NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 K 4.3211 8.3149 120.1397 56.1025 33.5194 175.4014 7 L 4.3682 8.2774 122.1506 53.1654 42.6150 174.4512 8 H 5.0519 9.1271 116.2269 54.2263 32.4971 172.5821 9 K 4.6108 8.5349 119.1388 55.9454 33.4660 176.0383 10 E 4.9655 8.8954 121.9754 53.7964 33.8421 173.6822 11 P 5.0005 0.0000 0.0000 63.3042 32.4938 174.8201 12 A 4.8816 8.2398 121.3627 51.5439 23.0751 175.5721 13 T 4.6490 8.5132 115.0932 61.4312 72.1745 173.8623 14 L 4.2998 8.6617 128.0437 55.7228 42.4564 175.4275 15 I 4.3651 8.3342 126.0893 61.9090 38.9133 175.8585 16 K 4.4391 7.5650 119.2901 55.5568 35.4030 173.5178 17 A 4.6359 8.7429 129.9704 51.7225 19.7977 176.7850 18 I 4.2067 8.3708 122.6109 62.6736 38.5964 174.8366 19 D 4.6341 7.9891 117.4624 52.9125 44.2942 175.6037 20 G 3.6764 8.7734 108.8034 47.8028 0.0000 173.9808 21 D 4.8896 8.0783 116.8554 53.1286 40.4598 175.3431 22 T 5.2134 7.7984 116.6664 62.3360 72.9463 173.3316 23 V 4.8226 8.7830 118.0693 59.5855 36.7124 174.0223 24 K 5.0361 9.3590 126.1768 55.3122 33.8058 175.3294 25 L 5.3163 9.4210 126.4930 53.3012 46.9656 175.2062 26 M 4.9924 9.2353 121.1737 54.5980 33.7111 173.9093 27 Y 4.9577 8.9474 128.5859 55.9738 41.5928 175.8239 28 K 3.5658 9.3961 126.6947 57.5912 29.7244 176.0679 29 G 3.9697 8.7900 103.2849 45.5671 0.0000 173.6531 30 Q 4.6469 7.8776 116.9296 53.3723 32.1311 172.6972 31 P 4.9383 0.0000 0.0000 63.1620 32.1159 175.6077 32 M 4.9287 9.5490 123.1317 54.2221 37.2752 173.8431 33 T 4.8608 8.4073 117.8810 62.3096 70.9365 173.5570 34 F 5.0535 9.4406 125.3259 55.5897 42.4447 174.3131 35 R 5.0230 8.8191 123.8652 54.2446 32.1025 175.0831 36 L 4.2093 8.6670 127.5761 54.6978 41.9449 177.2961 37 L 3.9496 8.5231 124.6796 55.6867 42.7311 178.1240 38 L 3.7513 8.8921 120.2077 55.3037 39.6419 174.1208 39 V 5.0255 7.2729 110.6761 59.5446 35.2975 174.9356 40 D 5.0002 9.2376 123.0840 52.9102 43.6151 175.1512 41 T 4.6380 8.4023 113.4969 58.9204 71.5424 172.7320 42 P 4.4363 0.0000 0.0000 62.7189 32.2872 175.5082 43 E 4.8604 9.1942 120.4531 54.9455 32.3653 177.0867 44 T 4.2306 8.3441 109.6986 62.2264 70.3727 175.4697 45 K 4.5300 7.8349 119.6359 55.1248 32.2778 174.4752 46 H 4.6996 8.8171 122.1303 54.9732 31.2049 173.4617 47 P 4.2097 0.0000 0.0000 65.6459 31.4517 177.2267 48 K 4.3352 8.1946 114.4084 58.4107 32.8602 178.3149 49 K 4.0901 8.0055 115.6571 56.9273 34.1374 179.5490 50 G 3.7022 8.8152 109.7698 46.3378 0.0000 175.8366 51 V 4.5832 8.7251 128.7019 61.0672 32.7629 174.1521 52 E 4.3550 9.0579 128.7406 55.2530 31.2767 176.2065 53 K 4.1433 8.2917 122.7736 57.9281 32.6962 176.7416 54 Y 4.2722 8.1428 122.9094 59.4169 36.0872 171.2439 55 G 3.6272 8.0545 107.4705 47.4229 0.0000 174.2668 56 P 4.3253 0.0000 0.0000 64.8987 31.4275 178.6951 57 E 3.9925 8.1555 116.8094 59.4832 29.5723 179.0406 58 A 4.0525 8.2507 120.9237 55.1452 18.4118 179.6150 59 S 4.1257 8.3167 111.4789 61.5747 62.5056 176.3295 60 A 4.0434 8.2881 123.5813 54.8513 18.0979 179.3640 61 F 3.9475 8.3981 119.2262 61.8372 39.5425 177.4212 62 T 3.9305 8.1269 115.3132 66.4767 68.2002 176.3776 63 K 3.8454 7.9919 121.3789 59.5069 32.3734 178.6557 64 K 3.8311 8.0429 119.7559 59.6134 31.8514 178.3623 65 M 3.8596 7.6008 117.3159 58.7870 31.9819 178.3159 66 V 3.8046 7.7617 112.4378 64.1484 31.5813 178.5145 67 E 3.9830 8.2844 117.7767 58.9819 29.4138 177.4279 68 N 4.6340 7.8361 112.9781 52.9699 38.9811 175.1178 69 A 4.5053 7.3119 121.3229 51.7213 19.3746 178.1146 70 K 4.2285 8.8728 120.5043 58.2353 32.8643 178.1600 71 K 4.6691 8.5248 117.7230 54.5928 36.1510 175.6236 72 I 4.9458 8.4173 124.9724 59.6465 39.9816 174.4468 73 E 5.0797 9.1599 124.8236 54.6774 34.0649 174.9263 74 V 4.6768 8.8095 115.8640 59.4640 35.1891 174.6213 75 E 4.9545 8.9096 124.7483 54.3630 31.9724 175.1273 76 F 4.6618 8.7915 125.6437 57.5972 40.1468 175.7876 77 D 4.9738 8.4109 120.3082 53.5588 43.2110 175.7681 78 K 4.3017 8.8713 116.8715 58.1073 33.1181 178.1925 79 G 4.1686 8.0948 111.2495 44.4525 0.0000 173.4803 80 Q 4.0797 8.6042 120.9247 56.7186 29.2076 176.8576 81 R 4.4960 8.4029 