NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 29 V 4.3243 8.0544 120.6640 62.8185 33.1364 174.2617 30 V 4.2421 8.6995 126.6480 60.3169 33.8101 172.3243 31 K 5.1840 8.6521 130.1236 54.9651 34.4731 174.4821 32 F 5.1682 8.5672 121.1125 56.4090 41.8823 172.5024 33 S 4.8188 8.5632 112.3892 57.4352 66.1464 172.7469 34 Y 4.6096 8.2877 120.9343 56.2152 42.1733 172.9612 35 M 4.9438 7.9506 126.0357 53.5858 34.2761 174.3891 36 W 4.8389 9.3385 135.0000 56.0334 33.3062 174.1047 37 T 4.8255 8.8272 124.2598 62.1039 69.8764 174.2862 38 I 4.1407 8.5892 128.8590 59.6336 38.2368 175.2481 39 N 4.7913 8.7510 124.6819 53.0062 39.7340 174.7582 40 N 4.5850 8.7276 115.2701 53.2177 36.6067 176.4144 41 F 4.0993 8.7020 122.3234 61.2813 39.9076 177.0043 42 S 4.1112 8.8661 114.4152 60.5969 62.6834 174.8796 43 F 4.3431 8.1234 118.3637 57.5847 39.1849 175.8262 44 C 3.9925 7.6548 119.6350 60.6276 28.0764 173.8086 45 R 4.4277 7.8508 122.1957 55.7536 30.0122 176.2789 46 E 4.1921 7.9151 118.9702 56.5616 29.8092 176.9429 47 E 4.3511 9.2271 124.3400 54.8223 30.9018 175.4992 48 M 4.4202 7.8388 118.7002 57.0030 32.2733 176.1151 49 G 4.1015 9.3150 115.1993 44.7833 0.0000 173.6262 50 E 4.3887 8.1603 119.6260 55.8348 30.3999 175.7628 51 V 4.8600 8.0776 120.0390 60.0807 35.0232 174.6132 52 I 4.8438 9.1414 123.1525 59.4951 40.1298 174.7586 53 K 5.1162 8.8268 125.6926 55.1815 34.9692 176.0741 54 S 4.1668 7.8366 117.5201 57.1389 64.3683 173.7341 55 S 4.4265 8.3422 116.2924 58.6759 63.2886 174.6423 56 T 4.4284 8.2107 111.9411 61.8267 69.7270 173.4441 57 F 5.1469 8.6314 117.8027 55.9825 42.1666 173.0806 58 S 4.6423 8.4000 112.6308 57.7558 65.3447 173.9322 59 S 3.7737 8.2670 115.9311 61.9949 62.9093 176.2871 *64 K 4.2079 7.7880 119.5729 52.9543 33.6425 177.0657 65 L 4.7335 7.5401 116.9514 54.2717 43.4940 176.1270 66 K 4.6123 8.4026 120.9360 54.3957 35.6519 175.4836 67 W 5.0696 8.7021 123.9461 55.0322 33.2939 173.8692 68 C 4.8966 8.8252 115.3207 57.3424 33.1774 172.6880 69 L 5.1370 8.6051 119.2164 53.4390 44.0927 176.1641 70 R 5.3783 8.9832 119.5935 54.5861 34.5584 174.6836 71 V 5.0542 9.5969 122.8360 60.1434 35.0877 174.5484 72 N 5.4005 9.1008 121.5238 50.4467 38.8515 173.8860 73 P 4.5012 0.0000 0.0000 64.7754 31.8920 177.8593 74 K 4.5110 8.2105 116.6046 55.8670 32.8083 176.9665 75 G 4.4129 8.2076 103.6172 45.2497 0.0000 175.3839 76 L 4.0901 8.5464 121.4964 57.6479 42.6427 176.0820 77 D 4.7026 8.0386 115.9509 52.2810 42.2082 175.0840 78 E 3.9518 8.9480 118.7707 59.5254 29.6316 178.6674 79 E 4.0233 7.8995 118.3973 58.3876 29.9115 177.3505 80 S 4.9805 8.2013 112.3212 57.7162 63.2292 175.9043 81 K 4.3340 7.9244 121.2288 59.8203 32.5843 177.4791 82 D 4.5502 8.2525 118.6878 55.4584 41.3242 174.9157 83 Y 5.2988 7.9110 116.0139 55.8032 42.0783 175.1132 84 L 4.7274 9.0338 121.6261 54.8468 43.1213 176.2025 85 S 5.4267 8.8822 119.1922 57.0156 65.5776 172.8528 86 L 4.9334 8.5415 125.2583 53.6256 45.2715 174.6927 87 Y 5.3048 9.1279 122.8324 56.2135 42.9809 173.7380 88 L 5.0604 9.2570 124.4949 53.5682 44.2526 174.6764 89 L 5.2444 9.1462 128.9962 53.2536 44.7542 174.9376 90 L 3.7336 8.8000 128.9985 54.2952 41.9860 177.1958 91 V 3.5661 8.3341 130.2759 65.9694 32.2156 177.3040 92 S 4.5862 7.3465 117.5515 57.0572 66.5964 174.6747 93 C 4.5242 8.2770 124.5609 56.8312 33.6253 171.8368 94 P 4.2953 0.0000 0.0000 65.9556 31.4015 178.0309 95 K 4.2364 7.6926 118.8041 54.1456 32.2079 180.1254 96 S 4.3810 8.5441 116.3744 61.5560 63.1207 174.3953 97 E 5.1083 7.5902 115.1395 55.5206 32.0363 175.3149 98 V 4.6680 8.9623 114.1857 60.0417 36.4407 174.6102 99 R 5.2347 8.8388 123.2624 55.5981 32.1689 175.2875 100 A 5.2476 9.2427 123.5539 50.8258 23.1301 175.6154 101 K 4.8061 9.1059 121.9783 55.6370 34.2689 175.9226 102 F 5.3340 8.1115 116.7355 55.4736 42.0130 173.1359 103 K 4.9492 8.9289 120.4063 54.9377 35.7469 174.8263 104 F 5.9232 9.4020 125.9239 56.0630 42.5343 174.4210 105 S 5.3232 9.5301 116.0253 57.3906 67.3124 172.3321 