NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 27 S 4.5723 8.1927 115.5646 57.4641 65.2542 172.0930 28 L 4.8682 7.8662 123.0473 51.5672 43.5731 173.0466 29 L 4.6755 10.4542 130.9092 53.5699 44.6954 174.3763 30 I 4.8450 8.3558 127.2122 60.0141 39.1320 174.6327 31 V 4.8016 8.6268 127.2456 61.1681 34.4980 174.7525 32 V 5.0350 8.6539 120.4190 60.1444 34.1701 174.7254 33 A 5.2487 8.9991 123.8388 50.6586 23.2245 174.4364 34 C 5.2103 8.8561 118.3706 57.6910 35.0998 173.7742 35 A 4.7275 9.3339 128.0681 50.5630 19.8218 175.5278 36 L 4.9238 8.4245 121.8790 55.0756 43.0899 175.9986 37 L 5.6077 9.4993 124.8399 53.2064 44.4552 176.6987 38 D 4.7240 8.9678 123.9829 51.6989 41.3311 177.0535 39 Q 3.9875 8.4681 117.2319 58.8999 28.5697 177.6754 40 D 4.7594 8.1734 114.9728 53.5307 41.0522 175.6962 41 N 4.3524 8.1745 115.6497 54.4945 36.8599 173.8589 42 R 4.8739 8.5271 116.4868 55.4646 32.2471 175.9878 43 V 5.6786 8.8982 122.4133 60.5982 34.3837 174.1210 44 L 4.0909 8.1961 128.3043 53.9181 42.6848 175.5743 45 L 5.0087 8.4290 126.3214 53.1652 45.0116 175.5357 46 T 5.3055 8.9797 111.2796 60.0793 72.7576 172.4749 47 Q 4.4182 8.5837 123.4963 53.8546 31.9917 174.6801 48 R 4.3023 8.4947 125.4869 55.5391 30.7824 175.0053 49 P 4.3632 0.0000 0.0000 62.3003 32.2348 176.3914 50 E 4.1504 8.8462 117.9478 57.5768 30.9445 179.6892 51 G 3.7568 7.6660 105.7696 46.8676 0.0000 173.8974 52 K 4.6495 8.9908 121.2430 55.6835 33.1921 175.1207 53 S 4.4945 7.6071 118.5164 57.8019 63.5557 175.8310 54 L 4.5509 8.3829 118.3062 52.0923 43.2684 175.6172 55 A 3.8692 8.5162 123.2590 52.9435 18.6628 178.4942 56 G 3.8384 8.1057 112.5068 44.7054 0.0000 172.8198 57 L 4.4392 7.9431 118.7838 53.6965 43.3179 176.5711 58 W 4.7701 8.9295 121.2078 56.1876 30.6363 175.6593 59 E 4.6624 8.9513 120.8287 54.6993 33.1419 174.2820 60 F 4.7451 8.2975 120.1690 56.7336 39.6811 174.0597 61 P 4.3781 0.0000 0.0000 62.7358 32.6046 176.2146 62 G 4.0656 8.0010 106.1840 48.4184 0.0000 170.7720 63 G 4.2144 7.6456 105.9122 45.6812 0.0000 173.0116 64 K 4.5788 8.7596 121.3957 56.6071 32.8948 176.3825 65 V 4.2230 8.3706 127.3436 61.7913 31.9035 175.5756 66 E 4.4705 8.5753 126.6825 54.7466 30.8606 175.9975 67 Q 4.0154 8.5014 119.5467 58.0429 29.0716 177.7226 68 G 3.9280 8.9335 109.0130 45.8356 0.0000 172.7089 69 E 4.6841 7.6554 118.1095 53.9667 32.1473 176.8990 70 T 4.1784 8.1412 113.1536 60.8533 71.1017 173.7803 71 P 4.2843 0.0000 0.0000 65.8547 31.2549 178.8958 72 E 3.5489 8.0742 116.6119 59.0698 29.3712 178.8134 73 A 3.9156 8.1145 121.0448 55.3887 18.4412 179.5651 74 S 4.1218 7.9163 113.4742 61.8659 62.8742 176.9814 75 L 3.8789 7.7339 122.5348 58.1508 41.9495 178.8260 76 I 3.5988 7.9040 120.1775 64.4438 37.0629 178.3843 77 R 3.8611 8.1675 119.4867 59.4493 29.4718 178.2043 78 E 3.9505 8.3088 118.5245 59.6767 29.6149 179.5428 79 L 4.0309 8.1757 119.0476 57.4587 41.6322 179.2803 80 E 4.0277 7.8364 120.2776 58.5675 29.4302 178.5260 81 E 3.9256 8.3388 117.7329 59.6375 29.9122 178.9021 82 E 4.2490 8.4766 118.3122 58.0188 29.7593 177.9324 83 L 5.4634 7.0561 114.3729 51.8209 43.9080 177.2338 84 G 3.6845 7.9645 106.1829 46.2893 0.0000 173.3181 85 V 4.3582 7.4669 119.0815 61.6535 33.6033 174.0976 86 H 5.1062 9.7115 125.5204 54.1067 31.0002 173.3420 87 V 4.7989 8.4236 122.7698 61.1346 34.5268 174.7274 88 Q 4.4296 8.5887 125.1429 54.3344 30.4579 176.5438 89 A 3.8160 8.6262 124.6683 55.5908 18.4270 179.4387 90 D 4.3313 7.9751 113.0709 56.3010 40.8962 176.6161 91 N 4.5533 7.8358 115.4151 52.7057 39.2313 174.2899 92 L 4.4720 7.2476 119.7987 53.4740 42.7236 175.9926 93 F 4.7473 8.4496 123.4580 54.6214 41.2329 173.6282 94 P 3.8049 0.0000 0.0000 63.6024 31.2075 174.1333 95 L 4.7151 8.8391 124.0543 56.1050 44.0602 176.9686 96 T 4.7709 7.2102 110.8115 61.4835 70.8944 171.1321 97 F 5.4903 8.1882 114.8345 55.4829 41.2442 173.5365 98 A 4.8318 9.0140 121.4176 50.3991 22.2875 175.6001 99 