NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 21 S 4.5896 8.2348 116.1973 58.4064 63.6106 173.2794 22 S 4.2587 7.8866 121.5971 58.0210 66.7207 172.9638 23 S 5.0593 9.8621 119.2143 57.8207 66.1281 171.5926 24 N 4.8996 8.6932 116.6116 50.8058 39.1091 174.9176 25 Y 4.0267 8.8063 122.1439 61.4861 38.6241 179.5493 26 C 4.2672 8.0231 116.7843 60.0124 38.5372 175.8892 27 N 4.3539 9.0207 118.5125 56.3255 38.0513 177.5199 28 Q 3.9742 8.1389 119.4340 59.4355 28.7963 178.8762 29 M 3.7456 7.9359 119.8974 58.2714 31.7524 178.8063 30 M 4.1032 8.1592 119.4137 57.9648 31.9288 178.7946 31 K 3.9997 7.6843 121.1016 59.1171 32.2852 179.0533 32 S 4.0664 7.9647 114.1598 61.8163 62.8192 175.6342 33 R 4.2585 8.2049 116.5530 55.8639 29.5587 175.7197 34 N 4.2603 8.1442 115.4493 54.8625 37.6445 175.1409 35 L 4.4168 8.4116 118.6404 55.4931 42.3018 177.9864 36 T 5.5728 7.6090 106.1255 60.6539 69.1349 176.0088 37 K 4.2087 8.3209 123.9076 59.1419 32.2639 177.4482 38 D 4.9267 7.6992 115.0154 52.1078 40.0637 174.7812 39 R 3.8765 7.4127 114.8146 56.4290 31.3613 173.8572 40 C 5.1193 8.6872 116.0962 54.9011 40.9631 173.9538 41 K 4.3146 8.7153 126.9623 55.4885 32.7651 174.6992 42 P 4.8358 0.0000 0.0000 65.2706 32.1950 176.5741 43 V 5.1148 7.5845 115.8885 60.3314 34.6546 174.2199 44 N 4.8301 8.9495 119.4928 52.8810 42.7858 172.9527 45 T 4.9613 8.2199 121.2769 61.7562 71.1888 173.3601 46 F 4.8989 8.9658 124.4297 55.7338 41.7670 174.6125 47 V 4.5468 8.5843 123.0050 61.2724 32.8158 176.2865 48 H 4.9207 8.7949 128.9394 54.3128 26.0997 174.1180 49 E 4.7843 7.7200 117.6338 53.1988 34.5652 176.4964 50 S 4.2660 8.5085 115.9216 58.6539 64.7375 175.3765 51 L 3.9712 8.6452 123.9366 58.1806 41.4268 179.7816 52 A 3.9822 7.9204 120.0824 55.0497 18.1812 179.2387 53 D 4.3478 7.8621 116.5386 57.2473 41.1156 178.7639 54 V 3.7291 7.6506 118.7351 65.9640 31.5248 178.1540 55 Q 3.9635 8.4502 117.8006 58.5125 28.5990 178.3526 56 A 4.0354 8.1138 121.8050 54.6690 18.2660 179.6619 57 V 3.5050 7.7283 117.0323 65.9289 31.3204 176.8597 58 C 3.9762 7.6932 114.2026 57.8316 39.8738 174.0121 59 S 4.6519 7.4222 114.1795 57.9527 64.0010 174.3374 60 Q 4.2909 7.5627 122.1964 56.2651 29.9995 178.1938 61 K 4.3460 8.7686 133.4868 56.6795 32.8941 174.7723 62 N 4.3402 8.8207 127.3648 53.6409 39.5165 174.2451 63 V 4.6126 8.4327 118.0490 59.3571 36.8699 174.6402 64 A 4.3499 8.4230 124.5476 52.2553 19.2281 178.3051 65 C 4.7542 9.2633 119.1103 55.6848 41.5213 175.1405 66 K 3.7972 8.7629 122.1114 60.0241 31.7036 177.8428 67 N 4.5523 8.1308 112.5672 52.8080 37.1709 176.0829 68 G 3.9243 8.5106 107.1104 46.0596 0.0000 174.4001 69 Q 4.3564 8.4094 119.5911 55.8019 29.4861 176.0721 70 T 4.7389 8.2558 108.8207 61.6517 69.4172 173.7726 71 N 5.1421 8.0691 117.2605 54.5220 38.4721 174.5662 72 C 5.5853 7.5679 115.5056 56.5828 44.7862 173.0061 73 Y 5.1126 9.0717 118.6879 56.3455 42.2106 173.9263 74 Q 5.1671 9.1162 125.4674 54.0082 31.4546 174.8861 75 S 4.5408 8.6779 121.7062 58.6702 63.1370 174.2544 76 Y 4.5288 9.1288 121.8938 60.4533 37.8258 176.1845 77 S 5.0516 7.8380 112.1038 56.2001 66.1315 174.0479 78 T 4.2625 8.2250 110.1827 61.8299 69.8600 173.7155 79 M 5.0247 8.9241 121.6261 53.3327 36.8956 174.7539 80 S 4.9554 9.0501 117.0833 58.3860 63.5440 173.0862 81 I 5.1669 9.2684 120.5136 59.4614 41.6511 174.1945 82 T 5.0346 8.8930 120.1869 61.9913 71.0903 172.7171 83 D 5.0424 9.3801 127.2408 53.2920 43.3799 174.2730 84 C 5.5026 9.2598 123.3709 55.2845 41.3905 172.7986 85 R 5.2794 9.0633 124.6363 53.9745 32.7438 174.3104 86 E 3.9896 9.2123 128.4343 56.4477 30.2269 176.8637 87 T 4.2018 8.4636 116.6069 60.8700 69.7803 175.9594 88 G 3.6384 8.5618 111.4171 48.1385 0.0000 174.4401 89 S 4.5776 7.3562 113.8725 57.9889 63.1795 173.4965 90 S 4.5986 7.5108 115.6040 57.2772 63.3684 173.7170 91 K 4.6053 8.1598 125.4872 54.4961 35.8524 