106 I 4.9873 8.8120 120.9753 59.7276 39.3148 174.9884 107 L 4.9679 8.7294 127.5243 53.6470 42.8754 176.9821 108 N 4.6477 8.9671 121.7654 51.4732 39.1017 175.4403 109 A 3.8955 8.5215 120.1128 55.3487 18.2478 178.6037 110 K 4.1402 8.1385 112.2449 56.6143 32.4232 177.7135 111 G 3.8559 8.3336 107.7443 45.3190 0.0000 173.4064 112 E 4.3493 8.2625 119.6554 55.3193 30.9824 176.0150 113 E 4.6079 8.6258 123.2553 56.9236 30.3534 176.0811 114 T 4.5809 8.9420 117.5238 60.3655 71.7039 173.0067 115 K 3.7435 8.5088 121.4921 57.3355 29.7036 175.5233 116 A 4.7384 7.7501 118.2910 52.2426 19.8753 178.2086 117 M 4.6332 9.3019 119.7691 53.3778 36.0633 174.2392 118 E 5.1614 8.4855 122.9989 53.9259 31.8362 175.3892 119 S 4.1488 8.5493 122.0208 58.1150 63.4570 175.3952 120 Q 4.0173 8.6677 122.2946 58.1424 28.8351 175.3091 121 R 4.6976 7.1299 113.5991 54.2629 33.0513 174.5702 122 A 4.4188 8.3904 120.9808 52.1943 19.3172 176.5281 123 Y 4.1332 9.0358 118.5579 55.8329 41.4141 175.0755 124 R 4.7580 8.3619 122.8263 56.0570 30.8693 175.4121 125 F 5.1924 9.7062 125.8027 56.1441 41.8877 175.3718 126 V 4.8700 8.2149 113.9625 58.8299 36.1388 174.7796 127 Q 3.9414 8.5850 122.6160 58.2900 28.8689 177.0609 128 G 3.8496 9.3978 114.0072 44.8807 0.0000 172.5446 129 K 4.4477 7.9715 122.1489 54.8426 33.8121 175.0429 130 D 5.7831 8.2539 125.6516 51.6163 42.5680 175.0799 131 W 5.1174 8.9924 118.1579 55.2407 33.6740 175.5206 132 G 3.6421 7.8772 108.4244 46.2523 0.0000 172.6593 133 F 4.8487 7.9149 121.9314 55.4029 40.7858 176.0496 134 K 4.0186 8.9281 127.9076 58.3926 32.8259 177.1727 135 K 4.3947 7.5931 116.7159 54.8435 31.9313 175.4351 136 F 4.4683 8.9046 124.4789 60.7774 40.3207 175.1974 137 I 4.4909 7.5981 118.7523 58.0885 41.0142 173.3853 138 R 3.7827 8.5655 126.9034 56.1459 31.1609 177.6322 139 R 4.1030 8.9721 126.4305 59.4874 29.9776 179.5230 140 G 3.5774 7.9373 103.7005 47.1177 0.0000 175.1536 141 F 4.3560 7.9403 122.6635 61.0694 39.5145 176.9448 142 L 3.6539 7.8166 118.6082 58.0184 42.0325 178.3273 143 L 4.3768 7.8884 115.8425 54.3642 42.1265 176.1932 144 D 4.4946 7.5149 122.9933 53.5345 41.8679 177.2350 145 E 3.9156 8.9528 123.1130 58.9743 29.8436 175.5445 146 A 4.0979 8.2373 120.5854 55.1198 17.4895 178.3300 147 N 4.3320 8.1869 112.8836 53.8511 38.7985 176.4382 148 G 3.7568 7.5740 105.5249 46.5271 0.0000 174.3335 149 L 4.3328 7.1198 114.8407 54.5742 42.7502 177.0370 150 L 5.3789 7.4530 117.7588 51.6405 42.0394 174.3749 151 P 4.4861 0.0000 0.0000 64.0255 32.3417 177.0002 152 D 4.1346 9.4618 120.2019 55.1522 38.3354 172.8358 153 D 4.4843 8.0619 115.2736 55.4110 40.5040 172.4809 154 K 4.8819 7.8417 116.0764 54.0141 35.1755 175.0557 155 L 4.5657 8.5256 127.0498 53.9203 43.7843 175.0280 156 T 4.9312 8.3709 122.8024 61.8957 71.1455 173.0232 157 L 5.2979 9.0840 127.0639 52.8849 44.9949 175.3857 158 F 5.4016 9.5072 124.5216 56.5873 42.6341 172.9795 159 C 5.4019 8.6011 126.3960 57.5943 34.3730 172.1376 160 E 4.7628 8.9122 125.2442 54.3850 32.4408 175.1365 161 V 4.5146 8.2133 123.1450 60.9618 35.2379 174.4329 162 S 4.9772 8.9360 123.0232 56.7997 66.0213 173.0569 163 V 4.5088 8.8912 126.3680 61.8389 33.0048 176.1449 164 V 4.0862 8.7831 127.3807 63.0423 31.0231 175.2864 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 29 V 8.05 4.32 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 0.96 0.00 0.00 0.95 0.00 0.00 30 V 8.70 4.24 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 1.03 0.00 0.00 0.99 0.00 0.00 31 K 8.65 5.18 0.00 1.82 1.72 0.00 1.84 0.00 0.00 1.77 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.47 7.81 32 F 8.57 5.17 0.00 3.17 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 33 S 8.56 4.82 0.00 3.28 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 34 Y 8.29 4.61 0.00 1.43 1.70 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 35 M 7.95 4.94 0.00 1.93 2.06 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.50 0.00 36 W 9.34 4.84 0.00 3.42 