NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1476 8.4045 120.3069 54.9276 32.7406 175.7350 2 K 3.9917 8.3774 128.1386 53.6427 32.6182 171.3470 3 L 4.6777 7.9832 121.4805 52.8250 43.3043 176.3512 4 D 4.6690 8.3845 123.9648 52.3168 41.1595 176.8797 5 Q 3.9448 8.5866 118.6202 59.4579 28.9553 177.7248 6 I 3.7183 7.9520 120.3708 64.6340 37.0636 177.9198 7 D 4.3488 7.8147 118.9015 57.4439 40.6012 178.8646 8 L 4.0413 7.8387 118.9089 57.7025 41.5128 179.1232 9 N 4.3649 8.2804 116.6867 55.9387 38.3118 177.5976 10 I 3.7953 7.6298 121.3108 64.6112 37.2287 178.0842 11 I 3.7271 7.9778 122.9754 65.2571 37.0595 178.8707 12 E 4.1135 8.5729 119.1701 60.8743 29.4798 180.9945 13 E 4.2907 7.6503 116.2167 59.4393 29.7648 178.4037 14 L 4.8365 8.0140 119.4030 56.9766 41.7711 179.1921 15 K 4.1545 8.4735 120.9034 59.7735 31.9516 179.7282 16 K 4.4292 7.4922 122.7198 58.0660 32.1933 180.2002 17 D 4.6957 7.8624 120.8452 53.0670 43.1475 175.1383 18 S 4.7479 8.8098 120.7876 58.8183 63.5103 174.8125 19 R 4.2901 8.8055 120.3366 56.7377 30.8136 176.6112 20 L 4.0544 8.0804 117.2068 54.9404 41.9850 177.3517 21 S 4.2945 9.0207 118.5983 58.1761 63.9741 174.9888 22 M 4.0266 9.0636 124.9277 59.7376 31.5552 179.8450 23 R 4.1860 8.0894 119.0971 59.8959 29.4398 178.9303 24 E 4.8708 7.9783 113.6134 56.9227 31.1652 177.5598 25 L 4.2013 7.8768 121.9709 58.1374 42.2308 178.4556 26 G 3.7514 8.1851 109.5019 47.9084 0.0000 176.2105 27 R 4.1091 7.4917 122.8957 59.7415 29.9516 178.9346 28 K 4.6581 8.3612 118.1309 57.2439 34.1649 183.3498 29 I 3.8892 8.0427 112.8315 61.2711 38.0325 176.4616 30 K 3.8493 7.3821 121.6127 55.0348 28.4359 179.0616 31 L 4.7559 7.0805 123.8001 52.9085 46.0085 174.8418 32 S 4.4536 8.4896 117.6029 57.4020 63.4564 173.4757 33 P 4.3801 0.0000 0.0000 63.9215 30.1010 175.0553 34 P 4.5863 0.0000 0.0000 64.2951 32.3145 177.9876 35 S 4.2215 7.7243 113.6383 61.1235 62.3905 176.3446 36 V 3.6388 8.1762 122.3896 65.2668 30.9727 178.2667 37 T 3.9525 7.4638 113.2083 64.0629 67.1819 175.7310 38 E 3.9316 7.9918 121.1140 59.4690 29.7524 178.4296 39 R 3.8657 7.9646 117.4257 59.6686 30.2284 178.5117 40 V 3.7040 7.9444 119.5698 67.1221 31.5034 179.0788 41 R 4.1152 7.9166 119.8317 61.0058 29.0716 180.7919 42 Q 4.3740 7.9506 116.5933 59.4495 28.8632 178.2917 43 L 4.0664 8.1054 120.0302 58.0386 41.4316 179.5883 44 E 4.0559 8.2368 117.6541 59.2075 29.4706 179.3583 45 S 4.2219 7.7956 112.8929 61.7420 63.3450 176.5079 46 F 4.2276 7.9508 120.3720 57.9329 38.5912 176.2693 47 G 3.9425 8.1070 105.9607 45.9004 0.0000 175.1056 48 I 3.7518 7.7864 120.1251 64.0950 37.3198 176.6469 49 I 3.8344 7.5783 120.9571 61.1824 37.2306 176.0266 50 K 4.2855 8.2417 124.8332 57.7571 33.2175 176.5888 51 Q 4.5254 7.1606 114.9316 55.6029 31.4799 171.9928 52 Y 4.6115 8.7633 121.0462 56.6162 39.9084 175.2389 53 T 4.5838 8.0741 117.7594 61.1885 70.1277 171.8028 54 L 4.7743 8.2250 120.5162 53.5488 45.2268 175.6845 55 E 4.6204 8.7357 123.9669 54.5717 31.1563 175.5255 56 V 4.2619 8.1386 123.0816 60.8426 33.9493 175.3129 57 D 4.5769 8.4239 125.6149 53.4995 41.2220 176.8138 58 Q 4.1081 8.7670 130.1066 59.4584 28.7225 179.7065 59 K 4.1573 8.3215 124.9859 59.6622 31.5578 183.1972 60 K 4.3517 8.0741 118.0844 58.8525 32.1040 178.6125 61 L 4.3775 7.4417 116.2597 54.7996 41.0095 177.5753 62 G 3.9198 8.1101 107.2575 45.9703 0.0000 174.1430 63 L 5.0741 7.8809 118.6078 52.3732 41.3723 174.9072 64 P 4.4401 0.0000 0.0000 63.3878 32.5581 176.9143 65 V 4.3883 7.6275 