175.0911 92 Y 4.2660 8.7442 125.0163 57.4442 39.0788 174.1250 93 P 3.0729 0.0000 0.0000 63.1196 32.3227 176.5876 94 N 4.6120 7.5626 119.1187 51.9377 36.9184 173.8762 95 C 4.3885 8.2061 117.4441 56.8059 42.3986 173.5168 96 A 4.9717 8.7678 124.7884 50.4074 22.1513 174.5907 97 Y 5.0476 8.4792 117.1535 56.0439 42.2698 174.6179 98 K 4.5201 9.4922 124.4992 55.6062 34.1985 175.1574 99 T 5.0322 8.5783 123.9618 62.5312 70.1653 174.1129 100 T 4.6550 8.9839 123.2104 61.7256 72.0427 172.6968 101 Q 5.0715 8.7560 127.0363 54.7042 31.1194 174.1012 102 A 4.7077 8.8550 125.8572 50.9937 23.6304 174.7296 103 N 5.4540 8.6817 116.0263 51.6615 41.0047 174.3474 104 K 4.7790 8.8872 122.4488 54.6383 37.4842 175.6304 105 H 4.9576 8.8417 119.1452 55.8341 30.1510 174.5961 106 I 4.9452 8.6918 115.9480 59.4138 40.7574 174.4089 107 I 5.1370 8.8455 124.3253 59.8085 40.1001 175.0236 108 V 4.9204 8.9141 119.8074 59.3946 35.5561 174.4654 109 A 5.0486 8.6249 125.3735 51.1279 20.5062 175.6918 110 C 5.1825 8.6907 119.2014 55.3605 44.6740 173.2472 111 E 4.6453 8.6802 119.8474 56.4974 34.5724 175.9030 112 G 4.1079 9.5466 108.6851 44.8331 0.0000 171.6051 113 N 5.0446 8.2459 116.5190 50.8209 40.8748 172.5757 114 P 4.2674 0.0000 0.0000 62.8037 31.8543 175.4621 115 Y 4.7722 8.4101 122.0582 57.6765 38.9781 174.9269 116 V 4.5056 8.4422 119.6885 58.4169 36.5844 173.5953 117 P 4.6510 0.0000 0.0000 63.2582 31.0524 176.7317 118 V 4.3042 8.6127 116.0796 61.4295 34.2467 175.4539 119 H 4.9280 7.6651 115.9078 54.1001 33.3504 172.7535 120 F 4.6922 8.8132 119.6100 57.6166 39.3046 174.7812 121 D 4.8845 9.0693 121.4330 55.6449 43.5726 175.2016 122 A 4.4093 7.5277 117.2388 51.9667 22.9300 174.8896 123 S 4.9956 8.5299 112.6467 57.4295 66.8360 175.2885 124 V 4.1242 8.9821 117.5090 61.6099 32.1109 175.3621 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 21 S 8.23 4.59 0.00 3.85 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 S 7.89 4.26 0.00 3.91 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 S 9.86 5.06 0.00 3.85 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 24 N 8.69 4.90 0.00 3.11 3.19 0.00 0.00 6.81 7.34 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 25 Y 8.81 4.03 0.00 3.05 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 26 C 8.02 4.27 0.00 3.24 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 27 N 9.02 4.35 0.00 2.87 3.03 0.00 0.00 7.04 7.53 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 28 Q 8.14 3.97 0.00 2.23 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 29 M 7.94 3.75 0.00 0.87 1.08 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.75 0.00 30 M 8.16 4.10 0.00 1.81 1.91 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 2.56 0.00 31 K 7.68 4.00 0.00 1.96 1.86 0.00 1.61 0.00 0.00 1.79 0.00 0.00 3.07 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.38 7.81 32 S 7.96 4.07 0.00 3.79 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 33 R 8.20 4.26 0.00 1.99 2.03 0.00 3.52 0.00 0.00 3.17 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.89 0.00 34 N 8.14 4.26 0.00 2.84 2.91 0.00 0.00 7.04 7.70 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 35 L 8.41 4.42 0.00 1.77 1.70 0.88 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.61 5.57 4.42 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 1.40 0.00 0.00 37 K 8.32 4.21 0.00 1.82 1.97 0.00 1.71 0.00 0.00 1.78 0.00 0.00 3.04 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.48 1.58 7.81 38 D 7.70 4.93 0.00 2.64 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 R 7.41 3.88 0.00 1.86 1.90 0.00 2.92 0.00 0.00 3.31 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 40 C 8.69 5.12 0.00 3.08 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.72 4.31 0.00 1.77 1.80 0.00 1.79 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.60 1.49 7.81 42 P 0.00 4.84 