NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 L 4.3589 8.1849 120.6208 54.9340 42.1714 175.2833 7 T 4.2835 8.0318 117.1621 63.2667 71.3272 172.6761 8 G 4.0634 8.0419 107.9610 45.9465 0.0000 172.2619 9 V 5.0125 8.5346 112.4295 59.3868 34.5090 175.4643 10 A 5.0125 8.7163 126.8602 50.3763 22.0220 175.3049 11 T 5.0960 8.3229 108.5924 60.0834 72.3763 172.9219 12 D 4.6578 9.4265 125.2555 53.1758 44.8358 176.0458 13 K 4.8770 8.7912 128.9279 55.0848 33.2927 173.3785 14 S 4.6924 10.7151 114.8111 59.2345 64.2146 173.2310 15 E 5.2474 8.1250 119.2750 54.7784 32.4406 174.9390 16 A 4.8020 8.8922 123.9089 50.2398 22.2973 175.5638 17 K 4.9042 8.4255 121.8885 54.6416 34.7928 175.5691 18 V 4.7811 8.2505 125.5942 60.1271 35.0948 174.2853 19 T 4.8370 8.5759 119.6511 61.7428 71.8578 172.8606 20 V 4.4370 9.3080 127.7876 61.2694 33.2829 174.5265 21 L 5.0304 8.5730 127.8953 53.3839 44.7682 176.4098 22 G 3.9753 9.3846 108.0093 46.8938 0.0000 173.5932 23 I 4.5244 8.0312 120.3977 59.7610 38.4690 176.1157 24 S 4.5136 8.5932 121.3422 58.5821 63.5370 175.2773 25 D 4.8299 8.7081 127.4486 53.0725 39.5188 174.6504 26 K 4.7046 7.4165 120.6573 53.9420 36.3757 174.7647 27 P 4.1925 0.0000 0.0000 63.8449 31.1334 176.4872 28 G 4.1277 9.1025 110.5920 45.9958 0.0000 175.6333 29 E 3.8892 8.3073 119.1384 59.1376 29.4604 178.6805 30 A 4.0816 8.1804 120.2295 55.3310 18.3936 179.1040 31 A 4.1074 7.6536 118.7788 55.4807 18.2550 179.8501 32 K 3.9145 7.8530 116.6019 59.6969 32.0065 179.6679 33 V 3.3287 7.5925 117.6410 66.0079 31.6512 177.6711 34 F 4.3436 7.4900 115.6151 59.1384 38.8667 178.1828 35 R 3.9535 8.3486 118.8024 59.0349 29.7691 178.3542 36 A 4.0096 7.7291 120.6597 55.3840 18.4169 179.4697 37 L 3.8871 7.6077 116.7020 58.0634 41.6818 179.8608 38 A 4.0090 7.9026 119.9868 55.2843 18.1083 179.4466 39 D 4.4341 8.1904 116.0856 56.7295 40.9276 177.7689 40 A 4.3441 7.5597 119.3185 51.1439 18.9215 176.7058 41 E 3.8009 8.2095 116.3197 57.3641 27.7107 174.5778 42 I 4.0704 7.5977 119.5453 60.5105 37.9251 175.2598 43 N 4.6554 8.6760 124.2568 52.6999 39.7277 173.8825 44 I 4.4421 8.1066 125.9153 61.5443 39.4064 173.5193 45 D 4.5286 9.0177 124.1901 54.9320 42.4616 178.0327 46 M 4.3699 5.8600 114.9846 55.3009 33.9501 176.4666 47 V 5.0242 8.2634 121.8522 61.2263 34.9743 174.3143 48 L 4.7509 9.1497 127.9655 53.6900 45.9029 174.0024 49 Q 5.1292 8.5477 126.3069 54.0457 31.4644 174.4806 50 N 4.6716 8.6520 125.0198 53.1781 40.2234 174.3031 51 V 3.9382 8.1850 115.2450 60.9672 32.3773 175.3764 52 F 4.5378 8.5220 122.9914 57.4851 40.2355 174.7950 53 S 4.3728 7.8919 124.4609 57.0334 63.4342 175.2191 54 V 3.6777 8.4859 125.9192 66.1634 31.4872 176.8958 55 E 4.0816 8.0436 117.4439 59.7674 29.4462 178.2689 56 D 4.3261 7.8779 117.2499 55.2005 41.2531 176.6207 57 G 3.6927 8.3230 106.4460 46.0562 0.0000 172.3815 58 T 4.5293 6.4918 111.9038 61.4976 71.5081 171.0082 59 T 5.1028 8.9585 117.6204 60.7764 71.7963 171.5849 60 D 5.4989 8.5907 121.6721 52.5151 45.2812 175.2042 61 I 5.1835 9.1211 120.2526 60.1264 41.5786 174.6627 62 T 5.0395 9.2092 122.8049 61.8038 72.2723 172.9598 63 F 5.7039 8.8807 119.1617 55.6915 42.3265 173.1111 64 T 5.6406 9.0917 109.1542 59.6246 72.3441 172.2237 65 C 4.9955 8.1853 115.3421 57.0409 33.0180 171.3011 66 P 4.8195 0.0000 0.0000 62.4323 31.2032 178.1496 67 R 4.0562 8.6492 121.4560 59.4802 29.6807 179.6624 68 S 4.3049 8.1829 112.6997 60.5281 63.3828 174.9770 69 D 4.9177 8.2078 120.8810 53.9823 41.4224 178.0117 70 G 4.1204 7.7639 110.1012 48.0606 0.0000 176.3748 71 R 3.3328 7.7333 122.5571 60.6592 29.4919 180.7059 72 R 3.9131 8.0235 119.0565 59.1473 29.8553 178.1714 73 A 4.0119 8.1638 120.3866 55.4479 18.5114 179.0633 74 M 3.9659 8.0954 118.9669 59.4474 32.1758 