NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 14 A 4.3993 8.1227 122.4662 52.1509 20.7345 175.3980 15 M 5.3848 8.3759 119.9465 52.4263 35.0762 172.4026 16 R 4.6781 9.1997 126.9581 54.3685 34.4836 173.4863 17 I 4.3315 8.3913 126.9988 61.5026 38.0097 175.5883 18 M 4.4547 9.2208 127.7403 55.4148 33.0626 175.9698 19 R 4.8427 9.4387 122.2433 53.6287 33.5665 175.3721 20 P 4.1944 0.0000 0.0000 66.1965 31.3261 178.5546 21 D 4.5670 7.9871 114.9599 56.2706 41.0213 176.7138 22 D 4.5745 8.3292 118.8289 55.0105 41.3117 175.6996 23 A 4.9241 7.6606 121.4703 49.7235 22.1647 175.5505 24 N 4.7148 8.3610 118.0141 51.7710 38.7663 176.5146 25 V 3.5167 8.2896 110.4394 64.2153 31.4999 177.3977 26 A 4.0999 8.0692 121.0033 52.7211 18.7939 178.3102 27 G 3.9165 8.6242 105.1365 44.9831 0.0000 172.3529 28 N 5.2644 7.7916 117.3728 51.2458 40.5646 174.7489 29 V 4.0228 8.7455 124.3609 63.3718 32.3036 175.5480 30 H 4.1935 9.2456 125.5791 55.6688 29.3729 176.6456 31 G 3.3801 8.9649 109.4944 48.0697 0.0000 175.9802 32 G 3.6933 8.0332 107.3072 47.8458 0.0000 175.7283 33 T 3.9009 7.7222 117.5963 66.5855 68.4470 176.8725 34 I 3.7805 7.6857 121.1547 64.3423 37.2340 178.2046 35 L 4.0856 8.3304 120.2412 57.7799 41.4625 179.5081 36 K 3.9634 8.2203 119.3762 59.8981 32.1776 178.7317 37 M 4.6162 8.0284 120.2362 57.8969 31.8505 178.7387 38 I 3.7437 8.0747 120.1734 64.5583 37.2682 178.1566 39 E 4.1457 8.3461 120.0258 59.1312 29.4454 178.4918 40 E 3.9623 8.4699 118.6476 59.4781 29.6974 179.1919 41 A 4.0912 8.1777 120.6999 55.1728 18.4613 179.9469 42 G 3.6433 8.5083 105.3439 47.2061 0.0000 175.7913 43 A 3.5059 8.2192 123.4789 54.7398 18.4109 179.7581 44 I 3.5435 7.4893 118.0877 64.6421 37.2711 178.6124 45 I 3.6410 7.4934 119.3634 63.8956 37.7584 178.1167 46 S 4.0122 7.8061 115.2313 61.6011 62.7133 176.6084 47 T 3.7797 7.6203 118.5200 66.1567 68.3733 176.1430 48 R 3.9876 7.9741 120.5814 59.7886 30.0677 177.9724 49 H 4.0873 8.0795 117.7743 59.4927 29.7126 176.7208 50 C 4.3232 8.1283 116.1642 61.2805 28.1905 174.4657 51 N 4.8349 7.6920 117.7892 52.9550 38.5969 176.1176 52 S 4.4105 7.7862 115.9291 59.7833 62.0037 174.5504 53 Q 4.5257 7.5329 121.2378 55.2492 29.3444 175.0214 54 N 4.1383 7.9195 113.0479 54.1546 36.7043 175.1238 55 G 3.8484 7.1475 105.3459 44.4577 0.0000 173.4448 56 E 3.9225 8.6136 119.5468 56.4058 29.9804 177.0649 57 R 4.4211 8.5460 125.0048 56.8532 31.1178 175.3725 58 C 5.3270 8.8144 117.2740 57.0123 33.5202 173.2731 59 V 4.5477 8.6448 118.1594 60.8655 34.5974 174.2324 60 A 4.7697 8.7307 129.5632 51.8370 19.1543 176.5426 61 A 4.9100 9.1375 124.7062 49.7407 22.0994 175.6606 62 L 3.6789 8.6899 123.5547 55.2086 42.0428 176.1296 63 A 4.5737 8.8644 128.6942 53.3473 20.8483 177.1538 64 R 4.6013 7.6585 113.9809 55.0867 33.9232 173.9734 65 V 4.6294 8.2857 125.5906 61.0649 33.2117 175.1730 66 E 4.4057 9.0650 127.8842 55.6055 30.4856 177.0628 67 R 3.9369 8.5629 119.7697 57.4889 30.6036 176.3574 68 T 4.5560 8.1669 114.9056 60.4520 70.5523 172.3063 69 D 4.8817 8.3204 127.0380 52.4532 43.1173 175.7916 70 F 4.6286 8.7079 122.2489 56.3365 39.5971 175.6121 71 L 4.4171 8.7334 127.1213 56.2440 42.2828 177.5571 72 S 4.7148 7.6176 110.4863 55.7488 65.8755 171.7663 73 P 4.6303 0.0000 0.0000 63.0100 32.5214 174.8248 74 M 4.9788 8.5384 119.5887 54.0871 35.5698 173.9845 75 C 5.3372 8.9554 121.8097 57.4242 32.0386 173.5826 76 I 3.9340 7.9206 121.8996 63.6245 37.1082 176.6409 77 G 4.0210 9.0786 113.8695 45.2221 0.0000 173.7055 78 E 4.3751 7.9896 119.0338 56.1595 31.3346 175.9406 79 V 4.6624 8.9084 122.2930 61.3800 33.4873 174.6339 80 A 4.7672 9.0065 131.2849 51.9411 19.8265 175.4585 81 H 5.2491 9.5100 121.0181 54.1741 31.0509 174.1496 82 V 4.9333 9.1253 124.2909 61.0420 33.7040 174.7968 83 S 4.9300 9.3097 122.3506 56.4705 66.0784 172.9099 84 A 5.2889 8.5499 122.8643 50.3808 22.3750 174.8602 85 E 4.5754 8.9212 120.0599 54.5649 33.6594 174.3565 86 I 4.3919 8.4057 128.1185 61.5949 37.1810 175.6739 87 