NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 28 H 4.7232 8.4444 120.4095 57.1323 29.7726 170.4653 29 M 3.0902 8.7408 129.7210 54.4382 31.8489 172.3582 30 E 4.5784 8.4391 120.1748 54.6679 34.0479 174.2198 31 C 4.5356 8.6013 123.1558 58.4285 29.3997 172.5523 32 A 3.6709 8.5970 127.8993 52.3302 14.7695 173.7843 33 D 4.6872 8.0659 116.5879 52.0881 44.0876 175.5679 34 V 4.1156 8.1584 126.4882 59.7361 31.4234 171.2416 35 P 4.5661 0.0000 0.0000 62.4357 30.6133 175.3796 36 L 4.6695 7.8618 122.0927 55.0190 48.5722 177.2820 37 L 4.2310 7.3051 127.7259 52.7790 43.4082 173.2825 *39 P 4.4198 0.0000 0.0000 62.5633 32.8941 175.6808 40 S 4.3822 7.6835 123.6331 57.2986 64.3897 176.4405 *42 K 4.2806 8.8355 115.4962 56.7429 34.0768 177.7883 43 E 4.1140 8.2724 119.1867 59.4451 29.3984 179.2213 44 M 4.1161 8.0002 118.2983 58.4796 31.9216 178.4874 45 M 4.0846 8.0219 118.4262 58.6650 32.2332 178.8771 46 S 4.1466 7.9357 115.0310 61.3121 62.9515 176.1879 47 Q 3.9074 8.1675 122.2096 59.3215 28.6669 178.6360 48 A 3.8907 7.8802 121.0290 55.2503 18.6271 179.4948 49 L 3.9444 7.7581 117.3541 57.9302 41.4480 179.9800 50 K 3.9013 8.1825 117.2408 59.4348 30.9931 178.9880 51 A 4.1496 7.8831 120.8860 55.1010 18.3361 179.8601 52 T 4.0484 7.7895 114.7293 66.4217 68.2784 176.5362 53 F 4.6945 7.4800 119.9746 61.2015 38.5663 178.0079 54 S 4.3840 7.9703 113.5760 61.4292 62.0040 175.8901 55 G 3.9774 8.3478 108.3765 44.7393 0.0000 175.0780 56 F 3.9601 8.7650 124.0258 61.3462 39.8429 177.4536 57 T 3.9544 7.9522 116.0753 65.9591 68.3316 176.4742 58 K 4.0011 7.6769 120.6697 59.0439 31.9497 178.7967 59 E 4.0833 7.3818 116.2252 58.8518 29.2116 178.3222 60 Q 3.7224 8.0617 118.6144 58.7055 28.3781 178.8555 61 Q 4.0069 7.6055 117.6772 58.7865 29.0515 177.9706 62 R 3.9753 7.3232 118.8605 58.6578 30.1838 177.6169 63 L 4.3884 7.9348 117.7569 55.3265 42.6097 177.6055 64 G 3.9844 8.0067 104.4999 44.7884 0.0000 173.8387 65 I 2.9423 7.3720 120.9975 60.6458 37.2585 174.2636 66 P 4.5250 0.0000 0.0000 61.9814 32.1854 176.3147 67 K 4.0503 8.4200 119.6957 58.7761 32.3868 176.5562 68 D 4.4503 7.8865 118.7491 52.5351 41.9920 174.3007 69 P 2.9700 0.0000 0.0000 64.8862 31.7627 178.7717 70 R 3.9400 7.8111 117.6917 58.5467 30.1442 176.5027 71 Q 4.5851 7.9190 115.1701 56.1691 29.4266 175.5337 72 W 5.0144 8.0712 117.5395 56.8645 31.6909 174.7024 73 T 5.1363 7.8864 112.4585 59.5697 71.4932 173.6967 74 E 4.6754 8.7452 121.9069 59.2768 29.1963 179.8367 75 T 3.8158 7.7594 114.7588 67.0975 68.6843 176.2136 76 H 3.7296 7.8368 117.4737 58.6094 28.5330 177.8858 77 V 4.0994 8.2463 120.3695 66.2304 31.4226 178.1692 78 R 4.2096 8.3334 118.3826 59.7817 30.1007 178.0614 79 D 4.3970 8.8871 119.3047 57.2538 40.7131 178.5883 80 W 4.4487 8.5778 128.9896 60.1953 30.6560 177.9586 81 V 2.8435 8.2298 117.9431 66.2626 31.3998 177.3911 82 M 4.5345 8.7933 117.8770 58.7270 32.1351 177.9025 83 W 4.2073 8.3142 128.0109 60.5552 30.8504 177.7674 84 A 3.3974 8.6725 120.8001 54.5445 17.5873 179.6936 85 V 3.5926 7.5326 116.9439 65.7502 31.3468 177.6070 86 N 4.2847 7.7572 115.6737 56.1004 39.0059 176.4125 87 E 3.6936 7.7461 120.1950 58.3278 29.1611 178.2727 88 F 4.6108 7.3999 113.6881 56.2294 39.8605 175.8907 89 S 3.6575 7.6996 115.5632 59.4912 60.0046 171.0389 90 L 4.4415 7.8843 120.0353 54.2432 43.2109 176.7679 91 K 4.3514 8.2784 116.1684 57.4674 34.4420 176.0391 92 G 3.9462 8.9666 109.5803 45.1372 0.0000 174.0058 93 V 3.8826 7.2691 119.3264 60.7973 32.5239 175.1165 94 D 4.7349 8.1177 121.5710 51.6242 41.4481 175.9397 95 F 4.8545 8.2849 117.6894 58.3611 39.9093 178.2842 96 Q 4.1179 8.2099 120.4087 58.9137 28.7600 178.7973 97 K 3.8574 8.3726 116.5908 58.7875 32.0297 177.5410 98 F 5.1310 7.2115 115.6502 57.8104 39.8265 176.5188 99 C 4.5844 7.5958 120.5122 57.4037 30.1655 171.0821 100 M 4.7799 7.3606 119.6207 52.9849 34.3109 174.9568 101 S 4.9276 8.5282 114.7691 57.5910 65.4881 175.2782 102 G 4.2244 9.1887 110.3335 47.5495 0.0000 175.6406 103 A 4.0578 8.2577 122.6122 54.9762 18.2989 179.5404 104 A 3.9672 7.6697 