NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 63 T 4.3758 8.0176 110.9495 61.2525 70.1973 174.2240 64 S 4.0344 8.2504 115.1242 59.7991 62.8744 174.0126 65 W 4.5990 7.6525 119.9067 56.6909 30.3950 177.7027 66 R 4.2314 7.9148 116.8334 57.1000 29.6502 177.3453 67 S 4.7670 8.8568 114.2297 59.2138 64.4844 172.8176 68 E 4.9529 7.4368 116.4686 55.9956 32.0927 173.8544 69 A 4.5644 7.8733 119.8831 52.0016 23.5068 175.2700 70 T 5.4877 8.8570 115.6821 61.9009 71.4669 173.7447 71 F 5.2325 9.0759 120.1411 55.5032 41.9649 173.3578 72 Q 5.1655 8.8338 117.0963 54.3548 33.1843 174.8091 73 F 5.0518 9.2357 122.9824 57.3943 42.8275 173.2426 74 T 4.7640 8.3669 123.4511 62.2554 69.7401 174.4070 75 V 3.7551 8.5760 127.8502 61.9172 32.7747 175.1581 76 E 4.6625 8.7796 127.1678 55.0640 31.7659 175.4512 77 R 4.1372 8.5602 116.0877 55.5862 28.3389 178.7165 78 F 4.0153 8.7502 121.3536 61.4885 39.4571 177.2759 79 S 4.6388 9.3528 113.7176 60.9545 62.6107 175.1219 80 R 4.4817 7.8353 118.0054 55.4089 30.1854 176.0406 81 L 4.0444 8.1253 122.0288 55.5614 42.2542 176.8527 82 S 4.5628 8.5994 117.5949 57.4058 64.5811 172.8607 83 E 4.7845 7.8921 118.6677 53.9022 33.0212 174.8028 84 S 4.7428 8.3864 114.3682 58.4081 64.2533 174.0612 85 V 4.6320 8.8425 115.4592 59.5342 34.9059 174.3065 86 L 5.2046 8.3963 124.9270 53.2355 44.6844 176.1156 87 S 3.0802 7.8361 120.3151 56.0299 64.5695 171.9914 88 P 4.3843 0.0000 0.0000 61.4195 31.7972 174.5432 89 P 4.3683 0.0000 0.0000 62.7937 32.5272 175.2272 90 C 4.4104 8.0293 121.9297 57.4078 33.9399 172.7133 91 F 5.5284 8.5774 125.4026 56.5536 39.6672 175.4114 92 V 4.3290 8.2928 122.4074 61.8934 35.1058 175.1255 93 R 4.0742 9.8952 126.1397 57.4477 28.2507 175.8686 94 N 3.8117 8.6676 111.7804 54.1021 38.1161 173.0468 95 L 4.8292 8.0908 115.7907 51.5217 45.4328 173.9700 96 P 3.8657 0.0000 0.0000 62.0434 32.5435 174.7780 97 W 4.9766 8.4613 124.9627 54.7031 31.8099 175.4673 98 K 4.9998 9.0727 121.9333 54.8185 36.6526 175.3853 99 I 4.8604 8.8176 123.9231 60.9407 39.0195 174.5353 100 M 5.2285 9.6182 126.2883 53.7961 35.0803 174.2811 101 V 5.1623 8.4438 125.6388 61.5253 35.1734 173.9565 102 M 5.0753 9.0344 122.3677 53.5980 34.7120 172.0679 103 P 4.8723 0.0000 0.0000 63.0128 32.5724 175.4016 104 R 4.8222 8.8427 120.6462 54.5772 35.1947 174.7190 105 F 4.7282 8.5949 117.7872 55.9631 41.1476 174.6278 *112 Q 3.3099 8.3624 123.5002 56.0628 29.4201 173.3651 113 K 3.8747 8.2130 122.2436 56.3072 31.9599 175.8263 114 S 5.3635 7.3490 109.5900 56.8099 68.2236 173.2793 115 V 4.7748 9.1184 121.1428 61.7148 32.9997 174.7159 116 G 4.5609 9.7836 116.9506 45.3500 0.0000 172.2112 117 F 5.5408 8.8821 127.3021 56.7304 42.3605 173.4691 118 F 5.3573 10.2100 124.7987 55.5927 43.6364 173.6445 119 L 5.3835 9.3599 123.0225 53.5871 44.3286 174.8689 120 Q 5.4066 9.5278 127.6176 54.5370 32.1855 173.5596 121 C 4.1460 9.1316 125.2913 57.7423 34.0399 173.1397 122 N 3.5765 8.1029 124.7399 54.1018 37.5294 176.0466 123 A 4.0588 7.8152 120.3192 54.9181 18.9906 179.6879 124 E 4.0245 7.9823 114.5736 59.1624 29.8030 177.8763 125 S 4.0585 7.0833 112.7084 58.8785 62.6141 173.4935 126 D 4.7281 8.5446 125.1626 53.3781 39.8150 176.5114 127 S 4.4665 7.8977 115.3925 58.8837 62.8976 173.5443 128 T 4.4675 8.5520 114.5464 61.2218 69.0944 174.2976 129 S 4.8659 8.2566 117.2745 58.6927 64.9312 174.2248 130 W 5.2895 8.5909 117.6341 56.1299 29.4039 175.7075 131 S 4.6442 8.5773 112.9353 57.8834 65.7901 173.3860 132 C 5.0313 9.2959 