117.6813 56.5646 31.1216 176.0986 82 T 5.0406 7.3985 107.0922 59.7620 72.0354 173.3576 83 D 4.8010 8.5759 123.6241 51.6723 41.6608 177.1001 84 K 3.8817 8.4244 117.1593 59.7355 32.4488 177.0599 85 Y 4.2541 8.0917 115.4438 57.7071 38.0449 176.0661 86 G 3.9025 8.2280 108.1698 45.5331 0.0000 173.6692 87 R 4.3870 8.3619 119.5154 54.8361 31.6619 176.4930 88 G 3.4790 8.3116 111.0928 46.1461 0.0000 172.3982 89 L 5.2883 8.7295 123.9105 53.1466 43.3905 175.6108 90 A 4.3890 8.2578 123.5390 51.2792 23.7072 173.8909 91 Y 4.8902 8.6524 117.2563 56.9723 39.8198 175.3010 92 I 4.7039 8.6471 125.3949 59.8575 39.7328 174.1994 93 Y 5.1274 9.1549 124.4239 56.0524 41.0650 174.5748 94 A 4.9099 9.0451 126.0147 50.1010 21.3989 176.1152 95 D 4.4874 9.8208 124.5756 56.0725 39.0112 175.6232 96 G 4.0219 8.5433 106.6901 45.1713 0.0000 173.8387 97 K 4.4655 7.8234 120.1450 55.0213 33.5390 175.4942 98 M 4.0185 8.4617 123.4208 54.9776 33.1291 177.0282 99 V 3.6247 8.7180 127.2955 66.0441 31.2606 177.5666 100 N 4.2887 8.0791 115.8110 56.5218 38.4040 176.8125 101 E 3.9443 8.0877 119.7373 59.0715 29.7034 178.2328 102 A 4.0672 7.9987 120.9006 55.3286 18.4412 179.6352 103 L 3.5294 7.9136 117.2388 57.7901 41.7087 179.9684 104 V 3.7462 7.4048 117.0702 66.0826 31.2917 178.0646 105 R 3.9455 8.1758 117.5963 59.0025 29.9423 177.4721 106 Q 4.3394 7.5634 115.3362 54.8521 29.2189 175.8215 107 G 3.9106 8.0359 108.7203 46.9132 0.0000 174.7441 108 L 4.5479 7.5135 116.3188 53.5709 42.4580 176.2118 109 A 4.6147 7.3897 117.9471 51.1564 21.8842 176.2989 110 K 4.8842 8.5669 119.1762 54.2863 35.7910 175.9264 111 V 4.2571 8.7164 123.2957 62.8072 31.8443 176.0385 112 A 4.6118 8.6628 130.2549 50.9296 19.6021 176.8298 113 Y 4.0132 8.5786 119.9117 57.5725 37.7348 175.8542 114 V 3.7415 7.7136 126.2263 62.6680 32.4207 175.5755 115 A 4.3839 8.1230 126.8271 50.6037 21.5539 176.3915 116 A 4.2965 8.5408 126.5227 51.9256 18.9661 175.4236 117 P 4.5254 0.0000 0.0000 63.6892 32.4437 176.8677 118 N 4.9316 7.7953 119.0141 52.2665 37.2706 174.8509 119 N 5.1358 7.6195 111.4271 53.0390 39.0617 177.3138 120 T 3.8230 8.3380 117.9183 67.7978 68.7102 174.9513 121 H 4.8518 7.9407 116.5144 55.8266 29.1468 176.7792 122 E 3.9375 8.3780 122.7997 59.7218 29.3720 178.8375 123 Q 3.9774 8.0775 117.4323 59.2191 28.6762 178.1534 124 H 4.1137 8.2346 118.6375 59.4790 29.9493 177.1787 125 L 3.9911 8.0151 120.6620 57.6849 41.4186 179.6620 126 R 3.9554 8.2424 118.3137 59.0613 30.0680 179.2319 127 K 3.9386 8.0103 118.3780 59.6174 32.0708 179.6290 128 S 4.1036 7.7824 115.4898 61.4223 62.6386 176.3832 129 E 3.9484 8.3521 121.9554 59.1217 29.3873 178.6846 130 A 3.7549 8.0521 120.9521 55.0445 18.4123 179.4483 131 Q 3.8046 7.9491 117.5566 59.2361 29.2227 178.2346 132 A 4.0268 8.0326 121.8230 54.9365 18.3306 179.8236 133 K 3.1547 7.7258 117.0164 59.2843 31.8439 179.2891 134 K 3.7512 7.5983 118.3467 59.4727 32.1312 177.7065 135 E 4.2092 8.0838 115.5643 55.3963 30.3801 176.1504 136 K 4.0597 7.8672 117.8251 57.2861 30.3312 175.4914 137 L 4.3764 8.0129 118.1154 55.2540 44.3853 178.9134 138 N 3.6286 9.4047 118.0413 54.2697 38.5595 176.1672 139 I 2.9312 5.4200 124.0000 64.5129 37.9540 176.9855 140 W 4.8345 7.7860 117.7215 56.4789 29.0391 176.5239 141 S 4.4694 8.0155 119.8595 58.6229 62.6239 173.9358 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 6 K 8.31 4.32 0.00 1.78 1.84 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.36 1.49 7.81 7 L 8.28 4.37 0.00 1.80 1.72 1.07 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 8 H 9.13 5.05 0.00 3.11 3.24 0.00 5.71 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 K 8.53 4.61 0.00 1.55 1.65 0.00 1.40 0.00 0.00 1.47 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.02 1.22 7.81 10 E 8.90 4.97 0.00 2.07 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 0.00 2.32 2.20 0.00 11 P 0.00 5.00 0.00 2.09 2.06 0.00 3.85 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 2.02 1.99 0.00 12 A 8.24 4.88 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 13 T 8.51 4.65 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 