NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 D 4.5366 8.2233 120.1844 54.1353 43.0893 176.7259 3 S 4.1687 8.0839 113.2803 59.5903 62.8612 173.3539 4 N 4.6200 7.9274 119.3274 55.3517 39.7357 176.0892 5 D 3.7235 7.9903 118.6873 57.1245 40.6929 178.0346 6 L 3.6313 7.5583 120.8572 57.8096 41.9579 178.4624 7 E 3.8948 8.9910 120.2687 59.2093 29.7148 177.8946 8 A 3.7666 8.0982 117.0644 55.6019 17.9958 179.8963 9 S 3.9469 8.0984 110.9782 60.8073 63.6868 174.9879 10 F 4.7610 7.9146 120.0433 58.7069 38.5452 177.1466 11 T 4.0675 8.2121 110.2306 65.7623 68.6934 175.7116 12 S 4.1148 7.9698 115.0173 61.1539 62.4013 175.9849 13 R 4.0936 8.2290 116.8658 56.4983 30.0184 175.7183 14 L 4.8212 7.2993 117.3069 52.1954 43.9644 174.6965 15 P 4.3622 0.0000 0.0000 62.2653 31.9607 175.6548 16 P 4.2711 0.0000 0.0000 65.7319 31.1160 178.4055 17 E 3.9323 8.1064 115.8598 59.5313 29.7769 178.7414 18 I 3.6753 7.7298 121.7896 64.5036 37.3184 177.7524 19 V 3.4083 8.3400 116.6964 66.3807 30.8296 177.8676 20 A 3.9019 8.2626 121.4731 55.8726 18.9902 178.7380 21 A 3.6510 8.6219 117.6747 56.1179 18.0528 179.2527 22 L 3.8886 8.1714 119.1195 57.7341 42.1819 180.0269 23 K 4.1691 7.8792 117.3565 57.7595 32.2794 177.8142 24 R 3.9697 7.4781 120.0958 55.5231 30.4596 176.2023 25 K 4.0898 8.5252 126.4481 56.2948 32.8535 175.8917 26 S 4.8133 8.7223 117.7785 57.2844 63.8602 173.5713 27 S 5.0085 8.1627 119.7409 56.3943 65.4896 173.5849 28 R 3.9464 8.5061 117.6617 58.9387 30.1894 176.2969 29 D 4.3743 8.7080 118.8219 53.5967 41.0645 174.6058 30 P 4.2213 0.0000 0.0000 65.8557 31.4193 176.7137 31 N 4.8634 7.7263 112.7438 53.2294 38.7114 175.6192 32 S 4.6153 8.2074 114.6996 58.2123 64.6599 174.6191 33 R 4.6640 7.7013 115.4005 55.2375 31.8154 174.6864 34 F 3.8384 9.4294 120.7422 59.2878 38.8580 178.1397 35 P 4.4333 0.0000 0.0000 64.7624 32.7349 176.8678 36 R 3.8793 8.1839 115.4029 59.1267 29.8187 178.6671 37 K 3.8273 8.1505 118.6039 60.0041 32.3260 178.0742 38 L 3.7453 7.6905 119.6382 58.5315 42.0649 177.9242 39 H 4.2392 9.3997 118.4919 59.7450 29.6251 177.1520 40 M 4.1908 8.6632 119.1575 58.4043 30.9540 177.9625 41 L 3.9569 7.8777 120.2268 58.9492 42.2664 178.7756 42 L 3.4887 8.1774 117.0153 58.6099 42.2661 178.9202 43 T 4.2200 8.2469 113.4870 64.7631 69.2399 175.9398 44 Y 4.2720 8.3587 123.1141 60.6561 38.4941 177.4574 45 L 3.8283 8.8440 120.8051 57.9978 41.7099 179.4142 46 A 4.1468 7.8808 117.2567 54.1112 18.5667 178.1713 47 S 4.6271 8.2982 111.1718 58.2773 64.5036 173.4953 48 N 5.1620 8.9307 119.1570 57.0255 39.2713 175.5486 49 P 3.9672 0.0000 0.0000 64.5964 32.3248 177.3539 50 Q 3.9804 8.1066 117.4433 59.5261 28.9651 178.5201 51 L 3.8954 8.0787 119.7920 57.6487 41.5917 179.0060 52 E 3.9750 8.1210 118.8666 59.3601 29.1863 178.1414 53 E 4.0846 8.1795 119.0516 58.8183 29.9063 177.8123 54 E 4.2192 8.4007 118.7668 59.8816 29.8458 179.5982 55 I 3.5952 7.8881 118.2121 62.7118 38.8744 175.7188 56 G 3.4116 8.9987 106.8144 44.9304 0.0000 172.6195 57 L 4.9406 7.3033 118.9361 54.8962 44.4379 174.8369 58 S 4.5354 9.5832 120.9101 57.0287 66.8746 173.0178 59 W 5.2855 8.6897 122.7468 56.5712 28.9059 176.6150 60 I 3.9773 8.8861 125.9953 63.0450 37.8055 175.0316 61 S 4.9030 7.9773 112.6131 56.1227 65.3767 173.1993 62 D 4.4337 8.5733 119.2883 53.7875 39.5005 177.5974 63 T 4.5151 7.6832 109.5739 61.9955 71.0071 173.9683 64 E 5.6154 8.3480 120.0211 54.6116 32.9478 174.9523 65 F 5.6663 10.0366 116.8197 55.5822 42.2407 172.9684 66 K 4.6483 9.8217 117.9483 55.9872 36.5116 174.9629 67 M 5.4293 9.0626 117.7132 55.7880 35.3780 173.8438 68 K 4.3324 7.7781 118.7588 53.3395 32.2377 177.4530 69 K 3.9129 8.5940 124.0545 59.7655 32.0694 178.3049 70 K 4.0492 7.6619 116.7608 59.5119 32.3707 178.0984 71 N 4.5953 8.6431 116.8008 56.0750 38.7173 177.9227 72 V 3.4378 7.5633 112.9214 64.4698 31.5992 178.2435 73 A 4.0139 7.9087 118.8127 54.4076 18.4151 179.1073 74 L 4.0803 8.1479 119.6262 57.8861 42.1833 178.5818 75 V 3.6116 7.8394 116.7061 66.5665 31.5469 176.7933 76 M 4.2046 8.4596 116.2923 55.0128 31.2634 176.9704 77 G 3.9078 8.2771 105.6848 46.1091 0.0000 173.2281 78 I 4.2466 7.4184 119.1369 58.9902 39.2447 176.2340 79 K 4.0547 8.5147 126.6755 56.3765 33.8586 