NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 V 4.2946 8.0549 120.6756 62.7672 33.1544 174.2010 3 K 4.3912 8.9665 125.6901 54.2729 33.9050 170.3159 4 V 4.8486 9.1481 125.6247 61.5955 33.8632 174.5869 5 T 4.5551 8.8862 123.1169 61.8173 73.0409 173.8579 6 Y 5.5946 8.0406 120.5008 57.3839 38.3885 175.9439 7 D 4.5893 7.8755 119.2809 53.5161 41.6956 176.1080 8 I 3.7119 8.0601 121.8578 60.5369 38.4182 174.3563 9 P 4.5698 0.0000 0.0000 62.2045 32.1983 176.7359 10 T 4.2427 8.1787 110.8631 61.5442 70.9194 175.5301 11 C 4.1552 8.4913 119.5358 62.9208 28.1346 175.9197 12 E 3.9433 8.1725 120.3540 59.5181 29.2425 178.4672 13 D 4.3391 8.2082 118.8371 57.3863 40.8879 178.0515 14 Y 4.0176 8.1967 119.9725 61.0850 38.8558 178.0192 15 C 4.0189 8.5203 117.4618 62.7602 28.2263 176.0814 16 A 3.9662 8.2834 122.6650 54.8950 17.9127 179.5159 17 L 3.7724 8.2047 119.2956 58.1763 41.9520 179.0235 18 R 3.7489 7.3557 116.7807 59.5630 30.3515 178.6677 19 I 3.8183 7.5620 119.0088 64.4698 37.1292 177.8445 20 N 4.5999 8.3303 115.2079 54.3198 38.3841 176.1242 21 A 4.6432 7.3793 122.9176 50.3107 20.4779 175.9812 22 G 3.3929 7.6249 106.6102 45.4149 0.0000 173.3043 *24 S 4.2130 7.5899 114.4756 57.4938 64.6164 173.1927 25 P 4.4721 0.0000 0.0000 62.5758 32.0330 175.5343 26 K 4.6984 8.1368 118.7529 54.6029 34.7033 177.2116 27 T 4.1825 8.2064 112.7895 61.6461 70.8592 175.9327 28 R 3.9869 8.5501 121.3671 59.3052 30.1076 178.9334 29 E 3.8951 8.2153 118.5967 59.2696 29.7142 178.6388 30 A 3.9719 8.1948 120.5335 55.0327 18.3616 179.4090 31 A 3.7301 8.1441 119.3029 55.2506 18.2226 179.6656 32 E 3.8476 8.2119 116.2743 59.6842 29.6607 179.6124 33 K 4.1992 7.9384 117.2084 58.7426 32.3539 178.9719 34 G 3.7773 7.9290 105.5056 46.5939 0.0000 175.9021 35 L 3.8077 7.7487 120.7023 57.1716 41.7431 177.4925 36 P 4.4504 0.0000 0.0000 63.9636 31.3549 176.5588 37 N 4.8381 7.6513 113.9454 52.6615 39.1142 174.6173 38 A 4.3224 7.6756 121.1984 51.6273 19.3298 178.3150 39 L 4.2699 8.5678 121.3625 57.6971 42.4692 177.7870 40 F 4.6075 7.6294 119.1228 57.0648 43.0531 173.2935 41 T 4.8511 7.2903 120.9182 61.5791 72.5568 172.8852 42 V 4.9784 8.2634 125.8992 59.9795 33.8891 175.2131 43 T 4.7770 9.0643 113.4239 59.8465 72.3835 172.4699 44 L 5.1390 8.4801 123.6353 53.1762 44.9564 175.0011 45 Y 4.9937 8.8317 120.3813 56.1362 41.9206 174.1175 46 D 4.9611 9.1209 124.1248 52.5211 42.9231 177.8982 47 K 3.7000 8.8935 128.2931 58.1234 31.2974 176.0099 48 D 4.7880 9.1514 123.8587 54.6518 41.1517 175.0750 49 R 4.5909 8.0225 120.6840 54.0279 31.8051 174.9555 50 L 3.9716 8.5745 127.6384 54.7685 42.5717 176.1655 51 I 3.9032 8.0126 118.8260 60.5646 39.0983 174.7366 52 G 4.5750 7.0836 107.0380 45.5056 0.0000 172.2823 *54 G 4.2656 8.2990 105.9924 46.3234 0.0000 172.2061 55 R 5.2888 8.7192 118.9239 54.2002 35.1932 174.3721 56 V 4.9951 8.7669 120.6205 61.2139 34.7715 174.5758 57 I 4.8436 9.4346 120.6946 58.6938 41.0278 175.1079 58 G 3.9759 7.5845 107.9873 46.7000 0.0000 171.9048 59 D 4.7371 7.8425 118.7322 52.5966 39.6414 177.3282 60 G 4.1587 8.8628 107.4027 46.0557 0.0000 173.6214 61 G 4.3607 7.7381 105.5891 46.8331 0.0000 174.1570 62 T 4.5773 8.6898 117.2525 64.1807 70.9474 175.4579 63 V 5.1351 7.3311 119.3068 60.4666 34.9173 173.7462 64 F 5.4485 9.6022 121.5036 55.8377 43.8275 173.3842 65 Q 5.1568 9.2520 121.9355 54.5188 32.1193 174.0756 66 I 4.7074 8.3231 127.5522 60.7647 38.3022 175.6456 67 V 4.4203 8.4648 119.0601 59.6477 36.7927 174.5742 68 D 4.4741 8.5741 117.9509 55.5554 38.0618 174.7868 69 I 4.1712 7.8485 120.0631 60.7531 36.7018 175.5461 70 A 4.6056 8.3229 128.2514 49.9936 21.6946 174.7962 71 V 4.7741 8.0593 121.9966 60.3924 34.5435 174.6134 72 L 4.0755 8.4552 126.4115 