NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 E 4.1793 8.4444 121.4681 55.7157 30.4678 174.6769 8 L 4.1250 8.4657 129.4595 54.2624 42.6944 174.4069 9 K 4.7044 9.3540 125.7507 54.5197 37.1152 174.8473 10 V 4.7033 8.2657 122.5582 61.5080 34.1069 174.1162 11 T 4.6955 9.0118 125.1360 61.9044 70.8177 173.3887 12 Q 5.1713 8.5331 124.4780 53.0334 32.4104 173.8266 13 P 4.1959 0.0000 0.0000 63.2545 31.7702 176.7973 14 E 4.2945 8.5210 123.1593 55.2536 28.4982 175.4146 15 K 4.3059 7.3196 121.9906 56.6997 36.3536 172.8304 16 S 5.2334 8.8191 114.0786 56.7827 65.2380 173.8528 17 V 4.4571 9.1147 127.0559 60.1563 33.5834 174.6282 18 S 5.4926 8.7534 121.0102 56.8169 64.6842 173.9029 19 V 4.5625 8.7086 123.6959 59.6188 34.9084 174.8551 20 A 4.3967 8.5639 124.8283 51.2027 19.8239 176.7687 21 A 4.1041 8.4824 123.8702 54.1962 18.8162 178.1794 22 G 3.9373 9.4777 112.1958 45.0506 0.0000 173.2613 23 D 4.7820 7.9829 119.7344 53.8454 42.7703 175.3627 24 S 5.1608 8.3450 114.8761 57.4188 66.3347 173.4334 25 T 4.6364 8.6231 114.7929 60.8435 71.2714 172.2782 26 V 4.6855 8.2111 124.6231 60.9583 34.1513 174.4076 27 L 4.6777 8.4684 127.8120 53.1502 43.5799 175.5007 28 N 5.5987 8.8093 121.2067 52.2864 40.3455 175.2729 29 C 5.3045 8.6644 120.9661 55.8491 45.4469 172.6208 30 T 5.4394 9.0928 115.4505 60.0478 72.1325 172.6266 31 L 5.3704 8.7439 122.8205 53.4310 44.0612 176.8611 32 T 4.3161 8.5074 111.3803 63.0498 69.5443 174.6644 33 S 4.5851 7.7339 114.9429 57.5223 65.1566 173.3076 34 L 4.5239 8.4776 124.6191 54.5337 41.7638 176.3174 35 L 4.6679 7.5249 119.1442 51.9028 43.7601 174.6239 36 P 4.4118 0.0000 0.0000 62.0396 32.3431 176.1915 37 V 3.4144 7.8439 118.8911 61.6931 31.7324 175.3960 38 G 4.6893 7.8340 114.2008 45.0386 0.0000 170.0325 39 P 4.8787 0.0000 0.0000 62.8259 32.9258 175.6413 40 I 4.9603 8.5395 123.1971 59.7037 39.3619 174.9428 41 K 5.3059 9.4867 126.2660 54.4891 36.0232 175.1276 42 W 5.4441 9.5547 123.9212 55.8274 31.2647 175.0570 43 Y 5.3599 9.5435 120.9789 56.2474 42.1096 174.2777 44 R 4.6270 9.1561 121.8657 55.9144 32.8835 176.8083 45 G 4.1537 9.2556 113.1565 44.9126 0.0000 172.6430 46 V 4.3148 7.9276 111.8228 60.3533 35.7950 175.5116 47 G 3.8747 8.4543 107.9544 44.8570 0.0000 174.1557 48 Q 4.0793 8.3229 116.0242 57.9059 28.8164 177.3239 49 S 4.8084 7.7670 113.3652 57.7000 63.4400 174.0624 50 R 4.0369 7.3854 116.7183 57.0266 29.6634 175.6407 51 L 4.4173 8.6496 124.3050 54.4030 43.4220 175.5266 52 L 3.9709 8.7720 128.9324 55.4876 42.1675 175.7486 53 I 4.4658 8.6010 126.7749 62.8765 39.5479 175.5148 54 Y 4.5535 7.6068 120.3772 56.4399 42.2699 173.4376 55 S 4.9072 7.3998 120.8536 57.0031 66.2736 174.5054 56 F 4.6882 9.7494 125.4653 56.7622 37.7808 177.0662 57 T 3.7692 8.4287 119.5120 66.2989 69.3957 175.9503 58 G 3.9768 8.1324 108.0347 44.9615 0.0000 172.6199 59 E 4.2934 8.5322 119.2963 56.3492 31.1821 177.0950 60 H 4.6914 8.5629 121.0552 55.1790 28.3789 173.7122 61 F 5.4134 8.1767 122.8132 55.7826 40.8643 173.2801 62 P 3.3941 0.0000 0.0000 62.1651 31.6075 176.4526 63 R 3.8397 7.8009 120.3379 58.6877 30.3655 176.6264 64 V 4.4434 8.0213 117.2466 61.1767 33.6912 175.4259 65 T 5.0179 8.5951 114.3707 61.3460 69.6636 173.5114 66 N 5.1129 8.1759 118.8770 52.7006 37.9565 173.8798 67 V 4.4809 8.5242 118.2731 61.9480 33.9740 174.6142 68 S 4.7577 8.2864 119.7361 56.1731 66.1838 172.8972 69 D 4.4069 8.7351 120.8326 54.5233 41.3016 175.7114 70 A 4.7323 8.6613 128.7787 52.2198 19.3453 176.8359 71 T 4.4494 8.1600 108.5344 62.8209 70.0422 174.9847 72 K 4.3605 7.6871 121.5175 55.4976 33.2737 177.0871 73 R 4.0401 8.4989 121.0052 58.7086 30.4942 177.1287 74 N 4.9120 7.7144 115.7323 51.5138 41.6409 174.3399 75 N 4.4378 8.8694 122.4528 54.9328 37.8990 175.2780 76 M 4.4745 7.8434 118.1290 55.2758 32.6384 174.1707 77 D 5.0895 7.4516 119.8403 52.6152 42.5328 176.1340 78 F 4.2471 8.9230 125.1346 57.0544 40.4284 175.5396 79 S 4.9062 8.6928 114.9235 58.8125 63.9871 173.6735 80 I 4.5160 8.0887 115.5852 58.9136 40.8688 173.9297 81 R 4.7275 8.1091 123.4447 54.6766 32.0976 174.9319 82 I 4.2301 8.5551 127.7890 59.8851 38.8979 174.7622 83 S 4.5952 8.6138 123.7126 57.6457 63.9817 174.4384 84 N 4.3324 8.4083 120.7304 52.4828 36.3528 