T 4.5110 8.4363 117.3650 62.1338 70.3722 173.9319 88 Y 5.1856 7.5831 121.1867 57.7931 42.2334 172.7288 89 T 4.9198 7.4157 114.4321 60.0980 71.6762 173.7493 90 S 4.4092 8.3919 120.5756 56.4954 65.9177 173.1902 91 K 3.9417 8.5634 119.6836 59.8958 31.8976 178.4548 92 H 5.2143 8.1333 111.4783 55.0610 30.2081 172.7025 93 S 5.1730 8.1598 113.8254 56.8453 67.1152 172.8322 94 V 4.7322 9.2802 120.7033 61.1747 34.4318 173.6280 95 E 4.0718 9.2368 129.3202 54.4206 31.4210 174.5849 96 V 4.7285 8.6423 126.6329 61.1853 34.9447 173.8392 97 Q 4.9959 8.9727 127.0387 54.3417 30.9331 174.6323 98 V 4.8905 9.1100 123.9719 61.3971 34.5909 173.7230 99 H 5.3379 9.4822 124.8381 53.9889 31.7256 173.3154 100 V 4.8688 8.8022 122.6295 61.3135 34.1565 173.8397 101 M 5.2982 9.1488 127.7680 53.7324 35.5693 174.0875 102 S 5.2230 8.9944 120.1098 56.8756 65.8863 172.4172 103 E 4.9972 9.2612 124.2193 54.3907 32.4513 173.9418 104 N 5.0625 9.3269 127.3018 52.6889 39.6693 175.3316 105 I 4.1481 8.5303 119.3897 61.5987 38.6353 176.6920 106 L 4.2881 8.1329 121.4129 57.3847 42.1395 177.8437 107 T 4.1152 8.2736 107.0711 61.9766 69.3801 175.9843 108 G 3.9867 8.3983 110.2056 44.9567 0.0000 173.6503 109 T 4.0895 7.8408 117.8050 63.5692 69.3517 173.5964 110 K 5.2045 8.6591 125.1954 54.6378 35.0251 175.7104 111 K 4.6875 8.8709 122.1554 54.4137 36.9465 175.3220 112 L 4.3483 8.5246 125.8319 55.5867 42.1575 176.5548 113 T 4.2736 9.1993 124.4233 66.1996 69.6091 174.4039 114 N 4.8151 7.7208 117.1519 52.3725 42.4343 172.8519 115 K 4.9704 8.4575 123.1713 54.5140 35.2394 175.3519 116 A 4.7673 9.1118 125.8458 50.3676 23.0264 174.6073 117 T 5.0007 8.4253 116.0578 61.7524 71.7249 173.3867 118 L 5.2799 9.1603 125.1854 52.7044 46.2303 175.3208 119 W 5.2926 9.0658 121.5361 55.2556 31.7312 174.4718 120 Y 5.2733 9.4112 121.9900 56.1986 41.4126 174.8013 121 V 4.7853 8.7421 121.4330 60.4695 35.0369 172.7503 122 P 5.0159 0.0000 0.0000 62.6259 32.9924 174.8382 123 L 5.2332 8.8138 123.8685 52.4252 44.6723 175.9178 124 S 4.4935 8.7932 118.5498 58.8449 62.7915 175.4454 125 L 4.1467 8.8304 127.1776 57.7615 41.5949 178.8978 126 K 4.0702 7.7617 116.8104 58.4210 32.4321 176.7033 127 N 4.6725 7.7002 116.3724 52.1293 39.8839 174.7686 128 V 3.6416 8.3835 126.4848 65.4639 31.7899 176.4102 129 D 4.5309 8.0688 117.2333 54.3557 41.2652 175.8801 130 K 4.3549 7.9579 122.8683 54.8994 33.1617 175.4887 131 V 4.4071 8.3319 128.5315 62.6733 32.1119 175.4058 132 L 4.7625 8.4853 127.8331 53.2019 43.7043 176.2229 133 E 4.3546 8.6702 120.4071 56.5280 30.3268 176.5065 134 V 4.2033 8.5342 124.4007 60.7108 32.5774 174.2541 135 P 4.3629 0.0000 0.0000 61.8264 31.8866 174.4463 136 P 4.4021 0.0000 0.0000 62.6350 32.0597 175.8085 137 I 4.2031 7.6911 113.0035 59.2398 39.5476 174.9930 138 V 3.9866 7.8050 121.1562 61.9654 32.4157 174.7169 139 Y 4.5439 8.3579 124.5310 56.2747 39.2567 176.6372 140 L 4.0560 8.7943 125.1474 56.9609 42.1808 177.7087 141 R 4.7388 8.3791 116.6901 53.7397 33.1539 176.4523 142 Q 3.9577 8.8041 122.5734 59.3240 29.1312 178.4919 143 E 4.2214 8.1672 119.3443 58.8938 29.2466 179.1362 144 Q 4.0260 7.8879 119.3195 58.7129 28.6921 178.0839 145 E 3.2503 7.5163 120.4856 59.0378 29.1955 178.7228 146 E 3.9252 7.9312 118.1039 59.4103 29.6337 179.0789 147 E 4.1007 8.2628 118.7624 59.3644 29.5546 179.6645 148 G 3.4675 8.2437 105.9192 47.5881 0.0000 175.6855 149 R 3.4516 7.9131 121.3572 58.9840 30.1466 178.8075 150 K 3.9698 7.8872 118.1665 59.4849 32.1274 179.5851 151 R 3.9483 7.8089 117.8532 59.3106 30.0245 178.3507 152 Y 4.0145 8.1094 119.2899 60.9479 38.7552 178.2266 153 E 3.5236 8.2110 119.1177 59.1225 29.4375 179.1910 154 A 3.9018 7.8606 121.0351 55.0269 18.5395 179.6550 155 Q 3.8383 7.8260 115.9866 59.1025 28.6357 178.6969 156 K 3.7207 7.4209 119.5690 59.1249 32.0628 179.0330 157 L 4.0540 7.7285 118.4249 57.3404 41.5745 178.7496 158 E 4.1618 7.5634 118.6589 58.3302 30.6180 178.2694 159 R 4.2457 7.4300 118.3538 55.7194 27.9780 175.2503 