14 L 8.66 4.30 0.00 1.63 1.57 0.92 1.00 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 15 I 8.33 4.37 2.07 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 1.15 0.80 0.94 0.00 0.00 16 K 7.56 4.44 0.00 1.79 1.60 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.85 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.37 1.40 7.81 17 A 8.74 4.64 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 18 I 8.37 4.21 2.01 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 1.31 0.69 0.91 0.00 0.00 19 D 7.99 4.63 0.00 2.67 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 G 8.77 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 0.00 0.00 0.00 21 D 8.08 4.89 0.00 2.85 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 22 T 7.80 5.21 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 1.28 0.00 0.00 23 V 8.78 4.82 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 0.70 0.00 0.00 0.95 0.00 0.00 24 K 9.36 5.04 0.00 1.83 1.79 0.00 1.60 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.61 7.81 25 L 9.42 5.32 0.00 1.68 1.63 0.30 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 26 M 9.24 4.99 0.00 2.14 2.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.54 0.00 27 Y 8.95 4.96 0.00 3.29 3.08 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 28 K 9.40 3.57 0.00 1.45 1.64 0.00 1.52 0.00 0.00 1.54 0.00 0.00 2.91 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.01 0.27 7.81 29 G 8.79 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Q 7.88 4.65 0.00 2.16 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.37 6.94 0.00 0.00 0.00 0.00 0.00 2.46 2.45 0.00 31 P 0.00 4.94 0.00 2.00 2.08 0.00 3.69 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 2.06 2.16 0.00 32 M 9.55 4.93 0.00 1.68 2.13 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.52 0.00 33 T 8.41 4.86 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 1.22 0.00 0.00 34 F 9.44 5.05 0.00 3.08 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 35 R 8.82 5.02 0.00 1.90 1.78 0.00 3.14 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 36 L 8.67 4.21 0.00 1.57 1.61 0.94 1.17 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 37 L 8.52 3.95 0.00 1.21 1.26 0.21 0.35 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 38 L 8.89 3.75 0.00 2.00 1.86 1.13 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 39 V 7.27 5.03 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 0.95 0.00 0.00 40 D 9.24 5.00 0.00 2.54 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 T 8.40 4.64 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 42 P 0.00 4.44 0.00 2.22 2.15 0.00 3.52 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.06 0.00 43 E 9.19 4.86 0.00 2.10 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 2.21 2.40 0.00 44 T 8.34 4.23 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 45 K 7.83 4.53 0.00 1.82 1.82 0.00 1.55 0.00 0.00 1.61 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.35 7.81 46 H 8.82 4.70 0.00 3.16 3.41 0.00 5.63 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.21 0.00 2.02 2.10 0.00 3.40 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.06 0.00 48 K 8.19 4.34 0.00 1.82 1.87 0.00 1.78 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.40 1.47 7.81 49 K 8.01 4.09 0.00 1.35 1.72 0.00 1.71 0.00 0.00 1.51 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.32 1.17 7.81 50 G 8.82 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.73 4.58 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 0.82 0.00 0.00 1.00 0.00 0.00 52 E 9.06 4.36 0.00 1.94 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 2.24 2.22 0.00 53 K 8.29 4.14 0.00 1.70 1.71 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.76 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.87 1.22 7.81 54 Y 8.14 4.27 0.00 3.21 3.07 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 55 G 8.05 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 P 0.00 4.33 0.00 2.15 2.11 0.00 3.57 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 