NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.2854 8.3044 118.1987 53.7869 33.5868 173.9475 1 E 3.3754 8.0072 119.4944 56.2117 26.7560 171.3060 2 Q 4.8749 8.4608 119.8989 55.0642 31.6468 177.2545 3 L 4.6790 8.6500 124.2981 54.3160 43.6079 175.9651 4 T 4.4499 8.9196 110.8520 60.2055 71.0329 175.9770 5 K 3.4238 8.6142 122.5483 59.9705 32.2323 179.5104 6 C 4.3346 8.0412 116.1626 59.8915 41.1832 175.7973 7 E 3.9184 7.9492 120.1345 59.3884 29.0796 179.5277 8 V 3.4781 7.7346 118.3321 65.8640 31.3051 177.7386 9 F 4.0686 8.2485 119.6464 61.5049 39.1310 176.8505 10 Q 4.1591 8.1729 117.2075 58.8061 28.3646 178.6467 11 K 4.1270 8.1392 118.6964 58.5680 32.3858 178.3724 12 L 4.3151 7.7500 117.7803 54.0953 41.6621 178.1769 13 K 3.7201 7.3443 121.6057 59.7555 32.0805 178.0780 14 D 4.4275 7.8751 115.3446 56.1028 40.8612 176.9122 15 L 3.9052 7.9531 119.2232 54.4251 42.1334 175.9733 16 K 3.9249 7.5159 120.1244 58.0881 32.0892 176.0619 17 D 4.6190 9.3283 124.8270 54.5961 39.6032 173.2054 18 Y 4.1135 8.5203 122.8585 58.7569 38.9454 176.5085 19 G 3.3771 8.6664 114.5006 45.9717 0.0000 174.0206 20 G 3.7746 8.3600 106.6158 45.0623 0.0000 173.7857 21 V 3.8982 7.6021 120.8972 60.9132 32.1863 175.9546 22 S 4.7831 8.2784 122.5780 57.8925 64.9877 174.8634 23 L 4.1295 8.5017 124.0603 57.9970 41.9800 177.2096 24 P 4.5622 0.0000 0.0000 66.2650 30.9603 177.8356 25 E 3.7454 7.9715 118.1999 58.6552 29.4521 178.8630 26 W 4.0995 7.9071 118.9481 59.5779 29.0989 178.6801 27 V 3.7107 8.0215 118.4158 66.0448 30.9137 177.3145 28 C 2.4500 7.4829 118.1779 58.8486 44.2139 175.6467 29 V 3.4101 7.6259 119.6498 65.8464 31.0775 177.8008 30 A 3.7605 8.0328 120.4175 55.1340 18.2586 179.4004 31 F 3.4575 8.2292 119.1123 61.5111 39.2116 176.7900 32 H 3.9623 8.3480 117.4026 59.1212 29.6944 176.7004 33 T 4.2742 7.9384 110.7199 63.1670 69.5483 175.5203 34 S 4.4121 7.8016 112.2221 56.4049 64.6831 174.4506 35 G 2.9893 8.3382 108.6734 46.9285 0.0000 174.2225 36 Y 3.7705 7.9327 114.0010 58.0448 35.5092 168.6741 37 D 4.9528 7.8616 121.4940 53.3422 40.3707 176.8449 38 T 4.0187 8.3420 117.6488 63.5408 69.6814 175.6064 39 Q 4.7923 8.3399 120.0204 55.5097 29.8770 175.5936 40 A 4.2273 7.9991 122.4699 52.1619 19.5547 177.5339 41 I 4.8788 8.2128 122.0169 59.4702 40.9252 175.0315 42 V 4.3770 8.5499 126.2715 60.9300 35.0415 173.9527 43 Q 4.4982 8.7177 128.8836 55.7050 29.9808 174.8053 44 N 4.9426 9.4745 125.1981 51.0454 41.3414 175.2511 45 N 4.4030 8.7879 116.1893 56.6801 38.4569 176.2616 46 D 4.7788 7.6670 112.9772 52.5070 40.7276 174.0728 47 S 4.6493 7.5691 112.3472 58.8883 66.9602 173.9403 48 T 5.0204 8.8583 116.7348 61.8520 71.1055 173.4956 49 E 5.3641 9.2651 125.1339 54.9052 32.6214 174.5587 50 Y 4.9963 9.0572 121.0665 57.3963 41.7219 177.7427 51 G 4.3648 9.1996 112.1258 44.0057 0.0000 173.3573 52 L 4.2806 8.6283 118.6811 57.2772 41.8536 178.6263 53 F 4.7842 8.0887 113.2598 56.6091 39.8080 175.5314 54 Q 3.4570 7.9462 119.2472 57.0301 26.6078 174.2287 55 I 4.4000 8.1138 119.3516 61.0389 39.1063 177.4525 56 N 6.0740 9.7770 124.8339 51.6253 39.2773 174.8502 57 N 5.5334 8.9072 116.9463 52.8009 37.8081 175.1767 58 K 4.2813 8.2700 122.6212 58.1393 33.8980 177.6519 59 I 3.8336 7.6587 118.6025 62.1621 39.8470 178.1975 60 W 4.4571 7.9426 121.0302 58.4071 29.9071 174.6174 61 C 5.7947 8.3372 110.9464 53.4927 45.3981 172.5060 62 K 5.0609 8.7227 120.3978 54.7594 34.3870 174.5860 63 D 5.0765 8.3548 125.2784 51.5500 42.4139 174.7972 64 D 4.4968 8.8656 116.9798 56.6720 39.6923 177.7740 65 Q 4.1062 8.3350 117.9467 58.1346 29.1506 175.8929 66 N 4.8402 8.7604 118.4151 50.8931 38.8772 172.4949 67 P 4.5250 0.0000 0.0000 63.8008 31.8110 176.8072 68 H 4.7334 8.0223 