122.9932 58.8199 35.2193 171.8972 133 H 5.3563 9.1887 126.3348 55.3762 31.3273 173.5168 134 A 5.2276 9.0452 125.6584 50.8600 23.2321 174.7748 135 Q 5.2542 8.8931 117.9619 54.5471 32.6743 174.6550 136 A 4.8025 8.8101 121.1903 51.4166 23.6544 175.3372 137 V 4.6612 8.9941 120.0966 61.2372 34.0612 174.4340 138 L 4.9499 9.0198 129.0754 53.1966 43.3902 175.6221 139 K 5.2908 9.7008 125.2688 54.7608 36.1383 174.8909 140 I 4.4359 8.9202 128.1150 59.3589 38.6572 175.2517 141 I 3.8256 8.3354 129.3844 61.5523 36.3802 175.5148 142 N 4.6909 8.9743 126.2061 51.8056 39.4766 175.1445 143 Y 4.3314 8.6227 126.0530 59.5266 38.3796 177.7154 144 R 3.6423 6.4455 117.6173 58.1902 30.6207 176.0827 145 D 4.1606 7.7507 115.5951 53.3261 42.8705 175.1617 146 D 4.6219 8.6029 127.9280 56.8091 41.3443 177.8851 147 E 4.1554 8.3599 117.1611 58.2664 29.5715 177.4921 148 K 4.3620 8.0630 117.1801 56.3796 32.6498 177.0898 149 S 4.6273 7.6021 115.8464 58.7647 63.5953 173.3737 150 F 5.2241 9.0508 126.6115 56.7168 41.0775 174.6273 151 S 5.2456 7.8372 119.0856 56.9792 66.3946 173.2077 152 R 4.5482 8.7978 119.0211 54.3599 34.2784 174.4205 153 R 5.3544 8.6043 117.7648 54.7562 32.0374 175.0735 154 I 5.0153 8.8294 113.3472 59.7125 41.8401 173.9402 155 S 5.0211 8.5953 116.9359 57.4176 65.2593 172.3976 156 H 4.1575 9.0061 125.0467 54.9320 33.6443 172.4033 157 L 4.6126 7.4265 126.6509 53.5762 42.0709 175.5194 158 F 4.6601 9.2232 126.4881 57.3426 40.4850 174.9546 159 F 3.1323 8.3260 116.8380 55.3422 41.0398 174.5751 160 H 4.2529 8.1785 114.2696 58.7283 27.9329 176.6828 161 K 3.8221 6.2523 116.8552 57.5615 32.6197 176.8326 162 E 4.5399 6.4790 118.3420 54.7963 30.0699 175.3755 163 N 5.2726 7.8850 115.6393 53.7813 39.1692 175.7977 164 D 5.8417 7.9885 117.9582 52.4871 43.0942 174.3465 165 W 5.1358 9.3218 128.9206 55.8426 34.3865 174.8227 166 G 3.4412 6.8153 111.7527 46.0843 0.0000 171.2088 167 F 4.6073 7.1589 120.1116 55.2862 41.3226 176.5252 168 S 4.5135 8.9593 120.8585 60.6421 63.6333 174.2770 169 N 5.1785 7.8532 116.7918 51.6988 38.4679 173.6725 170 F 4.2051 8.9878 122.9472 61.0982 40.4913 175.0881 171 M 4.7087 7.8680 117.2281 52.4947 36.1101 173.7109 172 A 4.5179 8.2891 123.2285 51.6708 20.2494 178.7020 173 W 4.0777 9.8399 135.0000 60.6151 30.6540 178.7528 174 S 4.2756 8.2326 112.7387 61.2230 62.6920 175.8457 175 E 4.0168 7.9109 122.4756 59.2217 29.3987 178.6443 176 V 3.3203 7.3047 117.0536 65.5853 31.5546 177.0378 177 T 4.4356 7.2677 106.6012 60.6582 69.2057 174.1996 178 D 4.4855 7.7359 123.2272 53.2339 40.6028 174.9163 179 P 4.2909 0.0000 0.0000 65.0773 31.1388 176.7583 180 E 4.4099 8.3589 117.0273 56.4604 29.9638 176.8534 181 K 4.0054 8.2892 118.8911 56.9671 32.8313 178.0355 182 G 3.4563 8.3188 106.2757 44.9846 0.0000 174.5158 183 F 4.5786 7.7079 117.5447 57.8133 39.8582 175.7237 184 I 4.6205 7.6335 119.4021 58.9567 40.4455 174.0524 185 D 4.3879 8.4056 125.7206 53.8821 43.8595 174.5844 186 D 4.4186 9.3999 126.0117 55.3924 39.7008 172.2647 187 D 4.4871 8.1836 111.7312 54.8873 40.0158 172.0280 188 K 4.9529 7.8765 115.5033 54.0093 35.6516 175.5371 189 V 4.5141 8.4211 123.5267 61.3040 34.7534 174.0305 190 T 4.8553 8.2018 123.9876 62.1600 70.4748 173.4901 191 F 4.8990 9.0211 125.0629 55.7069 42.0108 174.4593 192 E 5.0673 9.6101 122.4186 54.5428 33.6354 174.2420 193 V 4.8732 8.3386 124.7780 61.0267 35.2629 173.7323 194 F 5.3368 9.2352 130.4720 56.6230 41.6140 174.0804 195 V 4.5135 8.2689 126.3681 59.7131 34.2731 174.7758 