NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2006 8.1633 120.2897 54.5869 33.0455 174.2947 2 K 3.8038 8.6358 126.0694 56.8552 32.3794 175.2685 3 G 4.0497 8.4194 112.7920 44.1725 0.0000 172.3764 4 D 4.5088 8.4689 119.8561 54.2065 41.9116 177.1668 5 K 3.9344 8.9009 126.1740 59.8787 32.3822 179.3037 6 I 3.8211 7.8222 119.4496 63.9476 36.8954 178.4803 7 V 3.7070 7.9654 119.0783 66.0242 31.3050 178.0044 8 I 3.6946 7.5814 119.3639 64.5136 36.8500 178.3768 9 Q 3.9312 7.7928 118.7488 59.2720 28.5650 178.6116 10 H 4.0756 8.0815 117.0790 58.9280 28.6854 177.8047 11 L 4.0417 8.2106 120.9286 58.0656 41.4719 179.4670 12 N 4.3481 8.4233 116.5240 55.7413 37.8928 177.4706 13 K 3.9079 8.1593 121.5339 59.6359 32.3215 178.9966 14 I 3.7716 7.8155 120.0583 64.2650 37.0269 178.0924 15 L 4.0794 8.3353 121.6788 58.2223 41.9003 179.3640 16 G 3.6321 8.2761 105.5995 47.6236 0.0000 175.4831 17 N 4.4597 7.7911 117.7232 55.9907 38.6299 177.4279 18 E 3.9797 8.2205 120.1403 59.4076 29.5093 179.2501 19 L 4.0503 7.9250 119.0051 57.8580 41.6312 179.7921 20 I 3.6257 7.2783 118.7581 64.1847 36.9685 178.2698 21 A 3.3337 7.7788 121.5700 54.8735 18.1365 179.4173 22 I 3.5994 7.9888 118.6378 64.8997 37.3205 178.3752 23 N 4.3207 7.8200 116.5294 56.3185 38.2876 177.4273 24 Q 3.8274 7.9151 120.9175 59.4320 29.1903 177.8537 25 Y 4.6148 7.8975 118.0512 60.8658 37.8606 178.0240 26 F 3.9011 8.3449 121.7769 61.1278 39.5947 176.8467 27 L 3.9599 7.9558 119.7338 58.5833 41.8592 178.5320 28 H 3.9566 8.3734 115.9903 58.7768 28.6641 177.4332 29 A 4.1284 8.3823 122.7301 55.5467 18.2094 179.8996 30 R 3.8469 7.8618 115.6609 58.7662 29.9341 179.1827 31 M 3.4774 7.4562 119.1834 58.0819 31.8499 178.2054 32 Y 4.2923 7.5746 116.9406 60.9410 38.0474 178.0498 33 E 3.9136 8.2043 120.2095 59.5368 29.5802 178.4708 34 D 4.3544 7.8859 116.1682 56.4739 41.2527 177.2499 35 W 5.0137 7.6752 117.3154 56.6315 29.6286 177.0538 36 G 4.0291 8.2967 107.5268 45.0906 0.0000 174.8349 37 L 4.5842 8.0015 122.0609 52.9574 40.3887 176.8883 38 E 3.9253 8.1644 122.8991 59.4343 30.0838 179.0540 39 K 3.9618 7.8584 118.9523 59.4759 32.1998 178.5634 40 L 4.0237 7.8136 120.1479 57.9189 41.9766 178.7746 41 G 3.7446 8.5222 106.0451 47.8014 0.0000 175.2111 42 K 3.7352 8.5025 123.0009 59.4836 32.2720 178.2268 43 H 3.9211 8.0866 117.8868 59.2211 29.5381 176.9316 44 E 3.9489 8.3101 119.6735 59.5649 29.5030 178.3902 45 Y 4.0891 8.1595 119.4712 61.2470 38.8063 177.8772 46 H 4.0413 8.0887 116.9079 59.0395 28.8589 177.4119 47 E 3.7417 7.9315 120.3933 58.7918 29.4634 178.7924 48 S 4.3088 8.1524 113.9460 61.2835 62.4870 176.1353 49 I 3.6403 7.2822 122.1424 64.1361 36.8503 177.8553 50 D 4.2396 8.1879 119.9894 57.5476 40.6143 178.7412 51 E 3.9387 7.9486 118.3790 59.6300 29.4187 179.3766 52 M 4.0124 7.7997 118.2910 58.4257 32.0037 178.9881 53 K 4.0049 8.0972 118.5348 59.6003 32.0983 179.1960 54 H 4.2455 8.2920 116.4155 58.8684 28.6239 177.5551 55 A 3.9882 8.2728 122.8041 55.1829 18.0719 179.1483 56 D 4.2442 8.1291 116.3561 57.5259 41.3654 178.6061 57 K 3.9475 8.2022 118.9707 59.3884 31.9433 179.3042 58 L 3.9951 8.1349 119.1976 57.8730 41.5515 179.3621 59 I 3.6875 8.0620 119.9835 64.5397 37.1105 178.2864 60 K 3.8659 8.2406 119.2230 59.6736 31.9532 179.1911 61 R 3.9538 8.1192 118.4491 59.6547 29.9903 178.4208 62 I 3.7397 8.0408 119.7950 64.6049 37.1390 178.4262 63 L 3.9990 8.2185 119.7635 57.7917 41.2117 179.3943 64 F 4.4067 8.0640 119.7838 60.9199 39.7392 176.2777 65 L 4.4136 7.8033 117.9807 53.3927 41.2146 176.9513 66 E 3.7942 7.9050 117.3960 57.4047 27.2457 174.4791 67 G 3.9873 8.0657 108.0728 43.9629 0.0000 173.4602 68 L 4.5909 8.0103 118.8148 51.9389 42.7910 175.3482 69 P 4.4061 0.0000 0.0000 62.7487 31.7869 176.1587 70 N 4.7523 8.6343 120.5165 52.1890 38.4242 173.6932 