NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3272 8.2644 123.5833 52.4686 20.0220 175.9638 2 T 4.5032 8.3461 114.2897 61.8963 70.0869 172.3978 3 K 5.3414 8.3647 121.3698 54.6178 37.0717 174.8022 4 A 5.4117 9.2679 124.7843 50.9422 23.5069 174.8159 5 V 4.9893 8.7525 116.8790 61.3919 35.4233 172.9639 6 C 4.8524 8.9540 121.9716 58.3461 35.3123 172.6005 7 V 4.5886 8.5102 126.5509 61.6253 33.0162 174.1966 8 L 4.7098 9.0402 129.2928 53.7978 43.1414 176.1730 9 K 4.8828 9.0814 122.2974 55.3706 37.1028 176.2354 10 G 3.9229 7.9437 107.8247 45.6585 0.0000 172.1295 11 D 4.5333 8.8049 118.0356 55.8243 41.8844 177.2127 12 G 4.2248 7.6206 109.5993 44.3047 0.0000 171.9166 13 P 4.4101 0.0000 0.0000 63.7950 32.1093 176.4141 14 V 4.3703 7.8241 120.4862 62.3649 31.9866 174.9059 15 Q 5.1615 7.3393 123.7953 56.3212 32.0540 173.4797 16 G 4.0314 7.6658 105.7772 46.5474 0.0000 171.3247 17 I 5.1515 7.8488 119.6002 59.4650 40.9811 175.0367 18 I 4.6258 8.9086 127.8808 59.4955 40.1181 174.5366 19 N 5.0020 8.4245 124.5008 51.6838 40.7983 174.1237 20 F 5.3905 9.0161 119.8878 55.8114 43.4751 173.7354 21 E 5.1349 9.6385 122.9406 54.8498 33.0870 173.7307 22 Q 4.8366 9.2542 128.7259 53.9935 29.8149 174.7254 23 K 4.1378 8.9335 126.2065 58.6637 32.6888 177.7622 24 E 4.7828 7.8286 116.7184 54.0193 33.1621 176.5994 25 S 4.2324 8.9388 117.5396 60.9554 63.0233 174.6766 26 N 4.8024 8.1787 116.5427 52.2460 37.2816 174.2538 27 G 4.1990 7.9163 107.5550 43.1526 0.0000 171.7067 28 P 4.6281 0.0000 0.0000 62.5936 32.5165 176.1890 29 V 4.5899 8.8838 122.2998 61.3232 33.5349 175.0351 30 K 4.8355 9.3271 128.6109 56.2190 33.7175 176.1538 31 V 4.8953 9.6038 125.1538 60.8787 34.2570 174.2431 32 W 6.1376 7.9763 123.9561 54.8487 32.1607 175.1883 33 G 4.1214 7.5535 106.9727 45.2904 0.0000 170.5112 34 S 5.1251 7.8331 113.0629 56.4153 65.8919 173.2182 35 I 5.0308 8.6676 126.9229 59.4158 40.4331 174.9976 36 K 4.6490 9.2368 126.7548 55.8510 35.6020 177.1028 37 G 3.9558 8.7559 107.0645 45.8841 0.0000 172.9964 38 L 4.5907 7.5960 119.8239 52.3651 43.2647 176.5897 39 T 4.1669 8.3431 112.9459 61.2544 69.2886 173.6345 40 E 4.0180 8.6520 124.3833 57.3179 30.4093 175.2151 41 G 3.7823 8.3080 111.0183 44.0377 0.0000 172.1897 42 L 4.8112 8.2331 119.3861 54.6354 43.0187 176.5330 43 H 4.9772 9.3245 119.7552 53.7256 32.8912 173.1114 44 G 4.1538 9.1471 111.2099 47.2499 0.0000 172.2777 45 F 5.3870 8.9864 125.4110 57.0557 42.2528 172.8218 46 H 5.2540 8.7471 122.7964 54.0071 33.8392 172.8597 47 V 4.3995 8.5035 121.6527 62.4332 32.5210 175.2084 48 H 5.0322 9.5757 126.0851 54.6963 30.4940 176.1995 49 E 3.7025 8.9008 122.0550 58.9548 29.5077 177.0282 50 F 4.9552 8.1097 118.3604 55.0051 41.3854 176.9353 51 G 4.2810 8.3553 112.1689 44.5738 0.0000 174.2663 52 D 4.7950 7.9652 117.9150 52.7202 42.6445 174.5480 53 N 5.2923 8.7414 124.4025 52.3269 39.2626 176.5976 54 T 3.9554 8.7548 112.1052 63.8938 68.9371 174.3991 55 A 4.6769 7.8603 125.0703 51.3910 19.6477 177.4643 56 G 3.8491 8.0502 110.7388 47.0434 0.0000 175.2414 57 C 4.2174 8.5343 115.2029 62.8930 28.4356 176.0386 58 T 3.8663 8.0885 116.7595 66.7120 68.0605 175.6746 59 S 4.5249 7.9980 111.6923 58.8445 63.2137 174.4407 60 A 4.3831 7.6082 123.8336 52.0927 18.6582 179.3974 61 G 4.3557 7.6084 104.0957 43.9811 0.0000 170.7750 62 P 4.6763 0.0000 0.0000 62.0708 33.9435 175.0390 63 H 4.4894 8.3489 116.4715 55.6882 29.5349 175.4525 64 F 4.2169 9.1430 125.4977 58.4451 40.2929 175.0524 65 N 5.1127 7.9284 125.8642 51.5568 38.9588 172.8967 66 P 4.1319 0.0000 0.0000 65.2435 32.0815 177.8598 67 L 4.3149 7.6566 115.1091 53.7740 42.0335 176.3885 68 S 3.6018 7.5134 113.6938 59.6893 60.6412 171.7507 69 R 4.4694 8.2539 