NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 N 4.8498 8.4244 119.2231 53.2000 40.6559 174.6559 3 V 4.1690 7.3444 118.7956 58.8804 32.1679 171.0628 4 P 4.0280 0.0000 0.0000 62.2995 32.8650 176.5990 5 A 4.0821 8.8460 126.1150 55.1838 18.1828 178.2133 6 E 4.3231 7.8675 110.0262 56.8270 30.5209 176.2436 7 L 4.2649 7.1437 118.8285 54.5187 42.7663 176.3375 8 K 4.8079 8.2650 119.7275 55.5015 34.9030 175.2841 9 Y 5.1596 8.9106 118.4424 56.5818 42.7746 174.2986 10 S 5.1366 8.8057 116.0651 56.2483 65.3227 175.3205 11 K 4.1675 8.8896 123.5610 58.9627 31.9353 177.7292 12 E 4.2531 8.4158 117.4065 56.2827 30.2257 175.9000 13 H 4.3176 8.2624 115.7421 57.5978 26.5659 173.4990 14 E 5.3379 7.8027 117.6219 54.2178 34.2669 176.5419 15 W 5.0751 8.0799 117.7095 54.6932 32.0408 174.3775 16 L 5.2079 8.8487 120.4414 53.1368 45.2825 175.3593 17 R 4.7311 9.1284 124.9367 54.0964 32.0998 174.9680 18 K 3.7821 8.8090 128.8182 56.6288 32.6925 176.4352 19 E 4.3393 8.9760 128.2689 54.9166 31.1021 176.5991 20 A 4.0550 8.5252 122.9155 55.6632 18.3763 179.2163 21 D 4.3711 7.8768 113.0132 53.7217 39.4712 178.0876 22 G 3.9238 7.9701 111.0228 47.0862 0.0000 174.8726 23 T 4.2827 7.4545 109.5293 61.7256 70.7377 172.9305 24 Y 5.0739 9.2260 119.5687 56.4459 40.9484 175.4609 25 T 4.3472 8.6895 121.5564 62.9637 70.2279 173.9893 26 V 4.1160 7.7622 125.8139 60.2699 34.9128 174.9598 27 G 3.5660 6.0280 111.7372 45.5739 0.0000 171.4554 28 I 5.1123 8.2038 113.6261 59.2316 40.4625 175.6578 29 T 4.5426 8.4242 113.2014 60.7114 70.3449 175.3928 30 E 3.8198 8.7522 122.2554 59.8219 29.5591 178.1587 31 H 4.1033 8.6350 117.3002 59.6242 29.8813 176.7817 32 A 4.0106 8.2953 122.5328 55.1272 18.0937 179.5959 33 Q 4.0047 8.4116 116.2917 59.0376 28.4602 178.4078 34 E 3.9101 7.8786 120.7222 59.2018 29.7951 178.4158 35 L 4.0924 7.4750 117.4906 57.6041 41.7140 178.9687 36 L 4.0869 7.7573 119.5360 56.9280 42.3859 177.8335 37 G 3.8333 8.0501 104.9396 44.1465 0.0000 172.1329 38 D 4.5251 8.4572 117.4949 55.1578 41.0554 176.1007 39 M 4.5804 9.1880 124.7149 54.8716 32.9013 176.4932 40 V 4.5047 8.5333 114.9732 61.3533 34.6034 175.6895 41 F 5.0082 7.8091 120.6256 57.0747 42.7741 172.6964 42 V 4.2283 7.7833 124.6922 61.0161 34.1797 174.8106 43 D 4.2016 8.1363 128.7518 52.5958 40.6848 175.4885 44 L 4.4211 7.9873 124.5208 53.5900 42.5788 175.1082 45 P 4.4783 0.0000 0.0000 62.4351 32.7838 175.6655 46 E 4.1068 8.4568 120.5689 55.4842 30.0140 176.8319 47 V 3.8414 8.3262 123.8927 64.8227 31.8658 175.7197 48 G 4.0347 9.6968 116.6729 44.4445 0.0000 173.7661 49 A 4.2141 7.7847 121.5655 52.3628 19.5687 176.6160 50 T 5.0620 8.3262 116.4896 62.2486 70.7998 174.5690 51 V 4.5955 8.6116 116.9030 59.9475 36.6592 174.6523 52 S 4.9820 8.8936 118.1424 56.1568 64.9155 173.9291 53 A 4.2173 8.0822 126.2119 54.4508 18.3609 178.4347 54 G 4.0329 9.2217 111.6187 44.9890 0.0000 173.7408 55 D 4.4866 8.2148 120.8252 54.4751 42.1011 175.6920 56 D 4.7135 8.8970 122.8537 54.3584 40.4587 175.0373 57 C 4.7137 8.4413 119.5909 57.8102 31.3339 173.1534 58 A 4.4572 7.1635 119.9893 51.3570 22.6544 174.9423 59 V 4.6436 8.1035 117.7923 61.1290 34.8350 173.9880 60 A 4.6973 9.1645 130.2864 50.5115 20.9566 175.2176 61 E 5.0014 9.3451 123.6754 55.1063 31.5553 176.4615 62 S 5.0343 8.5643 120.1773 55.2133 65.7234 175.1714 63 V 3.4193 8.3056 114.7077 64.2725 31.0087 174.9035 *65 A 4.2657 7.7726 118.9045 51.3959 20.2137 175.9651 66 A 4.9539 8.4638 120.9200 51.0795 20.4210 177.2235 67 S 4.6940 9.3785 116.2728 56.6049 66.7935 173.0599 68 D 4.7695 8.7459 122.3788 54.0944 41.9269 175.5627 69 I 4.3090 8.3683 123.9488 59.9323 39.1537 174.3451 70 Y 5.1441 