NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3441 8.3049 120.3524 55.3510 32.8652 174.8366 2 K 4.2649 8.4798 118.8991 52.8830 33.4706 174.5051 3 T 4.2255 8.4469 114.9976 60.5583 70.8339 173.1429 4 F 4.2131 8.1864 124.0717 58.3026 40.3578 173.6971 5 T 3.2648 5.7900 110.0465 60.5768 69.2517 172.4196 6 A 4.0386 8.4406 132.4780 52.1111 18.4128 176.8906 7 K 4.0701 8.3789 121.4080 56.6258 32.7980 177.0556 8 P 4.1402 0.0000 0.0000 65.8074 31.7653 177.5449 9 E 3.9716 8.2798 118.7185 59.0853 29.6502 177.0871 10 T 4.3415 7.1367 117.9835 62.2749 67.2463 173.8901 11 V 4.6766 7.8156 119.2894 59.3602 35.7862 173.9664 12 K 4.0668 8.4062 118.3387 53.9653 33.9356 174.0443 13 R 3.6835 8.6544 135.0000 56.6460 28.1364 174.8377 14 D 5.3606 8.3047 122.9745 52.2022 44.7287 175.0576 15 W 5.8558 8.2606 116.9249 54.8594 32.9454 174.5674 16 Y 5.4014 8.5746 119.0143 55.5313 42.3401 174.1061 17 V 5.1091 8.4603 120.4511 61.5382 35.4490 175.0093 18 V 4.5060 8.1924 123.6880 60.7099 34.6290 172.6452 19 D 4.6408 8.9428 126.4129 53.0180 41.4001 176.8320 20 A 4.6078 8.2131 134.0151 51.7951 17.9194 176.5829 21 T 4.3423 7.0589 121.3325 65.8360 69.8717 178.2139 22 G 3.7096 7.8775 114.1372 48.0062 0.0000 173.9591 23 K 3.8333 8.1040 118.9745 57.5435 32.3770 177.4900 24 T 4.1133 8.4825 118.1735 63.5576 68.9769 171.7707 25 L 3.5381 8.5372 129.4258 55.1826 43.2136 173.4942 26 G 4.3242 8.8489 117.8556 46.6931 0.0000 176.3633 27 R 3.8796 7.6258 118.8670 58.0806 30.6947 178.9048 28 L 3.8438 7.9618 119.1397 57.9027 42.2383 178.1197 29 A 3.9309 8.0924 120.1896 55.6226 18.1269 178.7954 30 T 4.0182 8.1564 111.5233 65.8641 67.2417 175.7709 31 E 3.8952 7.8196 120.8008 58.9271 29.5256 178.7048 32 L 3.8758 8.0961 119.6075 57.5369 41.6371 178.7454 33 A 3.7676 8.9178 121.7348 55.5210 18.2049 179.7622 34 R 3.8234 8.2161 116.5281 59.8483 30.2351 179.5202 35 R 4.0929 7.6924 117.2646 58.8524 30.1180 178.8981 36 L 3.8542 8.4829 119.6604 57.3886 41.4030 178.6333 37 R 4.3320 7.6416 115.7487 55.3313 30.6517 176.0924 38 G 3.6823 7.9094 106.3000 47.3431 0.0000 175.1369 39 K 4.0737 8.2127 117.2492 56.9033 31.6533 176.5729 40 H 4.9404 7.8065 110.8056 55.1371 29.8114 174.4446 41 K 4.6802 7.5356 120.0960 56.2311 34.2078 177.0569 42 A 4.3348 8.2610 119.7565 52.5254 17.0263 177.9691 43 E 4.1214 7.9187 117.9372 56.0382 30.1611 174.6107 44 Y 3.9356 7.6291 119.9341 60.7025 38.8661 176.1923 45 T 4.7637 7.9544 135.0000 61.8471 68.8192 171.5781 46 P 4.3043 0.0000 0.0000 64.9465 32.0961 177.8652 47 H 4.5384 7.3688 115.5616 57.1789 29.1685 175.6954 48 V 4.4987 8.1760 117.4548 60.5154 34.2612 174.1571 49 D 4.6175 8.5421 124.2840 52.9659 40.1210 176.2332 50 T 4.4695 8.3463 112.3836 60.9955 69.3561 174.3195 51 G 4.0002 7.5577 108.6046 46.1804 0.0000 173.2552 52 D 4.7458 8.3588 121.0571 53.0102 42.8141 176.1020 53 Y 3.8848 7.8763 120.0050 58.1043 38.4296 174.7933 54 I 5.2664 8.3102 124.7872 58.9305 42.0408 174.0733 55 I 4.8667 8.5691 121.1958 59.3491 40.4014 176.1807 56 V 4.1909 7.9694 120.6247 61.0417 32.8813 173.8455 57 L 4.6749 8.5592 120.7548 56.1696 46.5439 176.6237 58 N 4.9873 7.8474 116.1176 52.3978 38.9628 176.6721 59 A 4.0358 8.2558 124.9927 55.5223 18.9352 179.9255 60 D 4.3883 8.2353 113.2009 56.0763 39.0737 177.5441 61 K 4.6095 7.8571 117.6730 55.7563 32.5458 176.3855 62 V 4.3019 8.0309 117.9851 60.2673 32.3975 175.1187 63 A 4.6277 8.0158 125.8048 50.8762 20.0898 177.6648 64 V 3.5339 8.3535 123.0424 63.5254 32.2464 175.0426 65 T 3.0335 7.5062 116.9506 60.7218 64.3378 170.7393 66 G 3.9493 7.1053 112.8309 