NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1B H 4.7241 8.3033 117.8289 54.7327 30.9602 173.0278 1C H 3.5342 8.8162 115.0722 57.6789 25.9003 172.5187 1D H 4.1998 8.7226 109.5114 56.8691 27.7844 174.7122 1E H 5.0619 8.1222 113.5027 53.8587 32.6791 173.2638 1F H 4.5495 8.9833 117.3423 56.0852 29.0425 174.4355 1G F 4.8029 8.4601 119.6231 57.6379 39.7383 174.8697 2 N 4.7265 8.2792 118.0395 52.0550 39.4231 174.7832 3 L 4.6468 8.0730 123.5285 52.2821 43.6371 174.7104 4 P 4.5589 0.0000 0.0000 61.2976 32.5988 174.3124 5 P 4.3927 0.0000 0.0000 61.9856 33.2364 176.3474 6 G 3.9212 8.8772 103.1705 45.8148 0.0000 171.3265 7 N 4.6567 7.9196 114.9637 51.2599 40.1698 173.9185 8 Y 4.9403 7.9691 113.6763 58.0493 38.6141 177.2647 9 K 4.1634 9.1461 122.4850 58.8730 32.2398 177.6071 10 K 4.6838 7.6283 115.8457 53.4154 34.5188 174.1452 11 P 4.7880 0.0000 0.0000 62.7342 32.2681 174.9721 12 K 4.9646 9.6381 120.1897 54.9687 37.4273 174.8997 13 L 4.9597 9.2280 121.0411 53.1725 44.5656 176.1645 14 L 4.9074 8.7592 124.2046 53.8213 42.9857 174.9413 15 Y 4.6573 9.4837 127.7281 56.1968 39.0458 174.2650 16 C 3.9360 7.8639 127.5421 58.1184 32.3951 174.3846 17 S 4.3210 8.0602 121.8327 61.0123 62.6052 175.7057 18 N 4.1470 7.4711 116.9592 55.4589 38.3246 176.6079 16 G 3.3460 7.8739 117.7421 45.0183 0.0000 174.6846 17 H 4.5810 8.1702 124.3327 57.7123 27.8052 175.2057 18 F 4.0270 7.3711 118.5592 60.0589 39.0246 177.2079 23 L 4.1825 9.0892 126.0797 55.5094 43.1249 175.5779 24 R 4.9299 9.1743 126.4486 54.5570 33.4170 174.0872 25 I 4.6905 8.4004 126.7116 59.5656 38.9254 175.5665 26 L 4.1959 9.3302 128.9669 53.1052 42.6253 176.4467 27 P 4.1554 0.0000 0.0000 66.0649 31.2838 177.3262 28 D 4.5295 7.9964 113.5461 53.6091 39.1545 177.0889 29 G 4.2744 8.5801 108.3992 45.9284 0.0000 173.8297 30 T 4.4011 7.8458 117.1041 62.8793 69.1922 173.7815 31 V 4.9591 8.2733 125.2396 61.0774 34.3339 174.0139 32 D 4.5025 8.6979 128.0698 52.7748 43.0200 174.1109 33 G 4.5948 8.9630 105.0990 45.3807 0.0000 171.9128 34 T 5.0033 8.5416 114.3552 60.7306 70.3957 173.7070 35 R 4.3906 8.7518 123.2291 56.9828 31.2736 176.4155 36 D 4.4912 8.0741 117.6954 53.7761 39.9143 176.4763 37 R 3.2822 8.5922 127.6371 58.1321 30.2048 177.0979 38 S 4.5019 7.8977 110.2367 57.9790 63.5358 173.7197 39 D 4.4055 7.7588 121.1585 55.1253 41.2758 176.3193 40 Q 4.2794 8.4279 122.4148 57.3048 29.5297 176.2841 41 H 4.9345 9.2200 115.8758 55.4343 29.0290 175.4278 42 I 4.5710 7.4746 110.7720 59.8830 38.6441 175.1956 43 Q 4.2494 7.7989 122.0458 55.8286 29.6123 174.8236 44 L 5.1686 9.0509 124.4013 52.7918 45.7468 175.3231 45 Q 4.8600 9.3215 124.2140 54.4539 31.0018 174.2411 46 L 5.0490 8.6148 126.6943 53.6812 43.6049 176.1917 47 S 4.6503 8.7568 115.8319 56.6621 66.7483 172.6729 48 A 4.5422 8.4690 123.0424 52.2976 20.5324 175.0039 49 E 4.0645 9.1718 121.5837 56.7012 29.6359 178.2113 50 S 4.5980 5.8100 114.3917 56.7354 65.2858 173.7049 51 V 3.9135 8.1621 121.5686 64.7246 31.4836 176.2037 52 G 3.9306 9.2688 115.2438 45.0270 0.0000 171.8317 53 E 5.1208 8.1546 119.8824 54.6177 32.2089 175.6537 54 V 4.7973 8.9320 116.6618 59.8381 36.7407 173.8828 55 Y 5.2572 8.8881 119.8706 56.4677 41.0791 175.2650 56 I 4.6382 8.5598 123.1056 59.6357 39.9433 174.0554 57 K 4.7742 8.8438 129.4392 54.1270 35.0175 175.0718 58 S 4.6395 8.9049 123.0929 58.3069 62.5672 174.9084 59 T 3.8164 8.4874 118.8976 64.6844 68.7120 175.9166 60 E 4.0555 8.3778 122.6139 58.8611 29.8814 177.1943 61 T 4.2057 