8.5033 124.3291 56.0424 40.1169 175.4071 71 A 4.3349 8.7305 125.4826 51.8820 18.8122 176.8770 72 P 4.5108 0.0000 0.0000 64.7049 32.0976 176.1874 73 V 4.5255 7.2742 110.4244 59.7726 36.0313 174.3965 74 S 4.7554 10.0883 117.6054 57.4403 64.4261 175.4589 75 G 3.9782 6.9542 108.9265 45.7231 0.0000 170.4688 76 E 5.0895 8.1451 122.3358 54.2733 32.6871 176.7097 77 I 4.4704 8.5579 127.9338 61.6836 37.3202 176.7034 78 V 3.8711 8.5302 120.7389 61.8940 32.5864 176.4157 79 A 4.7397 7.7415 120.3404 51.0556 22.2890 175.5671 80 V 4.9059 8.5692 113.2177 59.6453 35.9798 175.5205 81 N 4.0080 8.1099 121.4242 52.1485 38.0475 175.2443 82 D 4.3821 8.5667 126.7002 56.6664 41.0784 177.5872 83 A 4.1656 7.7080 119.3036 53.5565 18.1128 178.5767 84 L 4.3251 7.4956 116.6387 55.9799 42.0470 178.1688 85 S 4.3320 7.9773 115.1491 60.7481 62.9355 174.8378 86 D 4.8828 8.0275 116.9893 54.0813 43.8500 176.1508 87 S 5.4899 8.1991 113.9950 55.3540 63.2599 173.3928 88 P 4.3158 0.0000 0.0000 65.4052 31.6942 178.0400 89 E 4.2049 8.2783 117.1205 59.1132 29.2515 178.8223 90 L 4.3412 7.8276 121.5250 57.0933 41.5283 179.3327 91 V 3.6840 7.6866 118.1991 65.8911 31.1368 177.8824 92 N 4.8211 8.0915 116.4103 55.6707 39.0890 177.1858 93 S 4.3979 8.3146 115.6168 60.2783 64.5232 174.1203 94 E 5.0208 8.6636 121.6368 53.9600 30.1976 174.3278 95 P 4.3941 0.0000 0.0000 64.7583 31.7769 177.4526 96 Y 4.1228 7.6667 113.2837 57.3638 40.2809 174.9021 97 A 4.6915 7.9132 121.7827 52.0547 18.6992 179.5132 98 G 3.9000 7.5393 114.5240 48.8399 0.0000 174.7609 99 G 3.8961 8.4522 107.9533 45.0937 0.0000 174.0994 100 W 4.5129 8.1335 117.4328 57.2740 28.8425 175.3139 101 I 4.1907 9.0393 120.1232 62.4955 38.9029 175.5005 102 F 5.6742 7.5876 114.4736 55.6099 41.8833 172.6723 103 K 5.1229 9.9366 118.9068 54.6760 35.2740 175.3627 104 I 5.1177 9.2506 123.9382 59.2217 42.0772 173.9433 105 K 4.7208 9.3825 130.6876 54.7202 33.0451 175.2625 106 A 4.9264 8.8282 130.1625 52.1647 18.7909 176.9306 107 S 4.6589 8.8531 114.6690 58.0725 64.6066 173.6739 108 D 4.7614 7.8374 120.2584 51.8123 43.2937 175.5747 109 E 4.0525 8.9177 127.5646 59.3941 29.4810 179.3639 110 S 4.2783 8.0962 113.9367 61.4192 62.8495 175.8802 111 E 3.9053 8.2172 121.2758 59.4948 29.5495 178.9036 112 L 3.9543 7.5213 117.8240 58.2900 41.4918 179.6441 113 E 4.1732 7.8055 116.5914 58.7023 29.5622 178.2657 114 S 4.3816 7.8198 110.9382 58.1705 62.9859 173.8593 115 L 4.3806 6.7669 119.4076 55.0527 42.5223 176.7769 116 L 4.4400 8.9636 123.1551 54.7122 43.1368 176.9391 117 D 5.1662 8.7682 122.7162 52.5527 41.3599 176.9881 118 A 3.9850 9.0245 119.7973 55.8798 18.0479 179.7660 119 T 3.9233 8.0428 113.2529 66.9408 68.6594 176.5273 120 A 4.0518 8.7690 122.5559 54.6168 18.3659 179.2269 121 Y 3.9377 7.9445 118.5983 61.0799 38.9518 177.3581 122 E 3.7240 8.3034 119.6038 59.7184 29.3378 179.4014 123 A 4.0663 7.4734 119.4487 54.3618 18.7201 179.0797 124 L 3.9570 7.2861 118.0826 58.2350 42.2082 178.8406 125 L 3.9187 7.5109 118.9501 57.5533 41.3266 178.7831 126 E 4.1347 7.7128 115.7113 57.7511 29.3368 176.8161 127 D 4.4833 7.5643 124.5320 54.5313 40.9543 176.0708 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 N 8.42 4.85 0.00 2.76 2.97 0.00 0.00 6.69 6.83 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 3 V 7.34 4.17 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 0.59 0.00 0.00 1.06 0.00 0.00 4 P 0.00 4.03 0.00 1.84 1.73 0.00 2.85 0.00 0.00 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 1.36 0.00 5 A 8.85 4.08 1.28 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 6 E 7.87 4.32 0.00 2.05 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 