177.7719 80 L 3.8849 8.4541 121.3629 59.0304 42.0775 178.2429 81 N 3.9608 8.1164 115.7008 57.4172 38.8899 175.8483 82 T 3.7501 8.0718 109.7014 65.2989 68.7234 175.3382 83 L 3.7721 8.3230 123.3676 57.6098 42.2868 179.3373 84 N 4.2141 8.0767 116.1915 56.1650 38.7308 177.3954 85 V 3.5687 7.8172 119.7625 66.1999 31.3747 177.9543 86 N 4.1213 8.2152 116.2904 56.0838 38.3253 177.1349 87 L 3.7997 7.1010 119.9248 57.9170 41.5787 179.5121 88 R 4.1456 7.8795 117.5197 58.6661 29.9647 178.0890 89 D 4.3269 7.7758 117.7034 57.2140 40.8853 177.2262 90 L 4.3594 8.2728 116.8305 54.0555 41.7221 176.7204 91 A 3.7882 7.5714 120.2935 52.8268 15.6586 176.6408 92 F 5.0801 8.9188 117.4946 55.2145 42.7006 174.2916 93 E 4.7576 9.9327 123.4885 54.8046 31.5778 174.4472 94 Q 3.6765 8.9020 128.9097 54.4506 29.5243 174.7284 95 L 4.5031 7.1205 125.0006 54.8671 40.6783 176.8352 96 Q 4.2643 7.5623 115.6464 55.8893 29.7372 172.2712 97 H 3.7474 8.3498 124.2042 53.9627 31.4653 173.7589 98 D 4.5348 8.5736 122.3631 55.2474 41.1038 177.1704 99 K 4.4249 8.7299 127.6559 55.0991 31.7223 176.0166 100 G 3.8604 9.0823 114.3459 46.6806 0.0000 171.4263 101 G 3.9816 9.5997 109.0661 44.5358 0.0000 174.1505 102 W 5.2109 8.0167 118.0982 56.0357 31.6214 175.6985 103 T 4.9897 8.7457 117.3685 62.2272 72.8345 172.8270 104 Q 4.9523 8.1353 121.2244 54.5983 32.2572 174.1639 105 W 5.6258 9.5991 119.7128 55.2491 34.6280 173.1445 106 K 5.1371 8.9387 120.0687 56.5887 35.5438 174.0781 107 R 4.6859 8.9798 120.8072 56.0826 32.7510 175.6249 108 S 4.0274 9.1264 123.6077 61.7227 63.0609 175.9496 109 G 3.7743 7.9633 106.3963 46.3019 0.0000 173.2237 110 F 4.0646 8.9367 124.6387 57.9284 39.5282 174.7071 111 T 3.8165 8.4857 115.5461 63.2562 72.2127 175.8783 112 R 2.5100 7.3473 117.3259 56.1785 33.3528 176.7762 113 N 5.0323 7.5193 115.5575 50.2365 40.3157 174.3956 114 S 4.3331 7.8310 118.7516 59.2734 65.3132 177.5820 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 2 D 8.22 4.54 0.00 2.73 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 3 S 8.08 4.17 0.00 3.93 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 4 N 7.93 4.62 0.00 2.69 2.80 0.00 0.00 6.73 8.08 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 5 D 7.99 3.72 0.00 2.66 2.62 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 6 L 7.56 3.63 0.00 1.70 1.44 0.03 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 7 E 8.99 3.89 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 2.32 2.37 0.00 8 A 8.10 3.77 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 9 S 8.10 3.95 0.00 3.86 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 10 F 7.91 4.76 0.00 3.20 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 11 T 8.21 4.07 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 1.30 0.00 0.00 12 S 7.97 4.11 0.00 3.91 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 13 R 8.23 4.09 0.00 1.98 2.05 0.00 3.34 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 1.69 1.72 0.00 14 L 7.30 4.82 0.00 1.90 1.62 0.84 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 15 P 0.00 4.36 0.00 2.21 1.99 0.00 4.16 0.00 0.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.20 0.00 16 P 0.00 4.27 0.00 2.16 2.16 0.00 3.61 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.21 0.00 17 E 8.11 3.93 0.00 2.19 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 0.00 2.34 2.40 0.00 18 I 7.73 3.68 2.09 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.70 1.00 0.00 0.00 19 V 8.34 3.41 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 1.06 0.00 0.00 0.96 0.00 0.00 20 A 8.26 3.90 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 A 8.62 3.65 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 22 L 8.17 3.89 0.00 1.81 1.76 0.98 0.85 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 23 K 7.88 4.17 0.00 1.86 1.87 0.00 1.71 0.00 0.00 1.64 0.00 0.00 3.03 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.48 1.48 7.81 24 R 7.48 3.97 0.00 1.77 1.84 0.00 3.32 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 25 K 8.53 4.09 0.00 1.76 1.71 0.00 1.85 0.00 0.00 1.77 0.00 0.00 3.03 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.39 7.81 26 S 8.72 4.81 0.00 4.06 