45.0724 0.0000 170.1152 67 N 4.6650 8.3165 115.3272 53.9473 38.4908 175.1765 68 K 4.3844 7.9444 114.7975 56.1307 32.8085 178.0235 69 R 3.7836 7.8731 121.4877 59.3221 30.0267 177.3950 70 T 4.8955 7.7649 104.2380 61.2299 69.6758 173.4394 71 D 4.8681 7.9435 119.4117 54.5341 42.7253 176.7272 72 K 4.3270 8.0985 120.5003 56.1095 33.1848 174.6590 73 V 3.8127 7.2103 107.4626 60.7075 34.6759 173.9757 74 Y 3.7154 6.9361 119.1497 58.9095 34.7378 168.4084 75 Y 5.3636 7.7658 117.7484 56.4320 40.6638 174.7292 76 H 5.1055 9.0232 117.3895 54.3365 32.9801 171.9285 77 H 5.3209 8.9765 118.6209 53.3348 30.6109 172.8683 78 T 4.0148 8.6425 116.2039 66.1442 68.4250 174.5370 79 G 3.7664 7.8136 109.3439 45.0780 0.0000 172.2855 80 H 4.9927 7.2835 116.7458 54.4374 34.1636 175.8266 81 I 3.0463 7.8121 115.9859 60.5185 38.6754 176.4152 82 G 3.7209 9.6588 115.3566 49.2864 0.0000 173.6732 83 G 3.4503 7.9626 110.6054 45.9827 0.0000 172.3423 84 I 3.9053 7.4282 125.7216 61.0081 38.7606 174.5416 85 K 4.6779 9.1907 129.8582 54.6954 34.8480 175.6792 86 Q 5.1203 8.8403 123.9168 53.7292 32.3798 174.3681 87 A 5.2503 7.2000 128.7298 52.0758 22.7443 176.6917 88 T 4.1753 7.9860 116.5685 62.1120 68.6821 175.1438 89 F 3.8692 9.1856 129.1882 61.7269 39.5000 177.0216 90 E 4.0243 7.9886 118.5930 59.7149 29.5934 178.3815 91 E 4.1866 7.9658 117.3408 58.8899 29.3432 178.5342 92 M 3.8844 8.2709 119.2037 58.2018 31.6126 178.6527 93 I 3.6713 7.1662 118.6588 62.9660 38.5696 176.6924 94 A 4.2674 7.3997 124.5888 49.5224 17.1283 175.5963 95 R 4.0626 8.9305 113.6861 55.7147 30.6649 177.7863 96 R 3.4483 7.9484 119.4481 56.9296 26.5481 175.0369 97 P 4.3933 0.0000 0.0000 64.5176 30.4760 178.0913 98 E 3.9507 8.2339 118.5144 59.2274 29.3190 178.4473 99 R 4.1606 7.7099 116.3454 56.9000 30.4223 178.6688 100 V 3.6591 7.6608 119.0717 65.9709 31.3291 177.8568 101 I 3.9051 7.6645 117.8941 63.5246 36.8216 177.6833 102 E 4.1807 7.5746 120.7376 59.3163 29.3188 178.6374 103 I 4.0881 8.4581 112.8213 63.3417 37.6968 177.7210 104 A 4.1469 7.8500 122.2326 54.2103 18.5305 178.9142 105 V 4.0558 7.5156 115.6871 62.7170 31.8216 178.3168 106 K 4.3562 8.1299 120.9440 59.5434 32.0256 178.6324 107 G 3.5264 7.8588 106.4680 47.8691 0.0000 174.0358 108 M 4.3048 7.2430 118.2439 56.3434 32.9523 176.8219 109 L 4.3101 7.6860 118.5028 53.6068 43.0830 175.6109 110 P 4.6647 0.0000 0.0000 63.1546 34.3119 175.1671 111 K 3.8767 8.6312 117.1888 57.8845 30.7961 173.9408 112 G 4.2172 8.5817 105.2025 46.8895 0.0000 172.6517 113 P 4.4528 0.0000 0.0000 64.6169 31.8506 178.2784 114 L 4.3234 7.8550 118.8380 57.8781 42.0433 178.6353 115 G 4.1700 8.1181 106.6898 47.3532 0.0000 175.1628 116 R 4.1412 7.6507 120.3702 58.1915 29.8959 178.1854 117 A 4.1006 7.7698 120.0547 55.2130 18.6699 179.1798 118 M 4.0995 7.8964 117.1259 58.2443 32.1284 178.1502 119 F 3.8053 8.0994 120.6006 61.7317 39.3265 177.4338 120 R 4.1169 7.6180 115.5795 58.9264 30.0839 177.1687 121 K 4.5345 7.8872 117.4106 55.8910 31.9935 175.4879 122 L 5.1619 8.1267 121.0420 52.1206 43.8986 175.9876 123 K 4.6892 8.5282 125.1065 54.8631 34.4879 175.7142 124 V 4.1550 7.7534 116.5691 62.9472 33.5840 177.5988 125 Y 3.5677 7.5578 118.4850 58.1958 36.7239 169.9480 126 A 4.7808 8.5716 114.7305 50.7225 21.1298 176.6413 127 G 4.6185 9.1412 110.1363 47.0013 0.0000 171.0753 128 N 4.1913 8.4378 126.2209 53.5228 36.5931 175.0732 129 E 4.5248 7.8304 114.1701 55.3015 32.4010 174.1383 130 H 3.5184 8.1455 118.4670 53.6304 31.4109 172.6219 131 N 4.6391 8.3904 119.4370 53.6962 38.9526 175.4069 132 H 4.8536 