118.1796 54.5163 31.9907 176.7269 70 K 4.4017 8.9025 118.7309 56.0534 33.5392 176.6298 71 H 4.0070 9.0143 122.9066 56.8873 30.5202 174.9173 72 G 4.1175 7.3994 109.4915 45.9082 0.0000 172.1136 73 G 4.1637 9.2775 109.3032 43.2353 0.0000 173.2782 74 P 4.3724 0.0000 0.0000 65.3864 31.3106 178.2378 75 K 4.2123 7.8936 115.0283 57.6199 32.4820 176.8661 76 D 4.6378 7.6057 119.2811 53.5435 41.6560 176.3251 77 E 3.9110 8.6948 123.3338 59.0732 29.5464 176.7438 78 E 4.2306 7.9646 122.1522 55.4147 28.5098 174.8559 79 R 4.6494 7.5637 119.5582 55.2892 32.4359 174.9363 80 H 4.4099 9.0026 117.0404 55.4379 29.3304 177.1227 81 V 3.4445 8.2063 122.3693 66.1851 31.4306 177.0162 82 G 3.8880 8.2648 104.9362 47.0159 0.0000 173.6524 83 D 5.0633 8.0970 121.7453 53.4557 39.5805 176.0037 84 L 4.3671 8.5248 119.2237 53.3834 42.4383 178.6457 85 G 3.9691 8.3627 108.0019 46.6827 0.0000 173.3989 86 N 5.5887 8.6761 121.2168 51.5758 41.3294 173.9764 87 V 4.4612 8.7146 113.9620 59.8447 36.1987 174.6618 88 T 5.0850 8.1709 117.5416 61.8472 71.6265 173.0242 89 A 4.8522 8.9395 129.2177 50.8945 20.8118 177.3354 90 D 5.0766 8.7365 122.7373 51.9324 41.4596 177.1651 91 K 4.1105 8.5093 117.1973 59.9763 32.5487 177.1509 92 D 4.5674 8.2539 117.5627 53.7316 40.8865 175.9801 93 A 4.2581 8.2918 120.7120 52.5262 16.7916 177.0932 94 V 4.7682 8.1034 118.8046 62.5664 34.0016 174.4907 95 A 5.2062 8.9566 130.3241 50.1777 20.3201 175.7834 96 D 5.1229 8.5557 123.5153 53.4293 40.3521 175.9106 97 V 3.5745 8.6270 123.7873 62.8475 33.0153 174.9512 98 S 4.6864 8.4622 122.5397 57.5215 63.9244 172.5656 99 I 4.7672 9.4186 127.9806 59.1631 41.0653 174.1893 100 E 5.1853 8.8309 125.6209 54.5383 32.2063 174.4558 101 D 4.8896 9.2030 125.3350 52.9547 44.9804 175.6114 102 S 4.6925 8.9567 119.3151 58.5092 63.9328 174.8298 103 V 4.0791 7.9551 120.4528 64.4158 32.1932 176.3755 104 I 4.0952 7.9353 111.6458 61.0811 38.2312 174.6850 105 S 4.6481 8.4781 113.9368 57.5235 65.3951 174.1101 106 L 4.7297 8.9222 123.9489 54.1725 41.4166 176.4872 107 S 4.4529 7.8809 111.4793 58.6006 66.2749 176.3733 108 G 3.8525 8.4294 108.9778 44.9498 0.0000 173.3665 109 D 4.4309 8.8710 117.4298 57.6710 41.1905 177.1692 110 H 5.0323 8.0795 114.0029 55.5700 29.0179 173.9614 111 C 4.6117 8.0233 121.0496 59.6240 31.8177 173.4787 112 I 3.9368 8.3539 119.2430 60.4899 38.1338 175.6763 113 I 3.7055 7.2630 123.1690 62.9099 37.4604 176.3035 114 G 3.8145 9.4251 113.7016 45.2472 0.0000 172.7473 115 R 4.8623 7.4932 118.8229 54.7537 33.8924 174.5743 116 T 4.9487 7.9512 116.2047 61.9898 70.9133 173.9414 117 L 4.7132 8.6991 129.1905 54.2328 43.9182 175.4298 118 V 4.9014 8.6754 125.8743 61.0479 34.8816 174.1754 119 V 4.9271 8.5742 127.5958 60.7987 33.3697 174.9404 120 H 5.2690 9.0913 121.7828 54.1370 30.6006 174.7622 121 E 4.1984 9.5071 122.3185 59.0236 29.9903 176.9105 122 K 4.7481 8.5997 117.5404 53.7715 35.9624 175.5042 123 A 4.4936 8.3852 123.2519 52.1679 18.9729 176.9227 124 D 4.7053 9.7147 123.5773 54.0514 41.7267 175.8366 125 D 4.6146 9.4082 125.2763 53.0076 39.5293 176.7165 126 L 3.6393 10.0004 119.2617 56.1885 39.6218 176.0290 127 G 4.0634 8.7808 104.8285 45.8805 0.0000 174.8145 128 K 4.4980 8.0895 116.9939 56.0086 32.4288 177.4915 129 G 3.8010 7.8507 109.5415 45.0287 0.0000 176.2907 130 G 3.8059 8.3466 107.0479 45.5856 0.0000 172.4821 131 N 5.0339 7.2676 115.5603 50.1871 40.3860 174.5841 132 E 4.0776 8.8219 117.5358 59.7817 29.8503 179.4745 133 E 3.9280 8.2713 118.4139 59.3350 29.3342 178.4989 134 S 4.1588 8.4564 113.4480 61.5272 62.4474 175.7951 135 T 4.1580 7.9418 110.3790 62.9250 68.4888 175.6443 136 K 4.2903 7.7174 119.6136 57.7949 34.0263 176.8125 137 T 4.1082 7.9819 106.2447 