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 27 S 8.16 5.01 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 28 R 8.51 3.95 0.00 1.83 2.04 0.00 3.38 0.00 0.00 3.16 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.56 0.00 29 D 8.71 4.37 0.00 2.70 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 30 P 0.00 4.22 0.00 2.07 2.14 0.00 3.72 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 2.04 2.15 0.00 31 N 7.73 4.86 0.00 2.84 2.81 0.00 0.00 6.74 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 32 S 8.21 4.62 0.00 3.82 4.09 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 33 R 7.70 4.66 0.00 2.06 2.02 0.00 3.17 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.71 0.00 34 F 9.43 3.84 0.00 3.14 3.01 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 35 P 0.00 4.43 0.00 2.41 2.39 0.00 3.91 0.00 0.00 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.63 0.00 36 R 8.18 3.88 0.00 1.98 1.93 0.00 3.21 0.00 0.00 3.54 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.70 0.00 37 K 8.15 3.83 0.00 1.97 1.59 0.00 1.69 0.00 0.00 1.54 0.00 0.00 3.13 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.44 7.81 38 L 7.69 3.75 0.00 1.23 1.82 0.77 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 39 H 9.40 4.24 0.00 3.32 3.51 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 M 8.66 4.19 0.00 2.28 2.37 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.60 0.00 41 L 7.88 3.96 0.00 1.95 1.67 0.84 0.39 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 42 L 8.18 3.49 0.00 1.85 1.70 0.21 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 43 T 8.25 4.22 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 44 Y 8.36 4.27 0.00 3.09 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 L 8.84 3.83 0.00 1.80 1.67 0.80 0.47 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 46 A 7.88 4.15 1.52 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 0.00 0.00 47 S 8.30 4.63 0.00 3.94 4.40 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 48 N 8.93 5.16 0.00 2.90 2.80 0.00 0.00 6.89 7.91 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 49 P 0.00 3.97 0.00 2.22 2.14 0.00 3.66 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 2.14 2.24 0.00 50 Q 8.11 3.98 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.90 0.00 0.00 0.00 0.00 0.00 2.59 2.50 0.00 51 L 8.08 3.90 0.00 1.66 1.46 0.92 0.46 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 52 E 8.12 3.97 0.00 2.01 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 2.58 2.39 0.00 53 E 8.18 4.08 0.00 2.20 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 2.42 2.43 0.00 54 E 8.40 4.22 0.00 1.99 2.34 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 2.46 2.61 0.00 55 I 7.89 3.60 1.65 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 0.91 -0.36 0.72 0.00 0.00 56 G 9.00 3.41 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 0.00 57 L 7.30 4.94 0.00 1.50 1.46 0.81 0.95 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 58 S 9.58 4.54 0.00 3.98 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 59 W 8.69 5.29 0.00 3.32 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 I 8.89 3.98 1.92 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 1.24 0.75 1.09 0.00 0.00 61 S 7.98 4.90 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 62 D 8.57 4.43 0.00 2.76 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 T 7.68 4.52 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 64 E 8.35 5.62 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.43 0.00 65 F 10.04 5.67 0.00 2.68 2.42 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 0.00 66 K 9.82 4.65 0.00 1.88 1.88 0.00 1.10 0.00 0.00 1.58 0.00 0.00 2.85 0.00 0.00 2.50 0.00 0.00 0.00 0.00 1.55 1.63 7.81 67 M 9.06 5.43 0.00 1.92 2.03 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.35 0.00 68 K 7.78 4.33 0.00 1.29 1.36 0.00 1.69 0.00 0.00 1.33 0.00 0.00 2.50 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.30 0.21 7.81 69 K 8.59 3.91 0.00 1.76 1.83 0.00 1.74 0.00 0.00 1.83 0.00 0.00 3.30 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.52 1.65 7.81 70 K 7.66 4.05 0.00 1.63 1.83 0.00 1.72 0.00 0.00 1.66 0.00 0.00 3.07 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.48 7.81 71 N 8.64 4.60 0.00 2.80 2.87 0.00 0.00 7.07 8.