NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3404 8.2893 120.3445 55.5638 32.2935 174.7365 2 T 4.1759 8.0230 116.2500 59.3247 70.6506 172.4246 3 H 4.2893 8.8934 125.0818 55.1322 29.0427 175.7574 4 D 4.2885 8.2869 127.0208 54.7265 41.3307 175.5926 5 N 4.0805 7.9672 118.2327 53.2534 40.4762 174.0782 6 K 4.4215 8.1450 124.0046 55.2311 32.9322 175.3963 7 L 4.6171 7.7174 125.7521 56.1769 41.9151 173.6735 8 Q 4.4762 8.2143 117.8246 56.1496 29.9958 174.8203 9 V 3.2841 7.9148 111.8781 64.5207 29.5249 171.7674 10 E 4.4232 7.6149 114.6683 56.7835 32.8776 177.4429 11 A 4.3818 7.4500 125.9593 50.2954 17.7417 175.8569 12 I 4.2979 6.8948 119.6003 60.0699 40.9101 174.8612 13 K 4.3214 7.9303 128.5280 56.1288 34.2468 174.9607 14 R 5.0077 7.9540 118.0821 56.5570 29.7960 176.7264 15 G 3.6568 7.4460 106.2969 46.5210 0.0000 172.8584 16 T 5.0704 8.2530 115.9384 62.7540 71.0293 175.2547 17 V 4.4398 8.1227 122.9320 61.7018 34.8515 173.7342 18 I 4.4939 8.5942 130.4558 60.2389 38.3146 175.0409 19 D 5.0291 8.5573 125.9166 51.5344 43.6304 174.8308 20 H 3.7161 8.6764 111.9201 56.8464 26.4288 175.2355 21 I 4.1242 7.5574 119.6921 59.7570 38.2269 174.2986 22 P 4.4243 0.0000 0.0000 62.6188 31.7886 175.7155 23 A 4.5148 8.4855 124.4845 54.0803 18.6758 176.9897 24 Q 3.7652 8.8537 117.6995 57.2214 26.8343 175.0424 25 I 4.5572 7.7463 118.2965 61.3597 40.1213 178.2445 26 G 3.7583 8.6878 107.0095 48.0970 0.0000 175.3193 27 F 4.1936 8.3202 123.1583 60.4157 39.3718 176.9371 28 K 3.8842 8.0115 119.0175 59.4796 32.0359 178.6880 29 L 4.2176 8.1611 119.4584 57.6283 41.6405 179.3968 30 L 3.9394 7.8369 118.9288 58.2919 41.5912 179.4827 31 S 3.8877 7.6780 115.0374 61.1795 62.5124 176.2066 32 L 3.5991 8.1923 124.1188 57.5831 41.8838 178.1574 33 F 4.5281 8.2239 114.3121 56.1760 39.7827 176.1282 34 K 3.8486 7.5669 118.3647 57.6079 29.3496 174.5235 35 L 4.3862 7.9404 117.7959 55.7795 42.8856 178.3032 36 T 4.3230 7.8132 107.0971 61.8897 68.9650 174.6018 37 E 4.4097 7.9507 120.1710 56.7346 29.6156 175.6821 38 T 4.3905 7.4856 113.7114 61.1058 68.6607 174.1567 39 D 4.6153 8.3936 122.7999 54.8520 41.5144 176.7738 40 Q 4.4299 7.3420 117.8734 54.0924 30.0121 175.5698 41 R 4.1006 8.2464 121.0451 56.5940 31.8789 175.2942 42 I 4.8376 8.0375 120.0173 60.4259 41.4552 174.4220 43 T 4.6221 9.6809 124.6618 61.8455 70.7526 173.3921 44 I 4.9233 8.5251 126.8158 59.3182 40.4117 175.1550 45 G 4.1112 9.4677 113.8136 44.5082 0.0000 171.4155 46 L 5.1291 8.4801 125.6790 53.2409 44.4465 176.2995 47 N 4.1688 8.7924 119.4871 54.3212 36.2246 174.6129 48 L 4.4306 7.7191 119.7068 53.3180 40.6552 174.3771 49 P 4.4091 0.0000 0.0000 62.9324 32.1016 176.1720 50 S 4.6087 8.4263 111.0270 59.7284 67.2553 174.3014 51 G 3.9870 8.3831 111.4872 44.9493 0.0000 175.2858 52 E 4.0132 9.5440 122.9584 56.4199 30.7448 177.5694 53 M 4.4145 8.3515 118.3145 55.7925 29.7685 174.3430 54 G 4.2240 7.3940 109.0552 43.3984 0.0000 170.1398 55 R 4.4276 8.0833 116.5001 55.1294 32.1134 175.3418 56 K 4.4645 7.6183 116.3834 56.3021 35.4211 173.0664 57 D 5.5362 8.9517 127.5045 52.5336 44.6545 174.8710 58 L 5.0198 9.5001 123.3430 53.4762 46.3183 174.8379 59 I 4.9429 8.7635 124.7674 59.2109 41.4913 173.8157 60 K 4.8642 9.7111 129.2480 54.7952 35.0890 175.1597 61 I 4.7787 8.4422 125.6001 59.4699 40.2691 174.8282 62 E 4.6234 8.3180 124.1183 54.6631 33.0270 175.6217 63 N 4.5036 8.7170 116.9642 54.1143 37.5379 173.7426 64 T 4.4002 6.8406 104.2492 59.7412 71.8139 172.9061 65 F 5.6693 8.5998 122.7383 54.5113 42.0523 174.6130 66 L 4.5502 8.4653 124.5545 54.6976 41.7742 177.1711 67 S 4.2913 10.0263 117.9104 58.0642 63.7549 174.9353 68 E 3.9261 8.5928 123.6014 59.6371 29.1541 178.4711 69 D 4.6248 8.0021 116.9552 57.3094 41.0500 178.2595 70 Q 4.1516 8.0440 118.3751 58.7289 28.7260 178.7151 71 V 3.5601 7.6917 118.8925 66.2761 31.5613 177.6347 72 D 4.5919 7.6372 