S 5.1733 8.4490 113.5881 57.1383 65.5758 172.9752 100 H 4.5237 8.9610 127.0945 54.7744 33.3037 172.2879 101 G 3.7944 8.1942 113.4982 45.6999 0.0000 172.3080 102 Y 4.7387 8.0125 123.6444 55.9328 41.1030 177.2947 103 E 3.9455 8.8048 116.3286 58.7501 29.7204 176.1349 104 T 4.7368 7.2600 108.1162 61.5122 69.1281 172.7023 105 F 5.0533 7.4405 113.8151 57.1469 41.2159 171.9172 106 H 5.0043 9.7919 120.4552 54.4353 32.1473 172.8479 107 L 5.1870 8.6167 128.0765 53.7592 43.9689 174.5291 108 L 5.1002 9.0570 128.8259 53.7044 44.5480 174.6068 109 M 5.7559 9.3869 126.5624 51.8161 34.2208 171.6982 110 P 4.7777 0.0000 0.0000 62.2049 32.9802 174.7262 111 L 5.0677 9.2855 127.3220 53.7264 44.0107 174.8315 112 Y 5.2570 9.0547 124.1026 56.3409 41.0610 174.6246 113 F 5.6380 8.9784 116.6243 55.7012 41.6987 174.1754 114 C 5.2597 9.4181 120.6440 58.8032 34.7093 174.2024 115 S 5.1421 9.3645 119.0482 57.4723 63.4532 173.3147 116 H 4.6130 8.3585 120.2956 54.9650 30.9413 171.3401 117 Y 5.0149 7.4433 123.1639 55.8129 40.9555 174.0293 118 K 4.5482 9.4887 119.7055 55.5053 34.9769 176.4393 119 G 4.2130 8.8846 107.4195 45.1296 0.0000 173.0322 120 V 4.3172 7.9929 118.2954 60.2900 32.7474 175.3570 121 A 4.3709 8.9816 130.5577 52.9182 18.9105 176.4019 122 Q 4.6391 8.8246 121.1840 54.0845 33.2969 175.4578 123 G 4.3677 8.4263 110.7342 45.2106 0.0000 174.3033 124 R 4.1058 8.7398 124.3753 58.3373 30.3813 177.6070 125 E 4.5133 8.3705 118.1042 55.9803 29.8821 177.3860 126 G 4.0404 7.9890 105.2254 45.9564 0.0000 174.4617 127 Q 4.3564 7.2783 117.6628 55.3753 30.3613 174.7952 128 N 5.0277 9.1329 117.0915 51.9822 40.7992 174.4686 129 L 5.3414 8.5215 120.9385 53.0572 45.4384 176.2450 130 K 4.3052 8.7637 123.9213 54.9998 35.5782 174.7243 131 W 4.8851 8.8559 128.3764 56.1492 30.1246 175.8970 132 I 4.5591 8.8463 126.2277 58.8726 40.1481 174.8753 133 F 4.6262 9.2034 128.6890 59.2745 39.6920 175.8449 134 I 3.5520 7.8097 126.8802 64.8394 36.7730 178.2489 135 N 4.3534 6.5580 114.3563 55.0513 38.8193 175.9083 136 D 4.7914 8.0061 119.6465 54.4332 41.3576 178.0968 137 L 4.0903 7.6144 121.6337 57.7818 41.5002 178.3351 138 D 4.6358 7.8906 114.7965 54.4325 39.5559 177.7344 139 K 3.9756 8.1425 120.4284 57.9693 32.4603 176.2092 140 Y 4.5378 7.2145 116.4260 55.2661 40.0527 174.2018 141 P 4.5215 0.0000 0.0000 63.2634 32.3971 175.3382 142 M 5.5451 8.4126 122.4916 51.5923 36.3206 173.5352 143 P 4.4392 0.0000 0.0000 62.6550 32.3508 177.4985 144 E 3.9789 8.9807 120.3935 59.7462 29.0905 179.7329 145 A 3.8332 7.8380 119.4297 55.1572 18.7384 179.0037 146 D 4.6216 8.1019 117.0161 57.0056 40.3846 179.1169 147 K 4.0830 7.8597 119.7782 58.9234 31.5972 177.4820 148 P 4.2974 0.0000 0.0000 65.4618 31.3230 178.5989 149 L 3.9965 7.8636 117.8607 57.4860 41.4540 179.4294 150 V 3.7426 7.6430 117.7114 66.3391 31.3169 177.9736 151 Q 3.9866 8.1352 117.0640 59.1486 28.4397 179.0773 152 V 3.5603 7.5073 118.5090 65.7744 31.2930 177.8249 153 L 3.8894 7.5951 118.8364 57.9425 42.0081 178.6827 154 K 4.0039 7.7486 117.6003 59.5890 32.1768 178.8083 155 N 4.5376 7.8561 117.4474 55.6719 37.4337 175.6353 *156 F 4.1964 7.5832 124.2325 56.7883 38.1620 180.2831 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 27 S 8.19 4.57 0.00 3.97 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 0.00 28 L 7.87 4.87 0.00 1.79 1.65 1.08 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 29 L 10.45 4.68 0.00 1.74 1.71 0.85 0.42 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 30 I 8.36 4.84 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.79 0.95 0.00 0.00 31 V 8.63 4.80 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.98 0.00 0.00 32 V 8.65 5.04 2.24 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 0.90 0.00 0.00 1.07 0.00 0.00 33 A 9.00 5.25 1.26 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 0.00 0.00 0.00 34 C 8.86 5.21 0.00 2.97 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 35 A 9.33 4.73 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 36 L 8.42 4.92 0.00 1.57 1.73 0.63 0.28 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 37 L 9.50 5.61 0.00 1.81 1.74 1.