174.8620 85 V 3.7400 8.1608 118.6433 63.6800 32.7447 174.8879 86 T 4.8799 8.5761 115.2734 58.7834 71.5474 173.2875 87 P 4.1880 0.0000 0.0000 65.7830 31.4115 178.7974 88 E 4.1159 7.6456 115.4280 58.8708 29.3904 177.5386 89 D 4.6547 8.1382 117.1362 54.9675 41.3196 176.7415 90 A 4.2913 7.8278 123.1952 51.7494 19.0161 177.6939 91 G 4.1978 7.6430 108.0372 44.4490 0.0000 171.3672 92 T 5.0039 7.9264 116.2844 62.2043 70.6695 173.7294 93 Y 5.1107 9.0443 124.1282 56.5464 40.7149 174.2816 94 Y 5.0488 9.4950 121.2393 56.3073 41.7678 173.7237 95 C 3.9928 8.9928 124.5927 54.9238 44.0898 172.2968 96 V 4.7567 8.7095 126.8072 60.8889 34.2938 173.8863 97 K 4.8480 8.7634 129.4506 55.0922 34.0771 175.0798 98 F 5.2187 9.2663 125.4640 55.6620 43.0515 173.8307 99 Q 4.7408 9.0629 123.3619 54.9576 30.5883 174.5196 100 K 4.5757 8.8350 129.0386 55.7387 32.5316 176.4846 101 G 4.1389 8.4728 117.8089 43.5161 0.0000 170.2676 102 P 4.3220 0.0000 0.0000 64.9935 31.2295 176.4890 103 S 4.8036 7.6158 108.8140 55.8282 65.5079 172.8123 104 E 4.2932 8.4254 122.5946 55.1230 29.9254 175.2288 105 P 4.5788 0.0000 0.0000 62.1132 32.4458 175.7747 106 D 4.7706 8.3794 118.6678 55.0404 41.8823 175.9636 107 T 4.6994 8.6632 117.7694 61.5366 70.8647 173.6534 108 E 3.6731 8.9982 128.5596 56.2253 29.6534 176.2465 109 I 4.4866 8.2894 118.6833 60.8311 39.7565 174.9226 110 Q 4.5486 7.4722 122.0222 55.3001 32.3721 172.6442 111 S 4.8669 8.6626 117.1509 56.6062 65.9294 173.7908 112 G 3.9720 8.8846 113.2893 45.6873 0.0000 173.7675 113 G 3.9698 8.7412 107.0582 45.3852 0.0000 175.0059 114 G 3.5275 8.7745 105.7561 45.7432 0.0000 173.0551 115 T 4.7765 8.3833 116.9474 61.4231 72.5025 172.7904 116 E 4.7938 9.1137 127.8981 55.6456 31.5543 174.9997 117 V 4.8378 9.1112 127.1450 61.4271 33.8866 173.3889 118 Y 5.1380 9.1759 129.9599 55.8649 41.0134 174.1545 119 V 4.3665 7.7731 126.6871 60.9423 32.9925 175.4328 120 L 3.9113 8.2312 127.2383 54.9810 41.0348 177.0484 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 7 E 8.44 4.18 0.00 1.91 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.35 0.00 8 L 8.47 4.13 0.00 1.72 1.53 0.86 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.35 4.70 0.00 1.63 1.60 0.00 1.66 0.00 0.00 1.54 0.00 0.00 2.96 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.32 1.48 7.81 10 V 8.27 4.70 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 0.92 0.00 0.00 0.80 0.00 0.00 11 T 9.01 4.70 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 Q 8.53 5.17 0.00 1.90 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 6.87 0.00 0.00 0.00 0.00 0.00 2.37 2.27 0.00 13 P 0.00 4.20 0.00 2.07 2.03 0.00 3.75 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.16 0.00 14 E 8.52 4.29 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 2.30 2.30 0.00 15 K 7.32 4.31 0.00 1.79 1.92 0.00 1.46 0.00 0.00 1.76 0.00 0.00 2.78 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.27 1.29 7.81 16 S 8.82 5.23 0.00 3.90 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 17 V 9.11 4.46 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 0.92 0.00 0.00 18 S 8.75 5.49 0.00 3.85 3.99 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 19 V 8.71 4.56 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 0.69 0.00 0.00 0.88 0.00 0.00 20 A 8.56 4.40 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 21 A 8.48 4.10 1.22 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 22 G 9.48 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 0.00 0.00 0.00 23 D 7.98 4.78 0.00 2.76 2.57 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 24 S 8.35 5.16 0.00 3.66 3.74 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 25 T 8.62 4.64 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 1.05 0.00 0.00 26 V 8.21 4.69 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 0.85 0.00 0.00 0.85 0.00 0.00 27 L 8.47 4.68 0.00 0.98 1.52 0.23 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 28 N 8.81 5.60 0.00 2.68 2.81 0.00 0.00 6.99 7.66 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 29 C 8.66 5.30 0.00 3.07 3.35 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 30 T 9.09 5.44 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 1.25 