118.6935 56.8148 40.4671 178.5985 73 Q 4.2845 7.5392 116.2487 57.7660 28.3628 177.7474 74 L 4.4480 8.1217 120.0305 55.5286 41.9775 178.2334 75 A 4.2595 8.4063 122.5083 55.2973 18.3239 178.7954 76 L 3.9522 7.9929 115.4068 57.2836 42.4623 176.9053 77 Y 4.5180 8.1179 114.1431 58.4593 40.2152 175.9135 78 A 4.7305 9.1877 123.5254 49.4122 18.3304 172.8670 79 P 4.4644 0.0000 0.0000 63.2087 32.2224 176.7602 80 Q 3.5589 8.9417 120.4040 56.6979 25.9525 173.5673 81 A 4.3774 7.8715 119.8743 52.3099 19.9375 177.3429 82 T 4.6984 8.2584 109.7789 59.9603 71.1969 173.7355 83 V 4.8748 8.1598 123.9734 61.4440 34.9470 175.5476 84 N 5.0729 8.3918 119.4308 51.4065 39.9915 172.2778 85 R 3.7438 7.7623 118.6610 55.4487 31.1805 175.5235 86 I 4.5435 8.8904 127.9983 59.9068 35.6096 176.2446 87 D 4.5383 8.4222 124.1071 55.1483 42.3602 176.1738 88 N 4.9758 8.3268 126.8772 54.4458 40.4813 173.6353 89 Y 3.6041 6.6012 119.2345 59.2833 35.1801 171.0451 90 E 4.4002 9.0335 116.7358 56.3026 30.0933 177.9916 91 V 3.5676 7.0454 117.8850 63.2897 32.3067 177.8876 92 V 3.8613 8.0131 126.2308 62.3476 31.7269 174.4450 93 G 3.5823 8.1918 103.2959 48.6640 0.0000 173.6061 94 K 4.2650 7.4768 129.1169 53.8765 34.0923 175.7675 95 S 4.6016 8.2825 119.4756 56.6335 62.6129 171.6192 96 R 4.9942 7.9754 123.7085 51.9859 32.9853 173.5583 97 P 4.1659 0.0000 0.0000 63.5032 31.3969 175.7561 98 S 4.6947 9.8011 118.9625 56.0117 64.4754 173.0247 99 L 4.3991 8.2203 124.4790 53.9204 41.5735 175.8080 100 P 4.5049 0.0000 0.0000 62.5623 32.1356 176.0159 101 E 4.5195 8.6051 117.4832 56.6607 31.0025 175.4185 102 R 5.0715 7.6016 120.0001 55.6798 33.5072 173.8415 103 I 4.7877 9.1431 127.1014 59.9275 40.3196 174.4005 104 D 5.4269 8.6924 125.9388 53.1184 44.3910 177.5380 105 N 4.3942 9.3607 115.0597 54.1894 37.8326 175.8122 106 V 4.1332 7.4965 109.3805 62.0989 33.9081 176.5491 107 L 4.1908 7.7578 117.6859 54.1951 42.2201 176.2522 108 V 4.3996 7.7595 119.7522 60.7364 32.3777 175.0080 109 C 4.3225 9.1257 127.5414 59.5254 31.7609 172.5857 110 P 4.0198 0.0000 0.0000 64.3204 31.2857 175.9414 111 N 4.6229 7.4769 118.7751 52.9665 38.7631 175.7902 112 S 4.1762 8.7816 121.4195 60.8355 63.3910 174.3835 113 N 4.7198 8.4679 117.9989 53.2161 38.8026 174.0994 114 C 4.3121 7.8498 118.8091 59.1920 30.7670 174.3703 115 I 3.6286 8.4023 126.6475 63.7575 37.8231 177.5516 116 S 3.9518 7.7985 113.8049 61.3001 62.4410 175.0480 117 H 4.3155 7.7871 116.9833 58.6908 28.3935 176.1481 118 A 4.4755 7.2987 118.1371 51.9111 18.9144 176.4254 119 E 4.6749 7.5644 115.5817 54.3205 32.4269 174.3713 120 P 4.6210 0.0000 0.0000 62.8102 30.7684 176.5045 121 V 4.5432 7.1184 109.8594 59.5100 35.5257 175.8248 122 S 4.8183 8.4362 118.1481 57.3123 63.9903 174.6060 123 S 4.5341 8.6770 118.6101 59.1248 64.4925 173.1032 124 S 5.4100 8.0906 114.6394 57.9316 65.7871 172.7911 125 F 5.2867 9.2737 124.9795 55.6088 43.1823 173.9276 126 A 4.6067 9.0942 125.1684 51.5477 19.9368 176.3691 127 V 4.9577 8.1700 121.7125 61.2713 33.8553 175.1658 128 R 4.7423 8.6412 121.8343 54.9259 33.0132 173.5817 129 K 4.7827 8.5934 122.1648 55.4663 34.0671 176.0072 130 R 4.5428 8.0689 123.9347 55.1057 33.1803 173.4495 131 A 4.5143 8.4662 121.1292 52.6346 20.3735 177.6187 132 N 4.5731 9.6958 118.6472 53.6699 36.2258 173.1426 133 D 4.7078 7.3750 117.6081 54.0253 45.5450 173.9512 134 I 4.7610 8.1680 119.4010 60.3020 41.5915 174.2500 135 A 5.1114 9.2161 129.9468 50.6455 20.9101 175.6248 136 L 5.8487 9.1573 122.6562 52.0399 44.8671 175.3769 137 K 5.0028 8.7035 125.5326 54.4475 34.4737 174.7611 138 C 3.6963 9.1467 129.2488 59.3522 31.9348 174.4552 139 K 3.5731 8.2893 127.8411 59.5711 31.8893 177.4350 140 Y 4.2602 7.7825 117.1834 60.2477 38.2361 176.2565 141 C 4.2627 7.9864 113.4507 58.7045 30.5466 174.3811 142 E 4.8000 8.0284 117.4236 56.6147 26.7582 174.0698 143 K 4.3504 7.4144 118.0409 55.6734 