7.7463 115.9158 55.3488 29.3350 176.1501 133 A 4.1924 7.7061 122.8140 54.1809 18.9381 179.5367 134 A 4.1492 7.7544 116.7430 53.5015 18.6456 177.7057 135 Q 3.8975 7.2402 112.8117 54.4251 29.1474 175.8639 136 Q 3.3380 7.4390 116.1973 56.3046 26.6412 172.3893 137 P 4.6771 0.0000 0.0000 63.0259 32.7030 176.8655 138 Q 4.6373 8.4428 123.1449 54.0683 31.1890 175.2263 139 V 3.8247 8.5538 119.6948 62.4583 32.6072 175.8767 140 L 4.5277 8.1964 125.8021 54.1587 44.9115 174.6397 141 D 4.4646 8.8409 127.1252 53.6460 40.4124 176.4078 142 I 3.5567 8.4076 123.4675 61.8193 37.2027 173.4247 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 8.30 4.34 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.53 0.00 2 K 8.48 4.26 0.00 1.83 1.71 0.00 1.80 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.50 7.81 3 T 8.45 4.23 4.46 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 1.34 0.00 0.00 4 F 8.19 4.21 0.00 2.82 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 5 T 5.79 3.26 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 0.81 0.00 0.00 6 A 8.44 4.04 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 7 K 8.38 4.07 0.00 1.67 1.71 0.00 1.60 0.00 0.00 1.78 0.00 0.00 2.72 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.32 7.81 8 P 0.00 4.14 0.00 2.19 2.19 0.00 3.75 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 1.99 1.95 0.00 9 E 8.28 3.97 0.00 1.96 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 2.31 2.35 0.00 10 T 7.14 4.34 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 1.26 0.00 0.00 11 V 7.82 4.68 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 0.89 0.00 0.00 0.98 0.00 0.00 12 K 8.41 4.07 0.00 1.75 1.64 0.00 1.93 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.38 1.40 7.81 13 R 8.65 3.68 0.00 2.08 2.02 0.00 3.22 0.00 0.00 2.99 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 14 D 8.30 5.36 0.00 2.64 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 15 W 8.26 5.86 0.00 3.23 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 16 Y 8.57 5.40 0.00 2.93 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 17 V 8.46 5.11 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 1.05 0.00 0.00 0.87 0.00 0.00 18 V 8.19 4.51 2.21 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 0.79 0.00 0.00 0.94 0.00 0.00 19 D 8.94 4.64 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 20 A 8.21 4.61 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 21 T 7.06 4.34 4.26 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 1.29 0.00 0.00 22 G 7.88 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.10 3.83 0.00 1.81 1.79 0.00 1.68 0.00 0.00 1.82 0.00 0.00 2.89 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.55 1.52 7.81 24 T 8.48 4.11 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 25 L 8.54 3.54 0.00 1.84 1.68 0.92 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 26 G 8.85 4.32 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 0.00 27 R 7.63 3.88 0.00 1.85 1.98 0.00 3.27 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 1.71 1.55 0.00 28 L 7.96 3.84 0.00 1.76 1.65 0.92 1.05 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 29 A 8.09 3.93 1.34 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 0.00 0.00 30 T 8.16 4.02 4.33 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 1.22 0.00 0.00 31 E 7.82 3.90 0.00 2.12 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 2.24 2.31 0.00 32 L 8.10 3.88 0.00 1.79 1.58 0.88 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 