2.08 2.16 0.00 57 E 8.16 3.99 0.00 2.40 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 2.55 2.51 0.00 58 A 8.25 4.05 1.32 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 0.00 0.00 0.00 0.00 0.00 0.00 59 S 8.32 4.13 0.00 4.01 4.05 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 60 A 8.29 4.04 1.44 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 0.00 0.00 0.00 61 F 8.40 3.95 0.00 3.31 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 62 T 8.13 3.93 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 1.24 0.00 0.00 63 K 7.99 3.85 0.00 1.98 1.97 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.56 1.45 7.81 64 K 8.04 3.83 0.00 1.89 1.73 0.00 1.52 0.00 0.00 1.44 0.00 0.00 2.82 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.48 1.52 7.81 65 M 7.60 3.86 0.00 1.95 1.83 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.51 0.00 66 V 7.76 3.80 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 0.83 0.00 0.00 1.00 0.00 0.00 67 E 8.28 3.98 0.00 2.01 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 2.33 2.38 0.00 68 N 7.84 4.63 0.00 2.78 2.81 0.00 0.00 7.00 6.76 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 69 A 7.31 4.51 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 70 K 8.87 4.23 0.00 1.93 1.87 0.00 1.64 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.40 7.81 71 K 8.52 4.67 0.00 1.66 1.64 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.39 7.81 72 I 8.42 4.95 2.00 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 1.32 1.47 0.84 0.00 0.00 73 E 9.16 5.08 0.00 1.89 1.74 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 2.20 2.25 0.00 74 V 8.81 4.68 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.55 0.00 0.00 75 E 8.91 4.95 0.00 2.18 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.39 0.00 76 F 8.79 4.66 0.00 3.03 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 77 D 8.41 4.97 0.00 2.65 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 78 K 8.87 4.30 0.00 1.78 1.88 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.44 7.81 79 G 8.09 4.17 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 0.00 0.00 0.00 0.00 0.00 0.00 80 Q 8.60 4.08 0.00 2.15 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.93 6.79 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 81 R 8.40 4.50 0.00 1.60 1.45 0.00 2.88 0.00 0.00 3.08 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.61 0.00 82 T 7.40 5.04 4.19 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 1.13 0.00 0.00 83 D 8.58 4.80 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 84 K 8.42 3.88 0.00 1.60 1.83 0.00 1.23 0.00 0.00 1.54 0.00 0.00 2.96 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.20 0.54 7.81 85 Y 8.09 4.25 0.00 3.10 3.02 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 86 G 8.23 3.90 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 0.00 0.00 0.00 87 R 8.36 4.39 0.00 2.04 1.80 0.00 3.12 0.00 0.00 3.13 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 88 G 8.31 3.48 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 0.00 0.00 0.00 89 L 8.73 5.29 0.00 1.54 1.60 0.93 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.26 4.39 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Y 8.65 4.89 0.00 3.00 2.65 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 92 I 8.65 4.70 1.78 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.77 0.85 0.00 0.00 93 Y 9.15 5.13 0.00 2.78 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 94 A 9.05 4.91 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 D 9.82 4.49 0.00 2.81 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 96 G 8.54 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 0.00 0.00 0.00 97 K 7.82 4.47 0.00 2.02 1.76 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.40 7.81 98 M 8.46 4.02 0.00 1.89 1.53 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 2.40 0.00 99 V 8.72 3.62 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 1.03 0.00 0.00 0.94 0.00 0.00 100 N 8.08 4.29 0.00 2.89 2.94 0.00 0.00 6.77 