196 Q 4.4965 8.9037 122.5199 54.1436 31.3002 174.1636 197 A 5.1688 8.2624 126.0118 50.0475 21.7089 175.7301 198 D 4.7956 8.9147 121.2459 52.9792 42.5750 176.2424 199 A 4.1429 8.4084 122.5979 51.9258 18.8029 175.9860 200 P 4.8198 0.0000 0.0000 62.5138 32.6252 175.3506 201 H 4.7600 8.8626 116.6600 55.0264 31.7781 174.5105 202 G 2.7206 8.1397 107.7882 45.5778 0.0000 173.9838 203 V 3.8776 6.4977 115.0206 61.7941 34.5590 175.1640 204 A 4.5339 7.5067 134.6784 50.4922 18.9607 177.2556 205 W 4.4306 8.8019 120.4109 57.9033 29.2703 176.9828 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 63 T 8.02 4.38 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 1.29 0.00 0.00 64 S 8.25 4.03 0.00 3.77 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 65 W 7.65 4.60 0.00 3.36 3.28 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 66 R 7.91 4.23 0.00 1.95 2.33 0.00 2.97 0.00 0.00 3.51 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.83 0.00 67 S 8.86 4.77 0.00 3.93 4.18 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 0.00 0.00 0.00 0.00 68 E 7.44 4.95 0.00 1.87 1.78 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 2.20 2.39 0.00 69 A 7.87 4.56 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 70 T 8.86 5.49 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 1.32 0.00 0.00 71 F 9.08 5.23 0.00 3.13 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 72 Q 8.83 5.17 0.00 1.99 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.77 0.00 0.00 0.00 0.00 0.00 2.27 2.38 0.00 73 F 9.24 5.05 0.00 3.09 2.94 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.37 4.76 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 1.11 0.00 0.00 75 V 8.58 3.76 2.41 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 1.09 0.00 0.00 0.74 0.00 0.00 76 E 8.78 4.66 0.00 1.88 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 2.22 2.26 0.00 77 R 8.56 4.14 0.00 2.03 2.01 0.00 3.45 0.00 0.00 3.25 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.58 0.00 78 F 8.75 4.02 0.00 3.15 3.18 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 0.00 0.00 0.00 0.00 79 S 9.35 4.64 0.00 4.16 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 80 R 7.84 4.48 0.00 2.01 2.02 0.00 3.22 0.00 0.00 3.20 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 81 L 8.13 4.04 0.00 1.52 1.63 0.96 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 82 S 8.60 4.56 0.00 3.93 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 83 E 7.89 4.78 0.00 1.93 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 2.19 2.20 0.00 84 S 8.39 4.74 0.00 3.89 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 85 V 8.84 4.63 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 0.74 0.00 0.00 1.10 0.00 0.00 86 L 8.40 5.20 0.00 1.53 1.38 0.91 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 87 S 7.84 3.08 0.00 3.37 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 P 0.00 4.38 0.00 2.04 2.00 0.00 3.63 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.06 0.00 89 P 0.00 4.37 0.00 1.12 1.66 0.00 3.60 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.81 0.00 90 C 8.03 4.41 0.00 1.94 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 91 F 8.58 5.53 0.00 2.88 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 92 V 8.29 4.33 1.55 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 0.77 0.00 0.00 0.63 0.00 0.00 93 R 9.90 4.07 0.00 2.14 2.15 0.00 3.68 0.00 0.00 3.29 