178.8095 75 E 3.9533 8.8121 118.7850 61.4371 29.7292 180.7220 76 I 3.9114 7.6387 119.7195 64.4053 37.2202 178.1429 77 L 4.5290 7.7907 120.7900 58.1342 41.7908 179.8479 78 K 4.6346 8.3470 123.8209 58.7305 32.5503 178.6951 79 K 4.6958 8.1725 122.5124 52.8623 30.4710 175.3620 80 L 5.3537 8.0068 135.0000 55.8060 41.1056 175.3337 81 Q 3.1705 7.7176 123.3108 59.3376 29.0106 176.5300 82 V 3.6909 7.6463 118.1697 62.5042 31.1873 176.4969 83 Q 3.4576 9.2718 126.1921 53.2951 24.1255 169.4401 84 G 3.8031 6.9207 108.3021 45.9502 0.0000 170.3996 85 N 4.9475 6.9524 115.4360 51.6959 39.4275 174.4154 86 W 5.3366 6.9698 111.1834 56.5434 30.7559 174.4454 87 T 4.2148 9.3722 118.1313 66.2152 68.2426 174.1003 88 N 5.3151 8.0418 115.7470 53.1672 40.8248 172.6007 89 V 4.7102 8.2769 117.7543 60.1072 33.5857 175.5333 90 L 4.5585 8.5759 125.8998 54.2064 43.4203 175.3586 91 Y 5.3406 8.2234 120.5758 56.4152 43.2004 173.7028 92 D 4.2191 7.7429 123.3266 52.8441 44.8983 174.9697 93 D 4.7378 8.1933 126.7005 52.7532 40.4612 176.1099 94 Q 4.7631 8.3782 116.3561 56.5835 30.6242 174.8707 95 V 4.6753 7.9992 118.4062 61.3748 33.4353 174.9960 96 G 4.2236 8.7697 113.7491 44.2577 0.0000 171.4744 97 K 5.0266 9.1119 126.0323 54.8648 34.3184 175.2163 98 V 4.8929 8.7957 126.8176 61.2906 34.5696 174.2695 99 S 5.3338 9.1822 123.4679 56.6393 66.7917 173.0647 100 L 4.6584 8.7252 125.5710 53.2164 43.8801 175.5184 101 V 3.9686 8.7187 128.0052 63.1572 32.8285 175.2248 102 G 4.1503 8.6333 113.9060 47.2263 0.0000 172.0393 103 A 4.1054 8.7786 121.5207 53.7213 21.6008 177.0827 104 G 3.8882 9.1240 113.9046 46.8013 0.0000 173.5769 105 M 4.2443 7.5095 118.3784 56.0779 33.4711 178.3674 106 K 4.2591 7.4869 119.1438 55.9638 30.7243 174.5955 *109 P 4.4722 0.0000 0.0000 63.3876 33.8352 179.9414 110 G 3.7160 8.0567 105.5790 47.1670 0.0000 175.4458 111 V 3.8905 7.9039 120.2301 66.2783 31.5196 178.1500 112 T 3.9310 7.9112 108.6455 64.8441 68.9338 176.2531 113 A 4.0458 7.8590 123.8667 54.9496 18.3363 179.4065 114 E 4.2716 8.5390 118.2149 58.2818 29.3472 178.9167 115 F 4.2679 8.9160 121.4636 61.9271 39.4320 177.1417 116 M 4.2994 8.5732 118.0969 58.5838 31.3165 178.6610 117 E 3.9739 8.4437 118.5517 59.3605 29.3734 179.2691 118 A 3.9856 8.1582 120.8775 54.9758 18.2704 179.7935 119 L 3.8813 7.5886 117.4201 57.7084 41.7354 179.3797 120 R 3.8683 7.9197 118.6594 59.7664 29.8584 178.4121 121 D 4.5578 8.1276 116.8693 56.5708 40.9184 177.6428 122 V 4.0316 7.3289 116.6033 60.5436 31.9364 175.0951 123 N 4.1932 8.3066 117.5678 55.5589 37.2905 174.1111 124 V 4.4466 7.9513 109.6740 59.4024 34.9417 175.2082 125 N 4.7722 8.5204 121.3437 51.8905 40.0104 174.3083 126 I 4.1474 8.3213 126.9947 61.1142 37.9127 174.9996 127 E 4.3901 8.9266 125.5462 57.8688 30.4616 176.4825 128 L 4.8875 7.8019 120.3813 53.1945 45.5401 174.8573 129 I 5.0479 8.0932 124.2371 59.7945 41.3161 175.0461 130 S 4.5194 8.8590 120.6972 57.8354 65.6014 173.2740 131 T 5.1731 8.4248 116.7511 60.4253 72.5561 172.8244 132 S 4.5485 9.1093 115.4723 57.2414 65.9825 174.1699 133 E 4.1570 8.8497 118.3677 58.8393 30.0188 178.5685 134 I 4.4276 8.0039 111.0845 59.7554 39.3521 175.3431 135 R 4.9431 7.6838 122.2805 55.4336 34.1701 173.6835 136 I 4.4610 8.3250 126.3122 59.7522 39.8119 174.2824 137 S 5.1559 8.6408 123.8283 56.6231 65.5387 174.1200 138 V 4.9319 8.8002 117.1593 59.5405 35.8343 174.3687 139 L 5.2505 8.5394 123.2413 53.3534 44.0933 175.8334 140 I 4.8881 8.4936 115.9719 58.7262 42.0964 174.6458 141 R 4.3081 8.4798 120.7120 56.0791 30.5644 177.9196 142 E 3.9949 8.8771 121.4445 59.8045 29.1321 179.3838 143 D 4.3630 7.9946 118.4397 57.2736 41.1693 177.8187 144 D 4.5241 7.9365 117.4142 55.4364 40.7555 178.1102 145 L 3.9043 7.6705 122.2741 58.2008 41.9881 