120.4759 61.4845 33.5000 174.6133 66 S 5.2897 8.5604 122.5410 57.1307 67.1500 172.6552 67 C 5.1821 8.7111 118.4457 58.3977 33.0346 172.9923 68 I 4.7816 8.7686 123.0166 60.0562 39.0424 174.9441 69 V 4.8928 8.9752 126.2036 61.2136 34.7532 173.8638 70 E 5.1203 9.1712 127.4870 55.3261 31.2534 174.9245 71 A 5.3367 9.3304 126.6211 50.3387 22.2121 174.9919 72 T 4.7048 8.9992 116.7977 59.8356 69.9775 173.4994 73 V 3.8886 8.3166 129.2342 62.9777 32.2865 175.4184 74 K 4.2557 8.8578 126.6649 55.7860 34.1111 176.5208 75 N 4.2146 9.3944 117.3880 53.8790 36.1671 174.4386 76 A 3.7116 7.9729 116.8372 53.2197 16.3681 178.9856 77 D 4.7830 7.7203 120.8629 54.2089 39.9306 176.5350 78 Y 4.1372 8.1144 121.6244 60.4836 38.3385 177.1864 79 E 4.0416 8.3775 119.8172 59.4696 29.9202 178.7642 80 R 3.9922 8.4280 118.7125 59.1779 30.0707 178.2841 81 F 4.1428 8.2489 120.7191 60.8448 39.4182 177.1644 82 K 3.7152 8.5874 119.6820 59.5171 31.8384 178.7454 83 S 4.0205 7.8907 114.1924 61.9354 63.0654 175.6750 84 Y 3.9353 7.6652 121.7197 61.0265 38.2853 178.4166 85 I 3.0217 7.4048 120.6184 64.0091 36.9150 177.6613 86 Q 4.2114 7.4663 116.2257 56.6908 28.7608 176.9745 87 T 4.2557 7.2357 110.3187 60.5494 69.6950 174.0254 88 L 4.5184 6.7428 122.0175 52.4257 43.4575 174.6697 89 P 4.3826 0.0000 0.0000 63.6611 32.4719 175.3437 90 N 4.1832 8.6440 114.5657 54.3778 35.2106 174.2917 91 I 4.1176 7.3390 120.0917 59.4884 36.6180 174.9738 92 E 4.1482 8.4486 128.2378 59.0145 30.2313 176.3783 93 F 4.6639 7.2025 111.6048 56.4506 41.0964 173.2866 94 C 4.7442 8.3846 120.1832 58.9263 33.5126 172.1740 95 Y 4.9261 9.4985 125.5507 56.4264 39.7292 175.2528 96 R 4.3880 8.9420 125.1933 56.0011 30.7393 175.3758 97 I 4.7733 8.3913 119.5838 58.7044 40.7485 175.2761 98 A 4.1585 8.4057 126.0939 52.3277 19.4421 176.1463 99 G 3.8019 8.2761 103.2669 44.5532 0.0000 173.5313 100 A 4.1678 8.6379 120.7782 53.7811 19.5527 177.9979 101 A 4.4703 7.6929 117.5923 51.8962 20.2335 176.3381 102 C 4.4225 9.0030 116.1825 61.4600 30.1181 174.3241 103 Y 5.9613 7.6588 114.0927 55.7158 42.4866 174.1487 104 M 5.5561 9.0768 121.9619 53.7004 35.2135 174.8275 105 L 5.8350 9.2294 122.1704 52.9267 45.1431 174.8710 106 K 4.7652 7.4513 120.2342 54.3407 35.0581 174.5645 107 I 4.8011 8.0555 120.3917 59.1315 40.4404 174.0251 108 N 5.4910 8.3270 121.1200 51.7452 40.8586 174.0281 109 A 4.6199 8.8735 123.2442 50.3403 22.6962 177.2039 110 E 4.0388 9.1862 118.8571 58.9259 30.0953 177.2784 111 S 4.5696 7.5386 110.6256 55.9882 65.6377 175.5756 112 L 3.9836 8.5188 120.5059 58.2249 41.0907 179.5233 113 E 3.9713 7.9431 117.6233 59.1486 29.5189 178.7420 114 A 4.0636 7.9549 120.7040 54.6673 18.3574 179.9086 115 V 3.5725 7.7086 116.6681 66.1025 31.6838 177.4371 116 E 3.9382 8.0978 119.0040 59.6152 29.3731 178.2718 117 D 4.4151 8.2240 118.7260 57.5743 40.9578 178.8213 118 F 4.2251 8.4789 120.7992 61.4276 39.4162 177.2157 119 I 3.4114 8.5297 119.5876 64.3304 36.7053 177.9597 120 N 4.3027 8.2709 118.7130 57.1769 38.5404 178.1163 121 K 4.1190 8.1364 123.4367 59.4736 32.0249 180.1645 122 T 4.1136 7.6015 111.5578 64.2777 67.1055 176.5378 123 S 4.3733 7.5955 118.0813 60.6399 62.9130 174.6506 124 P 4.0803 0.0000 0.0000 64.9699 31.1142 176.4729 125 Y 4.6063 7.8249 114.5718 59.1008 40.1105 175.8159 126 A 4.9787 7.5737 118.3267 50.5526 22.8354 176.0483 127 Q 4.3505 9.0809 120.5665 56.1419 30.1806 175.5029 128 T 5.2183 8.3062 110.9304 60.0281 72.3918 173.0463 129 V 4.3345 8.6421 123.7828 61.5798 