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.98 0.00 94 N 8.67 3.81 0.00 1.44 2.09 0.00 0.00 6.85 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 95 L 8.09 4.83 0.00 1.53 0.94 0.75 0.64 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 96 P 0.00 3.87 0.00 1.71 1.81 0.00 3.26 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 1.64 1.76 0.00 97 W 8.46 4.98 0.00 3.05 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 98 K 9.07 5.00 0.00 1.62 1.57 0.00 1.54 0.00 0.00 1.63 0.00 0.00 2.66 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.16 1.22 7.81 99 I 8.82 4.86 1.99 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 1.33 0.92 0.98 0.00 0.00 100 M 9.62 5.23 0.00 2.26 1.99 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 2.51 2.53 0.00 101 V 8.44 5.16 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 0.90 0.00 0.00 -0.21 0.00 0.00 102 M 9.03 5.08 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.74 0.00 103 P 0.00 4.87 0.00 1.58 1.44 0.00 3.71 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 1.92 1.98 0.00 104 R 8.84 4.82 0.00 1.83 1.89 0.00 3.33 0.00 0.00 3.29 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.05 0.00 105 F 8.59 4.73 0.00 2.91 2.97 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 *112 Q 8.36 3.31 0.00 1.94 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.01 0.00 0.00 0.00 0.00 0.00 2.15 2.08 0.00 113 K 8.21 3.87 0.00 1.88 1.43 0.00 1.69 0.00 0.00 1.93 0.00 0.00 3.13 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.47 7.81 114 S 7.35 5.36 0.00 4.13 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 0.00 115 V 9.12 4.77 2.40 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 1.33 0.00 0.00 1.19 0.00 0.00 116 G 9.78 4.56 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 0.00 0.00 0.00 117 F 8.88 5.54 0.00 2.82 2.48 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 0.00 118 F 10.21 5.36 0.00 3.11 3.04 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 0.00 119 L 9.36 5.38 0.00 1.93 2.03 1.37 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 120 Q 9.53 5.41 0.00 2.23 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.54 0.00 0.00 0.00 0.00 0.00 2.20 2.42 0.00 121 C 9.13 4.15 0.00 1.31 2.35 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 0.00 122 N 8.10 3.58 0.00 1.58 1.42 0.00 0.00 6.68 7.72 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 0.00 123 A 7.82 4.06 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 0.00 124 E 7.98 4.02 0.00 1.84 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 2.26 2.31 0.00 125 S 7.08 4.06 0.00 3.47 3.52 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.54 4.73 0.00 2.85 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 0.00 127 S 7.90 4.47 0.00 4.03 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 0.00 128 T 8.55 4.47 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 1.21 0.00 0.00 129 S 8.26 4.87 0.00 4.28 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 0.00 130 W 8.59 5.29 0.00 3.49 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 0.00 131 S 8.58 4.64 0.00 3.73 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 0.00 132 C 9.30 5.03 0.00 3.26 3.13 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 0.00 133 H 9.19 5.36 0.00 3.30 3.20 0.00 5.71 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 0.00 134 A 9.05 5.23 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 0.00 135 Q 8.89 5.25 0.00 1.94 