60.2258 69.9616 175.1800 138 G 3.8704 8.0658 110.4751 45.6522 0.0000 173.8903 139 N 4.3068 7.8834 114.6645 53.9826 36.7939 176.1904 140 A 4.1400 7.7077 122.6096 53.1312 19.2513 180.0017 141 G 3.8102 7.3542 104.0562 45.0663 0.0000 173.5971 142 S 4.3206 8.6592 116.0019 59.0382 64.4493 174.2254 143 R 4.3895 8.4038 121.7529 55.5046 29.7828 176.3172 144 L 4.3568 8.9673 125.7685 57.1692 43.2087 176.9848 145 A 4.8208 7.7449 117.7534 51.4637 22.7685 174.8472 146 C 5.3021 8.4532 114.1585 58.4317 33.7862 172.6892 147 G 4.4718 8.0234 103.0320 46.0794 0.0000 172.8387 148 V 4.3036 8.3585 121.8706 62.4426 32.7348 175.4534 149 I 4.2245 8.7620 129.5100 60.7763 38.1799 175.1956 150 G 4.4322 8.9363 114.4691 43.8276 0.0000 172.3036 151 I 4.1983 8.4059 122.3153 61.3537 37.5866 175.3268 152 A 4.8334 8.7088 127.9743 49.6109 22.3238 176.0456 153 Q 4.0700 8.5286 118.6798 56.4530 29.2128 175.9817 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 A 8.26 4.33 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 0.00 0.00 2 T 8.35 4.50 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 3 K 8.36 5.34 0.00 1.89 1.69 0.00 1.73 0.00 0.00 1.91 0.00 0.00 3.06 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.56 1.50 7.81 4 A 9.27 5.41 1.11 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 5 V 8.75 4.99 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 0.76 0.00 0.00 0.94 0.00 0.00 6 C 8.95 4.85 0.00 3.17 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 7 V 8.51 4.59 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 0.93 0.00 0.00 0.92 0.00 0.00 8 L 9.04 4.71 0.00 1.60 1.59 1.04 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.08 4.88 0.00 1.64 1.62 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.37 7.81 10 G 7.94 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 11 D 8.80 4.53 0.00 2.68 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 12 G 7.62 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 13 P 0.00 4.41 0.00 2.19 2.17 0.00 3.76 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 14 V 7.82 4.37 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 1.09 0.00 0.00 0.94 0.00 0.00 15 Q 7.34 5.16 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.59 0.00 0.00 0.00 0.00 0.00 2.46 2.19 0.00 16 G 7.67 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 17 I 7.85 5.15 1.82 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 1.18 0.82 0.00 0.00 18 I 8.91 4.63 1.84 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 1.25 1.53 0.45 0.00 0.00 19 N 8.42 5.00 0.00 1.44 1.42 0.00 0.00 6.36 8.24 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 20 F 9.02 5.39 0.00 2.92 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 21 E 9.64 5.13 0.00 2.51 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 22 Q 9.25 4.84 0.00 2.12 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.71 0.00 0.00 0.00 0.00 0.00 2.47 2.64 0.00 23 K 8.93 4.14 0.00 1.81 1.89 0.00 1.78 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.48 1.43 7.81 24 E 7.83 4.78 0.00 1.98 1.79 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 2.30 2.28 0.00 25 S 8.94 4.23 0.00 3.98 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 26 N 8.18 4.80 0.00 2.83 2.94 0.00 0.00 5.79 7.00 0.00 0.00 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 G 7.92 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 28 P 0.00 4.63 0.00 2.09 2.04 0.00 3.68 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.11 0.00 29 V 8.88 4.59 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 1.06 0.00 0.00 30 K 9.33 4.84 0.00 1.90 1.83 0.00 1.62 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.51 