33.9059 175.3371 144 E 5.1337 8.1587 123.1586 54.5704 32.0336 174.8178 145 F 5.1390 9.2561 124.1961 55.6265 44.1115 174.1122 146 S 5.0205 8.6434 114.5958 57.5182 64.4227 175.0768 147 H 4.1671 8.8834 118.9619 58.9527 27.7005 177.6528 148 N 4.2440 7.4505 118.2291 55.7669 38.2723 177.2513 149 V 3.7136 8.0001 120.2618 65.9904 31.6154 178.2822 150 V 3.3566 7.6628 115.9037 65.8314 31.3009 177.2767 151 L 4.2244 7.8608 117.5089 56.3344 41.6921 177.3655 152 A 4.3794 8.0638 119.5642 55.5902 20.1236 176.5919 153 N 4.1996 7.3244 125.1670 54.7292 39.8818 173.7473 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 M 8.29 4.34 0.00 1.95 2.07 0.00 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.57 0.00 2 T 8.02 4.18 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 1.20 0.00 0.00 3 H 8.89 4.29 0.00 3.19 3.32 0.00 5.70 0.00 0.00 0.00 0.00 6.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 D 8.29 4.29 0.00 2.64 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 5 N 7.97 4.08 0.00 2.73 2.76 0.00 0.00 6.72 6.68 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 6 K 8.14 4.42 0.00 1.74 1.71 0.00 1.94 0.00 0.00 1.77 0.00 0.00 3.13 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.35 7.81 7 L 7.72 4.62 0.00 1.75 1.61 0.94 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 8 Q 8.21 4.48 0.00 2.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.84 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 9 V 7.91 3.28 2.07 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 0.75 0.00 0.00 0.92 0.00 0.00 10 E 7.61 4.42 0.00 1.96 1.83 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 2.25 2.20 0.00 11 A 7.45 4.38 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 12 I 6.89 4.30 1.86 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 1.29 0.48 0.90 0.00 0.00 13 K 7.93 4.32 0.00 1.77 1.60 0.00 1.68 0.00 0.00 2.05 0.00 0.00 2.89 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.20 1.15 7.81 14 R 7.95 5.01 0.00 2.05 2.04 0.00 2.75 0.00 0.00 3.89 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.39 0.00 15 G 7.45 3.66 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 0.00 0.00 0.00 16 T 8.25 5.07 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 1.29 0.00 0.00 17 V 8.12 4.44 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 1.03 0.00 0.00 0.92 0.00 0.00 18 I 8.59 4.49 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.65 0.90 0.00 0.00 19 D 8.56 5.03 0.00 2.79 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 20 H 8.68 3.72 0.00 3.30 3.45 0.00 5.89 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 I 7.56 4.12 1.98 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 1.32 0.56 0.95 0.00 0.00 22 P 0.00 4.42 0.00 2.22 2.03 0.00 3.67 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.15 0.00 23 A 8.49 4.51 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 24 Q 8.85 3.77 0.00 2.28 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.71 0.00 0.00 0.00 0.00 0.00 2.30 2.47 0.00 25 I 7.75 4.56 2.19 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 1.34 0.86 1.00 0.00 0.00 26 G 8.69 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 0.00 0.00 0.00 27 F 8.32 4.19 0.00 3.15 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 28 K 8.01 3.88 0.00 1.98 2.01 0.00 1.71 0.00 0.00 1.84 0.00 0.00 3.13 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.47 7.81 29 L 8.16 4.22 0.00 1.85 1.65 0.90 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 30 L 7.84 3.94 0.00 1.59 1.59 0.97 0.67 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 31 S 7.68 3.89 0.00 3.71 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 32 L 8.19 3.60 0.00 1.41 1.21 0.76 0.17 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 33 F 8.22 4.53 0.00 3.08 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 34 K 7.57 3.85 