2.14 2.19 0.00 7 L 7.14 4.26 0.00 1.12 1.02 0.10 0.75 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 8 K 8.26 4.81 0.00 1.72 1.64 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.54 7.81 9 Y 8.91 5.16 0.00 2.79 2.42 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 10 S 8.81 5.14 0.00 3.87 3.68 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 11 K 8.89 4.17 0.00 1.80 1.87 0.00 1.80 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.52 7.81 12 E 8.42 4.25 0.00 2.02 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 0.00 2.36 2.48 0.00 13 H 8.26 4.32 0.00 3.55 3.62 0.00 5.55 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 E 7.80 5.34 0.00 1.85 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 2.35 2.31 0.00 15 W 8.08 5.08 0.00 3.02 2.99 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 16 L 8.85 5.21 0.00 1.50 1.62 0.69 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 17 R 9.13 4.73 0.00 2.07 1.99 0.00 3.03 0.00 0.00 2.99 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.52 0.00 18 K 8.81 3.78 0.00 1.84 1.63 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.16 0.82 7.81 19 E 8.98 4.34 0.00 1.87 1.75 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 2.29 2.24 0.00 20 A 8.53 4.06 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 21 D 7.88 4.37 0.00 2.75 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 22 G 7.97 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 23 T 7.45 4.28 4.35 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 1.19 0.00 0.00 24 Y 9.23 5.07 0.00 2.84 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 25 T 8.69 4.35 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 1.04 0.00 0.00 26 V 7.76 4.12 0.67 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 0.48 0.00 0.00 0.45 0.00 0.00 27 G 6.03 3.57 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 28 I 8.20 5.11 2.01 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 1.41 0.76 0.90 0.00 0.00 29 T 8.42 4.54 4.65 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 1.44 0.00 0.00 30 E 8.75 3.82 0.00 2.19 2.39 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 2.43 2.49 0.00 31 H 8.64 4.10 0.00 3.42 3.58 0.00 5.92 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 32 A 8.30 4.01 1.50 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 0.00 0.00 0.00 0.00 0.00 0.00 33 Q 8.41 4.00 0.00 2.33 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.76 0.00 0.00 0.00 0.00 0.00 2.43 2.63 0.00 34 E 7.88 3.91 0.00 2.01 2.29 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 2.32 2.37 0.00 35 L 7.48 4.09 0.00 1.79 1.68 0.83 0.75 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 36 L 7.76 4.09 0.00 1.93 1.69 0.92 0.92 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 37 G 8.05 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 0.00 0.00 0.00 38 D 8.46 4.53 0.00 2.72 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 39 M 9.19 4.58 0.00 1.94 2.19 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.80 0.00 40 V 8.53 4.50 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 0.67 0.00 0.00 0.96 0.00 0.00 41 F 7.81 5.01 0.00 2.96 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 42 V 7.78 4.23 1.83 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 0.65 0.00 0.00 0.78 0.00 0.00 43 D 8.14 4.20 0.00 2.44 2.38 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 44 L 7.99 4.42 0.00 1.48 1.51 0.83 0.97 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 45 P 0.00 4.48 0.00 1.77 1.88 0.00 3.42 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 1.53 1.64 0.00 46 E 8.46 