7.6652 105.5271 60.9660 69.6875 175.7898 62 G 3.7818 8.3554 110.2394 45.5556 0.0000 173.7197 63 Q 4.3708 7.5334 119.0415 55.8729 30.2085 174.6854 64 Y 4.9068 9.1271 120.6280 56.4178 40.1560 175.0474 65 L 4.4170 8.9876 126.0145 55.3475 43.4961 175.5578 66 A 5.0935 8.6765 125.7502 50.7469 23.2446 174.4589 67 M 5.3541 8.5536 119.6964 53.7613 34.6828 175.6849 68 D 5.2531 9.9027 126.3842 51.9697 40.9084 177.0533 69 T 4.2281 8.5786 108.5575 63.9541 68.5696 174.3959 70 D 4.7049 8.5582 121.1295 53.9568 41.4540 176.9765 71 G 3.2186 8.6724 108.4256 45.2729 0.0000 172.8318 72 L 4.8803 7.7718 118.8102 52.9212 43.9669 175.8398 73 L 5.1561 8.4637 122.2845 54.8379 43.1474 175.3732 74 Y 4.8965 8.7758 119.1618 56.1476 41.9443 173.4093 75 G 4.2227 9.0018 108.9232 45.6915 0.0000 173.1266 76 S 5.0489 9.3103 121.6111 56.6332 64.2728 175.2149 77 Q 4.0310 9.1436 126.0782 58.3117 28.8752 176.6172 78 T 4.7605 7.6785 105.6714 59.0876 71.5270 172.6948 79 P 3.8614 0.0000 0.0000 61.3153 29.9779 175.1509 80 N 4.7924 7.5442 124.3391 51.9653 40.1602 176.1993 81 E 3.8817 8.6320 114.9760 59.3764 29.7201 177.4268 82 E 4.1605 9.0460 118.5288 57.3660 29.7872 177.2435 83 C 5.0886 7.8426 115.4085 58.9336 29.2866 173.4038 84 L 4.3831 7.2940 121.0540 53.5591 42.9521 175.6181 85 F 5.1549 8.8294 121.5707 55.5316 43.2423 174.2096 86 L 4.8093 9.1476 122.9759 53.8513 42.8055 175.4896 87 E 4.3938 8.9648 127.0266 55.3002 30.1210 175.6931 88 R 4.8128 8.5603 125.5495 54.0688 34.7518 174.7069 89 L 4.7191 8.6210 123.8918 55.1457 43.1844 175.7966 90 E 4.6900 9.2553 124.8728 55.1563 33.5044 175.0664 91 E 3.9549 9.6245 124.1320 57.9507 27.2637 174.1880 92 N 4.3130 8.6085 110.6223 54.2775 36.6225 174.2447 93 H 4.6731 8.5044 115.8441 57.7381 34.5339 173.3732 94 Y 4.6404 7.8129 115.8498 57.3082 40.1027 173.5526 95 N 5.4844 9.2780 118.5178 52.2637 41.0236 174.6618 96 T 5.3182 8.7090 111.7085 60.3139 73.2498 172.4019 97 Y 5.0519 8.7119 119.1079 56.6157 41.7527 174.1729 98 I 4.6518 8.6537 125.9680 59.1016 39.6885 175.3997 99 S 3.9277 8.7200 122.1233 58.6374 62.3426 174.0343 100 K 3.8736 8.6523 129.1548 59.4026 32.3119 178.5569 101 K 3.7361 7.9004 117.6442 59.0983 32.1554 177.4862 102 H 5.4126 8.2364 116.6805 54.5910 30.0963 176.6552 103 A 3.9608 7.7051 126.2302 55.1974 18.2025 179.9620 104 E 3.9282 8.0751 114.9109 58.9450 29.8576 178.3833 105 K 4.0895 7.5055 116.7969 55.7705 32.5951 175.9400 106 N 3.9363 7.6778 115.4942 53.9613 36.4223 174.7593 107 W 5.1435 7.8073 117.9916 56.0554 30.7269 177.1968 108 F 5.3111 9.0981 123.8974 55.6548 41.1566 175.6857 109 V 4.0712 8.9149 121.1211 62.8202 32.5208 175.1688 110 G 4.4071 8.6443 112.8932 45.1901 0.0000 171.3921 111 L 5.2755 8.2015 122.5594 52.4594 44.3499 177.1219 112 K 4.2275 9.2535 123.2913 55.5556 32.8272 178.3954 113 K 4.0506 8.4263 119.6254 58.8820 32.0162 177.7126 114 N 4.6667 8.0633 115.2540 52.3210 37.4779 175.8958 115 G 3.6669 7.8492 106.2782 46.1986 0.0000 173.7325 116 S 4.9862 7.6282 114.3698 56.3073 65.6638 173.3909 117 C 4.5499 8.6077 121.3012 59.7196 32.2878 172.7746 118 K 4.3832 8.6856 127.0112 54.3241 33.0243 175.9012 119 R 3.8111 8.7412 127.8195 56.7503 30.6144 176.6572 120 G 3.4945 8.7946 115.3653 48.2900 0.0000 173.8962 121 P 4.2913 0.0000 0.0000 64.9272 31.3559 177.7095 122 R 4.1916 7.7456 115.1105 57.0751 30.3413 176.4522 123 T 5.1357 7.6616 108.2957 59.9634 70.5538 173.5030 124 H 4.5947 7.9080 114.9264 54.9545 30.3909 173.1688 125 Y 3.8429 8.5925 118.4077 60.1273 38.0804 