178.0651 146 D 4.2893 8.1442 116.9896 57.6280 40.7519 178.1501 147 A 3.9572 8.0451 119.7602 54.2597 18.4256 178.7216 148 A 3.9594 7.7535 118.8133 54.0399 19.4153 179.3666 149 A 3.9125 7.8860 121.6177 55.9013 18.4594 180.6050 150 R 3.9630 7.6008 118.4638 61.6875 29.2339 180.8622 151 A 4.2345 7.4411 122.7349 55.2984 18.5964 180.2065 152 L 4.1284 7.7862 120.9795 59.9681 41.0321 181.7817 153 H 4.4358 8.5077 120.4678 59.4309 28.5476 177.7800 154 E 4.2854 8.1217 116.4685 59.1145 29.7958 179.1258 155 Q 4.2805 7.5002 117.5680 57.8830 30.0110 176.3263 156 F 4.7726 8.1611 117.6340 57.6888 40.2837 175.2292 157 Q 4.4283 8.3459 119.1997 55.5976 27.5723 179.6126 158 L 4.3260 7.7668 121.0627 54.4687 40.8904 178.6978 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 6 L 8.18 4.36 0.00 1.64 1.66 0.96 0.33 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 7 T 8.03 4.28 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 1.21 0.00 0.00 8 G 8.04 4.06 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 0.00 0.00 0.00 9 V 8.53 5.01 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 0.75 0.00 0.00 0.83 0.00 0.00 10 A 8.72 5.01 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 11 T 8.32 5.10 4.25 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 1.22 0.00 0.00 12 D 9.43 4.66 0.00 2.68 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 13 K 8.79 4.88 0.00 1.54 1.61 0.00 1.84 0.00 0.00 1.76 0.00 0.00 2.71 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.24 0.96 7.81 14 S 10.72 4.69 0.00 3.90 4.11 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 15 E 8.13 5.25 0.00 1.85 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 2.24 2.29 0.00 16 A 8.89 4.80 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 17 K 8.43 4.90 0.00 1.76 1.52 0.00 1.52 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.20 1.25 7.81 18 V 8.25 4.78 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 0.25 0.00 0.00 0.53 0.00 0.00 19 T 8.58 4.84 4.17 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 1.21 0.00 0.00 20 V 9.31 4.44 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 0.23 0.00 0.00 0.38 0.00 0.00 21 L 8.57 5.03 0.00 1.68 1.55 0.96 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 22 G 9.38 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 23 I 8.03 4.52 2.05 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 1.32 0.71 1.02 0.00 0.00 24 S 8.59 4.51 0.00 3.93 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 25 D 8.71 4.83 0.00 2.99 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 26 K 7.42 4.70 0.00 1.93 1.86 0.00 1.59 0.00 0.00 1.85 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.56 1.49 7.81 27 P 0.00 4.19 0.00 2.08 2.07 0.00 3.67 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 28 G 9.10 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 0.00 0.00 0.00 29 E 8.31 3.89 0.00 2.20 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 0.00 2.54 2.80 0.00 30 A 8.18 4.08 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.65 4.11 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 K 7.85 3.91 0.00 2.18 2.08 0.00 1.77 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.52 1.72 7.81 33 V 7.59 3.33 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 0.18 0.00 0.00 0.39 0.00 0.00 34 F 7.49 4.34 0.00 3.11 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 35 R 8.35 3.95 0.00 2.15 2.01 0.00 3.32 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.83 0.00 36 A 7.73 4.01 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 37 L 7.61 3.89 0.00 1.61 1.62 0.90 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 38 A 7.90 4.01 1.42 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 39 D 