0.00 1.81 2.01 0.00 1.65 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.55 1.49 7.81 35 L 7.94 4.39 0.00 1.66 1.70 0.86 0.63 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 36 T 7.81 4.32 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 1.19 0.00 0.00 37 E 7.95 4.41 0.00 1.96 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 2.23 2.38 0.00 38 T 7.49 4.39 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 1.25 0.00 0.00 39 D 8.39 4.62 0.00 2.69 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 40 Q 7.34 4.43 0.00 2.03 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.77 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 41 R 8.25 4.10 0.00 1.82 1.88 0.00 3.30 0.00 0.00 3.32 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.74 0.00 42 I 8.04 4.84 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.57 0.98 0.00 0.00 43 T 9.68 4.62 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 44 I 8.53 4.92 1.90 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 1.29 0.63 1.03 0.00 0.00 45 G 9.47 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 0.00 0.00 0.00 46 L 8.48 5.13 0.00 1.52 1.58 0.97 1.22 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 47 N 8.79 4.17 0.00 2.92 2.95 0.00 0.00 6.93 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 48 L 7.72 4.43 0.00 1.74 1.70 0.90 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 49 P 0.00 4.41 0.00 2.06 2.07 0.00 3.62 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 2.04 2.11 0.00 50 S 8.43 4.61 0.00 3.93 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 51 G 8.38 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 0.00 0.00 0.00 52 E 9.54 4.01 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 2.33 2.34 0.00 53 M 8.35 4.41 0.00 1.96 2.01 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.60 0.00 54 G 7.39 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 55 R 8.08 4.43 0.00 1.84 1.99 0.00 3.13 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 56 K 7.62 4.46 0.00 1.84 1.71 0.00 1.52 0.00 0.00 1.71 0.00 0.00 2.86 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.16 1.39 7.81 57 D 8.95 5.54 0.00 2.70 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 58 L 9.50 5.02 0.00 1.63 1.59 0.99 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.76 4.94 1.87 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 1.21 1.18 0.93 0.00 0.00 60 K 9.71 4.86 0.00 1.79 1.66 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.34 1.38 7.81 61 I 8.44 4.78 1.83 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 1.20 0.68 0.86 0.00 0.00 62 E 8.32 4.62 0.00 1.80 1.73 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 2.17 2.16 0.00 63 N 8.72 4.50 0.00 2.74 2.98 0.00 0.00 6.79 7.70 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 64 T 6.84 4.40 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 1.15 0.00 0.00 65 F 8.60 5.67 0.00 3.05 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 66 L 8.47 4.55 0.00 1.73 1.67 0.93 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 67 S 10.03 4.29 0.00 3.79 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 68 E 8.59 3.93 0.00 2.07 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 2.38 2.41 0.00 69 D 8.00 4.62 0.00 2.71 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 70 Q 8.04 4.15 0.00 2.31 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.91 0.00 0.00 0.00 0.00 0.00 2.48 2.44 0.00 71 V 7.69 3.56 2.18 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 1.02 0.00 0.00 1.02 0.00 0.00 72 D 7.64 4.59 0.00 2.98 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 73 Q 7.54 4.28 0.00 2.18 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.86 0.00 0.00 0.00 0.00 0.00 2.68 2.74 0.00 74 L 8.12 4.45 0.00 1.75 1.71 0.87 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 