55.1895 42.4400 178.0789 73 K 3.8444 9.1294 124.9155 59.7328 32.1528 178.9100 74 S 4.2629 8.1570 111.0368 60.4610 63.1497 174.0548 75 Y 4.4696 8.0111 117.3158 57.7507 38.2371 175.8524 76 Q 4.2669 7.8484 119.6782 56.7849 29.4369 175.9902 77 G 3.9711 9.7207 106.6759 46.1777 0.0000 174.4397 78 Q 4.3144 7.9669 113.8718 55.9765 29.1899 175.1432 79 A 3.9606 8.3793 120.9636 52.9003 16.7715 180.5944 80 Y 4.3423 7.8277 113.7857 60.6860 37.7190 178.1352 81 G 3.6666 8.1471 105.6378 48.0115 0.0000 175.4539 82 S 4.4934 7.9979 116.1112 61.1155 63.3303 175.9470 83 L 4.2814 8.2560 123.4125 58.2678 41.7559 179.4473 84 I 3.5953 7.7337 116.3554 62.6523 36.9970 177.4430 *86 E 4.3671 8.0266 120.7609 56.9236 31.5056 177.1634 87 H 4.4294 8.2749 115.5468 59.0128 29.0834 178.3575 88 I 3.5829 8.1281 117.3006 61.9595 35.8683 177.7213 *90 K 4.0726 8.1934 123.4207 56.6802 33.7847 177.0898 91 Y 3.6191 7.5367 119.0111 60.7169 38.4206 178.2956 92 I 2.8962 7.4761 120.6398 63.8361 36.8736 178.2751 93 K 3.8164 7.0200 120.0730 59.4041 32.0533 177.9445 94 N 4.4722 7.4329 114.5296 54.3735 38.7318 175.9626 95 V 4.1780 6.8922 111.3544 61.2446 34.1427 176.1233 96 S 4.3814 7.9519 114.3166 58.0073 62.9022 172.9928 97 V 4.5206 7.8646 117.3412 58.6474 35.4600 174.4531 98 E 3.9823 8.6029 121.0587 58.5352 29.3512 177.1292 99 S 4.4060 8.9278 119.8092 57.6716 61.8188 169.2160 100 V 3.9625 7.6198 121.5942 63.6169 31.9969 174.3227 101 Y 4.8580 8.9148 128.4759 55.8514 41.2024 174.3375 102 V 5.1109 7.9199 125.4996 61.1827 34.6729 174.2867 103 S 4.9914 9.0177 121.0876 56.8886 67.0817 172.1530 104 L 4.6153 8.1181 119.0464 55.0230 43.3540 174.5189 105 I 4.3092 8.0494 119.5815 59.2914 38.9838 175.2725 106 A 4.6836 8.2821 127.8212 50.0948 21.7075 175.5089 107 D 4.7572 8.3759 122.0380 52.3885 41.3423 175.2190 108 Y 4.4329 8.6924 116.5182 57.0866 38.9017 173.8687 109 P 3.8082 0.0000 0.0000 64.9076 31.6470 177.4948 110 A 3.8456 7.5024 122.8213 55.1508 17.9588 179.2230 111 D 4.4835 8.0309 117.5656 56.6979 38.9146 179.1391 112 K 3.9206 7.8851 119.4269 59.0134 32.1917 178.7509 113 L 4.0134 7.6036 120.6098 58.4955 42.0554 178.7687 114 Y 4.4751 7.2988 115.9636 60.8078 37.8746 178.0793 115 V 3.9200 8.0417 119.5949 66.0532 31.3303 178.0836 116 K 3.8767 7.8483 116.9171 58.4003 31.8103 177.5693 117 F 4.5029 8.2624 115.5670 57.0778 39.3037 176.4600 118 G 3.8979 8.0860 109.4126 45.0040 0.0000 173.9676 119 F 4.0579 7.7822 117.9130 56.4466 39.8986 172.4100 *121 P 4.2886 0.0000 0.0000 62.7411 32.3999 177.4618 122 T 4.1363 8.4198 111.8839 64.5042 69.0381 175.0562 123 E 4.5046 8.3118 120.5107 55.1634 30.0186 175.6943 124 P 4.5558 0.0000 0.0000 64.3575 32.2356 177.1631 125 D 4.5385 8.1618 118.5842 56.7885 41.3726 176.5130 126 S 4.8055 8.2524 113.6232 56.7493 66.9426 173.1690 127 G 4.4198 7.7978 109.8531 42.8231 0.0000 172.8754 128 G 3.7532 8.4374 110.9189 45.0291 0.0000 172.0032 *130 Y 4.5297 7.9025 116.4509 56.7642 38.8795 174.3322 131 I 4.1972 7.9905 119.9070 59.0961 40.5786 175.0477 132 K 4.5102 8.1367 123.6750 54.8207 34.6251 175.5799 133 Y 4.3909 8.6090 122.4504 58.3170 37.9779 175.3124 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 2 V 8.05 4.29 2.22 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 0.96 0.00 0.00 0.77 0.00 0.00 3 K 8.97 4.39 0.00 1.85 1.73 0.00 1.61 0.00 0.00 1.56 0.00 0.00 2.85 0.00 0.00 2.61 0.00 0.00 0.00 0.00 1.39 1.47 7.81 4 V 9.15 4.85 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 0.64 0.00 0.00 0.95 0.00 0.00 5 T 8.89 4.56 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 1.44 0.00 0.00 6 Y 8.04 5.59 0.00 2.87 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 7 D 7.88 4.59 0.00 2.72 2.61 