71 L 4.6295 8.2017 122.7300 54.2829 42.3666 177.3992 72 Q 4.1998 8.2507 121.8101 57.5750 29.7203 175.7516 73 E 4.3436 8.2081 117.3691 54.8561 30.4112 175.2912 74 L 4.5134 8.3219 125.1836 52.8849 43.8354 176.2601 75 G 3.8208 8.4332 115.3981 44.0962 0.0000 172.0603 76 K 3.8538 8.4086 120.3153 56.5774 32.1834 176.3788 77 L 4.3116 8.3208 126.1891 54.5217 42.4542 177.1092 78 L 4.6370 7.9969 121.4658 52.9954 41.4974 175.2033 79 I 4.0785 7.9323 122.4451 60.4714 38.1913 176.2762 80 G 4.1230 8.6982 113.5096 44.4427 0.0000 172.8305 81 E 4.8137 8.9697 117.2525 56.4253 31.8348 176.5266 82 H 5.0229 7.9378 112.9263 53.5950 31.5702 174.8250 83 T 4.1456 8.3391 118.3475 66.5545 68.7123 175.9138 84 K 3.8559 8.2489 121.2244 59.6727 32.2067 178.4179 85 E 3.9375 8.2097 119.6213 59.3167 29.5165 178.6259 86 M 3.9759 7.9599 118.3285 58.3460 32.1028 178.4579 87 L 4.1005 8.2994 119.3532 58.0664 41.7700 179.5664 88 E 4.0513 8.0923 118.1507 59.4863 29.2529 179.2470 89 C 4.2621 8.4633 117.1718 62.7394 28.1005 175.8268 90 D 4.7894 8.3022 120.5917 57.3594 40.5125 178.4281 91 L 3.9686 8.0189 120.7154 58.1619 42.1863 178.9752 92 K 3.9185 8.4141 118.6549 59.4921 31.8351 178.6128 93 L 3.9521 7.9783 119.1549 58.6652 41.7504 178.4976 94 E 4.2109 8.6557 118.4261 59.8029 29.2259 179.4875 95 Q 4.1318 8.0964 116.4320 58.1398 28.9075 177.6412 96 A 4.3790 7.8316 120.2066 53.3115 19.1429 178.6252 97 G 3.8835 7.7344 102.7794 45.6339 0.0000 176.2071 98 L 4.0284 7.8744 121.4569 57.4375 41.7719 177.4035 99 P 4.2985 0.0000 0.0000 65.9591 30.8781 178.1908 100 D 4.3078 8.0196 118.0691 57.1800 40.8213 178.1080 101 L 3.9926 7.8746 119.4174 58.1661 41.7486 179.9572 102 K 3.9512 8.4924 118.1412 59.2941 31.8987 179.4257 103 A 3.9825 8.0504 121.0176 55.0628 18.3590 179.5116 104 A 3.6032 8.2993 119.6592 55.2210 18.5215 179.8959 105 I 3.6521 8.1240 118.3939 64.5979 37.2616 178.5759 106 A 4.0523 8.0068 121.5056 55.2353 18.2005 179.1023 107 Y 3.9862 7.8598 119.5637 60.3487 38.8393 177.6300 108 C 4.0851 8.3225 117.7729 62.6362 28.1350 175.8308 109 E 3.9679 7.9922 119.9613 59.5723 28.9464 179.4545 110 S 4.0287 7.7327 113.5576 61.1278 62.6134 175.9251 111 V 3.9733 7.0657 112.7821 60.2778 31.6813 176.7003 112 G 3.0218 7.3914 106.8743 46.2686 0.0000 175.1451 113 D 4.4214 7.3956 121.5216 53.0552 38.9726 176.1055 114 Y 4.3331 7.4922 121.9084 60.2660 38.3961 177.1562 115 A 4.0557 8.0648 121.5588 55.2164 18.5173 179.6991 116 S 4.1034 8.3254 113.5637 61.5675 62.8146 176.7341 117 R 3.9055 7.8262 121.0927 59.7462 29.7357 178.3421 118 E 4.1435 8.4793 118.3845 59.2674 29.5110 179.2697 119 L 3.9291 7.8365 120.2220 58.3398 42.2116 179.1424 120 L 4.0616 8.2960 119.1271 57.6736 41.4006 179.4941 121 E 3.9741 8.5161 119.1172 59.4121 29.3760 179.0088 122 D 4.3647 7.9100 118.8661 57.3764 40.8047 178.9194 123 I 3.4834 7.5844 119.8241 64.1322 37.1168 177.9149 124 L 3.9214 8.0530 121.4332 58.4757 41.9408 178.6178 125 E 3.9448 8.5460 119.3072 59.5111 29.3647 178.7976 126 S 4.2765 8.0965 113.1354 61.2899 62.4588 175.9434 127 E 4.0969 8.5174 121.7658 59.4578 29.1903 179.1775 128 E 4.0886 8.3017 118.7054 59.3134 29.4716 179.1119 129 D 4.4303 7.8335 117.8336 57.5462 40.8063 178.2468 130 H 4.3341 8.1055 118.8533 59.4923 29.9044 177.3046 131 I 3.7124 7.8873 121.6569 64.3604 36.8630 177.9176 132 D 4.3250 8.3207 118.8139 57.0873 41.1232 178.0193 133 W 4.1319 8.3468 128.8146 60.4522 30.7044 177.7332 134 L 3.8048 8.4500 119.0902 57.8832 41.1446 179.1227 135 E 3.8545 8.1893 118.3077 59.9784 29.4504 179.5981 136 T 3.7640 7.8549 115.3677 66.7218 68.4663 176.5036 137 Q 3.6369 7.5526 119.6101 58.9502 28.1820 178.9730 138 L 3.7570 7.4760 119.7314 57.9300 41.5815 179.4367 139 D 4.3711 8.0295 118.7276 57.0424 40.6743 178.7794 140 L 3.9834 7.8294 119.8002 57.6694 41.4792 