114.7320 55.3867 28.9278 175.4314 69 S 4.3009 7.6357 114.8051 58.4673 62.5119 174.6227 70 R 3.7969 8.1457 126.9369 57.4130 30.6435 175.6886 71 N 4.2872 8.0828 116.5304 54.6250 37.7914 175.2641 72 I 3.7188 7.7520 119.6185 64.7663 37.6941 177.4449 73 C 4.5090 8.6531 115.3131 56.8816 40.8672 172.6865 74 N 4.0828 7.9288 117.9556 53.5081 37.3095 172.5421 75 I 4.2996 8.0527 117.6968 59.8955 42.1936 172.9939 76 S 4.6634 8.1473 119.3671 57.7950 63.2312 175.8234 77 C 3.8476 8.5351 125.3927 59.8203 34.3421 175.9777 78 D 4.3645 7.7050 119.7352 55.7009 38.5995 178.0787 79 K 4.1352 7.3843 118.8417 57.9237 31.9250 177.2549 80 F 5.3114 8.0228 117.6138 56.6908 39.0144 176.6971 81 L 4.9323 7.8696 119.4278 54.5512 42.4179 176.1435 82 D 4.8994 7.7600 118.7619 52.2773 41.7732 175.3429 83 D 4.4902 8.5240 116.9184 55.3291 41.3830 175.9498 84 D 4.6142 8.0269 119.6402 53.1947 40.8981 176.3363 85 L 4.6595 8.2743 127.6149 54.8559 41.7788 178.6929 86 T 3.8333 7.9531 117.7081 66.8415 68.4768 176.0361 87 D 4.4743 8.1128 120.3352 56.2168 39.6676 178.0465 88 D 4.2452 8.2983 119.9828 57.4695 40.9250 178.6598 89 I 3.3925 7.9003 120.2415 64.1433 36.5101 178.7025 90 V 3.3791 7.4779 118.8515 66.0535 31.3644 177.3528 91 C 4.2302 8.2263 118.0526 59.5205 44.5533 175.2836 92 A 3.6542 7.9586 122.7965 54.9806 17.6505 179.8052 93 K 3.7915 7.5913 117.0056 59.4029 32.0103 179.7343 94 K 3.9833 7.5672 118.0878 59.3368 31.9359 179.5621 95 I 2.5913 7.1380 120.0209 63.8324 36.8703 178.1043 96 L 4.1047 8.0698 121.2388 58.4282 41.7159 178.7516 97 D 4.4349 8.2554 117.8109 57.3070 40.8583 178.4818 98 K 4.3292 8.0655 117.5231 58.1944 32.5675 178.2019 99 V 4.2400 8.5252 109.4413 60.2430 33.8759 176.3539 100 G 3.9921 7.9253 105.8123 44.4915 0.0000 174.1046 101 I 4.1034 8.1533 117.2761 63.5019 37.9531 176.8507 102 N 5.3646 8.0217 115.1172 54.6030 38.6819 175.3279 103 Y 3.9178 7.7409 119.5939 59.7405 38.9511 176.6152 104 W 4.6770 8.2024 117.4443 57.3054 30.6443 176.3230 105 L 4.7088 8.1398 118.5087 52.4512 43.0175 177.3749 106 A 3.9976 8.7021 126.6330 55.1142 18.8856 177.6476 107 H 4.8398 7.8377 112.7160 53.9943 32.8050 174.6095 108 K 3.9230 8.9339 123.6060 59.5185 32.5765 178.8224 109 A 4.6210 7.9448 121.0234 54.3118 18.5324 178.2416 110 L 4.1623 7.9414 115.6414 57.6955 41.6588 177.4785 111 C 4.9597 7.9950 111.2365 56.5201 40.0000 174.0604 112 S 4.6852 8.2276 115.0605 57.9189 62.8075 173.3825 113 E 4.8873 7.6018 118.3296 55.7227 33.9103 174.9795 114 K 3.8849 8.6847 117.6760 57.4267 29.8857 176.9296 115 L 4.4874 7.7558 119.1522 57.8289 41.5591 178.4924 116 D 4.3820 8.2991 117.7931 56.8474 40.8658 177.5227 117 Q 3.9669 7.4301 115.3959 57.4457 28.8586 176.9916 118 W 4.7939 7.8939 119.9664 55.6901 29.9089 175.6803 119 L 3.9888 7.0025 119.7871 53.3603 42.0462 175.7039 120 C 4.2030 6.9969 123.5211 56.1470 41.6965 173.1257 121 E 3.8356 8.6647 127.7557 59.3051 29.3043 178.4285 122 K 4.3906 7.8848 116.0099 56.3016 32.1134 176.7318 123 L 4.3246 7.3349 124.9763 54.9075 41.8550 176.3189 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 0 M 8.30 4.29 0.00 2.16 2.68 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.56 0.00 1 E 8.01 3.38 0.00 2.28 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 2.28 2.36 0.00 2 Q 8.46 4.87 0.00 2.06 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.82 6.74 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 3 L 8.65 4.68 0.00 1.45 1.68 0.89 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.92 4.45 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 5 K 8.61 3.42 0.00 1.94 1.85 0.00 1.72 0.00 0.00 2.04 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.71 1.85 7.81 6 C 8.04 4.33 0.00 2.98 