33 A 8.92 3.77 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 34 R 8.22 3.82 0.00 1.90 1.97 0.00 3.26 0.00 0.00 3.14 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.79 0.00 35 R 7.69 4.09 0.00 1.69 1.86 0.00 2.90 0.00 0.00 2.76 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.68 0.00 36 L 8.48 3.85 0.00 1.59 1.61 0.76 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 37 R 7.64 4.33 0.00 1.70 1.95 0.00 3.35 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 38 G 7.91 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 39 K 8.21 4.07 0.00 1.68 1.86 0.00 1.61 0.00 0.00 1.80 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.40 7.81 40 H 7.81 4.94 0.00 3.22 3.31 0.00 5.76 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 7.54 4.68 0.00 1.69 1.67 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.14 7.81 42 A 8.26 4.33 1.18 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 0.00 0.00 43 E 7.92 4.12 0.00 2.08 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 2.26 2.32 0.00 44 Y 7.63 3.94 0.00 3.35 3.23 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 45 T 7.95 4.76 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 1.27 0.00 0.00 46 P 0.00 4.30 0.00 1.94 2.00 0.00 3.14 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.94 0.00 47 H 7.37 4.54 0.00 3.13 3.33 0.00 5.59 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 8.18 4.50 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 0.83 0.00 0.00 0.97 0.00 0.00 49 D 8.54 4.62 0.00 2.74 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 50 T 8.35 4.47 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 1.25 0.00 0.00 51 G 7.56 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.36 4.75 0.00 2.73 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 53 Y 7.88 3.88 0.00 1.43 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 54 I 8.31 5.27 1.91 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 1.38 0.87 0.00 0.00 55 I 8.57 4.87 2.17 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.70 1.15 0.00 0.00 56 V 7.97 4.19 2.12 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 0.92 0.00 0.00 1.08 0.00 0.00 57 L 8.56 4.67 0.00 1.90 1.45 1.06 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 58 N 7.85 4.99 0.00 2.90 2.81 0.00 0.00 6.71 7.36 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 59 A 8.26 4.04 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 60 D 8.24 4.39 0.00 2.78 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 61 K 7.86 4.61 0.00 1.79 1.87 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.36 7.81 62 V 8.03 4.30 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 1.05 0.00 0.00 1.08 0.00 0.00 63 A 8.02 4.63 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 64 V 8.35 3.53 0.94 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 0.45 0.00 0.00 0.46 0.00 0.00 65 T 7.51 3.03 4.20 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 1.18 0.00 0.00 66 G 7.11 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 0.00 0.00 0.00 67 N 8.32 4.67 0.00 2.68 2.80 0.00 0.00 6.82 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 68 K 7.94 4.38 0.00 1.87 1.94 0.00 1.25 0.00 0.00 1.49 0.00 0.00 2.73 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.24 1.16 7.81 69 R 7.87 3.78 0.00 1.87 1.99 0.00 3.20 0.00 0.00 3.45 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.83 0.00 70 T 7.76 4.90 4.28 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 1.28 0.00 0.00 71 D 7.94 4.87 0.00 2.78 