177.2199 126 G 4.0485 9.0415 111.0879 45.3675 0.0000 173.7831 127 Q 4.3378 7.3375 118.4987 54.6590 30.1202 177.1759 128 K 3.5454 8.3050 119.6908 58.9749 32.7756 179.3517 129 A 3.8754 7.8771 121.8915 54.6345 18.2648 178.5449 130 I 4.5192 6.7154 105.9153 60.5585 38.2968 175.4989 131 L 4.3671 7.2012 122.6192 54.0097 42.0233 176.1844 132 F 5.1660 9.4206 122.4368 55.4645 43.5543 173.9326 133 L 5.1656 9.1027 122.7311 52.8028 45.0233 173.6656 134 P 5.2982 0.0000 0.0000 62.3929 31.6959 175.3090 135 L 4.8038 9.3335 126.0061 52.4012 44.3886 174.9169 136 P 4.5060 0.0000 0.0000 62.6842 32.7049 176.8442 137 V 3.6014 8.2159 119.1080 63.7182 32.4051 171.6784 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 1B H 8.30 4.72 0.00 3.15 3.58 0.00 5.75 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1C H 8.82 3.53 0.00 3.31 3.33 0.00 6.05 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 1D H 8.72 4.20 0.00 3.22 3.30 0.00 5.64 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E H 8.12 5.06 0.00 3.33 3.22 0.00 5.66 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1F H 8.98 4.55 0.00 3.32 3.41 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 1G F 8.46 4.80 0.00 2.73 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.28 4.73 0.00 2.92 2.77 0.00 0.00 6.90 6.74 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 3 L 8.07 4.65 0.00 1.48 1.41 0.59 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.56 0.00 2.22 2.06 0.00 3.67 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.89 0.00 5 P 0.00 4.39 0.00 2.16 2.10 0.00 3.74 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.92 0.00 6 G 8.88 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 7 N 7.92 4.66 0.00 2.64 2.68 0.00 0.00 5.85 7.55 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 8 Y 7.97 4.94 0.00 3.03 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 9 K 9.15 4.16 0.00 1.83 1.90 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.51 1.50 7.81 10 K 7.63 4.68 0.00 1.74 1.72 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.40 7.81 11 P 0.00 4.79 0.00 2.07 2.05 0.00 3.33 0.00 0.00 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.84 0.00 12 K 9.64 4.96 0.00 1.63 1.78 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.87 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.60 1.63 7.81 13 L 9.23 4.96 0.00 1.70 1.73 0.78 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.76 4.91 0.00 1.60 1.63 0.34 0.88 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 15 Y 9.48 4.66 0.00 3.03 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 16 C 7.86 3.94 0.00 2.50 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 S 8.06 4.32 0.00 3.57 3.66 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.47 4.15 0.00 2.74 2.77 0.00 0.00 6.74 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.87 3.35 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 0.00 17 H 8.17 4.58 0.00 2.97 2.95 0.00 7.17 0.00 0.00 0.00 0.00 5.