NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2832 8.3144 121.7898 55.5825 33.0974 176.5281 2 E 4.4807 8.9055 112.6433 51.6707 33.6600 173.2366 3 T 4.1808 8.7210 118.1690 61.3723 72.0664 174.9554 4 A 4.0377 8.4743 122.9083 55.2336 18.4995 179.8849 5 A 4.1360 7.9926 118.7513 55.2488 18.5725 179.5914 6 A 4.1922 8.2361 119.4369 55.0691 18.3639 179.8255 7 K 3.9238 8.2839 118.3648 59.4470 32.2260 178.8146 8 F 4.0991 8.2674 120.8692 61.4450 39.3063 176.9552 9 E 3.9580 8.3527 117.9729 59.4197 29.0479 179.3745 10 R 3.8681 7.8699 117.5980 59.6219 30.2574 178.3299 11 Q 3.9626 8.0019 116.6886 58.0331 28.9548 176.3156 12 H 4.6262 7.8814 114.0392 54.1077 31.4218 173.2805 13 M 4.6206 8.0976 119.1157 53.8274 33.3245 176.6800 14 D 4.8445 8.9066 123.1289 53.2750 40.0700 175.7207 15 S 4.5404 8.3113 116.3135 59.3671 63.9225 176.6207 16 S 4.3430 7.7280 114.4979 60.0726 63.1511 174.2496 17 T 4.6537 7.0824 112.4544 59.9131 69.7055 173.8885 18 S 4.2236 8.6199 121.0203 60.2051 63.7359 173.8521 19 A 3.9687 6.9108 120.4048 51.1557 21.1685 175.5368 20 A 3.7388 8.6613 124.0221 52.2222 19.0876 177.4003 21 S 4.5211 8.6297 116.9778 59.9544 64.9729 175.2145 22 S 4.6410 7.6552 114.2009 57.0381 64.2191 174.6721 23 S 4.3925 8.5201 114.6068 59.5201 63.2660 174.6784 24 N 4.6747 8.0591 119.2625 54.2561 38.9950 175.4644 25 Y 4.0162 7.7801 121.3983 61.8886 38.7269 177.6472 26 C 4.2669 8.2797 116.5382 60.0091 39.1452 175.8224 27 N 4.3828 8.1693 117.6309 56.3895 38.0871 177.3617 28 Q 3.8998 7.8083 118.8620 59.3267 28.9327 178.7700 29 M 3.6729 7.4928 119.5951 58.4004 31.7105 178.7999 30 M 4.0875 8.0239 119.0663 57.9289 31.9775 178.8581 31 K 3.9487 7.6654 119.3081 59.5006 32.3614 178.9322 32 S 4.3571 8.1110 112.1411 59.9603 62.9986 175.2769 33 R 4.4686 7.4133 120.1814 54.9026 30.7280 175.2445 34 N 4.1907 7.9300 114.5186 54.6471 36.7714 174.8328 35 L 4.5009 8.2385 116.0397 55.0211 42.2266 178.0942 36 T 5.4843 7.5549 106.5815 60.3641 69.2764 174.7549 37 K 4.0048 8.2296 123.2020 59.8489 32.1026 177.1932 38 D 4.6350 7.5364 115.8824 54.3211 42.1296 175.8393 39 R 3.0892 6.8285 113.9949 55.4986 31.5052 173.7938 40 C 4.9234 8.4754 115.9421 55.1571 40.4207 173.9830 41 K 4.2036 8.4316 127.3212 55.6476 32.5597 174.9179 42 P 4.6818 0.0000 0.0000 65.3742 32.4494 176.4191 43 V 4.9930 7.6357 118.2831 60.8168 34.6572 174.4192 44 N 4.7802 9.2009 125.4363 52.6443 42.3500 172.8560 45 T 4.7653 7.9754 122.0345 61.7569 71.3359 173.1290 46 F 4.8305 8.9011 124.3559 55.6409 41.9942 174.5952 47 V 4.4168 9.1472 123.4586 60.8934 33.4267 175.8271 48 H 5.7230 8.4168 127.7339 54.2761 26.4809 173.2559 49 E 4.8192 7.6973 117.0470 53.3962 34.4227 176.8046 50 S 4.3952 8.3224 114.9196 58.1180 65.0789 174.8865 51 L 3.9876 8.5498 124.3055 58.4547 41.9547 179.1517 52 A 3.9974 8.0155 120.1290 55.4268 18.1364 179.2309 53 D 4.3591 7.7694 115.9528 57.3096 41.1195 178.9069 54 V 3.7965 7.9035 119.0038 66.0867 31.6524 178.1969 55 Q 3.9328 8.4048 117.6829 58.7105 28.6124 178.5197 56 A 4.0558 7.9695 121.3532 54.5619 18.3723 179.6004 57 V 3.5365 7.6296 116.8839 65.6944 31.3168 176.7911 58 C 3.9769 7.7540 114.7025 57.8633 39.9006 173.9380 59 S 4.6414 7.4130 114.4107 57.8778 63.8611 174.7299 60 Q 4.3371 7.2925 120.9356 56.0889 30.8589 177.0901 61 K 4.1795 7.8923 129.6513 57.1977 33.1226 176.0252 62 N 4.4337 8.8048 127.6382 53.5957 39.7135 174.3307 63 V 4.5951 8.3314 118.4348 59.1832 36.6941 174.9695 64 A 4.3059 8.3842 124.6683 52.2450 19.0331 178.4429 65 C 4.6380 9.4007 119.9139 55.7883 41.3113 175.3947 66 K 3.7257 8.4792 120.6964 59.4803 31.5383 178.3313 67 N 4.4808 8.0363 113.7692 53.2900 37.6118 175.8107 68 G 3.9576 8.2004 