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 37 T 8.83 4.83 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 38 I 8.59 4.14 1.64 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 -0.22 0.97 0.00 0.00 39 N 8.75 4.79 0.00 2.63 2.76 0.00 0.00 7.25 8.00 0.00 0.00 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 N 8.73 4.59 0.00 2.90 2.83 0.00 0.00 7.25 8.13 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 41 F 8.70 4.10 0.00 3.06 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 42 S 8.87 4.11 0.00 3.86 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 43 F 8.12 4.34 0.00 3.16 3.11 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 44 C 7.65 3.99 0.00 2.59 2.85 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 0.00 0.00 0.00 45 R 7.85 4.43 0.00 1.62 1.94 0.00 3.18 0.00 0.00 3.26 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.79 0.00 46 E 7.92 4.19 0.00 1.93 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 0.00 2.36 2.42 0.00 47 E 9.23 4.35 0.00 2.03 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 2.40 0.00 48 M 7.84 4.42 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.57 0.00 49 G 9.32 4.10 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 0.00 50 E 8.16 4.39 0.00 2.22 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 2.33 2.26 0.00 51 V 8.08 4.86 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 0.77 0.00 0.00 1.06 0.00 0.00 52 I 9.14 4.84 2.16 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 1.48 0.76 1.23 0.00 0.00 53 K 8.83 5.12 0.00 1.75 1.79 0.00 1.51 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.37 7.81 54 S 7.84 4.17 0.00 2.89 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 55 S 8.34 4.43 0.00 3.81 3.84 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 56 T 8.21 4.43 4.08 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 1.08 0.00 0.00 57 F 8.63 5.15 0.00 3.00 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 58 S 8.40 4.64 0.00 3.78 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 59 S 8.27 3.77 0.00 3.83 3.20 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 0.00 *64 K 7.79 4.21 0.00 1.82 1.80 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.04 7.81 65 L 7.54 4.73 0.00 1.41 1.14 0.91 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 66 K 8.40 4.61 0.00 1.39 1.46 0.00 1.52 0.00 0.00 1.54 0.00 0.00 2.74 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.19 1.40 7.81 67 W 8.70 5.07 0.00 1.78 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 68 C 8.83 4.90 0.00 2.94 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 69 L 8.61 5.14 0.00 0.96 1.56 1.08 0.97 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 70 R 8.98 5.38 0.00 1.84 1.88 0.00 3.03 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 71 V 9.60 5.05 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 1.04 0.00 0.00 1.08 0.00 0.00 72 N 9.10 5.40 0.00 2.91 3.04 0.00 0.00 6.89 8.27 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 73 P 0.00 4.50 0.00 2.01 2.06 0.00 3.71 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.23 0.00 74 K 8.21 4.51 0.00 1.92 1.81 0.00 1.85 0.00 0.00 1.83 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.40 7.81 75 G 8.21 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 76 L 8.55 4.09 0.00 1.95 1.81 0.90 1.07 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 77 D 8.04 4.70 0.00 2.97 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 78 E 8.95 3.95 0.00 2.10 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 2.41 2.41 0.00 79 E 7.90 4.02 0.00 2.13 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 0.00 2.36 2.30 0.00 80 S 8.20 4.98 0.00 4.29 4.07 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 81 K 7.92 4.33 0.00 1.94 2.17 0.00 1.63 0.00 0.00 1.82 0.00 0.00 3.02 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.61 1.46 7.81 82 D 8.25 4.55 0.00 2.38 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 83 Y 