0.00 2.14 2.10 0.00 3.63 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.11 0.00 43 V 7.58 5.11 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.95 0.00 0.00 44 N 8.95 4.83 0.00 2.71 2.38 0.00 0.00 7.07 6.76 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 45 T 8.22 4.96 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 0.99 0.00 0.00 46 F 8.97 4.90 0.00 3.14 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.58 4.55 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 0.88 0.00 0.00 1.20 0.00 0.00 48 H 8.79 4.92 0.00 3.13 3.25 0.00 5.67 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.72 4.78 0.00 1.92 1.81 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 2.25 2.27 0.00 50 S 8.51 4.27 0.00 4.05 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 51 L 8.65 3.97 0.00 1.75 1.76 0.94 0.87 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 52 A 7.92 3.98 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 53 D 7.86 4.35 0.00 2.86 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 54 V 7.65 3.73 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.94 0.00 0.00 55 Q 8.45 3.96 0.00 2.21 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.30 2.52 0.00 56 A 8.11 4.04 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 57 V 7.73 3.50 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 1.07 0.00 0.00 0.94 0.00 0.00 58 C 7.69 3.98 0.00 2.87 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 59 S 7.42 4.65 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 60 Q 7.56 4.29 0.00 1.74 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.94 0.00 0.00 0.00 0.00 0.00 1.60 2.14 0.00 61 K 8.77 4.35 0.00 2.13 1.93 0.00 1.62 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.50 1.46 7.81 62 N 8.82 4.34 0.00 2.73 2.65 0.00 0.00 7.00 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 63 V 8.43 4.61 2.03 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 0.70 0.00 0.00 0.90 0.00 0.00 64 A 8.42 4.35 1.21 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 0.00 0.00 0.00 65 C 9.26 4.75 0.00 3.18 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 66 K 8.76 3.80 0.00 1.74 1.91 0.00 1.70 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.49 1.64 7.81 67 N 8.13 4.55 0.00 2.82 2.91 0.00 0.00 6.05 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 68 G 8.51 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 69 Q 8.41 4.36 0.00 2.34 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.84 0.00 0.00 0.00 0.00 0.00 2.39 2.30 0.00 70 T 8.26 4.74 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 1.18 0.00 0.00 71 N 8.07 5.14 0.00 2.98 3.19 0.00 0.00 5.94 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 72 C 7.57 5.59 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 73 Y 9.07 5.11 0.00 2.86 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 74 Q 9.12 5.17 0.00 2.09 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.99 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 75 S 8.68 4.54 0.00 3.96 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 76 Y 9.13 4.53 0.00 3.02 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 77 S 7.84 5.05 0.00 3.86 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 T 8.23 4.26 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 1.05 0.00 0.00 79 M 8.92 5.02 0.00 1.93 1.98 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.47 0.00 80 S 9.05 4.96 0.00 3.95 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 81 I 9.27 5.17 1.87 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 1.23 0.72 0.95 0.00 0.00 82 T 8.89 5.03 4.54 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 0.00 0.00 0.00 1.39 0.00 0.00 83 D 9.38 5.04 0.00 2.73 2.54 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 0.00 0.00 0.00 0.00 84 C 9.26 5.50 0.00 2.98 