NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.5260 8.3044 120.2865 55.2982 33.8322 174.0988 3 V 4.0483 8.1121 122.1316 59.7816 32.9088 173.1143 4 W 4.5757 9.0502 135.0000 57.1001 31.6733 174.9743 5 T 3.9609 8.1188 122.3538 61.5830 67.1746 172.2257 6 P 4.6347 0.0000 0.0000 62.7409 32.3386 175.2659 7 V 4.0022 7.3628 120.1098 62.8470 32.7720 175.4280 8 N 4.2841 8.6950 125.2020 54.8823 35.9053 173.3546 9 N 5.0614 7.5227 108.0636 52.9662 40.2735 174.1643 10 K 4.0865 8.3206 115.9721 56.4890 32.6854 176.6636 11 M 4.9051 8.3385 121.2990 53.9638 35.1154 175.3934 12 F 4.6284 8.1372 115.7313 57.2152 40.7114 175.9035 13 E 3.5679 8.0967 121.7791 56.8805 28.0406 174.3906 14 T 3.7067 8.3900 118.6771 66.5947 68.8418 173.9602 15 F 4.5012 9.0645 124.2091 57.6684 36.7301 176.3898 16 S 4.5244 8.4247 114.7248 60.1743 63.0201 174.3819 17 Y 4.4372 8.2675 117.5629 57.9563 38.1707 174.9999 18 L 4.7551 7.5349 119.8381 52.0969 43.8827 174.4760 19 P 4.5052 0.0000 0.0000 61.6039 31.8376 174.9652 20 P 4.2483 0.0000 0.0000 62.9954 31.6561 176.6213 21 L 4.2246 8.3566 123.2999 54.7136 42.2580 177.7920 22 S 4.5292 8.8636 118.5528 57.5528 65.5906 175.1290 23 D 4.3464 8.5604 121.8877 57.6189 40.4796 178.8640 24 E 3.9371 8.0636 119.2314 59.4452 29.6773 178.7927 25 Q 3.9442 7.8380 117.6140 58.7923 28.6855 178.7870 26 I 3.7261 8.1162 121.1830 64.2765 37.2128 178.2744 27 A 4.0671 8.5236 121.8988 55.1018 18.1612 179.5636 28 A 4.0142 8.0807 119.3836 55.3832 18.4654 179.9384 29 Q 4.1075 7.9023 116.4740 59.0421 28.8025 178.9893 30 V 3.7633 8.0760 119.4563 66.1798 31.6033 177.8309 31 D 4.4493 8.3677 118.6917 57.4323 40.5375 178.1719 32 Y 4.2260 7.9826 119.7457 60.6665 38.8454 178.0797 33 I 3.9442 7.8746 120.6175 64.4955 37.2278 178.5822 34 V 3.5174 7.8652 118.6377 66.0702 31.2066 177.7998 35 A 3.8608 8.1422 119.3663 54.8127 18.2222 178.3788 36 N 4.0381 7.1636 111.7692 52.0789 38.7042 175.4973 37 G 3.7190 7.5054 108.4954 46.2782 0.0000 174.0984 38 W 5.0140 7.6618 118.8219 55.6119 31.1325 176.4877 39 I 4.3373 8.8856 123.0016 59.6966 37.6091 174.2094 40 P 4.8322 0.0000 0.0000 62.9808 32.8947 175.2172 41 C 4.9412 8.7772 120.2894 58.6346 35.5966 172.4807 42 L 5.2997 8.6430 124.6212 53.2547 44.4384 175.1622 43 E 5.6342 9.1922 120.8287 55.0044 34.2482 174.4863 44 F 5.5747 9.1526 116.2877 56.1419 42.2300 172.8822 45 A 4.3990 8.0538 119.1147 50.5024 22.6160 176.2985 46 E 4.3561 8.4455 118.4555 55.7289 31.1874 177.9929 47 S 4.4007 9.0142 116.1378 62.3294 62.8308 176.9291 48 D 4.6350 8.1711 116.5498 56.1034 40.6298 177.0156 49 K 4.6457 7.9395 117.7175 56.0054 32.8714 177.0184 50 A 3.9231 7.8410 124.7108 54.0707 18.5582 178.4488 51 Y 4.7628 7.4163 111.1321 55.6206 40.6345 176.0348 52 V 4.4766 8.5380 115.3532 61.5768 32.2212 175.5711 53 S 4.7712 8.3897 115.9803 57.5361 66.3589 173.7404 54 N 5.2313 8.5853 113.9253 52.6821 39.4620 176.1815 55 E 3.9375 8.5736 119.9974 60.2155 29.1304 179.4149 56 S 4.0113 8.9192 115.6155 60.4464 62.8648 176.0509 57 A 2.5800 7.5794 123.2784 53.6218 17.7394 179.0705 58 I 3.6287 7.0093 116.6272 63.2325 38.0985 177.0418 59 R 4.3545 7.5192 116.7184 55.5278 30.5259 176.2405 60 F 4.9586 7.2149 118.1364 56.3921 41.0727 176.3057 61 G 4.1084 8.1430 113.1928 45.7886 0.0000 175.2209 62 S 4.6035 8.4213 113.4523 58.4702 61.9467 174.3512 63 V 4.4883 7.1785 106.9267 61.1969 33.2313 177.6207 64 S 4.4908 8.2631 114.6044 59.4219 63.6015 173.3791 65 C 3.9545 8.0921 119.0651 61.6148 27.9544 173.2584 66 L 3.5249 8.4968 123.6480 55.6734 38.9458 173.3219 67 Y 4.4301 7.4701 118.6674 55.8045 40.7359 174.4274 68 Y 4.9447 7.1013 122.7565 56.7628 42.3756 174.3347 69 D 4.5919 9.0158 123.3100 54.8379 42.1416 177.1805 70 N 4.5395 8.8798 116.2573 54.0775 35.9347 175.9443 71 R 4.0028 7.9003 118.8655 58.9554 30.4944 176.9265 72 Y 4.4726 7.7599 114.7679 57.4879 38.6102 174.3820 73 W 5.1092 8.6597 123.0104 55.1405 33.1918 174.3922 74 T 4.2619 8.2505 117.3696 62.8678 69.3381 174.5378 75 M 4.6963 8.5569 126.4183 55.1817 33.2204 175.1042 76 W 4.7976 9.4178 135.0000 56.2381 31.4577 176.8353 77 K 3.3815 8.5018 128.3168 57.4512 30.8426 