8.19 4.43 0.00 2.84 2.76 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 40 A 7.56 4.34 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 41 E 8.21 3.80 0.00 2.10 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 2.25 2.26 0.00 42 I 7.60 4.07 1.95 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 1.35 0.77 0.95 0.00 0.00 43 N 8.68 4.66 0.00 2.68 2.73 0.00 0.00 7.10 7.94 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 44 I 8.11 4.44 1.78 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.61 0.91 0.00 0.00 45 D 9.02 4.53 0.00 2.69 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 46 M 5.86 4.37 0.00 2.08 2.01 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 2.64 2.50 0.00 47 V 8.26 5.02 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 0.80 0.00 0.00 0.76 0.00 0.00 48 L 9.15 4.75 0.00 1.72 1.45 0.97 0.88 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 49 Q 8.55 5.13 0.00 2.13 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.80 0.00 0.00 0.00 0.00 0.00 2.28 2.58 0.00 50 N 8.65 4.67 0.00 2.79 2.75 0.00 0.00 7.23 7.86 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 51 V 8.18 3.94 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 0.75 0.00 0.00 0.95 0.00 0.00 52 F 8.52 4.54 0.00 2.96 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 53 S 7.89 4.37 0.00 3.77 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 54 V 8.49 3.68 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 0.85 0.00 0.00 1.05 0.00 0.00 55 E 8.04 4.08 0.00 1.92 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 2.30 2.39 0.00 56 D 7.88 4.33 0.00 2.52 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.32 3.69 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 0.00 0.00 0.00 58 T 6.49 4.53 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 1.15 0.00 0.00 59 T 8.96 5.10 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 1.37 0.00 0.00 60 D 8.59 5.50 0.00 2.59 2.58 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 61 I 9.12 5.18 1.84 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.02 1.15 0.00 0.00 62 T 9.21 5.04 4.25 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 1.18 0.00 0.00 63 F 8.88 5.70 0.00 3.27 3.29 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 64 T 9.09 5.64 4.38 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 1.21 0.00 0.00 65 C 8.19 5.00 0.00 3.24 3.31 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 66 P 0.00 4.82 0.00 2.24 2.04 0.00 3.77 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.14 0.00 67 R 8.65 4.06 0.00 1.91 2.05 0.00 3.14 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.80 0.00 68 S 8.18 4.30 0.00 4.04 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 69 D 8.21 4.92 0.00 2.90 2.76 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 70 G 7.76 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 0.00 0.00 0.00 0.00 71 R 7.73 3.33 0.00 1.83 1.96 0.00 3.27 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.27 0.00 72 R 8.02 3.91 0.00 1.85 2.12 0.00 3.15 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.71 0.00 73 A 8.16 4.01 1.62 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 0.00 0.00 74 M 8.10 3.97 0.00 1.89 1.80 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.51 0.00 75 E 8.81 3.95 0.00 1.97 1.94 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 2.25 2.23 0.00 76 I 7.64 3.91 2.14 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 1.54 0.84 0.96 0.00 0.00 77 L 7.79 4.53 0.00 1.87 1.76 0.91 1.42 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 78 K 8.35 4.63 0.00 1.77 1.81 0.00 1.80 0.00 0.00 1.57 0.00 0.00 2.81 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.37 1.31 7.81 79 