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 E 8.09 3.94 0.00 1.98 1.92 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 2.29 2.28 0.00 102 A 8.00 4.07 1.63 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 0.00 0.00 103 L 7.91 3.53 0.00 1.85 1.63 1.00 0.78 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 0.00 104 V 7.40 3.75 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 1.10 0.00 0.00 0.97 0.00 0.00 105 R 8.18 3.95 0.00 2.02 2.08 0.00 3.33 0.00 0.00 3.20 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 106 Q 7.56 4.34 0.00 1.58 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.36 0.00 0.00 0.00 0.00 0.00 2.36 1.96 0.00 107 G 8.04 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 0.00 108 L 7.51 4.55 0.00 1.35 1.49 0.55 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.39 4.61 1.13 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 0.00 0.00 0.00 0.00 0.00 0.00 110 K 8.57 4.88 0.00 1.72 1.80 0.00 1.62 0.00 0.00 1.67 0.00 0.00 2.24 0.00 0.00 2.47 0.00 0.00 0.00 0.00 1.34 1.16 7.81 111 V 8.72 4.26 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 0.79 0.00 0.00 0.97 0.00 0.00 112 A 8.66 4.61 1.31 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 0.00 0.00 0.00 113 Y 8.58 4.01 0.00 2.97 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 0.00 114 V 7.71 3.74 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 1.06 0.00 0.00 115 A 8.12 4.38 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 0.00 116 A 8.54 4.30 1.31 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 0.00 0.00 0.00 117 P 0.00 4.53 0.00 2.21 2.19 0.00 3.77 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 118 N 7.80 4.93 0.00 2.75 2.83 0.00 0.00 6.75 8.00 0.00 0.00 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 N 7.62 5.14 0.00 2.85 2.95 0.00 0.00 6.09 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 0.00 120 T 8.34 3.82 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 1.10 0.00 0.00 121 H 7.94 4.85 0.00 2.92 3.13 0.00 5.63 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 E 8.38 3.94 0.00 2.16 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 0.00 2.31 2.37 0.00 123 Q 8.08 3.98 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.66 0.00 0.00 0.00 0.00 0.00 2.46 2.37 0.00 124 H 8.23 4.11 0.00 3.21 3.49 0.00 5.86 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 0.00 125 L 8.02 3.99 0.00 1.90 1.71 1.03 1.01 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 0.00 126 R 8.24 3.96 0.00 1.94 1.95 0.00 3.11 0.00 0.00 3.15 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.75 0.00 127 K 8.01 3.94 0.00 1.95 1.81 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.60 7.81 128 S 7.78 4.10 0.00 3.88 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 0.00 129 E 8.35 3.95 0.00 2.16 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 2.18 2.54 0.00 130 A 8.05 3.75 1.30 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 0.00 0.00 0.00 131 Q 7.95 3.80 0.00 2.16 2.21 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 2.32 2.48 0.00 132 A 8.03 4.03 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 0.00 133 K 7.73 3.15 0.00 1.49 1.39 0.00 1.11 0.00 0.00 1.02 0.00 0.00 2.51 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.21 7.81 134 K 7.60 3.75 0.00 1.84 1.96 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.41 1.44 7.81 135 E 8.08 4.21 0.00 1.99 1.97 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 2.30 2.46 0.00 136 K 7.87 4.06 0.00 1.91 1.92 0.00 1.71 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.40 7.81 137 L 8.01 4.38 0.00 1.81 1.68 0.94 0.78 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 0.00 138 N 9.40 3.63 0.00 2.63 1.74 0.00 0.00 7.13 7.30 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 0.00 139 I 5.42 2.93 1.07 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 -0.11 -0.44 0.00 0.00 140 W 7.79 4.83 0.00 3.20 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 0.00 141 S 8.02 4.47 0.00 4.02 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