108.5464 45.5774 0.0000 174.2037 69 Q 4.2564 8.5153 119.3442 56.2262 29.2285 176.1772 70 T 4.6979 8.2247 108.2767 61.7361 69.3557 174.0520 71 N 5.0539 8.0320 117.4354 54.0704 38.5294 174.2676 72 C 5.3012 7.4628 115.2192 56.7001 39.9362 172.7674 73 Y 5.0563 8.6164 118.7887 56.3312 41.6502 173.8746 74 Q 5.0667 9.1335 125.7304 54.0635 31.2239 174.9842 75 S 4.2878 8.6344 121.6452 58.6809 63.2068 174.3447 76 Y 4.4484 9.2142 121.2638 60.3315 37.8512 175.8139 77 S 5.0818 7.8784 112.3710 56.2130 66.2088 173.9444 78 T 4.3207 8.2662 109.9613 61.7870 69.9186 173.7596 79 M 5.0306 8.9085 121.5203 53.3871 37.1547 174.5553 80 S 4.9013 9.2882 116.8702 58.4277 63.5244 173.1284 81 I 5.1555 9.2833 120.2766 59.5187 41.7954 174.2732 82 T 4.9522 8.8352 119.2495 61.9191 71.7798 172.5515 83 D 4.9279 9.4140 127.5035 53.3293 43.1027 174.2562 84 C 5.4946 8.9130 123.3316 55.2389 39.7454 172.8233 85 R 5.2086 8.8689 124.3148 54.0216 32.7767 174.3017 86 E 4.0443 9.4774 128.2866 56.4825 29.0398 176.7740 87 T 4.2961 8.6988 116.9005 60.6193 70.0254 176.0517 88 G 3.7706 8.4906 111.0886 48.1838 0.0000 175.0926 89 S 4.2882 7.3239 111.6519 59.8571 63.7119 174.7936 90 S 4.0157 7.2323 115.3481 58.6370 62.4501 173.9022 91 K 4.4632 9.1021 125.7947 55.2527 34.9278 174.9978 92 Y 4.4187 8.8112 125.5088 57.6823 39.0067 173.7062 93 P 3.9883 0.0000 0.0000 62.5074 31.7808 176.3914 94 N 4.6772 8.6827 120.8015 52.4693 37.0671 172.2789 95 C 4.6675 8.1254 117.6530 56.2337 40.6074 173.1151 96 A 4.9335 8.7557 125.8108 50.3250 21.8747 174.4522 97 Y 5.1177 8.6593 117.9965 56.0113 42.2818 174.6719 98 K 4.5610 9.2985 123.7390 55.4097 34.1962 175.0984 99 T 5.0598 8.5883 124.2101 62.6756 70.2135 174.2764 100 T 4.5304 8.9814 122.9445 61.8225 71.8660 172.7009 101 Q 4.8417 8.6986 128.0345 55.2324 30.5444 174.3162 102 A 4.5398 8.7419 126.2598 51.5144 23.7711 174.5254 103 N 5.4441 8.7009 116.0375 51.9078 40.6871 174.3732 104 K 4.7044 8.6878 122.4737 55.0285 37.6800 175.4072 105 H 5.0902 8.7774 117.7379 55.6672 30.2952 174.9497 106 I 4.7984 8.4646 114.3884 59.2917 41.1149 174.3815 107 I 4.8657 7.9869 123.3762 59.7043 40.1733 175.1489 108 V 4.7883 8.4305 119.5438 59.3117 35.8653 174.4073 109 A 5.0961 8.6481 124.8822 50.9236 20.7219 175.6980 110 C 5.1461 8.6568 119.0895 55.4553 44.7260 173.0110 111 E 4.5723 8.7293 119.3386 56.7632 34.4543 176.4892 112 G 4.1388 9.0510 108.6962 45.2918 0.0000 172.0327 113 N 5.0035 8.4740 119.3552 51.2246 40.8399 173.5429 114 P 4.3488 0.0000 0.0000 62.7322 32.0019 175.6099 115 Y 4.7506 8.2825 121.0419 56.9263 38.7988 174.5573 116 V 4.4384 8.3862 119.5728 58.3198 36.6915 173.4610 117 P 4.3327 0.0000 0.0000 62.9377 31.1240 177.0098 118 V 4.3923 8.2807 115.7369 61.0684 33.7140 175.1159 119 H 4.9513 7.7414 119.0247 55.1279 33.3530 171.9384 120 F 4.5535 8.7910 127.9170 57.2459 39.3749 174.5750 121 D 4.5453 8.3126 126.9089 56.2948 41.8710 175.6615 122 A 4.6817 6.6740 117.4994 51.6466 22.5098 174.6451 123 S 5.0937 8.8888 112.9036 56.6667 66.0201 174.5311 124 V 4.1057 8.6461 121.6789 63.1564 31.1783 175.0140 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 1 K 8.31 4.28 0.00 1.74 1.64 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.44 7.81 2 E 8.91 4.48 0.00 1.99 1.75 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 2.27 2.37 0.00 3 T 8.72 4.18 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 1.22 0.00 0.00 4 A 8.47 4.04 1.35 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 0.00 0.00 5 A 7.99 4.14 1.33 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 0.00 0.00 6 A 8.24 4.19 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 7 K 8.28 3.92 0.00 1.88 2.02 0.00 