0.00 0.00 31 L 8.74 5.37 0.00 1.62 1.76 0.74 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 32 T 8.51 4.32 4.24 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 1.21 0.00 0.00 33 S 7.73 4.59 0.00 3.79 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 34 L 8.48 4.52 0.00 1.69 1.70 1.03 1.19 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 35 L 7.52 4.67 0.00 1.60 1.53 0.92 0.76 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 36 P 0.00 4.41 0.00 2.11 2.04 0.00 3.71 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.92 0.00 37 V 7.84 3.41 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.54 0.00 0.00 38 G 7.83 4.69 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 39 P 0.00 4.88 0.00 2.07 2.01 0.00 3.65 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 2.29 2.27 0.00 40 I 8.54 4.96 1.66 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.01 0.76 0.00 0.00 41 K 9.49 5.31 0.00 1.94 1.52 0.00 1.16 0.00 0.00 1.42 0.00 0.00 2.55 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.30 1.38 7.81 42 W 9.55 5.44 0.00 3.39 3.35 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 43 Y 9.54 5.36 0.00 3.06 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 44 R 9.16 4.63 0.00 1.42 1.62 0.00 3.08 0.00 0.00 2.69 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.73 0.00 45 G 9.26 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 46 V 7.93 4.31 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 0.79 0.00 0.00 0.94 0.00 0.00 47 G 8.45 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 0.00 0.00 0.00 48 Q 8.32 4.08 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 7.47 0.00 0.00 0.00 0.00 0.00 2.33 2.30 0.00 49 S 7.77 4.81 0.00 3.85 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 50 R 7.39 4.04 0.00 1.87 1.94 0.00 2.44 0.00 0.00 2.82 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.38 0.00 51 L 8.65 4.42 0.00 1.90 1.65 0.96 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 52 L 8.77 3.97 0.00 1.67 1.55 0.55 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 53 I 8.60 4.47 2.22 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.31 1.07 0.00 0.00 54 Y 7.61 4.55 0.00 2.96 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 55 S 7.40 4.91 0.00 3.51 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 F 9.75 4.69 0.00 3.38 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 8.43 3.77 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 58 G 8.13 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 59 E 8.53 4.29 0.00 2.20 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 0.00 2.39 2.51 0.00 60 H 8.56 4.69 0.00 3.27 3.29 0.00 5.85 0.00 0.00 0.00 0.00 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 F 8.18 5.41 0.00 2.99 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 62 P 0.00 3.39 0.00 1.75 1.34 0.00 3.75 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 1.74 1.78 0.00 63 R 7.80 3.84 0.00 1.56 1.93 0.00 3.15 0.00 0.00 3.10 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 64 V 8.02 4.44 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.95 0.00 0.00 65 T 8.60 5.02 4.42 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 0.96 0.00 0.00 66 N 8.18 5.11 0.00 2.83 2.92 0.00 0.00 5.83 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 67 V 8.52 4.48 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 0.89 0.00 0.00 0.98 0.00 0.00 68 S 8.29 4.76 0.00 3.99 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 69 D 8.74 4.41 0.00 2.74 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 70 A 8.66 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 71 T 8.16 4.45 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 72 K 7.69 4.36 0.00 1.69 1.80 0.00 1.50 0.00 0.00 1.55 0.00 0.00 2.64 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.34 1.40 7.81 73 R 8.50 4.04 0.00 1.76 1.97 0.00 3.13 0.00 0.00 3.13 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 74 N 7.71 4.91 0.00 2.69 2.54 0.00 0.00 6.96 6.71 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 75 N 8.87 4.44 0.00 2.85 2.90 0.00 0.00 6.17 7.66 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 76 M 7.84 4.47 0.00 2.38 2.13 