33.9229 174.1378 130 T 4.7988 8.5118 124.7487 62.3556 70.2238 173.7553 131 H 4.7787 9.0251 124.5943 53.6743 30.9666 173.9518 132 V 3.8827 8.1702 124.4625 62.7237 32.1276 175.4390 133 I 3.8899 8.1954 129.5364 61.2968 37.0566 176.1334 134 F 4.7083 8.8784 126.6449 59.8827 39.2847 175.3990 135 S 4.6072 7.4184 110.8400 57.8507 65.0441 173.4875 136 E 4.6982 8.4754 120.1567 54.2884 32.2098 174.4958 137 I 4.2014 8.2291 125.9957 60.0267 38.2248 175.4326 138 D 4.4900 8.7614 126.0779 54.7509 40.9751 176.0305 139 T 4.3586 8.5632 116.3909 62.7921 70.7115 175.2224 140 K 4.1846 7.9792 127.1757 54.6582 31.8331 180.5275 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 8.40 4.15 0.00 1.34 1.16 0.00 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.32 0.00 2 K 8.38 3.99 0.00 1.90 1.57 0.00 1.83 0.00 0.00 1.71 0.00 0.00 2.88 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.36 1.09 7.81 3 L 7.98 4.68 0.00 1.55 1.59 0.91 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 4 D 8.38 4.67 0.00 2.81 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 5 Q 8.59 3.94 0.00 2.17 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.86 6.88 0.00 0.00 0.00 0.00 0.00 2.42 2.50 0.00 6 I 7.95 3.72 2.06 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 1.63 1.08 0.91 0.00 0.00 7 D 7.81 4.35 0.00 2.89 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 8 L 7.84 4.04 0.00 1.78 1.70 0.96 0.70 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 9 N 8.28 4.36 0.00 2.75 2.86 0.00 0.00 6.92 7.47 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 10 I 7.63 3.80 2.05 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 0.81 0.94 0.00 0.00 11 I 7.98 3.73 1.99 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.70 0.89 0.00 0.00 12 E 8.57 4.11 0.00 1.96 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 2.25 2.21 0.00 13 E 7.65 4.29 0.00 2.51 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 2.29 2.40 0.00 14 L 8.01 4.84 0.00 1.67 1.80 1.05 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 15 K 8.47 4.15 0.00 1.75 1.88 0.00 1.69 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.58 7.81 16 K 7.49 4.43 0.00 1.99 1.71 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.39 1.31 7.81 17 D 7.86 4.70 0.00 2.64 2.53 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 18 S 8.81 4.75 0.00 4.43 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 0.00 19 R 8.81 4.29 0.00 1.95 2.01 0.00 3.21 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 20 L 8.08 4.05 0.00 1.65 1.69 0.99 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 21 S 9.02 4.29 0.00 4.00 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 22 M 9.06 4.03 0.00 2.05 2.18 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 2.70 2.57 0.00 23 R 8.09 4.19 0.00 1.81 1.94 0.00 3.19 0.00 0.00 3.39 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.25 0.00 24 E 7.98 4.87 0.00 2.07 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 2.35 2.25 0.00 25 L 7.88 4.20 0.00 1.80 1.92 0.95 1.07 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 26 G 8.19 3.75 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 0.00 0.00 0.00 0.00 0.00 0.00 27 R 7.49 4.11 0.00 1.97 1.87 0.00 3.21 0.00 0.00 3.26 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.54 0.00 28 K 8.36 4.66 0.00 1.60 1.77 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.25 1.20 7.81 29 I 8.04 3.89 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 1.01 0.96 