1.79 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.45 7.81 8 F 8.27 4.10 0.00 3.20 3.26 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 9 E 8.35 3.96 0.00 2.31 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 2.51 2.72 0.00 10 R 7.87 3.87 0.00 1.82 1.94 0.00 3.25 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 11 Q 8.00 3.96 0.00 1.53 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.47 0.00 0.00 0.00 0.00 0.00 2.25 2.52 0.00 12 H 7.88 4.63 0.00 2.17 2.77 0.00 5.61 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 13 M 8.10 4.62 0.00 1.95 2.15 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 2.69 2.59 0.00 14 D 8.91 4.84 0.00 2.79 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 15 S 8.31 4.54 0.00 3.96 3.91 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 16 S 7.73 4.34 0.00 4.12 4.01 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 17 T 7.08 4.65 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 1.21 0.00 0.00 18 S 8.62 4.22 0.00 3.99 3.96 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 19 A 6.91 3.97 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 20 A 8.66 3.74 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.63 4.52 0.00 3.84 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 22 S 7.66 4.64 0.00 4.02 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.52 4.39 0.00 4.04 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 24 N 8.06 4.67 0.00 2.83 2.84 0.00 0.00 6.75 7.28 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 25 Y 7.78 4.02 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 26 C 8.28 4.27 0.00 3.18 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 27 N 8.17 4.38 0.00 2.93 2.91 0.00 0.00 7.14 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 28 Q 7.81 3.90 0.00 2.03 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.82 0.00 0.00 0.00 0.00 0.00 2.30 2.38 0.00 29 M 7.49 3.67 0.00 0.84 1.14 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.60 0.00 30 M 8.02 4.09 0.00 1.75 1.90 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 2.47 0.00 31 K 7.67 3.95 0.00 2.02 2.02 0.00 1.53 0.00 0.00 1.72 0.00 0.00 3.12 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.47 7.81 32 S 8.11 4.36 0.00 3.98 4.01 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 33 R 7.41 4.47 0.00 1.85 1.97 0.00 3.59 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 2.00 0.00 34 N 7.93 4.19 0.00 2.87 2.89 0.00 0.00 6.83 7.92 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 35 L 8.24 4.50 0.00 1.73 1.62 0.82 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.55 5.48 4.44 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 1.42 0.00 0.00 37 K 8.23 4.00 0.00 1.87 1.89 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.45 1.52 7.81 38 D 7.54 4.64 0.00 2.58 2.56 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 39 R 6.83 3.09 0.00 1.76 1.64 0.00 2.93 0.00 0.00 3.28 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.45 0.00 40 C 8.48 4.92 0.00 3.08 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 41 K 8.43 4.20 0.00 1.85 1.76 0.00 1.75 0.00 0.00 1.66 0.00 0.00 3.24 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.38 7.81 42 P 0.00 4.68 0.00 2.19 2.31 0.00 3.72 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 1.98 0.00 43 V 7.64 4.99 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 0.81 0.00 0.00 0.97 0.00 0.00 44 N 9.20 4.78 0.00 2.63 2.27 0.00 0.00 6.78 7.93 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 45 T 7.98 4.77 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 0.86 0.00 0.00 46 F 8.90 4.83 0.00 3.00 