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 0.00 0.00 0.00 0.00 8 I 8.06 3.71 1.84 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 1.37 0.68 0.90 0.00 0.00 9 P 0.00 4.57 0.00 2.14 2.00 0.00 3.67 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.06 0.00 10 T 8.18 4.24 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 1.23 0.00 0.00 11 C 8.49 4.16 0.00 3.01 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 12 E 8.17 3.94 0.00 2.05 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 2.39 2.42 0.00 13 D 8.21 4.34 0.00 2.96 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 14 Y 8.20 4.02 0.00 3.04 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 15 C 8.52 4.02 0.00 3.10 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 16 A 8.28 3.97 1.35 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 17 L 8.20 3.77 0.00 1.68 1.68 0.82 0.68 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 18 R 7.36 3.75 0.00 1.77 1.83 0.00 3.02 0.00 0.00 3.32 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.86 0.00 19 I 7.56 3.82 1.83 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 1.49 0.77 0.89 0.00 0.00 20 N 8.33 4.60 0.00 2.83 2.83 0.00 0.00 6.92 7.04 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 21 A 7.38 4.64 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 22 G 7.62 3.39 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 0.00 *24 S 7.59 4.21 0.00 4.01 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 25 P 0.00 4.47 0.00 2.21 2.08 0.00 3.72 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 26 K 8.14 4.70 0.00 1.94 1.90 0.00 1.87 0.00 0.00 1.83 0.00 0.00 3.09 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.42 1.65 7.81 27 T 8.21 4.18 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 1.24 0.00 0.00 28 R 8.55 3.99 0.00 1.89 2.04 0.00 3.15 0.00 0.00 3.29 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.72 0.00 29 E 8.22 3.90 0.00 2.03 1.95 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 2.37 2.38 0.00 30 A 8.19 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 31 A 8.14 3.73 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 32 E 8.21 3.85 0.00 2.09 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 2.33 2.55 0.00 33 K 7.94 4.20 0.00 1.85 1.84 0.00 1.67 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.67 7.81 34 G 7.93 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 35 L 7.75 3.81 0.00 1.51 1.60 0.81 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.45 0.00 1.98 2.07 0.00 3.52 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.12 0.00 37 N 7.65 4.84 0.00 2.78 2.78 0.00 0.00 6.93 7.38 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 38 A 7.68 4.32 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.57 4.27 0.00 1.74 1.88 1.29 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 40 F 7.63 4.61 0.00 1.58 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 0.00 0.00 0.00 0.00 41 T 7.29 4.85 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 1.10 0.00 0.00 42 V 8.26 4.98 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 0.85 0.00 0.00 1.03 0.00 0.00 43 T 9.06 4.78 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 1.10 0.00 0.00 44 L 8.48 5.14 0.00 1.31 1.39 0.99 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 45 Y 8.83 4.99 0.00 2.78 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 46 D 9.12 4.96 0.00 2.53 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 47 K 8.89 3.70 0.00 1.94 1.00 0.00 1.79 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.37 1.47 7.81 48 D 9.15 4.79 0.00 2.64 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.02 4.59 0.00 1.83 1.86 0.00 3.12 0.00 0.00 3.08 