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 38 D 8.97 4.72 0.00 2.48 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 0.00 0.00 0.00 39 Q 8.47 3.99 0.00 1.98 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 7.33 0.00 0.00 0.00 0.00 0.00 2.30 2.29 0.00 40 D 8.17 4.76 0.00 2.64 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 41 N 8.17 4.35 0.00 3.15 3.00 0.00 0.00 6.99 7.62 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 42 R 8.53 4.87 0.00 2.31 2.24 0.00 3.41 0.00 0.00 3.16 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.70 0.00 43 V 8.90 5.68 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 1.10 0.00 0.00 1.06 0.00 0.00 44 L 8.20 4.09 0.00 0.27 0.87 0.15 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 45 L 8.43 5.01 0.00 1.47 1.62 0.70 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 46 T 8.98 5.31 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 1.14 0.00 0.00 47 Q 8.58 4.42 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.98 0.00 0.00 0.00 0.00 0.00 1.70 1.73 0.00 48 R 8.49 4.30 0.00 1.60 1.76 0.00 3.36 0.00 0.00 3.18 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.51 0.00 49 P 0.00 4.36 0.00 2.13 2.18 0.00 3.70 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 1.93 1.91 0.00 50 E 8.85 4.15 0.00 2.28 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 2.34 2.30 0.00 51 G 7.67 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 52 K 8.99 4.65 0.00 1.72 1.80 0.00 1.70 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.34 1.38 7.81 53 S 7.61 4.49 0.00 3.91 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 54 L 8.38 4.55 0.00 1.63 1.61 0.92 0.71 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 55 A 8.52 3.87 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 56 G 8.11 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 0.00 0.00 0.00 57 L 7.94 4.44 0.00 1.50 1.62 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 58 W 8.93 4.77 0.00 3.46 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 59 E 8.95 4.66 0.00 2.20 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 0.00 2.28 2.27 0.00 60 F 8.30 4.75 0.00 2.98 3.17 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 61 P 0.00 4.38 0.00 2.10 2.14 0.00 4.14 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 2.07 1.90 0.00 62 G 8.00 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 0.00 0.00 0.00 63 G 7.65 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 0.00 0.00 0.00 0.00 64 K 8.76 4.58 0.00 1.76 1.71 0.00 1.72 0.00 0.00 1.60 0.00 0.00 2.69 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.43 7.81 65 V 8.37 4.22 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 1.18 0.00 0.00 0.97 0.00 0.00 66 E 8.58 4.47 0.00 2.20 1.82 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 2.27 2.40 0.00 67 Q 8.50 4.02 0.00 2.03 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.29 0.00 0.00 0.00 0.00 0.00 2.37 2.32 0.00 68 G 8.93 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 69 E 7.66 4.68 0.00 2.16 1.82 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 2.21 2.18 0.00 70 T 8.14 4.18 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 1.20 0.00 0.00 71 P 0.00 4.28 0.00 2.34 2.28 0.00 3.62 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 2.17 2.22 0.00 72 E 8.07 3.55 0.00 1.94 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 2.27 2.10 0.00 73 A 8.11 3.92 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 74 S 7.92 4.12 0.00 4.05 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 75 L 7.73 3.88 0.00 1.72 1.55 0.91 0.87 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 76 I 7.90 3.60 2.01 