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 F 7.37 4.03 0.00 3.05 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 23 L 9.09 4.18 0.00 1.85 1.56 0.89 0.19 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 24 R 9.17 4.93 0.00 1.96 1.94 0.00 3.24 0.00 0.00 3.37 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.71 0.00 25 I 8.40 4.69 1.84 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.74 0.89 0.00 0.00 26 L 9.33 4.20 0.00 1.82 1.58 0.93 0.87 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 27 P 0.00 4.16 0.00 1.99 2.11 0.00 3.53 0.00 0.00 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.92 0.00 28 D 8.00 4.53 0.00 2.79 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 29 G 8.58 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 0.00 0.00 0.00 0.00 30 T 7.85 4.40 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 1.23 0.00 0.00 31 V 8.27 4.96 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 0.91 0.00 0.00 0.92 0.00 0.00 32 D 8.70 4.50 0.00 2.94 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 G 8.96 4.59 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 0.00 0.00 0.00 34 T 8.54 5.00 4.34 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 1.41 0.00 0.00 35 R 8.75 4.39 0.00 1.88 2.02 0.00 3.25 0.00 0.00 3.14 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.43 0.00 36 D 8.07 4.49 0.00 2.82 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 37 R 8.59 3.28 0.00 1.86 1.88 0.00 3.30 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.23 0.00 38 S 7.90 4.50 0.00 3.96 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 39 D 7.76 4.41 0.00 2.81 2.58 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 0.00 0.00 0.00 0.00 40 Q 8.43 4.28 0.00 1.85 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.20 0.00 0.00 0.00 0.00 0.00 2.26 2.24 0.00 41 H 9.22 4.93 0.00 3.29 3.49 0.00 5.77 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.47 4.57 1.89 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 1.51 0.91 1.00 0.00 0.00 43 Q 7.80 4.25 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.88 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 44 L 9.05 5.17 0.00 1.49 1.43 0.82 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 9.32 4.86 0.00 2.09 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.84 0.00 0.00 0.00 0.00 0.00 2.25 2.36 0.00 46 L 8.61 5.05 0.00 1.69 1.41 0.90 1.04 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 47 S 8.76 4.65 0.00 3.91 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 48 A 8.47 4.54 1.30 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 0.00 0.00 49 E 9.17 4.06 0.00 1.72 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.31 0.00 50 S 5.81 4.60 0.00 4.13 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 51 V 8.16 3.91 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 1.03 0.00 0.00 52 G 9.27 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 53 E 8.15 5.12 0.00 1.82 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 2.19 2.27 0.00 54 V 8.93 4.80 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 1.10 0.00 0.00 55 Y 8.89 5.26 0.00 2.95 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 I 8.56 4.64 1.64 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.60 0.65 0.00 0.00 57 K 8.84 4.77 0.00 1.55 1.56 0.00 1.18 0.00 0.00 1.32 0.00 0.00 2.51 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.97 0.39 7.81 58 S 8.90 4.64 0.00 3.84 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 59 T 8.49 3.82 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 1.18 0.00 0.00 60 E 8.38 4.06 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 2.24 2.39 0.00 61 T 7.67 4.21 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 1.21 0.00 0.00 62 G 8.36 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 63 Q 7.53 4.37 0.00 1.95 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.78 0.00 0.00 0.00 0.00 0.00 2.38 2.31 