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.51 0.00 50 L 8.57 3.97 0.00 1.47 1.43 0.25 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 51 I 8.01 3.90 0.56 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 0.15 0.04 0.00 0.00 52 G 7.08 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.30 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 55 R 8.72 5.29 0.00 1.76 1.76 0.00 3.21 0.00 0.00 3.43 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.57 0.00 56 V 8.77 5.00 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 1.36 0.00 0.00 1.03 0.00 0.00 57 I 9.43 4.84 1.91 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.05 0.94 0.00 0.00 58 G 7.58 3.98 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 0.00 0.00 0.00 59 D 7.84 4.74 0.00 2.69 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.86 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 61 G 7.74 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 T 8.69 4.58 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 63 V 7.33 5.14 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 0.77 0.00 0.00 1.08 0.00 0.00 64 F 9.60 5.45 0.00 2.97 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 Q 9.25 5.16 0.00 2.14 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.92 0.00 0.00 0.00 0.00 0.00 2.27 2.43 0.00 66 I 8.32 4.71 1.64 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.71 0.81 0.00 0.00 67 V 8.46 4.42 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 0.84 0.00 0.00 0.96 0.00 0.00 68 D 8.57 4.47 0.00 2.93 2.81 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 69 I 7.85 4.17 1.98 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 1.36 0.86 0.96 0.00 0.00 70 A 8.32 4.61 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 71 V 8.06 4.77 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 1.14 0.00 0.00 0.99 0.00 0.00 72 L 8.46 4.08 0.00 1.85 1.73 0.78 1.04 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 73 K 9.13 3.84 0.00 2.03 1.85 0.00 1.71 0.00 0.00 1.84 0.00 0.00 3.08 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.46 7.81 74 S 8.16 4.26 0.00 3.96 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 75 Y 8.01 4.47 0.00 3.01 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 76 Q 7.85 4.27 0.00 2.25 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.22 0.00 0.00 0.00 0.00 0.00 2.44 2.70 0.00 77 G 9.72 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 78 Q 7.97 4.31 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.45 0.00 0.00 0.00 0.00 0.00 2.51 2.33 0.00 79 A 8.38 3.96 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 80 Y 7.83 4.34 0.00 3.12 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 81 G 8.15 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 82 S 8.00 4.49 0.00 4.08 4.14 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 83 L 8.26 4.28 0.00 1.93 2.00 1.08 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 84 I 7.73 3.60 2.06 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.61 0.95 0.00 0.00 *86 E 8.03 4.37 0.00 2.24 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 0.00 2.72 2.45 0.00 87 H 8.27 4.43 0.00 3.59 3.76 0.00 5.62 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 88 I 8.13 3.58 1.85 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.89 0.92 0.00 0.00 *90 K 8.19 4.07 0.00 1.86 1.99 0.00 1.78 0.00 0.00 1.84 0.00 0.00 2.88 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.40 1.42 7.81 91 Y 7.54 3.62 0.00 1.43 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 0.00 0.00 0.00 0.00 92 I 7.48 2.90 1.62 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 0.88 0.44 0.48 0.00 0.00 93 K 7.02 3.82 0.00 