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.57 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 136 A 8.81 4.80 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 0.00 137 V 8.99 4.66 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 1.02 0.00 0.00 1.12 0.00 0.00 138 L 9.02 4.95 0.00 1.68 0.48 0.92 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 139 K 9.70 5.29 0.00 1.81 1.68 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.86 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.38 1.63 7.81 140 I 8.92 4.44 1.88 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.20 0.58 0.44 0.00 0.00 141 I 8.34 3.83 1.91 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.72 0.91 0.00 0.00 142 N 8.97 4.69 0.00 2.34 2.61 0.00 0.00 6.70 7.76 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 0.00 143 Y 8.62 4.33 0.00 3.04 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 0.00 144 R 6.45 3.64 0.00 1.45 1.66 0.00 2.78 0.00 0.00 2.86 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.50 0.00 145 D 7.75 4.16 0.00 2.52 2.32 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 0.00 146 D 8.60 4.62 0.00 2.68 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 0.00 147 E 8.36 4.16 0.00 2.11 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 2.25 0.00 148 K 8.06 4.36 0.00 1.62 1.67 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.93 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.48 1.39 7.81 149 S 7.60 4.63 0.00 3.94 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 0.00 150 F 9.05 5.22 0.00 3.07 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 0.00 151 S 7.84 5.25 0.00 3.91 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 0.00 152 R 8.80 4.55 0.00 1.33 1.25 0.00 2.21 0.00 0.00 2.25 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.50 0.00 153 R 8.60 5.35 0.00 1.87 1.95 0.00 3.02 0.00 0.00 3.30 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.67 0.00 154 I 8.83 5.02 2.22 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.88 1.04 0.00 0.00 155 S 8.60 5.02 0.00 3.92 3.80 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 0.00 156 H 9.01 4.16 0.00 2.09 2.42 0.00 5.82 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 L 7.43 4.61 0.00 1.52 1.28 0.61 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 158 F 9.22 4.66 0.00 3.41 3.24 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 0.00 159 F 8.33 3.13 0.00 2.55 2.50 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 0.00 160 H 8.18 4.25 0.00 3.40 3.60 0.00 5.52 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 0.00 161 K 6.25 3.82 0.00 0.86 1.54 0.00 1.77 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.20 0.88 7.81 162 E 6.48 4.54 0.00 1.67 1.77 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 2.16 1.88 0.00 163 N 7.88 5.27 0.00 3.32 3.38 0.00 0.00 5.59 8.07 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 0.00 164 D 7.99 5.84 0.00 2.98 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 0.00 165 W 9.32 5.14 0.00 2.85 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 0.00 166 G 6.82 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 0.00 0.00 0.00 167 F 7.16 4.61 0.00 3.20 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 S 8.96 4.51 0.00 4.16 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 0.00 169 N 7.85 5.18 0.00 2.75 2.84 0.00 0.00 6.86 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 F 8.99 4.21 0.00 