160 M 4.4164 7.6642 119.9372 54.7603 35.1914 175.7940 161 E 4.0927 8.1914 121.0198 56.8516 29.6519 174.0808 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 14 A 8.12 4.40 1.27 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 0.00 0.00 15 M 8.38 5.38 0.00 1.99 1.83 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.25 0.00 16 R 9.20 4.68 0.00 1.86 1.68 0.00 3.23 0.00 0.00 3.34 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 17 I 8.39 4.33 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.64 0.91 0.00 0.00 18 M 9.22 4.45 0.00 1.91 2.15 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.79 0.00 19 R 9.44 4.84 0.00 1.69 1.81 0.00 3.15 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.69 0.00 20 P 0.00 4.19 0.00 2.17 2.12 0.00 3.59 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.13 0.00 21 D 7.99 4.57 0.00 2.65 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 22 D 8.33 4.57 0.00 2.88 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 23 A 7.66 4.92 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 24 N 8.36 4.71 0.00 2.93 2.89 0.00 0.00 7.27 8.15 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 25 V 8.29 3.52 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 0.70 0.00 0.00 0.93 0.00 0.00 26 A 8.07 4.10 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 27 G 8.62 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 N 7.79 5.26 0.00 2.64 2.70 0.00 0.00 6.70 7.68 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 29 V 8.75 4.02 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 0.76 0.00 0.00 0.96 0.00 0.00 30 H 9.25 4.19 0.00 3.06 3.12 0.00 5.70 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 31 G 8.96 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 32 G 8.03 3.69 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 0.00 0.00 0.00 33 T 7.72 3.90 4.42 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 1.29 0.00 0.00 34 I 7.69 3.78 2.10 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 1.65 1.00 1.17 0.00 0.00 35 L 8.33 4.09 0.00 1.89 1.80 0.98 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 36 K 8.22 3.96 0.00 1.93 2.00 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.46 1.51 7.81 37 M 8.03 4.62 0.00 2.15 2.26 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 2.77 2.46 0.00 38 I 8.07 3.74 2.11 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.91 0.97 0.00 0.00 39 E 8.35 4.15 0.00 2.21 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 2.46 2.57 0.00 40 E 8.47 3.96 0.00 2.26 2.01 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 2.36 2.53 0.00 41 A 8.18 4.09 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 42 G 8.51 3.64 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 0.00 0.00 0.00 43 A 8.22 3.51 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 44 I 7.49 3.54 1.95 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 1.37 0.73 0.87 0.00 0.00 45 I 7.49 3.64 1.79 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.28 0.88 0.00 0.00 46 S 7.81 4.01 0.00 3.94 3.74 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 47 T 7.62 3.78 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 1.23 0.00 0.00 48 R 7.97 3.99 0.00 1.90 1.89 0.00 3.06 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 49 H 8.08 4.09 0.00 3.26 3.37 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 C 8.13 4.32 0.00 2.98 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 51 N 7.69 4.83 0.00 2.62 2.78 0.00 0.00 6.61 7.40 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 52 S 7.79 4.41 0.00 3.98 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 53 Q 7.53 4.53 0.00 2.01 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.40 0.00 0.00 0.00 0.00 0.00 2.25 2.22 0.00 54 N 7.92 4.14 0.00 2.79 2.86 0.00 0.00 6.83 8.96 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 55 G 7.15 3.85 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 0.00 