119.0642 55.1671 18.3423 179.4379 105 L 4.1419 7.9568 117.6533 58.8211 42.3353 178.7941 106 C 4.2620 8.6339 116.7058 62.7648 27.8396 175.9287 107 A 4.0317 7.8197 121.1954 55.0678 17.9561 179.2918 108 L 4.1510 7.8528 117.1475 55.6202 42.0919 178.6349 109 G 4.0323 7.8288 103.7110 44.9334 0.0000 174.1575 110 K 3.7413 8.6164 118.5202 59.3245 32.0905 178.0647 111 E 3.8598 8.1072 117.2560 59.9670 29.0263 178.8075 112 C 4.3980 7.9445 117.4016 61.6951 28.7017 175.3903 113 F 4.4375 8.6219 122.4573 61.3473 38.4062 176.9760 114 L 4.1293 8.9006 120.2498 57.9848 41.4866 178.6237 115 E 4.1570 8.0761 118.2444 58.6903 29.1659 178.9269 116 L 3.7443 7.4807 118.1568 55.3629 41.9093 176.8032 117 A 4.6036 6.3498 120.1940 49.0337 21.6893 174.0832 118 P 4.4089 0.0000 0.0000 62.7170 31.8379 177.5768 119 D 4.3522 8.6086 118.5135 56.4680 40.8893 177.5955 120 F 4.6208 8.0101 116.1675 59.3800 40.5677 178.0808 121 V 3.7756 7.9427 111.4347 64.3815 31.4781 178.5429 122 G 3.9792 8.0810 105.1199 48.1447 0.0000 175.4362 123 D 4.6509 8.0853 120.7408 57.3540 40.9109 178.6846 124 I 3.5867 7.8164 119.6980 64.4103 37.0841 177.9730 125 L 4.1804 7.9406 119.5061 58.0819 41.6525 179.6892 126 W 3.7778 8.6512 127.7274 60.0929 30.3902 177.4095 127 E 3.0490 8.4535 119.7222 59.4694 29.2470 178.3967 128 H 4.4240 8.4343 118.1647 59.0214 29.7967 177.0229 129 L 3.2117 8.6090 122.7084 57.9085 41.8573 178.6769 130 E 3.7233 7.9820 119.5340 58.9326 29.4184 178.7283 131 I 3.5751 7.1676 119.9338 64.3088 37.0701 178.1984 132 L 3.8774 7.4583 119.2726 57.7361 41.0918 179.7190 133 Q 3.7411 7.0085 115.5670 58.7610 28.7896 178.3048 134 K 3.9699 7.6140 119.0643 59.5032 32.3266 178.0630 135 E 4.0823 8.4384 118.5946 57.9222 30.8694 176.7663 136 D 4.7561 7.6060 118.8306 51.5382 40.3647 174.6836 137 V 3.4510 7.6126 119.5235 63.8136 32.3436 175.7511 138 K 4.1454 8.6365 126.9681 56.9227 32.8366 175.1238 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 28 H 8.44 4.72 0.00 3.16 3.32 0.00 5.81 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 M 8.74 3.09 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.60 0.00 30 E 8.44 4.58 0.00 1.90 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 2.20 2.40 0.00 31 C 8.60 4.54 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 32 A 8.60 3.67 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 33 D 8.07 4.69 0.00 2.71 2.52 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 34 V 8.16 4.12 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 0.86 0.00 0.00 0.94 0.00 0.00 35 P 0.00 4.57 0.00 2.09 2.05 0.00 3.79 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.24 0.00 36 L 7.86 4.67 0.00 1.58 1.57 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 37 L 7.31 4.23 0.00 1.58 1.57 0.92 1.00 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 *39 P 0.00 4.42 0.00 2.21 2.14 0.00 3.74 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 1.89 1.97 0.00 40 S 7.68 4.38 0.00 3.97 3.39 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 *42 K 8.84 4.28 0.00 2.14 2.17 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.41 1.49 7.81 43 E 8.27 4.11 0.00 2.19 2.05 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 2.64 2.36 0.00 44 M 8.00 4.12 0.00 2.07 2.13 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 2.70 2.64 0.00 45 M 8.02 4.08 0.00 2.03 2.30 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.60 0.00 46 S 7.94 4.15 0.00 3.97 3.94 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 47 Q 8.17 3.91 0.00 2.31 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 48 A 7.88 3.89 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 49 L 7.76 3.94 0.00 1.72 1.49 1.00 0.96 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 50 K 8.18 3.90 0.00 1.86 1.93 0.00 1.76 0.00 0.00 1.83 0.00 0.00 3.10 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.64 1.65 7.81 51 A 7.88 4.15 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 52 T 7.79 4.05 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 0.98 0.00 0.00 53 F 7.48 4.69 