3.35 3.43 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 0.00 171 M 7.87 4.71 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.99 2.22 0.00 172 A 8.29 4.52 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 0.00 173 W 9.84 4.08 0.00 3.40 3.14 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 0.00 174 S 8.23 4.28 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 0.00 175 E 7.91 4.02 0.00 1.98 1.99 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 2.25 2.33 0.00 176 V 7.30 3.32 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 0.32 0.00 0.00 0.71 0.00 0.00 177 T 7.27 4.44 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 0.72 0.00 0.00 178 D 7.74 4.49 0.00 2.98 2.74 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 0.00 0.00 0.00 0.00 179 P 0.00 4.29 0.00 2.23 2.20 0.00 3.82 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 2.01 2.02 0.00 180 E 8.36 4.41 0.00 2.07 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 2.28 2.40 0.00 181 K 8.29 4.01 0.00 1.95 2.00 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.19 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.55 1.75 7.81 182 G 8.32 3.46 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 0.00 0.00 0.00 0.00 183 F 7.71 4.58 0.00 3.05 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 0.00 184 I 7.63 4.62 1.90 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 1.25 0.91 0.96 0.00 0.00 185 D 8.41 4.39 0.00 1.83 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 0.00 0.00 0.00 186 D 9.40 4.42 0.00 2.73 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 0.00 187 D 8.18 4.49 0.00 2.94 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 0.00 188 K 7.88 4.95 0.00 1.74 1.55 0.00 1.57 0.00 0.00 1.51 0.00 0.00 2.80 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.30 1.50 7.81 189 V 8.42 4.51 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 0.13 0.00 0.00 -0.13 0.00 0.00 190 T 8.20 4.86 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 1.20 0.00 0.00 191 F 9.02 4.90 0.00 2.90 2.46 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 0.00 192 E 9.61 5.07 0.00 1.95 1.76 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 2.22 2.37 0.00 193 V 8.34 4.87 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 0.97 0.00 0.00 0.97 0.00 0.00 194 F 9.24 5.34 0.00 3.08 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 0.00 195 V 8.27 4.51 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 0.21 0.00 0.00 0.01 0.00 0.00 196 Q 8.90 4.50 0.00 1.74 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.78 0.00 0.00 0.00 0.00 0.00 1.50 1.56 0.00 197 A 8.26 5.17 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 0.00 198 D 8.91 4.80 0.00 2.64 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 0.00 199 A 8.41 4.14 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 0.00 200 P 0.00 4.82 0.00 2.12 2.13 0.00 3.73 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.26 0.00 201 H 8.86 4.76 0.00 3.14 3.05 0.00 5.94 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 G 8.14 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 0.00 0.00 0.00 203 V 6.50 3.88 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 0.83 0.00 0.00 0.99 0.00 0.00 204 A 7.51 4.53 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 0.00 205 W 8.80 4.43 0.00 3.27 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 * Residues marked with a * may have inaccurate shift predictions.