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 85 R 9.06 5.28 0.00 1.89 1.79 0.00 3.12 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 86 E 9.21 3.99 0.00 2.09 1.73 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 2.07 1.63 0.00 87 T 8.46 4.20 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 1.18 0.00 0.00 88 G 8.56 3.64 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 0.00 0.00 0.00 89 S 7.36 4.58 0.00 4.09 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 90 S 7.51 4.60 0.00 3.72 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 91 K 8.16 4.61 0.00 1.79 1.64 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.82 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.44 1.43 7.81 92 Y 8.74 4.27 0.00 2.93 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 93 P 0.00 3.07 0.00 1.71 1.19 0.00 3.69 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.78 0.00 94 N 7.56 4.61 0.00 2.67 2.78 0.00 0.00 6.96 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 95 C 8.21 4.39 0.00 3.13 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 96 A 8.77 4.97 1.10 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 0.00 0.00 97 Y 8.48 5.05 0.00 2.89 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 9.49 4.52 0.00 1.87 1.84 0.00 1.55 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.50 7.81 99 T 8.58 5.03 4.32 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 1.31 0.00 0.00 100 T 8.98 4.65 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 1.22 0.00 0.00 101 Q 8.76 5.07 0.00 1.99 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.76 0.00 0.00 0.00 0.00 0.00 2.20 2.38 0.00 102 A 8.86 4.71 1.21 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 0.00 0.00 0.00 103 N 8.68 5.45 0.00 2.57 2.73 0.00 0.00 6.69 7.61 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 0.00 104 K 8.89 4.78 0.00 1.65 1.64 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.84 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.39 7.81 105 H 8.84 4.96 0.00 3.10 3.27 0.00 5.59 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.69 4.95 2.30 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 1.32 0.99 1.06 0.00 0.00 107 I 8.85 5.14 2.03 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 1.25 0.58 0.94 0.00 0.00 108 V 8.91 4.92 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 0.46 0.00 0.00 0.89 0.00 0.00 109 A 8.62 5.05 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 0.00 110 C 8.69 5.18 0.00 1.86 1.72 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 0.00 111 E 8.68 4.65 0.00 1.84 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 2.28 2.25 0.00 112 G 9.55 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 0.00 113 N 8.25 5.04 0.00 2.64 2.68 0.00 0.00 6.88 7.69 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 0.00 114 P 0.00 4.27 0.00 2.22 2.05 0.00 3.82 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 1.98 1.95 0.00 115 Y 8.41 4.77 0.00 2.80 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 0.00 116 V 8.44 4.51 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.95 0.00 0.00 117 P 0.00 4.65 0.00 1.72 1.77 0.00 3.48 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.96 0.00 118 V 8.61 4.30 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 0.63 0.00 0.00 0.94 0.00 0.00 119 H 7.67 4.93 0.00 3.02 3.14 0.00 5.61 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.81 4.69 0.00 3.00 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 0.00 121 D 9.07 4.88 0.00 2.65 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 A 7.53 4.41 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 0.00 123 S 8.53 5.00 0.00 3.61 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 0.00 124 V 8.98 4.12 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 0.65 0.00 0.00 0.96 0.00 0.00