0.00 3.31 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 54 S 7.97 4.38 0.00 4.28 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 0.00 55 G 8.35 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 56 F 8.76 3.96 0.00 3.33 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 T 7.95 3.95 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 1.15 0.00 0.00 58 K 7.68 4.00 0.00 2.05 1.90 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.49 1.65 7.81 59 E 7.38 4.08 0.00 2.04 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 2.16 2.26 0.00 60 Q 8.06 3.72 0.00 1.82 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.43 0.00 0.00 0.00 0.00 0.00 1.18 1.16 0.00 61 Q 7.61 4.01 0.00 2.18 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.96 0.00 0.00 0.00 0.00 0.00 2.46 2.30 0.00 62 R 7.32 3.98 0.00 2.06 2.25 0.00 3.42 0.00 0.00 3.24 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 63 L 7.93 4.39 0.00 1.50 1.63 0.95 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.01 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 65 I 7.37 2.94 1.49 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.35 0.18 0.00 0.00 66 P 0.00 4.53 0.00 2.32 2.12 0.00 3.17 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.16 0.00 67 K 8.42 4.05 0.00 1.68 1.98 0.00 1.73 0.00 0.00 1.58 0.00 0.00 3.05 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.63 7.81 68 D 7.89 4.45 0.00 2.59 2.52 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 69 P 0.00 2.97 0.00 1.68 1.31 0.00 3.48 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.58 0.00 70 R 7.81 3.94 0.00 2.09 2.00 0.00 3.07 0.00 0.00 3.49 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 71 Q 7.92 4.59 0.00 2.26 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.73 0.00 0.00 0.00 0.00 0.00 2.64 2.48 0.00 72 W 8.07 5.01 0.00 3.59 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 73 T 7.89 5.14 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 1.03 0.00 0.00 74 E 8.75 4.68 0.00 2.08 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 0.00 2.59 2.35 0.00 75 T 7.76 3.82 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 1.18 0.00 0.00 76 H 7.84 3.73 0.00 2.84 1.61 0.00 5.64 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 V 8.25 4.10 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 1.44 0.00 0.00 1.46 0.00 0.00 78 R 8.33 4.21 0.00 2.07 2.02 0.00 3.07 0.00 0.00 2.86 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.25 0.00 79 D 8.89 4.40 0.00 2.88 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.58 4.45 0.00 3.52 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 81 V 8.23 2.84 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 0.95 0.00 0.00 1.01 0.00 0.00 82 M 8.79 4.53 0.00 2.20 2.05 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.66 0.00 83 W 8.31 4.21 0.00 3.63 3.62 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 84 A 8.67 3.40 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.53 3.59 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 1.17 0.00 0.00 0.98 0.00 0.00 86 N 7.76 4.28 0.00 2.73 2.83 0.00 0.00 6.99 7.63 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 87 E 7.75 3.69 0.00 1.16 1.12 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 1.47 1.47 0.00 88 F 7.40 4.61 0.00 2.87 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 89 S 7.70 3.66 0.00 3.92 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 90 L 7.88 4.44 0.00 1.60 1.61 0.83 1.03 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 91 K 8.28 4.35 0.00 1.78 1.70 0.00 1.53 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.24 1.30 7.81 92 G 8.97 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 0.00 0.00 0.00 93 V 7.27 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 0.57 0.00 0.00 0.91 0.00 0.00 94 D 8.12 4.73 0.00 2.68 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 F 8.28 4.85 0.00 3.19 3.22 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 96 Q 8.21 4.12 0.00 2.24 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.99 