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 7 E 7.95 3.92 0.00 2.07 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 2.29 0.00 8 V 7.73 3.48 1.90 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 0.98 0.00 0.00 0.56 0.00 0.00 9 F 8.25 4.07 0.00 3.22 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 10 Q 8.17 4.16 0.00 2.35 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.48 2.68 0.00 11 K 8.14 4.13 0.00 1.72 1.83 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.62 7.81 12 L 7.75 4.32 0.00 1.58 1.51 0.98 0.67 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 13 K 7.34 3.72 0.00 1.91 1.74 0.00 1.58 0.00 0.00 1.60 0.00 0.00 2.85 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.32 1.54 7.81 14 D 7.88 4.43 0.00 2.55 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 15 L 7.95 3.91 0.00 1.14 0.25 -0.25 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 16 K 7.52 3.92 0.00 1.76 1.80 0.00 1.88 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.51 1.49 7.81 17 D 9.33 4.62 0.00 3.04 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 Y 8.52 4.11 0.00 3.09 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 19 G 8.67 3.38 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 0.00 20 G 8.36 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 21 V 7.60 3.90 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 -0.20 0.00 0.00 0.66 0.00 0.00 22 S 8.28 4.78 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 23 L 8.50 4.13 0.00 1.75 1.72 0.78 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 24 P 0.00 4.56 0.00 2.51 2.60 0.00 3.78 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.21 0.00 25 E 7.97 3.75 0.00 1.93 1.89 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 1.78 2.06 0.00 26 W 7.91 4.10 0.00 3.63 3.13 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 27 V 8.02 3.71 2.44 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 1.39 0.00 0.00 1.23 0.00 0.00 28 C 7.48 2.45 0.00 1.23 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 V 7.63 3.41 2.16 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 0.69 0.00 0.00 0.68 0.00 0.00 30 A 8.03 3.76 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 31 F 8.23 3.46 0.00 2.80 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 H 8.35 3.96 0.00 3.18 3.49 0.00 5.99 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 T 7.94 4.27 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 34 S 7.80 4.41 0.00 3.94 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 G 8.34 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 0.00 0.00 0.00 36 Y 7.93 3.77 0.00 3.34 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 37 D 7.86 4.95 0.00 2.72 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 8.34 4.02 4.45 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 0.00 0.00 0.00 1.23 0.00 0.00 39 Q 8.34 4.79 0.00 2.14 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.86 0.00 0.00 0.00 0.00 0.00 2.53 2.33 0.00 40 A 8.00 4.23 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 41 I 8.21 4.88 1.77 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 1.02 0.85 0.49 0.00 0.00 42 V 8.55 4.38 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 0.77 0.00 0.00 0.95 0.00 0.00 43 Q 8.72 4.50 0.00 2.05 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.56 0.00 0.00 0.00 0.00 0.00 2.31 2.43 0.00 44 N 9.47 4.94 0.00 2.97 2.71 0.00 0.00 6.54 6.80 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 45 N 8.79 4.40 0.00 2.69 2.90 0.00 0.00 6.60 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 46 D 7.67 4.78 0.00 2.72 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 S 7.57 4.65 0.00 4.19 