1.83 1.87 0.00 1.75 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.42 7.81 94 N 7.43 4.47 0.00 2.54 2.71 0.00 0.00 6.85 8.02 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 95 V 6.89 4.18 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 0.39 0.00 0.00 0.36 0.00 0.00 96 S 7.95 4.38 0.00 3.83 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 97 V 7.86 4.52 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 0.70 0.00 0.00 0.96 0.00 0.00 98 E 8.60 3.98 0.00 1.92 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 0.00 2.31 2.34 0.00 99 S 8.93 4.41 0.00 4.17 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 V 7.62 3.96 2.22 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 1.05 0.00 0.00 1.14 0.00 0.00 101 Y 8.91 4.86 0.00 3.13 2.93 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 0.00 102 V 7.92 5.11 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 1.13 0.00 0.00 0.98 0.00 0.00 103 S 9.02 4.99 0.00 3.93 3.86 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 0.00 104 L 8.12 4.62 0.00 1.14 1.33 -0.01 -1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 105 I 8.05 4.31 1.79 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.90 0.84 0.00 0.00 106 A 8.28 4.68 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 0.00 107 D 8.38 4.76 0.00 3.01 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 0.00 108 Y 8.69 4.43 0.00 3.01 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 0.00 109 P 0.00 3.81 0.00 2.27 2.42 0.00 3.78 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.12 0.00 110 A 7.50 3.85 1.48 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 0.00 0.00 0.00 0.00 0.00 0.00 111 D 8.03 4.48 0.00 2.79 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 0.00 112 K 7.89 3.92 0.00 1.80 1.88 0.00 1.70 0.00 0.00 1.62 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.51 7.81 113 L 7.60 4.01 0.00 1.53 1.16 1.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 114 Y 7.30 4.48 0.00 3.06 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 0.00 115 V 8.04 3.92 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 1.05 0.00 0.00 1.02 0.00 0.00 116 K 7.85 3.88 0.00 1.63 1.33 0.00 1.73 0.00 0.00 1.60 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.63 7.81 117 F 8.26 4.50 0.00 3.55 3.33 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 0.00 118 G 8.09 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 0.00 0.00 0.00 119 F 7.78 4.06 0.00 3.28 3.12 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 *121 P 0.00 4.29 0.00 2.11 2.07 0.00 3.72 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.11 0.00 122 T 8.42 4.14 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 1.33 0.00 0.00 123 E 8.31 4.50 0.00 2.08 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 2.46 2.27 0.00 124 P 0.00 4.56 0.00 2.20 2.20 0.00 3.80 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.00 0.00 125 D 8.16 4.54 0.00 2.72 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 0.00 126 S 8.25 4.81 0.00 3.91 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 0.00 127 G 7.80 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 0.00 0.00 0.00 0.00 128 G 8.44 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *130 Y 7.90 4.53 0.00 3.14 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 0.00 131 I 7.99 4.20 1.60 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.50 0.25 0.00 0.00 132 K 8.14 4.51 0.00 1.87 1.75 0.00 1.83 0.00 0.00 1.78 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.48 7.81 133 Y 8.61 4.39 0.00 3.07 2.82 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 * Residues marked with a * may have inaccurate shift predictions.