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 V 7.56 3.44 1.96 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 0.65 0.00 0.00 0.84 0.00 0.00 73 A 7.91 4.01 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 L 8.15 4.08 0.00 2.04 1.87 0.92 0.74 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 75 V 7.84 3.61 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 0.77 0.00 0.00 0.72 0.00 0.00 76 M 8.46 4.20 0.00 2.05 2.03 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.35 0.00 77 G 8.28 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 0.00 0.00 0.00 78 I 7.42 4.25 1.92 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 1.41 0.83 1.01 0.00 0.00 79 K 8.51 4.05 0.00 1.80 1.74 0.00 1.74 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.54 1.46 7.81 80 L 8.45 3.88 0.00 1.66 1.64 0.93 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 81 N 8.12 3.96 0.00 2.79 2.76 0.00 0.00 6.76 7.22 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 82 T 8.07 3.75 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 83 L 8.32 3.77 0.00 1.80 1.92 0.89 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 84 N 8.08 4.21 0.00 2.92 2.85 0.00 0.00 6.59 7.82 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 85 V 7.82 3.57 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 1.05 0.00 0.00 0.94 0.00 0.00 86 N 8.22 4.12 0.00 1.84 1.74 0.00 0.00 6.95 7.31 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 87 L 7.10 3.80 0.00 1.42 1.17 0.39 -1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 88 R 7.88 4.15 0.00 1.97 1.94 0.00 3.14 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.77 0.00 89 D 7.78 4.33 0.00 2.99 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 90 L 8.27 4.36 0.00 1.54 1.60 1.07 0.73 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 91 A 7.57 3.79 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 92 F 8.92 5.08 0.00 3.00 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 93 E 9.93 4.76 0.00 2.15 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 2.29 2.32 0.00 94 Q 8.90 3.68 0.00 1.73 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.07 0.00 0.00 0.00 0.00 0.00 1.93 1.42 0.00 95 L 7.12 4.50 0.00 1.76 1.67 1.02 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 96 Q 7.56 4.26 0.00 1.86 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.83 0.00 0.00 0.00 0.00 0.00 2.09 2.19 0.00 97 H 8.35 3.75 0.00 3.11 3.11 0.00 5.81 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 D 8.57 4.53 0.00 2.67 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 99 K 8.73 4.42 0.00 1.78 1.73 0.00 1.89 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.63 1.46 7.81 100 G 9.08 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 0.00 0.00 0.00 101 G 9.60 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 0.00 102 W 8.02 5.21 0.00 3.28 3.19 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 0.00 103 T 8.75 4.99 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 0.92 0.00 0.00 104 Q 8.14 4.95 0.00 2.09 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.66 0.00 0.00 0.00 0.00 0.00 2.12 2.20 0.00 105 W 9.60 5.63 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 0.00 106 K 8.94 5.14 0.00 2.21 1.85 0.00 1.91 0.00 0.00 1.92 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.65 1.56 7.81 107 R 8.98 4.69 0.00 1.83 1.94 0.00 2.21 0.00 0.00 3.14 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 108 S 9.13 4.03 0.00 3.93 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 0.00 109 G 7.96 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 0.00 110 F 8.94 4.06 0.00 3.18 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 0.00 111 T 8.49 3.82 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 1.33 0.00 0.00 112 R 7.35 2.51 0.00 1.62 1.86 0.00 3.30 0.00 0.00 3.00 7.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.63 0.00 113 N 7.52 5.03 0.00 2.61 2.59 0.00 0.00 6.83 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 S 7.83 4.33 0.00 3.93 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00