0.00 0.00 0.00 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.45 0.00 77 D 7.45 5.09 0.00 2.59 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 F 8.92 4.25 0.00 2.80 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 79 S 8.69 4.91 0.00 3.81 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 80 I 8.09 4.52 1.19 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 -0.30 0.28 0.16 0.00 0.00 81 R 8.11 4.73 0.00 1.68 1.68 0.00 3.14 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.51 0.00 82 I 8.56 4.23 1.68 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.12 0.82 0.00 0.00 83 S 8.61 4.60 0.00 3.70 3.74 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 84 N 8.41 4.33 0.00 2.79 2.81 0.00 0.00 6.87 7.19 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 85 V 8.16 3.74 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 0.91 0.00 0.00 0.91 0.00 0.00 86 T 8.58 4.88 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 1.26 0.00 0.00 87 P 0.00 4.19 0.00 2.19 2.14 0.00 3.58 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.09 0.00 88 E 7.65 4.12 0.00 2.04 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 2.36 2.34 0.00 89 D 8.14 4.65 0.00 2.88 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 90 A 7.83 4.29 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 91 G 7.64 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 0.00 0.00 0.00 92 T 7.93 5.00 4.28 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 0.87 0.00 0.00 93 Y 9.04 5.11 0.00 3.14 3.37 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 94 Y 9.49 5.05 0.00 2.99 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 95 C 8.99 3.99 0.00 1.23 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 0.00 0.00 0.00 0.00 96 V 8.71 4.76 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 0.61 0.00 0.00 1.05 0.00 0.00 97 K 8.76 4.85 0.00 1.69 1.59 0.00 1.57 0.00 0.00 1.45 0.00 0.00 2.86 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.23 1.33 7.81 98 F 9.27 5.22 0.00 3.13 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 99 Q 9.06 4.74 0.00 2.10 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.92 0.00 0.00 0.00 0.00 0.00 2.37 2.33 0.00 100 K 8.83 4.58 0.00 1.89 1.87 0.00 1.99 0.00 0.00 1.95 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.77 1.49 7.81 101 G 8.47 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 P 0.00 4.32 0.00 2.06 2.14 0.00 3.66 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 2.05 2.10 0.00 103 S 7.62 4.80 0.00 3.79 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 0.00 104 E 8.43 4.29 0.00 2.01 1.87 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 2.33 2.25 0.00 105 P 0.00 4.58 0.00 2.21 2.06 0.00 3.79 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 2.02 2.00 0.00 106 D 8.38 4.77 0.00 2.39 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 0.00 107 T 8.66 4.70 4.30 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 1.23 0.00 0.00 108 E 9.00 3.67 0.00 1.45 1.64 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 1.98 1.70 0.00 109 I 8.29 4.49 1.79 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.72 0.86 0.00 0.00 110 Q 7.47 4.55 0.00 2.05 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.82 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 111 S 8.66 4.87 0.00 3.87 3.56 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 0.00 112 G 8.88 3.97 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 0.00 0.00 0.00 113 G 8.74 3.97 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 0.00 0.00 0.00 114 G 8.77 3.53 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 0.00 115 T 8.38 4.78 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 1.26 0.00 0.00 116 E 9.11 4.79 0.00 2.11 1.86 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 2.40 2.35 0.00 117 V 9.11 4.84 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.83 0.00 0.00 118 Y 9.18 5.14 0.00 3.10 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 0.00 119 V 7.77 4.37 1.91 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 0.78 0.00 0.00 0.93 0.00 0.00 120 L 8.23 3.91 0.00 1.47 1.53 0.93 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00