K 8.17 4.70 0.00 1.73 1.95 0.00 1.88 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.38 7.81 80 L 8.01 5.35 0.00 2.03 2.16 0.91 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 81 Q 7.72 3.17 0.00 2.44 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.74 0.00 0.00 0.00 0.00 0.00 2.25 2.24 0.00 82 V 7.65 3.69 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 0.76 0.00 0.00 0.93 0.00 0.00 83 Q 9.27 3.46 0.00 2.24 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.66 0.00 0.00 0.00 0.00 0.00 2.16 1.91 0.00 84 G 6.92 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 0.00 0.00 0.00 85 N 6.95 4.95 0.00 2.60 2.93 0.00 0.00 6.61 7.68 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 86 W 6.97 5.34 0.00 3.54 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 87 T 9.37 4.21 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 1.25 0.00 0.00 88 N 8.04 5.32 0.00 2.85 2.96 0.00 0.00 6.23 7.68 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 89 V 8.28 4.71 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 0.84 0.00 0.00 0.92 0.00 0.00 90 L 8.58 4.56 0.00 1.62 1.61 0.91 0.62 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 91 Y 8.22 5.34 0.00 2.89 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 92 D 7.74 4.22 0.00 2.62 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 0.00 0.00 0.00 0.00 93 D 8.19 4.74 0.00 2.61 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 94 Q 8.38 4.76 0.00 2.03 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.83 0.00 0.00 0.00 0.00 0.00 2.21 2.18 0.00 95 V 8.00 4.68 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 0.75 0.00 0.00 0.89 0.00 0.00 96 G 8.77 4.22 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 0.00 0.00 0.00 0.00 0.00 0.00 97 K 9.11 5.03 0.00 1.82 1.69 0.00 1.58 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.38 7.81 98 V 8.80 4.89 2.23 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 1.03 0.00 0.00 0.96 0.00 0.00 99 S 9.18 5.33 0.00 3.79 3.70 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 0.00 100 L 8.73 4.66 0.00 1.93 1.59 0.75 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 101 V 8.72 3.97 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 0.84 0.00 0.00 0.92 0.00 0.00 102 G 8.63 4.15 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 8.78 4.11 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 0.00 104 G 9.12 3.89 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 0.00 0.00 0.00 105 M 7.51 4.24 0.00 1.93 2.22 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 2.54 2.42 0.00 106 K 7.49 4.26 0.00 1.86 1.85 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.55 1.37 7.81 *109 P 0.00 4.47 0.00 2.36 2.39 0.00 3.46 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.29 0.00 110 G 8.06 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 0.00 0.00 0.00 111 V 7.90 3.89 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 1.05 0.00 0.00 0.97 0.00 0.00 112 T 7.91 3.93 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 1.16 0.00 0.00 113 A 7.86 4.05 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 0.00 114 E 8.54 4.27 0.00 2.32 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 0.00 2.47 2.24 0.00 115 F 8.92 4.27 0.00 3.44 3.31 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 0.00 116 M 8.57 4.30 0.00 2.16 2.35 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 3.09 0.00 117 E 8.44 3.97 0.00 2.16 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 2.33 2.48 0.00 118 A 8.16 3.99 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 0.00 119 L 7.59 3.88 0.00 1.86 1.72 1.00 0.48 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 0.00 120 R 7.92 3.87 0.00 1.90 2.09 0.00 