0.00 0.00 30 K 7.38 3.85 0.00 2.07 1.73 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.30 1.23 7.81 31 L 7.08 4.76 0.00 1.61 1.47 0.93 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 32 S 8.49 4.45 0.00 4.05 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 33 P 0.00 4.38 0.00 2.06 2.17 0.00 3.66 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 2.03 2.09 0.00 34 P 0.00 4.59 0.00 2.21 2.29 0.00 3.73 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.93 0.00 35 S 7.72 4.22 0.00 3.86 4.07 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 0.00 0.00 0.00 0.00 36 V 8.18 3.64 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 0.73 0.00 0.00 0.94 0.00 0.00 37 T 7.46 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 1.21 0.00 0.00 38 E 7.99 3.93 0.00 2.15 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 0.00 2.32 2.41 0.00 39 R 7.96 3.87 0.00 2.11 2.01 0.00 3.21 0.00 0.00 3.27 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.93 0.00 40 V 7.94 3.70 2.13 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 1.13 0.00 0.00 1.02 0.00 0.00 41 R 7.92 4.12 0.00 1.81 1.92 0.00 3.32 0.00 0.00 3.17 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.54 0.00 42 Q 7.95 4.37 0.00 2.37 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.68 2.58 0.00 43 L 8.11 4.07 0.00 1.89 1.75 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 44 E 8.24 4.06 0.00 2.03 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 0.00 2.49 2.62 0.00 45 S 7.80 4.22 0.00 3.80 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 46 F 7.95 4.23 0.00 3.12 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 47 G 8.11 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 48 I 7.79 3.75 2.03 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.46 0.90 0.00 0.00 49 I 7.58 3.83 1.82 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 1.28 0.42 0.43 0.00 0.00 50 K 8.24 4.29 0.00 1.70 1.84 0.00 1.79 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.39 7.81 51 Q 7.16 4.53 0.00 1.94 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.70 0.00 0.00 0.00 0.00 0.00 2.21 2.32 0.00 52 Y 8.76 4.61 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 53 T 8.07 4.58 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 1.22 0.00 0.00 54 L 8.22 4.77 0.00 1.58 1.46 0.94 0.84 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 55 E 8.74 4.62 0.00 1.99 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 2.24 2.22 0.00 56 V 8.14 4.26 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 0.79 0.00 0.00 0.93 0.00 0.00 57 D 8.42 4.58 0.00 2.75 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 58 Q 8.77 4.11 0.00 2.08 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.69 0.00 0.00 0.00 0.00 0.00 2.44 2.35 0.00 59 K 8.32 4.16 0.00 1.78 1.81 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.35 7.81 60 K 8.07 4.35 0.00 1.84 1.90 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.74 7.81 61 L 7.44 4.38 0.00 1.73 1.68 0.91 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.11 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 63 L 7.88 5.07 0.00 1.68 1.54 0.97 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 64 P 0.00 4.44 0.00 2.18 2.16 0.00 3.91 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.95 0.00 65 V 7.63 4.39 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 1.03 0.00 0.00 0.96 0.00 0.00 66 S 8.56 5.29 0.00 3.73 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 