75 A 8.41 4.26 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 0.00 0.00 0.00 0.00 0.00 76 L 7.99 3.95 0.00 1.44 1.11 0.72 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 77 Y 8.12 4.52 0.00 3.00 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 78 A 9.19 4.73 1.29 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 0.00 0.00 79 P 0.00 4.46 0.00 2.06 2.01 0.00 3.85 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.28 0.00 80 Q 8.94 3.56 0.00 2.21 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.00 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 81 A 7.87 4.38 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 82 T 8.26 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 1.18 0.00 0.00 83 V 8.16 4.87 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 0.83 0.00 0.00 0.93 0.00 0.00 84 N 8.39 5.07 0.00 2.74 2.80 0.00 0.00 6.95 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 85 R 7.76 3.74 0.00 1.33 0.94 0.00 2.71 0.00 0.00 2.29 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.48 0.00 86 I 8.89 4.54 2.00 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 0.98 1.08 0.62 0.00 0.00 87 D 8.42 4.54 0.00 3.01 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 88 N 8.33 4.98 0.00 2.83 2.83 0.00 0.00 6.94 7.46 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 89 Y 6.60 3.60 0.00 3.22 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 90 E 9.03 4.40 0.00 1.65 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 2.28 2.27 0.00 91 V 7.05 3.57 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 1.14 0.00 0.00 92 V 8.01 3.86 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 0.81 0.00 0.00 0.88 0.00 0.00 93 G 8.19 3.58 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 0.00 0.00 0.00 94 K 7.48 4.26 0.00 1.68 1.71 0.00 1.73 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.31 1.38 7.81 95 S 8.28 4.60 0.00 3.88 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 96 R 7.98 4.99 0.00 1.68 1.79 0.00 3.34 0.00 0.00 2.48 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.45 0.00 97 P 0.00 4.17 0.00 1.94 2.23 0.00 3.75 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 2.04 2.18 0.00 98 S 9.80 4.69 0.00 3.80 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 99 L 8.22 4.40 0.00 1.68 1.61 0.90 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 4.50 0.00 2.20 2.02 0.00 3.70 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.09 0.00 101 E 8.61 4.52 0.00 2.05 2.18 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 2.33 2.31 0.00 102 R 7.60 5.07 0.00 1.83 1.83 0.00 3.18 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.70 0.00 103 I 9.14 4.79 2.00 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 1.48 0.66 1.12 0.00 0.00 104 D 8.69 5.43 0.00 2.63 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 0.00 105 N 9.36 4.39 0.00 2.87 2.94 0.00 0.00 6.79 7.83 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 0.00 106 V 7.50 4.13 1.82 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 0.23 0.00 0.00 0.95 0.00 0.00 107 L 7.76 4.19 0.00 1.45 1.14 0.74 0.78 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 0.00 108 V 7.76 4.40 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 0.88 0.00 0.00 0.94 0.00 0.00 109 C 9.13 4.32 0.00 3.35 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 0.00 110 P 0.00 4.02 0.00 0.85 1.70 0.00 2.45 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.65 0.00 111 N 7.48 4.62 0.00 3.35 2.91 0.00 0.00 6.77 7.41 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 0.00 112 S 8.78 4.18 0.00 4.03 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 0.00 113 N 8.47 4.72 0.00 2.72 2.89 0.00 0.00 7.14 7.34 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 0.00 114 C 7.85 4.31 0.00 3.06 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 