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 72 K 8.10 4.33 0.00 2.11 1.79 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.69 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.64 1.61 7.81 73 V 7.21 3.81 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 0.86 0.00 0.00 0.70 0.00 0.00 74 Y 6.94 3.72 0.00 3.27 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 75 Y 7.77 5.36 0.00 2.91 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 76 H 9.02 5.11 0.00 3.24 3.40 0.00 5.20 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.98 5.32 0.00 3.14 3.25 0.00 5.79 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 T 8.64 4.01 4.31 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 1.22 0.00 0.00 79 G 7.81 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 80 H 7.28 4.99 0.00 3.18 3.24 0.00 5.87 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 7.81 3.05 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 1.38 0.48 0.92 0.00 0.00 82 G 9.66 3.72 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 0.00 0.00 0.00 83 G 7.96 3.45 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 0.00 0.00 0.00 0.00 84 I 7.43 3.91 1.85 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 1.17 0.71 0.96 0.00 0.00 85 K 9.19 4.68 0.00 1.34 1.56 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.77 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.29 7.81 86 Q 8.84 5.12 0.00 2.16 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 7.19 0.00 0.00 0.00 0.00 0.00 2.26 2.51 0.00 87 A 7.20 5.25 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 88 T 7.99 4.18 4.29 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 1.29 0.00 0.00 89 F 9.19 3.87 0.00 3.24 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 90 E 7.99 4.02 0.00 2.34 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 0.00 2.36 2.43 0.00 91 E 7.97 4.19 0.00 2.21 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 2.37 2.40 0.00 92 M 8.27 3.88 0.00 1.38 1.71 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 2.54 0.00 93 I 7.17 3.67 1.67 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.14 0.84 0.00 0.00 94 A 7.40 4.27 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 95 R 8.93 4.06 0.00 1.95 2.13 0.00 2.99 0.00 0.00 3.16 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.49 0.00 96 R 7.95 3.45 0.00 1.91 2.23 0.00 3.09 0.00 0.00 3.35 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.59 0.00 97 P 0.00 4.39 0.00 2.18 2.35 0.00 3.85 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.87 0.00 98 E 8.23 3.95 0.00 1.96 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 2.38 2.35 0.00 99 R 7.71 4.16 0.00 2.00 1.89 0.00 3.09 0.00 0.00 3.05 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.69 0.00 100 V 7.66 3.66 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 1.39 0.00 0.00 0.45 0.00 0.00 101 I 7.66 3.91 1.90 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 1.56 0.95 0.92 0.00 0.00 102 E 7.57 4.18 0.00 2.32 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 2.71 0.00 103 I 8.46 4.09 2.00 0.00 0.00 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 1.72 0.83 1.07 0.00 0.00 104 A 7.85 4.15 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 V 7.52 4.06 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 0.71 0.00 0.00 0.79 0.00 0.00 106 K 8.13 4.36 0.00 2.36 2.16 0.00 1.69 0.00 0.00 1.77 0.00 0.00 3.23 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.53 1.64 7.81 107 G 7.86 3.53 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 