1.51 7.81 31 V 9.60 4.90 2.17 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 0.78 0.00 0.00 1.12 0.00 0.00 32 W 7.98 6.14 0.00 3.49 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 33 G 7.55 4.12 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 0.00 0.00 0.00 34 S 7.83 5.13 0.00 3.87 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 35 I 8.67 5.03 1.82 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.44 0.90 0.00 0.00 36 K 9.24 4.65 0.00 1.77 1.90 0.00 1.35 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.44 1.36 7.81 37 G 8.76 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 38 L 7.60 4.59 0.00 1.66 1.36 0.82 0.45 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 39 T 8.34 4.17 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 40 E 8.65 4.02 0.00 1.96 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 2.30 2.49 0.00 41 G 8.31 3.78 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 0.00 0.00 0.00 42 L 8.23 4.81 0.00 1.52 1.60 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.32 4.98 0.00 3.01 3.35 0.00 5.65 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 44 G 9.15 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 F 8.99 5.39 0.00 3.17 3.02 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 46 H 8.75 5.25 0.00 3.14 2.96 0.00 5.85 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.50 4.40 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.90 0.00 0.00 48 H 9.58 5.03 0.00 3.17 3.45 0.00 5.67 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.90 3.70 0.00 1.67 1.12 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 1.47 2.07 0.00 50 F 8.11 4.96 0.00 3.18 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 51 G 8.36 4.28 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 0.00 52 D 7.97 4.80 0.00 2.60 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 53 N 8.74 5.29 0.00 2.72 2.77 0.00 0.00 7.30 7.54 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 54 T 8.75 3.96 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 1.23 0.00 0.00 55 A 7.86 4.68 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 56 G 8.05 3.85 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 0.00 0.00 0.00 57 C 8.53 4.22 0.00 2.97 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 58 T 8.09 3.87 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 1.23 0.00 0.00 59 S 8.00 4.52 0.00 3.98 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 60 A 7.61 4.38 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 0.00 0.00 61 G 7.61 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 0.00 0.00 0.00 0.00 62 P 0.00 4.68 0.00 2.03 2.20 0.00 3.63 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 1.97 1.98 0.00 63 H 8.35 4.49 0.00 2.86 3.19 0.00 5.73 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 64 F 9.14 4.22 0.00 2.92 2.97 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 65 N 7.93 5.11 0.00 2.58 2.44 0.00 0.00 7.16 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 66 P 0.00 4.13 0.00 1.90 1.97 0.00 3.07 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.99 0.00 67 L 7.66 4.31 0.00 1.56 1.64 0.90 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.51 3.60 0.00 3.99 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 69 R 8.25 4.47 0.00 1.87 1.99 0.00 3.12 0.00 0.00 3.45 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.53 0.00 70 K 8.90 4.40 0.00 1.65 1.69 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.77 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.37 7.81 71 H 9.01 4.01 0.00 3.21 3.29 0.00 5.96 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 72 G 7.40 4.12 