179.5070 141 I 3.5819 7.4164 119.8687 64.4041 36.7480 178.2738 142 D 4.3063 7.4347 117.5716 57.2331 40.7460 178.6543 143 K 4.1300 8.0671 118.2871 58.6566 32.1904 178.5035 144 I 4.3119 8.1285 110.5154 59.5243 39.3276 176.7882 145 G 4.0143 7.8906 107.8455 45.5370 0.0000 174.3092 146 L 4.0039 8.4971 122.1612 57.9385 42.1191 179.2686 147 E 3.9796 8.1773 118.0474 59.6202 29.4837 179.0440 148 N 4.3266 8.0924 115.8651 56.2962 38.4964 176.5926 149 Y 3.9463 7.9246 119.7887 60.8742 39.1462 178.0252 150 L 4.0334 8.2068 119.8089 57.7508 41.5726 179.2515 151 Q 3.9220 8.0638 119.5684 59.2752 28.7811 178.2677 152 S 4.2449 7.8572 114.2460 60.1736 63.2901 175.3134 153 Q 4.2765 7.7405 120.5649 55.0969 28.6200 175.2538 154 M 4.7758 6.8598 120.5107 54.1771 33.3978 175.8752 155 D 4.4561 8.4283 118.5676 54.6931 41.4387 176.0222 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 4.20 0.00 1.37 1.73 0.00 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.42 0.00 2 K 8.64 3.80 0.00 1.70 1.72 0.00 1.75 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.40 1.45 7.81 3 G 8.42 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 4 D 8.47 4.51 0.00 2.85 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 K 8.90 3.93 0.00 1.85 1.79 0.00 1.76 0.00 0.00 1.80 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.51 7.81 6 I 7.82 3.82 1.94 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 1.40 0.24 -0.10 0.00 0.00 7 V 7.97 3.71 2.34 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 1.24 0.00 0.00 1.22 0.00 0.00 8 I 7.58 3.69 2.01 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 1.81 0.73 0.90 0.00 0.00 9 Q 7.79 3.93 0.00 2.11 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.32 2.49 0.00 10 H 8.08 4.08 0.00 3.35 3.32 0.00 5.63 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 11 L 8.21 4.04 0.00 1.99 1.74 1.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.42 4.35 0.00 2.93 2.84 0.00 0.00 6.66 8.17 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 13 K 8.16 3.91 0.00 1.91 2.04 0.00 1.50 0.00 0.00 1.61 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.53 7.81 14 I 7.82 3.77 2.03 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 1.43 0.53 0.92 0.00 0.00 15 L 8.34 4.08 0.00 1.81 1.82 0.92 1.34 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 16 G 8.28 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 N 7.79 4.46 0.00 2.96 2.87 0.00 0.00 6.92 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 18 E 8.22 3.98 0.00 2.13 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 0.00 2.62 2.52 0.00 19 L 7.92 4.05 0.00 1.67 1.68 0.90 0.70 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 20 I 7.28 3.63 1.97 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 1.41 1.05 0.84 0.00 0.00 21 A 7.78 3.33 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 22 I 7.99 3.60 1.99 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 1.49 0.69 0.85 0.00 0.00 23 N 7.82 4.32 0.00 2.72 2.82 0.00 0.00 6.77 8.61 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 24 Q 7.92 3.83 0.00 1.99 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.24 0.00 25 Y 7.90 4.61 0.00 3.04 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 26 F 8.34 3.90 0.00 3.34 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 L 7.96 3.96 0.00 1.91 1.82 0.88 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 28 H 8.37 3.96 0.00 3.55 3.19 0.00 5.69 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.38 4.13 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 30 R 7.86 3.85 0.00 1.68 1.85 0.00 3.11 0.00 0.00 2.84 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.69 0.00 31 M 7.46 3.48 0.00 0.86 1.61 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.21 0.00 32 Y 7.57 4.29 0.00 