7.91 5.30 0.00 3.03 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 84 L 9.03 4.73 0.00 1.91 1.83 1.14 1.14 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 85 S 8.88 5.43 0.00 4.22 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 86 L 8.54 4.93 0.00 1.44 1.05 0.79 -0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 87 Y 9.13 5.30 0.00 2.87 2.79 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 0.00 0.00 0.00 88 L 9.26 5.06 0.00 1.94 1.44 1.09 0.11 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 89 L 9.15 5.24 0.00 1.77 1.63 0.93 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 90 L 8.80 3.73 0.00 1.34 1.59 -0.63 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 91 V 8.33 3.57 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 0.62 0.00 0.00 0.81 0.00 0.00 92 S 7.35 4.59 0.00 3.39 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 93 C 8.28 4.52 0.00 2.59 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 94 P 0.00 4.30 0.00 2.18 2.12 0.00 3.73 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.90 0.00 95 K 7.69 4.24 0.00 1.80 1.64 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.03 7.81 96 S 8.54 4.38 0.00 3.86 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 97 E 7.59 5.11 0.00 2.02 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 0.00 2.23 2.40 0.00 98 V 8.96 4.67 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 0.77 0.00 0.00 1.05 0.00 0.00 99 R 8.84 5.23 0.00 1.86 1.92 0.00 3.14 0.00 0.00 3.34 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.70 0.00 100 A 9.24 5.25 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 0.00 101 K 9.11 4.81 0.00 1.68 1.62 0.00 1.60 0.00 0.00 1.64 0.00 0.00 2.82 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.37 7.81 102 F 8.11 5.33 0.00 2.72 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 0.00 103 K 8.93 4.95 0.00 1.73 1.57 0.00 1.57 0.00 0.00 1.90 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.52 7.81 104 F 9.40 5.92 0.00 2.97 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 0.00 105 S 9.53 5.32 0.00 4.13 4.10 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 0.00 106 I 8.81 4.99 1.96 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 1.43 1.04 0.93 0.00 0.00 107 L 8.73 4.97 0.00 1.48 1.54 0.73 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 108 N 8.97 4.65 0.00 2.92 2.98 0.00 0.00 6.50 7.74 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 0.00 109 A 8.52 3.90 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 0.00 110 K 8.14 4.14 0.00 1.87 1.83 0.00 1.77 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.41 7.81 111 G 8.33 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 0.00 0.00 0.00 112 E 8.26 4.35 0.00 2.06 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 2.25 0.00 113 E 8.63 4.61 0.00 1.88 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 2.40 2.25 0.00 114 T 8.94 4.58 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 1.34 0.00 0.00 115 K 8.51 3.74 0.00 1.82 1.61 0.00 1.50 0.00 0.00 1.56 0.00 0.00 2.76 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.37 1.40 7.81 116 A 7.75 4.74 1.27 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 0.00 117 M 9.30 4.63 0.00 0.52 1.36 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.13 0.00 118 E 8.49 5.16 0.00 1.87 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 2.07 2.29 0.00 119 S 8.55 4.15 0.00 3.73 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 0.00 120 Q 8.67 4.02 0.00 2.16 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 121 R 7.13 4.70 0.00 1.69 1.76 0.00 2.68 0.00 0.00 2.99 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.84 0.00 122 A 8.39 4.42 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 0.00 123 Y 9.04 4.13 0.00 2.58 1.47 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 0.00 124 R 8.36 4.76 0.00 1.88 1.96 0.00 3.27 0.00 0.00 3.32 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.77 