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 0.00 0.00 0.00 73 G 9.28 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 74 P 0.00 4.37 0.00 2.08 2.18 0.00 3.70 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 2.07 2.25 0.00 75 K 7.89 4.21 0.00 1.75 1.86 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.47 7.81 76 D 7.61 4.64 0.00 2.76 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 77 E 8.69 3.91 0.00 1.92 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 2.28 0.00 78 E 7.96 4.23 0.00 2.06 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.31 0.00 79 R 7.56 4.65 0.00 1.95 1.76 0.00 2.87 0.00 0.00 3.91 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.55 0.00 80 H 9.00 4.41 0.00 3.48 3.40 0.00 5.65 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.21 3.44 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 0.70 0.00 0.00 0.43 0.00 0.00 82 G 8.26 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 83 D 8.10 5.06 0.00 2.67 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 84 L 8.52 4.37 0.00 1.98 1.96 1.03 0.99 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 85 G 8.36 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 0.00 0.00 0.00 86 N 8.68 5.59 0.00 2.62 2.74 0.00 0.00 6.54 7.68 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 87 V 8.71 4.46 1.77 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 -0.20 0.00 0.00 0.76 0.00 0.00 88 T 8.17 5.08 4.21 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 1.20 0.00 0.00 89 A 8.94 4.85 1.29 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 90 D 8.74 5.08 0.00 2.89 2.84 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 91 K 8.51 4.11 0.00 1.88 1.99 0.00 1.56 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.40 1.46 7.81 92 D 8.25 4.57 0.00 2.80 2.72 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 93 A 8.29 4.26 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 94 V 8.10 4.77 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 1.01 0.00 0.00 0.99 0.00 0.00 95 A 8.96 5.21 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 0.00 0.00 96 D 8.56 5.12 0.00 2.56 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 97 V 8.63 3.57 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 0.59 0.00 0.00 0.62 0.00 0.00 98 S 8.46 4.69 0.00 3.89 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 I 9.42 4.77 1.97 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.87 1.02 0.00 0.00 100 E 8.83 5.19 0.00 1.96 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.31 0.00 101 D 9.20 4.89 0.00 2.88 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 0.00 102 S 8.96 4.69 0.00 3.91 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 0.00 103 V 7.96 4.08 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 0.80 0.00 0.00 0.95 0.00 0.00 104 I 7.94 4.10 1.95 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 1.53 0.82 1.04 0.00 0.00 105 S 8.48 4.65 0.00 3.92 3.85 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 0.00 106 L 8.92 4.73 0.00 1.87 1.64 1.04 0.58 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 0.00 107 S 7.88 4.45 0.00 3.96 3.79 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 0.00 108 G 8.43 3.85 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 0.00 0.00 0.00 109 D 8.87 4.43 0.00 2.63 2.84 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 0.00 110 H 8.08 5.03 0.00 3.23 3.43 0.00 5.64 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 C 8.02 4.61 0.00 3.05 2.84 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 0.00 112 I 8.35 3.94 1.63 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.16 0.93 0.00 0.00 113 I 7.26 