177.8750 78 L 4.9195 8.2559 125.5278 52.7579 45.4326 173.8375 79 P 4.3241 0.0000 0.0000 63.2827 32.2448 177.7942 80 M 4.3518 8.8315 123.7077 53.8067 30.4070 176.0116 81 F 4.4713 7.3997 118.0354 59.0404 40.0183 176.5281 82 G 3.9526 9.1550 112.2898 45.7185 0.0000 172.9524 83 C 4.2605 8.0344 120.8196 59.5368 31.6291 173.3402 84 R 4.4812 8.6642 124.1504 55.6610 31.3541 174.7202 85 D 4.8593 7.7905 118.9555 51.3274 42.6970 174.4821 86 P 4.3511 0.0000 0.0000 66.3484 31.0103 178.1922 87 M 4.1146 8.2733 117.9756 58.3200 31.8625 178.4899 88 Q 4.0048 8.1258 117.8755 58.8224 28.9240 178.9055 89 V 3.6228 7.7579 118.7810 66.0864 31.7712 177.9212 90 L 4.0270 8.0417 118.6796 57.8859 41.3690 179.7702 91 R 3.9725 8.3245 118.3023 59.3226 29.9633 178.9972 92 E 4.0984 8.3776 118.4168 59.2172 29.3395 179.4233 93 I 3.4886 7.6472 120.0266 64.2065 37.1590 178.5809 94 V 3.4429 7.5901 118.3283 65.8148 31.3552 177.9553 95 A 3.9137 8.0431 120.5747 55.1773 18.2331 179.1124 96 C 2.0000 7.8072 117.5781 62.0945 30.9364 176.0002 97 T 3.6741 7.6024 111.3238 64.3748 67.9375 176.3729 98 K 3.8259 7.6318 121.7585 59.3175 32.3346 178.4855 99 A 4.0153 7.7118 119.9075 53.4909 19.2528 177.5939 100 F 4.6435 7.8482 116.0536 54.8549 39.2748 173.7260 101 P 4.3922 0.0000 0.0000 64.2085 31.8352 177.9801 102 D 4.6918 8.1082 116.6367 53.7766 41.1395 175.2397 103 A 4.8060 7.2608 120.2187 50.1842 21.9489 176.6324 104 Y 4.1765 8.7672 117.5370 57.6761 39.4844 175.2897 105 V 5.2990 8.7756 122.9129 61.1841 35.2366 174.2965 106 R 4.9863 9.4706 123.7495 54.2741 33.0930 173.6999 107 L 4.8823 8.2083 123.4863 53.7761 43.9457 175.6668 108 V 4.9162 8.8711 118.2221 59.5836 36.5551 174.1220 109 A 4.8848 7.9814 122.1522 50.6234 22.7145 175.2927 110 F 5.2767 9.1168 119.9305 55.7240 42.6582 174.3446 111 D 5.4191 8.7683 121.8819 52.6330 42.6638 176.3911 112 N 4.7257 9.1971 123.3271 54.3214 38.2718 176.4640 113 Q 4.1572 8.9298 119.1374 59.0551 28.9516 177.4651 114 K 4.1177 8.3482 113.7016 56.3728 33.0218 176.5236 115 Q 3.4416 7.7298 118.6301 55.5014 27.5003 172.5989 116 V 4.3932 6.8183 116.7439 60.2028 34.2680 173.3054 117 Q 4.4861 8.8299 123.5203 56.4999 29.2112 175.7952 118 I 4.1768 7.8201 118.5790 60.9216 38.5740 174.6797 119 M 4.3672 6.5520 119.2106 54.1272 34.0227 173.6634 120 G 4.9505 8.2625 111.8408 47.6273 0.0000 171.6052 121 F 5.0072 7.0392 115.0848 55.4050 41.0618 172.7402 122 L 4.4745 8.8174 122.4594 55.4708 42.0457 176.7542 123 V 4.5118 9.0067 117.8259 61.3453 34.2243 175.6098 124 Q 4.4802 7.6880 120.8053 54.4419 32.6653 173.1084 125 R 4.3004 8.0500 125.0341 53.1687 33.2137 172.9500 126 P 4.1303 0.0000 0.0000 62.6797 31.5413 177.2894 127 K 4.1208 8.5333 120.9383 58.8952 32.6314 177.6688 128 S 4.3679 7.8985 112.8477 59.0446 63.7100 174.3198 129 A 4.3759 7.8761 125.4991 52.8432 18.5218 177.5454 130 R 4.7496 8.6526 119.9320 56.2318 32.1167 175.3110 131 D 4.9383 8.7281 115.6928 52.5816 39.7503 175.2170 132 W 5.4777 7.8581 115.3171 55.0312 31.3659 174.1306 133 Q 4.2548 8.4023 117.3003 52.9467 31.2883 174.2210 134 P 4.5184 0.0000 0.0000 62.1732 32.6902 177.0074 135 A 4.0036 8.9588 123.3907 55.6472 18.2402 179.8662 136 N 4.5358 8.1397 110.7786 54.8676 37.5670 175.7520 137 K 4.4705 7.9425 117.8977 56.1489 32.7532 177.4986 138 R 3.5902 7.4913 120.6844 57.8703 30.1038 176.8472 139 S 4.9817 7.4091 110.3046 56.2847 66.0364 174.2292 140 V 3.9774 8.6562 115.0252 61.7119 32.0310 175.6027 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 M 8.30 4.53 0.00 1.98 2.15 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.58 0.00 3 V 8.11 4.05 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 1.04 0.00 0.00 0.96 0.00 0.00 4 W 9.05 4.58 0.00 3.44 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 5 T 8.12 3.96 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 1.05 0.00 0.00 6 P 0.00 4.63 0.00 2.23 2.19 0.00 3.78 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.95 0.00 7 V 7.36 4.00 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 0.76 0.00 0.00 0.91 0.00 0.00 8 N 8.69 4.28 0.00 2.91 2.85 0.00 0.00 6.80 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 