0.00 0.00 0.00 0.00 0.00 2.50 2.35 0.00 97 K 8.37 3.86 0.00 1.00 1.27 0.00 1.53 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.59 1.43 7.81 98 F 7.21 5.13 0.00 3.30 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 99 C 7.60 4.58 0.00 3.23 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 0.00 100 M 7.36 4.78 0.00 2.31 2.23 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.75 0.00 101 S 8.53 4.93 0.00 4.38 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 0.00 102 G 9.19 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 0.00 103 A 8.26 4.06 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 0.00 104 A 7.67 3.97 1.44 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 0.00 105 L 7.96 4.14 0.00 2.00 1.98 1.50 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 106 C 8.63 4.26 0.00 2.94 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 A 7.82 4.03 1.43 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 0.00 0.00 108 L 7.85 4.15 0.00 2.05 1.89 1.10 0.83 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 0.00 109 G 7.83 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 K 8.62 3.74 0.00 1.62 1.58 0.00 0.61 0.00 0.00 0.85 0.00 0.00 2.75 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.79 0.21 7.81 111 E 8.11 3.86 0.00 2.19 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 0.00 2.35 2.42 0.00 112 C 7.94 4.40 0.00 3.09 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 0.00 113 F 8.62 4.44 0.00 3.35 3.36 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 0.00 114 L 8.90 4.13 0.00 1.89 1.72 0.99 1.05 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 0.00 115 E 8.08 4.16 0.00 2.26 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 2.28 2.50 0.00 116 L 7.48 3.74 0.00 1.22 0.55 1.07 0.48 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 0.00 117 A 6.35 4.60 1.43 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 0.00 0.00 118 P 0.00 4.41 0.00 2.28 2.10 0.00 3.62 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 2.15 2.25 0.00 119 D 8.61 4.35 0.00 2.28 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 0.00 0.00 0.00 120 F 8.01 4.62 0.00 3.06 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 0.00 121 V 7.94 3.78 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 0.97 0.00 0.00 0.97 0.00 0.00 122 G 8.08 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 0.00 123 D 8.09 4.65 0.00 2.87 2.91 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.82 3.59 1.76 0.00 0.00 0.51 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 0.54 -0.14 0.00 0.00 125 L 7.94 4.18 0.00 2.21 2.42 0.88 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 126 W 8.65 3.78 0.00 3.20 3.50 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 0.00 127 E 8.45 3.05 0.00 2.25 2.05 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 2.02 2.39 0.00 128 H 8.43 4.42 0.00 3.54 3.64 0.00 5.66 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 L 8.61 3.21 0.00 1.54 1.39 -0.39 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 130 E 7.98 3.72 0.00 1.31 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.14 0.00 131 I 7.17 3.58 2.03 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 1.43 0.62 0.66 0.00 0.00 132 L 7.46 3.88 0.00 1.40 1.46 0.13 0.95 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 0.00 133 Q 7.01 3.74 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.81 0.00 0.00 0.00 0.00 0.00 2.14 2.26 0.00 134 K 7.61 3.97 0.00 1.65 1.72 0.00 1.74 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.53 7.81 135 E 8.44 4.08 0.00 1.87 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 2.32 0.00 136 D 7.61 4.76 0.00 2.64 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 7.61 3.45 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 0.80 0.00 0.00 0.91 0.00 0.00 138 K 8.64 4.15 0.00 1.90 1.76 0.00 1.85 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.28 1.39 7.81 * Residues marked with a * may have inaccurate shift predictions.