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 47 V 9.15 4.42 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 1.12 0.00 0.00 1.04 0.00 0.00 48 H 8.42 5.72 0.00 3.06 3.46 0.00 5.61 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 49 E 7.70 4.82 0.00 1.95 1.84 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 2.25 2.26 0.00 50 S 8.32 4.40 0.00 4.07 4.02 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 0.00 0.00 0.00 51 L 8.55 3.99 0.00 1.83 1.75 1.03 1.03 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 52 A 8.02 4.00 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 53 D 7.77 4.36 0.00 2.88 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 54 V 7.90 3.80 2.20 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 1.24 0.00 0.00 1.04 0.00 0.00 55 Q 8.40 3.93 0.00 2.25 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.31 2.47 0.00 56 A 7.97 4.06 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 57 V 7.63 3.54 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 0.99 0.00 0.00 0.93 0.00 0.00 58 C 7.75 3.98 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 59 S 7.41 4.64 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 60 Q 7.29 4.34 0.00 1.73 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.96 0.00 0.00 0.00 0.00 0.00 1.95 2.21 0.00 61 K 7.89 4.18 0.00 1.98 1.84 0.00 1.62 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.48 1.44 7.81 62 N 8.80 4.43 0.00 2.80 2.67 0.00 0.00 7.00 7.71 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 63 V 8.33 4.60 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 0.67 0.00 0.00 0.81 0.00 0.00 64 A 8.38 4.31 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 65 C 9.40 4.64 0.00 3.08 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.48 3.73 0.00 1.71 1.89 0.00 1.72 0.00 0.00 1.78 0.00 0.00 3.05 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.38 7.81 67 N 8.04 4.48 0.00 2.81 2.91 0.00 0.00 6.22 7.00 0.00 0.00 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 G 8.20 3.96 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 0.00 0.00 0.00 69 Q 8.52 4.26 0.00 2.13 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.85 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 70 T 8.22 4.70 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 1.16 0.00 0.00 71 N 8.03 5.05 0.00 2.97 3.13 0.00 0.00 6.02 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 72 C 7.46 5.30 0.00 2.99 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 73 Y 8.62 5.06 0.00 2.87 2.88 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 74 Q 9.13 5.07 0.00 2.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.98 0.00 0.00 0.00 0.00 0.00 2.23 2.25 0.00 75 S 8.63 4.29 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 76 Y 9.21 4.45 0.00 3.02 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 77 S 7.88 5.08 0.00 3.87 3.91 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 78 T 8.27 4.32 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 1.00 0.00 0.00 79 M 8.91 5.03 0.00 1.94 1.98 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.49 0.00 80 S 9.29 4.90 0.00 3.92 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 81 I 9.28 5.16 1.86 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.77 1.04 0.00 0.00 82 T 8.84 4.95 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 1.21 0.00 0.00 83 D 9.41 4.93 0.00 2.67 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 84 C 8.91 5.49 0.00 3.01 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 85 R 8.87 5.21 0.00 1.93 1.80 0.00 3.13 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 86 E 9.48 