0.00 64 Y 9.13 4.91 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 65 L 8.99 4.42 0.00 1.59 1.39 0.80 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 66 A 8.68 5.09 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 M 8.55 5.35 0.00 2.19 2.21 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.71 0.00 68 D 9.90 5.25 0.00 2.97 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 69 T 8.58 4.23 4.37 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 1.37 0.00 0.00 70 D 8.56 4.70 0.00 2.79 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 71 G 8.67 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 0.00 0.00 0.00 72 L 7.77 4.88 0.00 1.96 1.61 0.87 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.46 5.16 0.00 1.57 1.61 0.91 0.92 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 74 Y 8.78 4.90 0.00 3.10 3.03 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 75 G 9.00 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 76 S 9.31 5.05 0.00 3.75 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 77 Q 9.14 4.03 0.00 2.15 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.55 0.00 0.00 0.00 0.00 0.00 2.44 2.34 0.00 78 T 7.68 4.76 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 1.23 0.00 0.00 79 P 0.00 3.86 0.00 1.15 0.49 0.00 3.57 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.46 0.00 80 N 7.54 4.79 0.00 2.95 3.00 0.00 0.00 5.86 7.66 0.00 0.00 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 8.63 3.88 0.00 2.03 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 2.26 2.30 0.00 82 E 9.05 4.16 0.00 2.13 2.26 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 2.35 2.45 0.00 83 C 7.84 5.09 0.00 3.15 3.16 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 84 L 7.29 4.38 0.00 1.34 1.29 0.79 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 85 F 8.83 5.15 0.00 2.99 3.05 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 86 L 9.15 4.81 0.00 1.49 1.57 0.85 0.66 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 87 E 8.96 4.39 0.00 2.08 1.88 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 2.16 1.80 0.00 88 R 8.56 4.81 0.00 1.76 1.78 0.00 3.07 0.00 0.00 2.88 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.60 0.00 89 L 8.62 4.72 0.00 1.61 1.69 1.00 0.92 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 90 E 9.26 4.69 0.00 2.21 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 2.29 2.44 0.00 91 E 9.62 3.95 0.00 2.42 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 2.29 2.40 0.00 92 N 8.61 4.31 0.00 2.82 2.87 0.00 0.00 6.84 8.16 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 93 H 8.50 4.67 0.00 2.89 2.85 0.00 5.94 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 7.81 4.64 0.00 3.03 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 N 9.28 5.48 0.00 3.04 2.55 0.00 0.00 6.91 7.50 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 96 T 8.71 5.32 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 1.34 0.00 0.00 97 Y 8.71 5.05 0.00 2.79 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 98 I 8.65 4.65 1.65 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.22 0.36 0.57 0.00 0.00 99 S 8.72 3.93 0.00 4.00 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 0.00 100 K 8.65 3.87 0.00 1.63 1.60 0.00 1.61 0.00 0.00 1.42 0.00 0.00 2.80 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.23 1.05 7.81 101 K 7.90 3.74 0.00 1.75 1.60 0.00 1.71 0.00 0.00 1.64 0.00 0.00 3.21 