0.00 125 F 9.71 5.19 0.00 3.26 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 0.00 126 V 8.21 4.87 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 0.96 0.00 0.00 0.93 0.00 0.00 127 Q 8.59 3.94 0.00 1.91 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.66 0.00 0.00 0.00 0.00 0.00 2.27 2.45 0.00 128 G 9.40 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 129 K 7.97 4.45 0.00 1.84 1.93 0.00 0.94 0.00 0.00 1.40 0.00 0.00 2.59 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.21 0.92 7.81 130 D 8.25 5.78 0.00 2.81 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.99 5.12 0.00 2.98 2.79 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 0.00 0.00 0.00 132 G 7.88 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 0.00 133 F 7.91 4.85 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 0.00 134 K 8.93 4.02 0.00 1.86 1.91 0.00 1.93 0.00 0.00 1.84 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.54 1.69 7.81 135 K 7.59 4.39 0.00 1.38 0.74 0.00 1.56 0.00 0.00 1.09 0.00 0.00 3.05 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.59 1.14 7.81 136 F 8.90 4.47 0.00 3.28 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 I 7.60 4.49 1.50 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.22 1.08 0.00 0.00 138 R 8.57 3.78 0.00 1.81 1.78 0.00 3.18 0.00 0.00 3.24 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.15 0.00 139 R 8.97 4.10 0.00 1.90 1.99 0.00 3.41 0.00 0.00 3.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.70 0.00 140 G 7.94 3.58 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 0.00 0.00 0.00 141 F 7.94 4.36 0.00 3.10 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 0.00 142 L 7.82 3.65 0.00 1.73 1.72 0.79 0.67 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 0.00 143 L 7.89 4.38 0.00 1.74 1.69 0.95 1.48 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 0.00 144 D 7.51 4.49 0.00 2.74 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 0.00 145 E 8.95 3.92 0.00 1.93 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 1.90 0.00 146 A 8.24 4.10 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 0.00 147 N 8.19 4.33 0.00 2.41 2.37 0.00 0.00 6.76 8.84 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 0.00 148 G 7.57 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 0.00 0.00 0.00 149 L 7.12 4.33 0.00 1.43 1.62 1.04 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 150 L 7.45 5.38 0.00 1.63 1.57 1.01 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 0.00 151 P 0.00 4.49 0.00 2.19 2.16 0.00 4.04 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.95 0.00 152 D 9.46 4.13 0.00 2.83 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 0.00 153 D 8.06 4.48 0.00 3.02 2.79 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 0.00 0.00 0.00 154 K 7.84 4.88 0.00 1.83 1.64 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.83 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.46 1.55 7.81 155 L 8.53 4.57 0.00 1.01 1.06 0.66 -0.28 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 0.00 156 T 8.37 4.93 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 1.20 0.00 0.00 157 L 9.08 5.30 0.00 1.64 1.59 0.75 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 158 F 9.51 5.40 0.00 3.02 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 0.00 159 C 8.60 5.40 0.00 3.11 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 0.00 160 E 8.91 4.76 0.00 1.79 1.63 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 1.98 1.73 0.00 161 V 8.21 4.51 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 0.17 0.00 0.00 0.36 0.00 0.00 162 S 8.94 4.98 0.00 3.69 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 0.00 163 V 8.89 4.51 2.33 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 1.09 0.00 0.00 1.28 0.00 0.00 164 V 8.78 4.09 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 0.80 0.00 0.00 0.98 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.