3.19 3.08 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 0.00 0.00 0.00 0.00 33 E 8.20 3.91 0.00 2.20 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 34 D 7.89 4.35 0.00 2.65 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 W 7.68 5.01 0.00 3.62 3.13 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 36 G 8.30 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 37 L 8.00 4.58 0.00 2.15 1.64 1.12 1.16 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 38 E 8.16 3.93 0.00 1.96 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 2.41 2.32 0.00 39 K 7.86 3.96 0.00 1.82 1.95 0.00 1.60 0.00 0.00 1.78 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.46 7.81 40 L 7.81 4.02 0.00 1.53 0.95 0.99 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.52 3.74 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 42 K 8.50 3.74 0.00 1.80 2.01 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.94 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.41 1.39 7.81 43 H 8.09 3.92 0.00 3.27 3.26 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 E 8.31 3.95 0.00 2.30 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 3.00 0.00 45 Y 8.16 4.09 0.00 3.02 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 H 8.09 4.04 0.00 3.08 3.21 0.00 5.69 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 7.93 3.74 0.00 1.91 1.71 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 1.47 1.86 0.00 48 S 8.15 4.31 0.00 4.14 3.95 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 49 I 7.28 3.64 1.86 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 1.07 0.62 0.84 0.00 0.00 50 D 8.19 4.24 0.00 2.80 2.55 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 51 E 7.95 3.94 0.00 2.14 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 0.00 2.76 2.70 0.00 52 M 7.80 4.01 0.00 2.05 2.21 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.52 0.00 53 K 8.10 4.00 0.00 1.92 1.84 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.62 7.81 54 H 8.29 4.25 0.00 3.40 3.37 0.00 5.65 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.27 3.99 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.13 4.24 0.00 2.89 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 57 K 8.20 3.95 0.00 2.04 1.86 0.00 1.77 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.50 7.81 58 L 8.13 4.00 0.00 1.88 1.73 0.96 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.06 3.69 2.02 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 1.52 0.73 0.92 0.00 0.00 60 K 8.24 3.87 0.00 1.97 1.89 0.00 1.67 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.47 1.61 7.81 61 R 8.12 3.95 0.00 2.07 2.16 0.00 3.33 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.80 0.00 62 I 8.04 3.74 2.03 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 1.54 0.71 0.94 0.00 0.00 63 L 8.22 4.00 0.00 1.98 1.78 0.97 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 64 F 8.06 4.41 0.00 2.98 3.32 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 65 L 7.80 4.41 0.00 2.01 1.61 0.83 0.85 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 66 E 7.91 3.79 0.00 2.05 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 0.00 2.18 2.11 0.00 67 G 8.07 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 68 L 8.01 4.59 0.00 1.61 1.60 0.91 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.41 0.00 2.03 1.99 0.00 3.63 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 70 N 8.63 4.75 0.00 2.69 2.75 0.00 0.00 7.04 7.58 0.00 0.00 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 L 8.20 4.63 0.00 1.64 1.61 0.90 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.25 4.20 0.00 1.97 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.20 6.81 0.00 0.00 0.00 0.00 0.00 2.27 2.41 0.00 73 E 8.21 4.34 0.00 2.