N 5.2731 8.7684 125.1224 52.3834 40.2467 174.3775 79 I 4.3515 8.8238 124.4842 59.4248 40.0052 174.3908 80 E 5.2614 8.9063 128.7914 54.8906 30.6001 174.8685 81 A 4.8903 8.3306 127.8033 50.2482 23.4929 174.2915 82 E 4.8466 9.4585 122.9797 53.8215 30.4547 173.4608 83 P 4.3693 0.0000 0.0000 62.2270 31.8211 174.0245 84 P 4.2096 0.0000 0.0000 62.6761 30.7731 176.3287 85 F 3.5429 7.8334 122.5423 57.2582 42.0597 174.6862 86 G 4.1617 5.7252 113.2995 43.5622 0.0000 171.5063 87 D 4.0815 8.5030 117.8111 55.3364 41.3082 177.6731 88 S 3.8107 8.3869 120.8023 56.5974 64.4262 172.4956 89 Y 4.8452 7.8983 121.7855 56.8511 37.9425 175.0911 90 I 3.9751 9.8199 127.2310 61.1286 38.7303 175.2956 91 I 4.7557 7.9905 127.2085 59.6060 38.8471 174.7780 92 I 4.3197 8.0700 126.5447 60.5969 40.7785 177.1973 93 G 3.8655 7.7928 113.1737 44.5967 0.0000 172.8864 94 V 4.4779 7.4243 110.4252 60.1296 34.6852 177.8808 95 E 3.6580 8.0648 123.0132 58.7955 30.1588 176.0177 96 P 4.4206 0.0000 0.0000 62.2208 29.3499 176.2582 97 G 3.9286 8.2704 108.5480 45.3551 0.0000 171.0376 98 Q 4.2411 7.5468 120.7629 56.9844 30.0873 175.9934 99 L 4.7149 9.6965 123.0124 53.7641 44.6435 175.5383 100 K 5.1489 8.1340 117.4292 55.6108 35.8302 176.0954 101 L 4.7656 9.0795 124.1562 53.3073 46.0719 174.6915 102 N 4.6611 8.9990 122.9815 52.5720 40.2798 173.5588 103 W 4.5381 8.7823 135.0000 57.0025 34.8188 171.9276 104 F 3.1658 7.8709 124.1953 54.6718 39.0676 179.1443 105 K 3.8997 7.3588 121.7216 55.6328 32.0457 174.5616 106 K 3.8104 8.4993 118.4168 57.4089 31.6957 178.5882 107 G 3.9193 8.4061 105.6742 46.7581 0.0000 173.6102 108 S 4.3614 7.7685 114.0863 58.2802 63.5958 173.4895 109 S 4.2658 7.6671 116.5253 57.9262 66.3776 173.7635 110 L 3.4276 8.3163 124.5930 55.3990 39.2735 173.5978 111 E 4.2058 7.9545 120.7202 56.6783 27.0299 175.2027 112 H 4.5206 8.0544 119.6214 55.3033 29.0388 173.5549 113 H 4.7775 7.9938 120.7247 54.8176 32.7867 173.1295 114 H 4.5962 8.4805 119.7202 55.8314 32.5500 172.7327 115 H 4.7588 8.8791 126.2552 55.9730 31.3716 172.7261 116 H 4.8883 8.3469 121.5431 57.1819 37.1501 172.9528 117 H 4.3925 7.9985 121.8306 56.7796 29.5061 172.8629 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 4.49 0.00 2.03 2.20 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.57 0.00 2 D 8.06 4.81 0.00 2.70 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 3 K 7.41 4.71 0.00 1.71 1.69 0.00 1.81 0.00 0.00 1.77 0.00 0.00 3.05 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.34 7.81 4 L 7.98 4.62 0.00 1.69 1.63 0.92 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 5 Q 7.90 4.69 0.00 2.02 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.56 7.36 0.00 0.00 0.00 0.00 0.00 2.27 2.38 0.00 6 L 7.57 4.31 0.00 1.63 1.63 0.93 0.87 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 7 K 8.20 4.17 0.00 1.74 1.78 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.37 7.81 8 G 10.06 3.50 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 M 8.55 3.18 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.46 0.00 10 S 7.56 4.87 0.00 3.98 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 11 Y 7.72 4.75 0.00 2.99 2.75 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 0.00 0.00 0.00 12 S 7.28 4.69 0.00 4.20 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 13 M 8.45 4.36 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 14 C 9.91 4.20 0.00 2.69 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 0.00 0.00 0.00 0.00 15 T 8.30 4.21 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 1.29 0.00 0.00 16 G 7.91 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 0.00 0.00 0.00 0.00 17 K 10.28 5.01 0.00 1.67 1.68 0.00 1.63 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.46 1.55 7.81 18 F 8.82 4.96 0.00 2.93 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 19 K 8.94 4.55 0.00 1.80 1.67 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.36 7.81 20 V 8.63 3.85 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 0.97 0.00 0.00 21 V 9.51 4.18 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 1.05 0.00 0.00 22 K 7.65 4.66 0.00 1.88 1.57 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.87 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.41 1.51 7.81 23 E 8.98 4.10 0.00 2.09 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 2.51 2.47 0.00 24 I 8.43 3.67 1.80 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.84 -0.73 