9 N 7.52 5.06 0.00 2.62 2.68 0.00 0.00 7.31 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 10 K 8.32 4.09 0.00 1.93 1.50 0.00 0.61 0.00 0.00 1.07 0.00 0.00 2.64 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.33 1.40 7.81 11 M 8.34 4.91 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.64 0.00 12 F 8.14 4.63 0.00 3.09 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 13 E 8.10 3.57 0.00 2.17 1.84 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 2.23 2.16 0.00 14 T 8.39 3.71 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 0.14 0.00 0.00 15 F 9.06 4.50 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 16 S 8.42 4.52 0.00 4.15 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 0.00 17 Y 8.27 4.44 0.00 3.04 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 18 L 7.53 4.76 0.00 1.81 1.61 0.89 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.51 0.00 2.05 2.01 0.00 3.71 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 20 P 0.00 4.25 0.00 2.07 2.03 0.00 3.73 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.24 0.00 21 L 8.36 4.22 0.00 1.56 1.46 0.27 0.58 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 22 S 8.86 4.53 0.00 4.02 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 23 D 8.56 4.35 0.00 2.70 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 24 E 8.06 3.94 0.00 2.01 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 2.35 2.39 0.00 25 Q 7.84 3.94 0.00 2.23 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 26 I 8.12 3.73 2.07 0.00 0.00 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 1.58 0.80 1.10 0.00 0.00 27 A 8.52 4.07 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 28 A 8.08 4.01 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 29 Q 7.90 4.11 0.00 2.43 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.75 0.00 0.00 0.00 0.00 0.00 2.40 1.91 0.00 30 V 8.08 3.76 2.32 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 1.10 0.00 0.00 1.09 0.00 0.00 31 D 8.37 4.45 0.00 2.99 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 32 Y 7.98 4.23 0.00 3.22 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 33 I 7.87 3.94 2.16 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 1.69 1.24 1.08 0.00 0.00 34 V 7.87 3.52 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 1.07 0.00 0.00 0.96 0.00 0.00 35 A 8.14 3.86 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 36 N 7.16 4.04 0.00 1.44 1.42 0.00 0.00 7.02 8.89 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 37 G 7.51 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 38 W 7.66 5.01 0.00 3.37 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 39 I 8.89 4.34 2.12 0.00 0.00 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 1.48 0.83 0.73 0.00 0.00 40 P 0.00 4.83 0.00 2.09 1.98 0.00 3.82 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.14 0.00 41 C 8.78 4.94 0.00 3.03 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 42 L 8.64 5.30 0.00 1.84 1.60 0.83 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 43 E 9.19 5.63 0.00 2.10 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 2.38 2.33 0.00 44 F 9.15 5.57 0.00 2.95 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 45 A 8.05 4.40 -0.17 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 46 E 8.45 4.36 0.00 2.18 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 2.28 2.39 0.00 47 S 9.01 4.40 0.00 4.01 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 0.00 48 D 8.17 4.63 0.00 2.68 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 49 K 7.94 4.65 0.00 1.49 1.67 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.31 1.41 7.81 50 A 7.84 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 Y 7.42 4.76 0.00 2.88 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 52 V 8.54 4.48 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 0.48 0.00 0.00 0.78 0.00 0.00 53 S 8.39 4.77 0.00 3.99 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 54 N 8.59 5.23 0.00 2.77 2.86 0.00 0.00 6.53 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 