3.71 1.78 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 1.21 0.39 0.89 0.00 0.00 114 G 9.43 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 0.00 0.00 0.00 115 R 7.49 4.86 0.00 1.58 1.80 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.29 0.00 116 T 7.95 4.95 4.26 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 0.00 0.00 1.29 0.00 0.00 117 L 8.70 4.71 0.00 1.77 1.52 0.42 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.68 4.90 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 0.77 0.00 0.00 0.73 0.00 0.00 119 V 8.57 4.93 2.31 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 0.73 0.00 0.00 1.09 0.00 0.00 120 H 9.09 5.27 0.00 3.25 3.56 0.00 5.66 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.51 4.20 0.00 2.07 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 0.00 2.36 2.35 0.00 122 K 8.60 4.75 0.00 1.75 1.69 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.39 7.81 123 A 8.39 4.49 1.22 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 0.00 124 D 9.71 4.71 0.00 2.78 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 0.00 125 D 9.41 4.61 0.00 2.92 2.89 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 0.00 126 L 10.00 3.64 0.00 1.85 1.78 0.94 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.78 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 0.00 0.00 0.00 128 K 8.09 4.50 0.00 1.89 1.81 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.38 1.52 7.81 129 G 7.85 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 0.00 130 G 8.35 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 0.00 0.00 0.00 131 N 7.27 5.03 0.00 2.94 2.80 0.00 0.00 6.88 7.54 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 0.00 132 E 8.82 4.08 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.32 0.00 133 E 8.27 3.93 0.00 2.07 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 2.37 2.41 0.00 134 S 8.46 4.16 0.00 4.08 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 T 7.94 4.16 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 1.26 0.00 0.00 136 K 7.72 4.29 0.00 1.82 1.81 0.00 1.67 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.33 1.45 7.81 137 T 7.98 4.11 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 138 G 8.07 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 0.00 139 N 7.88 4.31 0.00 2.91 2.90 0.00 0.00 6.90 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 0.00 140 A 7.71 4.14 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 0.00 141 G 7.35 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 0.00 0.00 0.00 142 S 8.66 4.32 0.00 3.82 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 R 8.40 4.39 0.00 1.64 1.77 0.00 3.18 0.00 0.00 3.20 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.64 0.00 144 L 8.97 4.36 0.00 1.69 1.70 0.94 0.76 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 0.00 145 A 7.74 4.82 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 0.00 146 C 8.45 5.30 0.00 3.01 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 0.00 147 G 8.02 4.47 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 0.00 148 V 8.36 4.30 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 0.81 0.00 0.00 0.91 0.00 0.00 149 I 8.76 4.22 1.81 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.37 0.46 0.00 0.00 150 G 8.94 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 0.00 151 I 8.41 4.20 1.86 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 1.25 0.54 0.91 0.00 0.00 152 A 8.71 4.83 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 0.00 153 Q 8.53 4.07 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.78 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00