3.10 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 121 D 8.13 4.56 0.00 2.67 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 0.00 122 V 7.33 4.03 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 0.76 0.00 0.00 0.97 0.00 0.00 123 N 8.31 4.19 0.00 2.81 2.90 0.00 0.00 6.88 7.59 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 0.00 124 V 7.95 4.45 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 0.75 0.00 0.00 0.94 0.00 0.00 125 N 8.52 4.77 0.00 2.65 2.71 0.00 0.00 7.06 7.94 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 0.00 126 I 8.32 4.15 1.92 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.73 0.96 0.00 0.00 127 E 8.93 4.39 0.00 1.98 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 2.24 0.00 128 L 7.80 4.89 0.00 1.67 1.45 0.91 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 129 I 8.09 5.05 1.85 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 1.22 0.78 0.83 0.00 0.00 130 S 8.86 4.52 0.00 3.83 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 0.00 131 T 8.42 5.17 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 1.04 0.00 0.00 132 S 9.11 4.55 0.00 3.89 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 0.00 133 E 8.85 4.16 0.00 1.92 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 2.38 2.29 0.00 134 I 8.00 4.43 2.01 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.97 0.89 0.00 0.00 135 R 7.68 4.94 0.00 1.97 1.69 0.00 3.00 0.00 0.00 3.14 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 136 I 8.32 4.46 1.52 0.00 0.00 0.66 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 0.65 -0.45 0.00 0.00 137 S 8.64 5.16 0.00 3.89 3.71 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 0.00 138 V 8.80 4.93 2.23 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 0.77 0.00 0.00 1.20 0.00 0.00 139 L 8.54 5.25 0.00 1.59 1.55 0.90 0.67 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 0.00 140 I 8.49 4.89 1.88 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 1.36 0.95 1.02 0.00 0.00 141 R 8.48 4.31 0.00 1.85 1.88 0.00 3.28 0.00 0.00 3.36 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.55 0.00 142 E 8.88 3.99 0.00 2.20 2.28 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 2.35 2.35 0.00 143 D 7.99 4.36 0.00 2.66 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 0.00 144 D 7.94 4.52 0.00 2.86 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 0.00 145 L 7.67 3.90 0.00 1.94 1.70 0.93 1.11 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 0.00 146 D 8.14 4.29 0.00 2.74 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 0.00 147 A 8.05 3.96 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 0.00 148 A 7.75 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 0.00 149 A 7.89 3.91 1.34 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 0.00 0.00 0.00 150 R 7.60 3.96 0.00 1.96 1.96 0.00 3.28 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.53 0.00 151 A 7.44 4.23 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 0.00 152 L 7.79 4.13 0.00 1.68 1.69 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 153 H 8.51 4.44 0.00 3.32 3.38 0.00 5.58 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 0.00 154 E 8.12 4.29 0.00 2.08 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 2.26 2.18 0.00 155 Q 7.50 4.28 0.00 1.85 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.69 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 156 F 8.16 4.77 0.00 3.08 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 0.00 157 Q 8.35 4.43 0.00 2.19 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 6.96 0.00 0.00 0.00 0.00 0.00 2.16 2.12 0.00 158 L 7.77 4.33 0.00 1.66 1.47 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.