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 48 T 8.86 5.02 4.36 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 0.00 0.00 0.00 0.84 0.00 0.00 49 E 9.27 5.36 0.00 2.06 2.02 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 2.30 2.26 0.00 50 Y 9.06 5.00 0.00 3.13 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 51 G 9.20 4.36 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 L 8.63 4.28 0.00 1.48 1.43 0.89 0.18 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 53 F 8.09 4.78 0.00 3.11 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Q 7.95 3.46 0.00 2.40 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.74 6.83 0.00 0.00 0.00 0.00 0.00 2.53 2.63 0.00 55 I 8.11 4.40 1.84 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.57 1.00 0.00 0.00 56 N 9.78 6.07 0.00 3.02 3.36 0.00 0.00 6.57 7.11 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 57 N 8.91 5.53 0.00 2.96 3.24 0.00 0.00 6.25 7.13 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 58 K 8.27 4.28 0.00 1.90 1.85 0.00 1.67 0.00 0.00 1.82 0.00 0.00 2.78 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.40 1.45 7.81 59 I 7.66 3.83 0.87 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.82 -0.35 0.00 0.00 60 W 7.94 4.46 0.00 3.67 3.31 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 61 C 8.34 5.79 0.00 3.17 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 62 K 8.72 5.06 0.00 1.87 1.62 0.00 1.55 0.00 0.00 1.87 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.31 1.38 7.81 63 D 8.35 5.08 0.00 2.65 2.46 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 0.00 0.00 0.00 0.00 64 D 8.87 4.50 0.00 2.80 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 Q 8.33 4.11 0.00 2.23 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.16 0.00 0.00 0.00 0.00 0.00 2.42 2.43 0.00 66 N 8.76 4.84 0.00 2.75 2.83 0.00 0.00 7.27 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 P 0.00 4.52 0.00 2.10 2.08 0.00 3.63 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 1.99 2.09 0.00 68 H 8.02 4.73 0.00 3.39 3.30 0.00 5.87 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 S 7.64 4.30 0.00 4.17 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 R 8.15 3.80 0.00 1.62 1.91 0.00 3.28 0.00 0.00 3.05 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.48 0.00 71 N 8.08 4.29 0.00 2.93 2.72 0.00 0.00 7.02 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 72 I 7.75 3.72 1.76 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.50 1.09 0.00 0.00 73 C 8.65 4.51 0.00 3.44 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 N 7.93 4.08 0.00 2.83 2.82 0.00 0.00 6.85 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 75 I 8.05 4.30 1.83 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 0.84 0.78 0.75 0.00 0.00 76 S 8.15 4.66 0.00 3.78 3.57 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 77 C 8.54 3.85 0.00 2.08 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 78 D 7.71 4.36 0.00 2.88 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 K 7.38 4.14 0.00 1.45 1.77 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.30 1.45 7.81 80 F 8.02 5.31 0.00 3.30 3.13 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 81 L 7.87 4.93 0.00 1.87 1.78 1.15 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 82 D 7.76 4.90 0.00 2.78 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 83 D 8.52 4.49 0.00 2.70 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 D 8.03 4.61 0.00 2.68 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 85 L 8.27 4.66 0.00 1.77 1.69 0.95 0.89 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 86 T 7.95 3.83 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 