4.04 0.00 1.98 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 2.10 1.80 0.00 87 T 8.70 4.30 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 1.19 0.00 0.00 88 G 8.49 3.77 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 0.00 0.00 0.00 89 S 7.32 4.29 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 90 S 7.23 4.02 0.00 3.77 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 91 K 9.10 4.46 0.00 1.86 1.85 0.00 1.38 0.00 0.00 1.74 0.00 0.00 2.86 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.29 1.49 7.81 92 Y 8.81 4.42 0.00 2.90 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 3.99 0.00 1.76 0.85 0.00 3.58 0.00 0.00 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.63 0.00 94 N 8.68 4.68 0.00 2.67 2.76 0.00 0.00 7.05 7.54 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 95 C 8.13 4.67 0.00 3.12 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 96 A 8.76 4.93 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 0.00 0.00 0.00 0.00 0.00 97 Y 8.66 5.12 0.00 2.88 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 98 K 9.30 4.56 0.00 1.82 1.73 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.44 7.81 99 T 8.59 5.06 4.31 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 1.27 0.00 0.00 100 T 8.98 4.53 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 0.00 101 Q 8.70 4.84 0.00 1.95 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.72 0.00 0.00 0.00 0.00 0.00 2.22 2.38 0.00 102 A 8.74 4.54 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 0.00 103 N 8.70 5.44 0.00 2.57 2.75 0.00 0.00 6.64 7.61 0.00 0.00 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 K 8.69 4.70 0.00 1.73 1.58 0.00 1.85 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.44 7.81 105 H 8.78 5.09 0.00 3.17 3.23 0.00 5.77 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.46 4.80 1.74 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 1.26 0.68 1.12 0.00 0.00 107 I 7.99 4.87 1.68 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.92 0.84 0.00 0.00 108 V 8.43 4.79 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 0.67 0.00 0.00 0.81 0.00 0.00 109 A 8.65 5.10 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 0.00 110 C 8.66 5.15 0.00 1.78 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 0.00 0.00 0.00 111 E 8.73 4.57 0.00 1.80 1.79 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 2.29 2.27 0.00 112 G 9.05 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 0.00 113 N 8.47 5.00 0.00 2.65 2.69 0.00 0.00 6.84 7.69 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 0.00 114 P 0.00 4.35 0.00 2.23 2.05 0.00 3.82 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 115 Y 8.28 4.75 0.00 2.81 2.88 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 0.00 116 V 8.39 4.44 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 0.68 0.00 0.00 0.89 0.00 0.00 117 P 0.00 4.33 0.00 0.49 1.28 0.00 3.33 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.81 0.00 118 V 8.28 4.39 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 0.62 0.00 0.00 0.93 0.00 0.00 119 H 7.74 4.95 0.00 3.29 3.10 0.00 5.85 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.79 4.55 0.00 2.65 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 0.00 121 D 8.31 4.55 0.00 2.66 2.59 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 0.00 0.00 0.00 0.00 122 A 6.67 4.68 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 0.00 123 S 8.89 5.09 0.00 3.95 4.08 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 0.00 0.00 0.00 124 V 8.65 4.11 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 0.78 0.00 0.00 0.93 0.00 0.00