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.73 0.93 0.00 0.00 77 R 8.17 3.86 0.00 1.92 2.03 0.00 3.28 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 78 E 8.31 3.95 0.00 2.14 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 2.49 2.57 0.00 79 L 8.18 4.03 0.00 1.62 1.65 0.85 1.06 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 80 E 7.84 4.03 0.00 2.09 2.02 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 2.18 2.40 0.00 81 E 8.34 3.93 0.00 1.91 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 0.00 2.34 2.48 0.00 82 E 8.48 4.25 0.00 2.04 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 2.58 2.48 0.00 83 L 7.06 5.46 0.00 1.78 1.60 0.82 0.58 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 84 G 7.96 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 0.00 0.00 0.00 85 V 7.47 4.36 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 0.86 0.00 0.00 0.93 0.00 0.00 86 H 9.71 5.11 0.00 3.12 3.21 0.00 5.61 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 87 V 8.42 4.80 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 0.79 0.00 0.00 0.99 0.00 0.00 88 Q 8.59 4.43 0.00 2.11 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.62 0.00 0.00 0.00 0.00 0.00 2.43 2.30 0.00 89 A 8.63 3.82 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 90 D 7.98 4.33 0.00 2.61 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 91 N 7.84 4.55 0.00 2.82 2.92 0.00 0.00 6.92 8.15 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 92 L 7.25 4.47 0.00 1.37 1.34 0.37 0.51 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 93 F 8.45 4.75 0.00 1.63 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 94 P 0.00 3.80 0.00 1.92 1.85 0.00 3.70 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.98 0.00 95 L 8.84 4.72 0.00 1.89 1.84 0.94 1.13 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 96 T 7.21 4.77 4.19 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 1.14 0.00 0.00 97 F 8.19 5.49 0.00 2.98 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 98 A 9.01 4.83 1.26 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 0.00 0.00 0.00 99 S 8.45 5.17 0.00 4.17 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 0.00 100 H 8.96 4.52 0.00 3.08 2.77 0.00 5.63 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 G 8.19 3.79 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 0.00 0.00 0.00 102 Y 8.01 4.74 0.00 2.15 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 0.00 103 E 8.80 3.95 0.00 1.98 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 2.23 1.87 0.00 104 T 7.26 4.74 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 1.40 0.00 0.00 105 F 7.44 5.05 0.00 3.37 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 0.00 106 H 9.79 5.00 0.00 3.28 3.26 0.00 5.76 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 0.00 107 L 8.62 5.19 0.00 2.29 1.79 1.20 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 108 L 9.06 5.10 0.00 1.86 1.56 0.86 0.65 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 0.00 109 M 9.39 5.76 0.00 2.15 2.01 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.40 0.00 110 P 0.00 4.78 0.00 2.12 1.87 0.00 3.97 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.06 0.00 111 L 9.29 5.07 0.00 1.59 1.54 0.33 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 112 Y 9.05 5.26 0.00 2.86 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 0.00 113 F 8.98 5.64 0.00 3.31 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 0.00 114 C 9.42 5.26 0.00 3.07 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 0.00 115 S 9.36 5.14 0.00 4.17 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 0.00 116 H 8.36 4.61 0.00 3.15 3.33 0.00 5.93 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 Y 7.44 5.01 0.00 3.25 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 0.00 118 K 9.49 4.55 0.00 1.81 1.77 0.00 1.61 0.00 0.00 1.56 0.00 