0.00 0.00 25 A 9.76 4.56 1.16 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 0.00 0.00 26 E 8.28 4.80 0.00 2.13 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 27 T 8.36 4.09 4.24 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 1.25 0.00 0.00 28 Q 7.85 3.74 0.00 2.21 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.93 7.07 0.00 0.00 0.00 0.00 0.00 2.44 2.29 0.00 29 H 8.32 5.00 0.00 3.05 3.24 0.00 5.64 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 30 G 8.64 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 T 7.76 4.82 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 1.24 0.00 0.00 32 I 8.36 4.84 1.40 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.17 -0.24 0.00 0.00 33 V 9.43 4.65 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.86 0.00 0.00 34 I 8.44 4.56 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 1.08 1.33 1.04 0.00 0.00 35 R 8.30 5.02 0.00 2.14 1.84 0.00 3.26 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 36 V 8.86 4.85 2.28 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 0.72 0.00 0.00 1.30 0.00 0.00 37 Q 9.30 4.85 0.00 2.10 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.97 0.00 0.00 0.00 0.00 0.00 2.21 2.42 0.00 38 Y 8.69 3.60 0.00 2.86 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 39 E 9.58 4.26 0.00 1.74 1.70 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 2.29 2.33 0.00 40 G 8.74 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 41 D 8.13 4.66 0.00 2.54 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 42 G 9.01 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 0.00 0.00 0.00 0.00 43 S 8.39 3.44 0.00 4.01 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 44 P 0.00 5.06 0.00 1.15 1.44 0.00 3.71 0.00 0.00 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.98 0.00 45 C 7.92 4.91 0.00 2.94 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 K 8.50 4.93 0.00 1.97 1.76 0.00 1.67 0.00 0.00 1.99 0.00 0.00 2.85 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.89 1.51 7.81 47 I 8.93 4.62 1.86 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.15 0.58 0.00 0.00 48 P 0.00 4.67 0.00 2.04 1.89 0.00 2.93 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.10 0.00 49 F 8.36 5.31 0.00 2.96 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 E 8.16 4.65 0.00 2.05 1.68 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 2.29 2.33 0.00 51 I 8.08 4.77 2.06 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.42 1.10 0.00 0.00 52 M 8.46 4.74 0.00 1.96 2.03 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.50 0.00 53 D 8.03 4.65 0.00 2.85 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 54 L 8.44 3.61 0.00 1.91 1.27 0.93 0.90 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 55 E 9.47 4.95 0.00 2.00 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 2.28 2.32 0.00 56 K 8.10 4.38 0.00 2.04 1.91 0.00 1.91 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.53 1.44 7.81 57 R 7.63 4.47 0.00 1.78 2.04 0.00 3.19 0.00 0.00 3.08 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.57 0.00 58 H 7.62 5.20 0.00 3.07 2.99 0.00 5.76 0.00 0.00 0.00 0.00 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 V 8.25 4.28 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 0.82 0.00 0.00 0.84 0.00 0.00 60 L 6.80 5.37 0.00 1.60 1.50 0.90 1.22 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 61 G 8.89 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 R 9.34 4.84 0.00 1.73 1.69 0.00 3.14 0.00 0.00 3.05 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.65 0.00 63 L 8.19 4.75 0.00 1.41 1.28 0.51 -0.68 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 64 I 9.08 3.99 1.85 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.50 0.87 0.00 0.00 65 T 7.06 4.49 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 1.18 0.00 0.00 66 V 7.92 2.97 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 0.76 0.00 0.00 0.91 0.00 0.00 67 N 8.64 4.80 0.00 2.92 3.09 0.00 0.00 6.41 7.73 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 68 P 0.00 4.61 0.00 2.15 2.26 0.00 3.85 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.00 0.00 69 I 8.05 5.02 1.86 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.64 0.77 0.00 0.00 70 V 8.63 4.37 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 1.02 0.00 0.00 71 T 8.57 4.30 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 1.20 0.00 