0.00 115 I 8.40 3.63 1.84 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 1.23 0.95 0.76 0.00 0.00 116 S 7.80 3.95 0.00 3.60 3.68 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 0.00 117 H 7.79 4.32 0.00 3.12 3.32 0.00 5.71 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 A 7.30 4.48 1.28 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 0.00 0.00 119 E 7.56 4.67 0.00 1.84 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 2.19 2.16 0.00 120 P 0.00 4.62 0.00 2.02 2.02 0.00 3.57 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.07 0.00 121 V 7.12 4.54 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 0.67 0.00 0.00 0.51 0.00 0.00 122 S 8.44 4.82 0.00 3.81 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 0.00 123 S 8.68 4.53 0.00 4.24 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 0.00 124 S 8.09 5.41 0.00 3.88 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 0.00 125 F 9.27 5.29 0.00 3.09 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 0.00 126 A 9.09 4.61 1.25 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 0.00 0.00 127 V 8.17 4.96 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 0.87 0.00 0.00 1.03 0.00 0.00 128 R 8.64 4.74 0.00 1.93 1.97 0.00 2.85 0.00 0.00 3.22 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.59 0.00 129 K 8.59 4.78 0.00 1.78 1.72 0.00 1.73 0.00 0.00 1.80 0.00 0.00 2.72 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.33 1.38 7.81 130 R 8.07 4.54 0.00 1.73 1.82 0.00 3.26 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 131 A 8.47 4.51 1.25 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 0.00 0.00 132 N 9.70 4.57 0.00 2.91 2.98 0.00 0.00 6.93 8.06 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 0.00 133 D 7.38 4.71 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 0.00 134 I 8.17 4.76 1.78 0.00 0.00 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 1.22 0.63 0.88 0.00 0.00 135 A 9.22 5.11 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 0.00 136 L 9.16 5.85 0.00 1.64 1.71 0.77 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 137 K 8.70 5.00 0.00 1.86 1.71 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.40 1.40 7.81 138 C 9.15 3.70 0.00 3.15 2.81 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 0.00 0.00 0.00 0.00 139 K 8.29 3.57 0.00 1.52 1.30 0.00 1.57 0.00 0.00 1.11 0.00 0.00 2.39 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.66 1.08 7.81 140 Y 7.78 4.26 0.00 2.98 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 0.00 141 C 7.99 4.26 0.00 3.18 3.25 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 0.00 142 E 8.03 4.80 0.00 2.13 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 0.00 2.15 2.41 0.00 143 K 7.41 4.35 0.00 1.64 1.33 0.00 1.55 0.00 0.00 1.54 0.00 0.00 2.86 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.62 1.63 7.81 144 E 8.16 5.13 0.00 1.85 1.66 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 2.17 2.36 0.00 145 F 9.26 5.14 0.00 2.95 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 0.00 146 S 8.64 5.02 0.00 4.15 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 0.00 147 H 8.88 4.17 0.00 3.30 3.56 0.00 5.27 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 N 7.45 4.24 0.00 2.63 2.85 0.00 0.00 6.95 8.43 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 0.00 149 V 8.00 3.71 2.30 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 0.95 0.00 0.00 0.99 0.00 0.00 150 V 7.66 3.36 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 0.50 0.00 0.00 0.76 0.00 0.00 151 L 7.86 4.22 0.00 1.71 1.69 0.81 0.55 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 0.00 152 A 8.06 4.38 1.28 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 0.00 0.00 153 N 7.32 4.20 0.00 2.69 2.90 0.00 0.00 7.05 7.56 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