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.88 1.35 7.81 102 H 8.24 5.41 0.00 3.08 2.32 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 0.00 103 A 7.71 3.96 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 0.00 104 E 8.08 3.93 0.00 2.05 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 0.00 2.21 2.18 0.00 105 K 7.51 4.09 0.00 0.86 1.28 0.00 1.34 0.00 0.00 1.38 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.18 0.98 7.81 106 N 7.68 3.94 0.00 3.01 3.11 0.00 0.00 6.91 7.19 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 0.00 107 W 7.81 5.14 0.00 3.29 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 0.00 108 F 9.10 5.31 0.00 2.90 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 0.00 109 V 8.91 4.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.71 0.00 0.00 110 G 8.64 4.41 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 0.00 111 L 8.20 5.28 0.00 1.44 1.48 1.03 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 112 K 9.25 4.23 0.00 1.94 1.67 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.35 7.81 113 K 8.43 4.05 0.00 1.71 1.86 0.00 1.70 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.37 7.81 114 N 8.06 4.67 0.00 2.78 2.87 0.00 0.00 6.06 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 0.00 115 G 7.85 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 S 7.63 4.99 0.00 3.93 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 0.00 117 C 8.61 4.55 0.00 3.01 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 0.00 118 K 8.69 4.38 0.00 1.72 1.75 0.00 1.81 0.00 0.00 1.55 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.31 1.30 7.81 119 R 8.74 3.81 0.00 1.77 1.67 0.00 3.16 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.48 0.00 120 G 8.79 3.49 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 0.00 0.00 0.00 0.00 121 P 0.00 4.29 0.00 1.93 2.20 0.00 3.10 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.53 0.00 122 R 7.75 4.19 0.00 1.91 1.93 0.00 3.30 0.00 0.00 3.25 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 123 T 7.66 5.14 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 1.36 0.00 0.00 124 H 7.91 4.59 0.00 3.36 3.50 0.00 5.48 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 0.00 125 Y 8.59 3.84 0.00 3.08 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 G 9.04 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 0.00 127 Q 7.34 4.34 0.00 1.89 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.76 0.00 0.00 0.00 0.00 0.00 2.14 2.18 0.00 128 K 8.30 3.55 0.00 1.71 1.62 0.00 1.50 0.00 0.00 1.56 0.00 0.00 2.79 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.26 7.81 129 A 7.88 3.88 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 0.00 130 I 6.72 4.52 1.70 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.22 0.60 0.00 0.00 131 L 7.20 4.37 0.00 1.09 0.85 0.29 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 132 F 9.42 5.17 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 0.00 133 L 9.10 5.17 0.00 2.03 1.72 0.89 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 5.30 0.00 2.23 2.26 0.00 3.91 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.10 0.00 135 L 9.33 4.80 0.00 1.70 1.69 1.00 1.18 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 0.00 136 P 0.00 4.51 0.00 1.94 2.03 0.00 3.85 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 137 V 8.22 3.60 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 0.67 0.00 0.00 0.92 0.00 0.00