55 E 8.57 3.94 0.00 2.19 2.26 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 2.69 2.46 0.00 56 S 8.92 4.01 0.00 4.00 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 57 A 7.58 2.58 1.15 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 0.00 0.00 58 I 7.01 3.63 1.79 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 1.48 0.81 0.84 0.00 0.00 59 R 7.52 4.35 0.00 1.90 2.01 0.00 3.20 0.00 0.00 3.22 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 60 F 7.21 4.96 0.00 3.00 2.78 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 61 G 8.14 4.11 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 0.00 62 S 8.42 4.60 0.00 3.87 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 63 V 7.18 4.49 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 0.67 0.00 0.00 0.54 0.00 0.00 64 S 8.26 4.49 0.00 4.11 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 0.00 65 C 8.09 3.95 0.00 2.96 2.95 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 66 L 8.50 3.52 0.00 1.76 1.73 0.94 0.95 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 67 Y 7.47 4.43 0.00 2.90 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 68 Y 7.10 4.94 0.00 2.83 2.70 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 69 D 9.02 4.59 0.00 2.78 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 70 N 8.88 4.54 0.00 3.05 3.24 0.00 0.00 6.98 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 71 R 7.90 4.00 0.00 1.54 1.71 0.00 3.10 0.00 0.00 3.34 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 72 Y 7.76 4.47 0.00 3.05 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 73 W 8.66 5.11 0.00 3.05 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 74 T 8.25 4.26 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 0.95 0.00 0.00 75 M 8.56 4.70 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.79 0.00 76 W 9.42 4.80 0.00 3.60 3.25 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 77 K 8.50 3.38 0.00 1.65 0.74 0.00 1.76 0.00 0.00 1.55 0.00 0.00 2.74 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.79 0.21 7.81 78 L 8.26 4.92 0.00 1.59 1.56 0.99 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.32 0.00 0.55 1.77 0.00 3.63 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 1.95 2.15 0.00 80 M 8.83 4.35 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.54 0.00 81 F 7.40 4.47 0.00 3.11 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 82 G 9.16 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 83 C 8.03 4.26 0.00 3.08 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 84 R 8.66 4.48 0.00 1.81 1.90 0.00 3.35 0.00 0.00 3.14 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.52 0.00 85 D 7.79 4.86 0.00 2.73 2.70 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 86 P 0.00 4.35 0.00 2.33 2.34 0.00 3.77 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 2.09 2.08 0.00 87 M 8.27 4.11 0.00 2.06 2.49 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.59 0.00 88 Q 8.13 4.00 0.00 2.24 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.74 0.00 89 V 7.76 3.62 2.29 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 1.09 0.00 0.00 0.97 0.00 0.00 90 L 8.04 4.03 0.00 1.92 1.71 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.32 3.97 0.00 2.05 2.01 0.00 3.15 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.87 0.00 92 E 8.38 4.10 0.00 2.22 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 0.00 2.62 2.66 0.00 93 I 7.65 3.49 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 1.32 0.77 0.82 0.00 0.00 94 V 7.59 3.44 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 0.96 0.00 0.00 0.94 0.00 0.00 95 A 8.04 3.91 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.81 2.00 0.00 1.23 2.19 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 97 T 7.60 3.67 4.11 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 1.07 0.00 0.00 98 K 7.63 3.83 0.00 1.78 1.98 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.37 1.38 7.81 99 A 7.71 4.02 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 0.00 100 F 7.85 4.64 0.00 2.83 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 0.00 101 P 0.00 4.39 0.00 2.12 2.11 0.00 3.24 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.87 0.00 102 D 8.11 4.69 0.00 2.68 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 0.00 103 A 7.26 4.81 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 0.00 104 Y 8.77 4.18 0.00 2.45 2.70 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 0.00 105 V 8.78 5.30 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 0.99 0.00 0.00 0.93 0.00 0.00 106 R 9.47 4.99 0.00 1.83 1.91 0.00 2.34 0.00 0.00 2.