0.00 2.86 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.36 1.50 7.81 119 G 8.88 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 0.00 0.00 0.00 0.00 120 V 7.99 4.32 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 0.93 0.00 0.00 0.98 0.00 0.00 121 A 8.98 4.37 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 0.00 122 Q 8.82 4.64 0.00 2.12 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 7.00 0.00 0.00 0.00 0.00 0.00 2.32 2.48 0.00 123 G 8.43 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 0.00 0.00 0.00 0.00 124 R 8.74 4.11 0.00 2.07 2.00 0.00 3.14 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.76 0.00 125 E 8.37 4.51 0.00 2.10 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 2.21 2.20 0.00 126 G 7.99 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 0.00 0.00 0.00 127 Q 7.28 4.36 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.84 6.65 0.00 0.00 0.00 0.00 0.00 2.28 2.41 0.00 128 N 9.13 5.03 0.00 2.37 2.93 0.00 0.00 7.20 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 0.00 129 L 8.52 5.34 0.00 1.51 1.51 0.94 0.83 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 0.00 130 K 8.76 4.31 0.00 0.96 0.79 0.00 0.61 0.00 0.00 1.20 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.99 1.10 7.81 131 W 8.86 4.89 0.00 3.18 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 0.00 132 I 8.85 4.56 1.67 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.25 0.86 0.00 0.00 133 F 9.20 4.63 0.00 3.07 3.21 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 0.00 134 I 7.81 3.55 1.52 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 1.46 0.55 0.67 0.00 0.00 135 N 6.56 4.35 0.00 2.65 2.88 0.00 0.00 6.86 8.06 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 0.00 136 D 8.01 4.79 0.00 3.01 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 0.00 137 L 7.61 4.09 0.00 1.65 1.72 1.02 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 138 D 7.89 4.64 0.00 2.82 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 0.00 139 K 8.14 3.98 0.00 1.77 1.51 0.00 1.71 0.00 0.00 1.63 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.46 7.81 140 Y 7.21 4.54 0.00 2.94 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 0.00 141 P 0.00 4.52 0.00 2.21 2.06 0.00 3.90 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 2.29 2.20 0.00 142 M 8.41 5.55 0.00 1.85 1.94 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.58 0.00 143 P 0.00 4.44 0.00 2.23 2.02 0.00 3.63 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.12 0.00 144 E 8.98 3.98 0.00 1.98 2.02 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 2.45 2.38 0.00 145 A 7.84 3.83 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 0.00 146 D 8.10 4.62 0.00 2.95 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 0.00 147 K 7.86 4.08 0.00 1.90 1.88 0.00 1.69 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.73 7.81 148 P 0.00 4.30 0.00 2.11 2.06 0.00 3.81 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.16 0.00 149 L 7.86 4.00 0.00 2.00 1.67 0.95 1.17 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 0.00 150 V 7.64 3.74 2.31 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 1.07 0.00 0.00 1.05 0.00 0.00 151 Q 8.14 3.99 0.00 2.24 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.68 0.00 0.00 0.00 0.00 0.00 2.46 2.37 0.00 152 V 7.51 3.56 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 0.95 0.00 0.00 0.92 0.00 0.00 153 L 7.60 3.89 0.00 1.96 1.78 0.86 0.58 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 0.00 154 K 7.75 4.00 0.00 1.92 1.82 0.00 1.74 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.40 1.53 7.81 155 N 7.86 4.54 0.00 2.79 2.92 0.00 0.00 6.99 8.22 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 *156 F 7.58 4.20 0.00 2.27 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 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.