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.22 0.00 74 L 8.32 4.51 0.00 1.52 1.50 0.89 1.04 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 75 G 8.43 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 0.00 0.00 0.00 76 K 8.41 3.85 0.00 1.70 1.75 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.53 7.81 77 L 8.32 4.31 0.00 1.64 1.54 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.00 4.64 0.00 1.80 1.63 0.99 0.87 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 79 I 7.93 4.08 1.90 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 1.35 0.74 0.94 0.00 0.00 80 G 8.70 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 81 E 8.97 4.81 0.00 2.15 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 2.32 2.27 0.00 82 H 7.94 5.02 0.00 3.20 3.29 0.00 5.49 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 T 8.34 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 1.45 0.00 0.00 84 K 8.25 3.86 0.00 1.85 1.89 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.73 1.45 7.81 85 E 8.21 3.94 0.00 1.77 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 86 M 7.96 3.98 0.00 1.86 2.31 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.32 0.00 87 L 8.30 4.10 0.00 2.01 1.70 1.08 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 88 E 8.09 4.05 0.00 2.22 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 0.00 2.32 2.47 0.00 89 C 8.46 4.26 0.00 3.23 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 D 8.30 4.79 0.00 3.09 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 L 8.02 3.97 0.00 1.92 1.89 0.93 0.40 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 92 K 8.41 3.92 0.00 2.00 1.89 0.00 1.77 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.73 7.81 93 L 7.98 3.95 0.00 1.97 2.00 0.79 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 94 E 8.66 4.21 0.00 2.23 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 2.76 2.57 0.00 95 Q 8.10 4.13 0.00 2.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.93 0.00 0.00 0.00 0.00 0.00 2.42 2.61 0.00 96 A 7.83 4.38 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 97 G 7.73 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 98 L 7.87 4.03 0.00 1.73 1.76 0.95 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 99 P 0.00 4.30 0.00 2.27 2.34 0.00 3.66 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.08 0.00 100 D 8.02 4.31 0.00 2.92 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 0.00 101 L 7.87 3.99 0.00 1.95 1.75 0.94 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 102 K 8.49 3.95 0.00 1.79 1.88 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.72 7.81 103 A 8.05 3.98 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 0.00 104 A 8.30 3.60 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 0.00 105 I 8.12 3.65 2.03 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 1.48 1.11 0.94 0.00 0.00 106 A 8.01 4.05 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 Y 7.86 3.99 0.00 3.09 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 0.00 108 C 8.32 4.09 0.00 3.18 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 0.00 109 E 7.99 3.97 0.00 2.21 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 2.40 2.51 0.00 110 S 7.73 4.03 0.00 3.88 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.07 3.97 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 0.18 0.00 0.00 0.77 0.00 0.00 112 G 7.39 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 0.00 0.00 0.00 113 D 7.40 4.42 0.00 2.62 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 0.00 114 Y 7.49 4.33 0.00 3.09 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 0.00 115 A 8.06 4.06 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.33 4.10 0.00 4.19 