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.37 0.00 107 L 8.21 4.88 0.00 1.45 0.73 0.89 1.13 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 0.00 108 V 8.87 4.92 1.66 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 0.43 0.00 0.00 0.55 0.00 0.00 109 A 7.98 4.88 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 0.00 110 F 9.12 5.28 0.00 2.99 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 0.00 111 D 8.77 5.42 0.00 2.40 2.47 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 0.00 0.00 0.00 0.00 112 N 9.20 4.73 0.00 2.94 3.06 0.00 0.00 6.34 7.39 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 0.00 113 Q 8.93 4.16 0.00 2.30 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.93 0.00 0.00 0.00 0.00 0.00 2.48 2.54 0.00 114 K 8.35 4.12 0.00 1.76 1.86 0.00 1.91 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.47 7.81 115 Q 7.73 3.44 0.00 2.15 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.66 0.00 0.00 0.00 0.00 0.00 2.28 2.26 0.00 116 V 6.82 4.39 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 0.58 0.00 0.00 0.92 0.00 0.00 117 Q 8.83 4.49 0.00 2.14 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.87 0.00 0.00 0.00 0.00 0.00 2.22 1.94 0.00 118 I 7.82 4.18 0.89 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.07 0.50 0.00 0.00 119 M 6.55 4.37 0.00 2.09 2.29 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.70 0.00 120 G 8.26 4.95 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 0.00 121 F 7.04 5.01 0.00 3.24 3.36 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 0.00 122 L 8.82 4.47 0.00 1.58 1.60 0.61 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 123 V 9.01 4.51 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 0.57 0.00 0.00 0.87 0.00 0.00 124 Q 7.69 4.48 0.00 1.96 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.87 0.00 0.00 0.00 0.00 0.00 2.13 2.22 0.00 125 R 8.05 4.30 0.00 1.38 1.31 0.00 2.21 0.00 0.00 2.32 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.18 0.00 126 P 0.00 4.13 0.00 2.13 2.11 0.00 2.20 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.55 0.00 127 K 8.53 4.12 0.00 1.91 1.98 0.00 1.56 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.38 1.42 7.81 128 S 7.90 4.37 0.00 4.03 4.04 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 0.00 129 A 7.88 4.38 1.55 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 0.00 0.00 130 R 8.65 4.75 0.00 1.80 1.86 0.00 3.38 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.57 0.00 131 D 8.73 4.94 0.00 2.91 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 0.00 132 W 7.86 5.48 0.00 3.68 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 0.00 133 Q 8.40 4.25 0.00 1.98 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 7.06 0.00 0.00 0.00 0.00 0.00 2.31 2.03 0.00 134 P 0.00 4.52 0.00 2.39 2.00 0.00 3.41 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.74 0.00 135 A 8.96 4.00 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 0.00 136 N 8.14 4.54 0.00 2.81 2.95 0.00 0.00 5.83 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 0.00 137 K 7.94 4.47 0.00 1.51 1.66 0.00 1.60 0.00 0.00 1.61 0.00 0.00 2.80 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.27 1.25 7.81 138 R 7.49 3.59 0.00 1.39 0.66 0.00 3.05 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.50 0.00 139 S 7.41 4.98 0.00 4.01 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 0.00 140 V 8.66 3.98 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 0.60 0.00 0.00 0.94 0.00 0.00