4.11 0.00 2.01 1.89 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 2.37 2.26 0.00 47 V 8.33 3.84 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 0.89 0.00 0.00 0.98 0.00 0.00 48 G 9.70 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 49 A 7.78 4.21 1.28 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 50 T 8.33 5.06 4.23 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 1.27 0.00 0.00 51 V 8.61 4.60 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 0.68 0.00 0.00 0.97 0.00 0.00 52 S 8.89 4.98 0.00 3.89 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 53 A 8.08 4.22 1.32 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 0.00 0.00 54 G 9.22 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 55 D 8.21 4.49 0.00 2.77 2.60 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 56 D 8.90 4.71 0.00 2.75 2.59 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 57 C 8.44 4.71 0.00 2.76 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 58 A 7.16 4.46 1.09 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 0.00 0.00 59 V 8.10 4.64 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 0.98 0.00 0.00 0.92 0.00 0.00 60 A 9.16 4.70 1.17 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 0.00 0.00 0.00 61 E 9.35 5.00 0.00 2.18 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 2.30 2.37 0.00 62 S 8.56 5.03 0.00 3.96 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 63 V 8.31 3.42 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 0.80 0.00 0.00 0.94 0.00 0.00 *65 A 7.77 4.27 1.28 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 66 A 8.46 4.95 1.28 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 67 S 9.38 4.69 0.00 3.83 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 68 D 8.75 4.77 0.00 2.43 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 0.00 0.00 0.00 69 I 8.37 4.31 1.76 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 1.18 0.66 1.05 0.00 0.00 70 Y 8.50 5.14 0.00 2.92 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 71 A 8.73 4.33 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 72 P 0.00 4.51 0.00 2.15 2.38 0.00 3.92 0.00 0.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 73 V 7.27 4.53 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 0.61 0.00 0.00 0.91 0.00 0.00 74 S 10.09 4.76 0.00 3.90 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 75 G 6.95 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 76 E 8.15 5.09 0.00 2.05 1.80 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 2.21 2.38 0.00 77 I 8.56 4.47 2.00 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.79 0.92 0.00 0.00 78 V 8.53 3.87 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 0.72 0.00 0.00 0.97 0.00 0.00 79 A 7.74 4.74 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 80 V 8.57 4.91 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 0.87 0.00 0.00 0.93 0.00 0.00 81 N 8.11 4.01 0.00 1.44 1.91 0.00 0.00 7.61 8.64 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 82 D 8.57 4.38 0.00 2.72 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 83 A 7.71 4.17 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 84 L 7.50 4.33 0.00 1.55 1.61 0.74 0.83 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 85 S 7.98 4.33 0.00 4.03 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 86 D 8.03 4.88 0.00 2.60 2.67 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 87 S 8.20 5.49 0.00 4.01 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 88 P 0.00 4.32 0.00 2.26 2.40 0.00 3.79 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.18 0.00 89 