1.18 0.00 0.00 87 D 8.11 4.47 0.00 3.09 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 D 8.30 4.25 0.00 3.00 2.93 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 0.00 0.00 0.00 89 I 7.90 3.39 1.93 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.74 0.56 0.00 0.00 90 V 7.48 3.38 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 0.96 0.00 0.00 0.91 0.00 0.00 91 C 8.23 4.23 0.00 3.19 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 92 A 7.96 3.65 0.46 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 0.00 0.00 0.00 0.00 0.00 0.00 93 K 7.59 3.79 0.00 1.62 1.28 0.00 1.18 0.00 0.00 0.76 0.00 0.00 2.13 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.30 1.00 7.81 94 K 7.57 3.98 0.00 1.95 1.92 0.00 1.79 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.48 7.81 95 I 7.14 2.59 1.34 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.66 0.00 0.00 96 L 8.07 4.10 0.00 2.32 2.15 1.15 1.50 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 97 D 8.26 4.43 0.00 2.94 2.80 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 98 K 8.07 4.33 0.00 2.13 2.13 0.00 1.63 0.00 0.00 1.83 0.00 0.00 3.18 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.70 1.64 7.81 99 V 8.53 4.24 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 0.90 0.00 0.00 0.98 0.00 0.00 100 G 7.93 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 0.00 101 I 8.15 4.10 1.88 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.31 0.93 0.00 0.00 102 N 8.02 5.36 0.00 2.76 2.84 0.00 0.00 7.23 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 0.00 103 Y 7.74 3.92 0.00 2.44 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 0.00 0.00 0.00 0.00 104 W 8.20 4.68 0.00 3.58 3.20 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 0.00 105 L 8.14 4.71 0.00 1.71 1.71 0.85 0.72 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 0.00 106 A 8.70 4.00 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 0.00 107 H 7.84 4.84 0.00 3.15 3.15 0.00 5.63 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 K 8.93 3.92 0.00 1.90 2.07 0.00 1.51 0.00 0.00 1.80 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.45 7.81 109 A 7.94 4.62 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 0.00 110 L 7.94 4.16 0.00 1.70 1.71 0.85 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 111 C 7.99 4.96 0.00 2.76 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 S 8.23 4.69 0.00 3.98 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 E 7.60 4.89 0.00 2.11 1.88 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 2.22 2.38 0.00 114 K 8.68 3.88 0.00 1.97 1.81 0.00 1.68 0.00 0.00 1.84 0.00 0.00 2.89 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.47 1.47 7.81 115 L 7.76 4.49 0.00 1.79 1.88 0.96 1.09 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 0.00 116 D 8.30 4.38 0.00 2.79 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 0.00 117 Q 7.43 3.97 0.00 1.90 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.61 0.00 0.00 0.00 0.00 0.00 2.01 1.16 0.00 118 W 7.89 4.79 0.00 3.51 3.42 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 0.00 119 L 7.00 3.99 0.00 1.67 1.36 1.18 0.99 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 0.00 120 C 7.00 4.20 0.00 2.67 2.41 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 0.00 121 E 8.66 3.84 0.00 2.04 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 0.00 2.31 2.28 0.00 122 K 7.88 4.39 0.00 1.71 1.79 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.93 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.36 7.81 123 L 7.33 4.32 0.00 1.69 1.52 0.94 0.82 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