67 C 8.71 5.18 0.00 2.72 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 68 I 8.77 4.78 1.96 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 1.15 1.09 1.12 0.00 0.00 69 V 8.98 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 1.32 0.00 0.00 1.00 0.00 0.00 70 E 9.17 5.12 0.00 2.05 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 2.40 2.41 0.00 71 A 9.33 5.34 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 72 T 9.00 4.70 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 1.22 0.00 0.00 73 V 8.32 3.89 1.47 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 0.17 0.00 0.00 0.43 0.00 0.00 74 K 8.86 4.26 0.00 1.78 1.62 0.00 1.96 0.00 0.00 1.56 0.00 0.00 2.76 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.35 7.81 75 N 9.39 4.21 0.00 2.82 2.86 0.00 0.00 6.92 7.35 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 76 A 7.97 3.71 1.41 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 0.00 0.00 77 D 7.72 4.78 0.00 2.82 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 78 Y 8.11 4.14 0.00 3.32 3.27 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 79 E 8.38 4.04 0.00 2.20 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 2.45 2.50 0.00 80 R 8.43 3.99 0.00 2.05 2.20 0.00 3.24 0.00 0.00 3.37 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.87 0.00 81 F 8.25 4.14 0.00 3.18 3.18 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 0.00 82 K 8.59 3.72 0.00 1.98 1.93 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.42 1.46 7.81 83 S 7.89 4.02 0.00 3.88 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 84 Y 7.67 3.94 0.00 1.96 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.40 3.02 1.30 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.10 0.65 0.62 0.00 0.00 86 Q 7.47 4.21 0.00 1.93 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.85 0.00 0.00 0.00 0.00 0.00 2.28 2.43 0.00 87 T 7.24 4.26 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 1.17 0.00 0.00 88 L 6.74 4.52 0.00 1.40 1.47 0.86 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.38 0.00 2.12 1.99 0.00 3.77 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 1.93 1.94 0.00 90 N 8.64 4.18 0.00 2.84 3.04 0.00 0.00 6.81 7.42 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 91 I 7.34 4.12 1.71 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.62 0.77 0.00 0.00 92 E 8.45 4.15 0.00 1.80 1.60 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 2.39 2.25 0.00 93 F 7.20 4.66 0.00 2.46 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 94 C 8.38 4.74 0.00 2.93 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 95 Y 9.50 4.93 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 96 R 8.94 4.39 0.00 1.90 1.88 0.00 2.74 0.00 0.00 2.49 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.50 0.00 97 I 8.39 4.77 1.87 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.82 0.96 0.00 0.00 98 A 8.41 4.16 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 99 G 8.28 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 0.00 100 A 8.64 4.17 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 0.00 101 A 7.69 4.47 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 0.00 102 C 9.00 4.42 0.00 2.95 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 0.00 103 Y 7.66 5.96 0.00 3.01 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 0.00 104 M 9.08 5.56 0.00 2.27 2.24 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 2.72 