E 8.28 4.20 0.00 2.18 2.27 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 2.36 2.36 0.00 90 L 7.83 4.34 0.00 1.71 1.76 0.95 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 91 V 7.69 3.68 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 1.02 0.00 0.00 0.95 0.00 0.00 92 N 8.09 4.82 0.00 2.85 2.85 0.00 0.00 7.32 7.57 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 93 S 8.31 4.40 0.00 4.05 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 94 E 8.66 5.02 0.00 2.08 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 2.25 2.26 0.00 95 P 0.00 4.39 0.00 1.80 2.20 0.00 3.29 0.00 0.00 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.77 0.00 96 Y 7.67 4.12 0.00 2.81 2.39 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 97 A 7.91 4.69 1.19 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 0.00 0.00 98 G 7.54 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 99 G 8.45 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 0.00 100 W 8.13 4.51 0.00 3.58 3.48 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 0.00 101 I 9.04 4.19 1.82 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 1.17 0.66 0.97 0.00 0.00 102 F 7.59 5.67 0.00 3.22 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 0.00 103 K 9.94 5.12 0.00 1.74 1.71 0.00 1.06 0.00 0.00 1.29 0.00 0.00 2.18 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.12 1.05 7.81 104 I 9.25 5.12 2.23 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.68 1.03 0.00 0.00 105 K 9.38 4.72 0.00 1.85 1.73 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.39 7.81 106 A 8.83 4.93 1.33 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 0.00 0.00 107 S 8.85 4.66 0.00 3.89 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 0.00 108 D 7.84 4.76 0.00 2.65 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 0.00 109 E 8.92 4.05 0.00 2.03 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 2.43 2.33 0.00 110 S 8.10 4.28 0.00 4.04 4.13 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 0.00 111 E 8.22 3.91 0.00 2.11 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 2.35 2.61 0.00 112 L 7.52 3.95 0.00 1.91 1.73 1.15 0.38 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 0.00 113 E 7.81 4.17 0.00 2.12 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 2.32 0.00 114 S 7.82 4.38 0.00 3.97 4.04 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 0.00 0.00 0.00 115 L 6.77 4.38 0.00 1.70 1.56 0.68 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 116 L 8.96 4.44 0.00 1.92 1.76 1.10 0.93 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 0.00 117 D 8.77 5.17 0.00 2.88 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 0.00 118 A 9.02 3.98 1.54 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 0.00 0.00 119 T 8.04 3.92 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 1.21 0.00 0.00 120 A 8.77 4.05 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 0.00 121 Y 7.94 3.94 0.00 2.78 2.59 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 0.00 122 E 8.30 3.72 0.00 2.20 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 2.29 2.30 0.00 123 A 7.47 4.07 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 0.00 124 L 7.29 3.96 0.00 1.57 1.62 0.89 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 125 L 7.51 3.92 0.00 1.68 1.49 0.74 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 126 E 7.71 4.13 0.00 2.08 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 2.30 2.29 0.00 127 D 7.56 4.48 0.00 2.74 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 * Residues marked with a * may have inaccurate shift predictions.