0.00 72 E 7.62 4.54 0.00 1.95 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 2.27 2.25 0.00 73 K 8.58 4.04 0.00 1.79 1.77 0.00 1.55 0.00 0.00 1.40 0.00 0.00 2.46 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.30 1.13 7.81 74 D 7.69 4.68 0.00 2.52 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 75 S 8.15 4.26 0.00 3.93 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 76 P 0.00 4.39 0.00 2.00 2.06 0.00 3.72 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 77 V 9.43 4.35 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 1.07 0.00 0.00 78 N 8.77 5.27 0.00 2.64 2.71 0.00 0.00 6.92 7.46 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 79 I 8.82 4.35 2.16 0.00 0.00 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 1.18 0.93 0.64 0.00 0.00 80 E 8.91 5.26 0.00 1.98 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 2.30 2.09 0.00 81 A 8.33 4.89 1.01 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 0.00 0.00 82 E 9.46 4.85 0.00 2.00 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 2.22 2.29 0.00 83 P 0.00 4.37 0.00 2.01 2.22 0.00 4.23 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.39 0.00 84 P 0.00 4.21 0.00 1.96 2.09 0.00 3.69 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.62 0.00 85 F 7.83 3.54 0.00 2.87 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 86 G 5.73 4.16 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 0.00 0.00 0.00 87 D 8.50 4.08 0.00 2.59 2.47 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 88 S 8.39 3.81 0.00 3.96 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 Y 7.90 4.85 0.00 2.86 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 90 I 9.82 3.98 1.95 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 1.48 0.79 0.49 0.00 0.00 91 I 7.99 4.76 1.89 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 1.17 1.16 0.88 0.00 0.00 92 I 8.07 4.32 1.61 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.32 0.41 0.00 0.00 93 G 7.79 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 94 V 7.42 4.48 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 0.76 0.00 0.00 1.04 0.00 0.00 95 E 8.06 3.66 0.00 1.99 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 2.30 2.35 0.00 96 P 0.00 4.42 0.00 2.21 2.14 0.00 3.70 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.01 0.00 97 G 8.27 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 Q 7.55 4.24 0.00 2.17 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.64 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 99 L 9.70 4.71 0.00 1.63 1.57 1.04 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 100 K 8.13 5.15 0.00 1.58 1.68 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.92 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.37 1.43 7.81 101 L 9.08 4.77 0.00 1.58 1.57 0.92 0.33 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 0.00 102 N 9.00 4.66 0.00 2.85 2.73 0.00 0.00 6.78 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 0.00 103 W 8.78 4.54 0.00 3.48 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 0.00 104 F 7.87 3.17 0.00 3.40 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 0.00 105 K 7.36 3.90 0.00 1.76 1.54 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.53 1.22 7.81 106 K 8.50 3.81 0.00 1.75 1.53 0.00 1.80 0.00 0.00 1.77 0.00 0.00 3.07 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.45 1.55 7.81 107 G 8.41 3.92 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 0.00 0.00 0.00 108 S 7.77 4.36 0.00 3.81 3.75 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 0.00 0.00 0.00 109 S 7.67 4.27 0.00 3.59 3.43 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 0.00 110 L 8.32 3.43 0.00 1.59 1.55 0.84 0.94 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 0.00 111 E 7.95 4.21 0.00 1.97 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 2.29 2.26 0.00 112 H 8.05 4.52 0.00 3.20 3.13 0.00 5.76 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 H 7.99 4.78 0.00 3.17 3.15 0.00 5.79 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 H 8.48 4.60 0.00 3.11 3.13 0.00 5.72 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 H 8.88 4.76 0.00 3.17 3.25 0.00 6.02 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 H 8.35 4.89 0.00 3.12 3.21 0.00 5.82 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.00 4.39 0.00 3.10 3.19 0.00 6.01 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