2.59 0.00 105 L 9.23 5.84 0.00 1.78 1.82 0.91 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 106 K 7.45 4.77 0.00 0.79 0.74 0.00 1.60 0.00 0.00 1.80 0.00 0.00 2.79 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.07 1.27 7.81 107 I 8.06 4.80 1.46 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.52 0.11 0.00 0.00 108 N 8.33 5.49 0.00 2.50 2.67 0.00 0.00 6.67 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 0.00 109 A 8.87 4.62 1.11 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 0.00 110 E 9.19 4.04 0.00 1.96 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 0.00 2.31 2.25 0.00 111 S 7.54 4.57 0.00 3.95 3.92 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 0.00 0.00 0.00 112 L 8.52 3.98 0.00 1.72 1.80 0.95 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 113 E 7.94 3.97 0.00 2.12 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 0.00 2.32 2.34 0.00 114 A 7.95 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 0.00 115 V 7.71 3.57 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 1.09 0.00 0.00 0.97 0.00 0.00 116 E 8.10 3.94 0.00 2.13 2.11 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 2.33 2.39 0.00 117 D 8.22 4.42 0.00 2.92 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 0.00 118 F 8.48 4.23 0.00 3.16 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 0.00 119 I 8.53 3.41 2.01 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.91 0.89 0.00 0.00 120 N 8.27 4.30 0.00 2.79 2.87 0.00 0.00 7.00 7.78 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 0.00 121 K 8.14 4.12 0.00 1.84 1.73 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.32 7.81 122 T 7.60 4.11 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 0.09 0.00 0.00 123 S 7.60 4.37 0.00 3.79 3.86 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 0.00 124 P 0.00 4.08 0.00 0.99 1.65 0.00 3.55 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.96 0.00 125 Y 7.82 4.61 0.00 3.05 3.09 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 0.00 0.00 0.00 0.00 126 A 7.57 4.98 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 0.00 127 Q 9.08 4.35 0.00 2.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.70 0.00 0.00 0.00 0.00 0.00 2.35 2.28 0.00 128 T 8.31 5.22 4.34 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 1.27 0.00 0.00 129 V 8.64 4.33 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 0.90 0.00 0.00 0.95 0.00 0.00 130 T 8.51 4.80 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 1.23 0.00 0.00 131 H 9.03 4.78 0.00 3.10 3.15 0.00 5.62 0.00 0.00 0.00 0.00 6.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 V 8.17 3.88 1.81 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 0.64 0.00 0.00 0.87 0.00 0.00 133 I 8.20 3.89 1.98 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.61 0.98 0.00 0.00 134 F 8.88 4.71 0.00 3.10 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 0.00 135 S 7.42 4.61 0.00 3.97 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 0.00 136 E 8.48 4.70 0.00 1.93 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 2.20 2.32 0.00 137 I 8.23 4.20 1.89 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 1.43 0.71 0.92 0.00 0.00 138 D 8.76 4.49 0.00 2.68 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 0.00 139 T 8.56 4.36 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 1.27 0.00 0.00 140 K 7.98 4.18 0.00 1.80 1.62 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.36 1.00 7.81