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 0.00 117 R 7.83 3.91 0.00 1.99 2.24 0.00 3.27 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.73 0.00 118 E 8.48 4.14 0.00 2.20 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 0.00 2.53 2.50 0.00 119 L 7.84 3.93 0.00 1.91 1.90 0.95 0.66 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 0.00 120 L 8.30 4.06 0.00 1.85 1.72 0.95 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 121 E 8.52 3.97 0.00 2.18 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 0.00 2.35 2.60 0.00 122 D 7.91 4.36 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 0.00 123 I 7.58 3.48 1.94 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.79 0.81 0.00 0.00 124 L 8.05 3.92 0.00 1.81 1.87 0.95 1.18 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 0.00 125 E 8.55 3.94 0.00 2.13 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 0.00 2.33 2.35 0.00 126 S 8.10 4.28 0.00 4.01 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 0.00 127 E 8.52 4.10 0.00 2.17 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.54 0.00 128 E 8.30 4.09 0.00 2.22 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 2.36 2.38 0.00 129 D 7.83 4.43 0.00 2.98 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 0.00 130 H 8.11 4.33 0.00 3.27 3.53 0.00 5.61 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 0.00 131 I 7.89 3.71 2.07 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.67 0.94 0.00 0.00 132 D 8.32 4.32 0.00 2.95 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 0.00 133 W 8.35 4.13 0.00 3.51 3.47 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 0.00 134 L 8.45 3.80 0.00 1.88 1.70 0.84 1.27 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 0.00 135 E 8.19 3.85 0.00 2.13 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 2.32 2.61 0.00 136 T 7.85 3.76 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 137 Q 7.55 3.64 0.00 1.68 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.78 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 138 L 7.48 3.76 0.00 1.75 1.60 0.86 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 139 D 8.03 4.37 0.00 2.75 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 0.00 140 L 7.83 3.98 0.00 1.93 1.76 0.90 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 141 I 7.42 3.58 1.80 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.09 0.80 0.00 0.00 142 D 7.43 4.31 0.00 2.76 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 0.00 143 K 8.07 4.13 0.00 1.71 1.86 0.00 1.64 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.53 7.81 144 I 8.13 4.31 1.89 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 1.82 0.70 0.93 0.00 0.00 145 G 7.89 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 0.00 0.00 0.00 146 L 8.50 4.00 0.00 1.77 1.68 0.96 0.94 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 0.00 147 E 8.18 3.98 0.00 2.10 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 148 N 8.09 4.33 0.00 3.03 2.88 0.00 0.00 6.71 7.48 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 0.00 149 Y 7.92 3.95 0.00 3.00 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 0.00 150 L 8.21 4.03 0.00 1.83 1.73 0.97 1.00 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 0.00 151 Q 8.06 3.92 0.00 2.19 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.84 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 152 S 7.86 4.24 0.00 3.85 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 Q 7.74 4.28 0.00 2.02 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.82 0.00 0.00 0.00 0.00 0.00 1.74 1.98 0.00 154 M 6.86 4.78 0.00 1.95 1.97 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 2.84 2.47 0.00 155 D 8.43 4.46 0.00 2.63 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00