0.00 0.00 0.00 108 M 7.24 4.30 0.00 1.85 2.23 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 2.66 2.69 0.00 109 L 7.69 4.31 0.00 1.88 1.65 0.91 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 110 P 0.00 4.66 0.00 2.21 2.21 0.00 3.86 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 2.04 1.97 0.00 111 K 8.63 3.88 0.00 2.00 1.82 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.35 1.41 7.81 112 G 8.58 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 0.00 113 P 0.00 4.45 0.00 2.17 2.09 0.00 3.60 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 2.08 2.13 0.00 114 L 7.85 4.32 0.00 1.76 1.66 0.92 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 115 G 8.12 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 0.00 116 R 7.65 4.14 0.00 2.22 1.93 0.00 3.05 0.00 0.00 3.02 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.65 0.00 117 A 7.77 4.10 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 0.00 118 M 7.90 4.10 0.00 2.03 2.28 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.55 0.00 119 F 8.10 3.81 0.00 3.10 3.15 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 0.00 120 R 7.62 4.12 0.00 2.11 2.17 0.00 3.37 0.00 0.00 3.30 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.95 0.00 121 K 7.89 4.53 0.00 1.76 1.43 0.00 0.61 0.00 0.00 1.03 0.00 0.00 2.64 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.17 1.33 7.81 122 L 8.13 5.16 0.00 1.23 1.26 0.84 0.10 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 0.00 123 K 8.53 4.69 0.00 2.03 1.77 0.00 1.61 0.00 0.00 1.96 0.00 0.00 3.17 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.51 7.81 124 V 7.75 4.15 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 0.83 0.00 0.00 1.03 0.00 0.00 125 Y 7.56 3.57 0.00 3.24 3.28 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 0.00 126 A 8.57 4.78 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 0.00 127 G 9.14 4.62 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 0.00 0.00 0.00 128 N 8.44 4.19 0.00 2.84 2.87 0.00 0.00 7.00 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 0.00 129 E 7.83 4.52 0.00 1.86 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 0.00 2.17 2.53 0.00 130 H 8.15 3.52 0.00 2.99 2.94 0.00 5.51 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 0.00 131 N 8.39 4.64 0.00 2.76 2.83 0.00 0.00 6.89 8.09 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 0.00 132 H 7.75 4.85 0.00 3.34 3.16 0.00 5.61 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 A 7.71 4.19 1.14 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 0.00 0.00 0.00 134 A 7.75 4.15 1.16 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 0.00 0.00 135 Q 7.24 3.90 0.00 1.33 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.61 0.00 0.00 0.00 0.00 0.00 1.16 1.27 0.00 136 Q 7.44 3.34 0.00 2.04 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.87 0.00 0.00 0.00 0.00 0.00 2.19 2.35 0.00 137 P 0.00 4.68 0.00 2.12 2.19 0.00 3.68 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 138 Q 8.44 4.64 0.00 2.07 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.92 0.00 0.00 0.00 0.00 0.00 2.29 2.31 0.00 139 V 8.55 3.82 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 0.73 0.00 0.00 0.97 0.00 0.00 140 L 8.20 4.53 0.00 1.93 1.80 0.84 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 141 D 8.84 4.46 0.00 2.82 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 0.00 142 I 8.41 3.56 1.84 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 1.26 0.29 0.88 0.00 0.00