0.00 0.00 56 E 8.61 3.92 0.00 1.94 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 2.30 2.35 0.00 57 R 8.55 4.42 0.00 1.77 1.84 0.00 3.31 0.00 0.00 3.38 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.58 0.00 58 C 8.81 5.33 0.00 3.04 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 59 V 8.64 4.55 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 1.06 0.00 0.00 0.94 0.00 0.00 60 A 8.73 4.77 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 61 A 9.14 4.91 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 62 L 8.69 3.68 0.00 1.52 1.54 0.47 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 63 A 8.86 4.57 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 64 R 7.66 4.60 0.00 1.85 1.86 0.00 2.99 0.00 0.00 3.08 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.64 0.00 65 V 8.29 4.63 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 0.91 0.00 0.00 0.94 0.00 0.00 66 E 9.07 4.41 0.00 2.01 1.94 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 2.69 2.63 0.00 67 R 8.56 3.94 0.00 1.80 1.90 0.00 3.18 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 1.66 1.66 0.00 68 T 8.17 4.56 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 69 D 8.32 4.88 0.00 2.61 2.52 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 70 F 8.71 4.63 0.00 3.07 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 71 L 8.73 4.42 0.00 1.80 1.73 0.90 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 72 S 7.62 4.71 0.00 3.94 3.80 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 73 P 0.00 4.63 0.00 2.10 2.10 0.00 3.72 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 74 M 8.54 4.98 0.00 2.09 1.94 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 2.57 2.54 0.00 75 C 8.96 5.34 0.00 2.90 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 76 I 7.92 3.93 1.86 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 1.22 0.61 0.95 0.00 0.00 77 G 9.08 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 78 E 7.99 4.38 0.00 2.12 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.26 0.00 79 V 8.91 4.66 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 0.84 0.00 0.00 0.93 0.00 0.00 80 A 9.01 4.77 1.27 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 0.00 0.00 81 H 9.51 5.25 0.00 3.09 3.24 0.00 5.75 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 82 V 9.13 4.93 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 0.97 0.00 0.00 83 S 9.31 4.93 0.00 3.86 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 84 A 8.55 5.29 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 85 E 8.92 4.58 0.00 1.97 1.71 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 2.15 2.23 0.00 86 I 8.41 4.39 1.69 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 1.27 0.53 0.74 0.00 0.00 87 T 8.44 4.51 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 1.32 0.00 0.00 88 Y 7.58 5.19 0.00 3.17 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 89 T 7.42 4.92 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 1.02 0.00 0.00 90 S 8.39 4.41 0.00 3.24 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 91 K 8.56 3.94 0.00 1.76 1.77 0.00 1.64 0.00 0.00 1.83 0.00 0.00 2.88 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.05 1.34 7.81 92 H 8.13 5.21 0.00 3.21 3.28 0.00 5.70 0.00 0.00 0.00 0.00 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 S 8.16 5.17 0.00 4.27 4.12 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 94 V 9.28 4.73 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 0.94 0.00 0.00 0.99 0.00 0.00 95 E 9.24 4.07 0.00 1.16 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.47 0.00 96 V 8.64 4.73 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 0.75 0.00 0.00 0.92 0.00 0.00 97 Q 8.97 5.00 0.00 2.03 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.53 0.00 0.00 0.00 0.00 0.00 2.25 2.23 0.00 98 V 9.11 4.89 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 1.15 0.00 0.00 0.97 0.00 0.00 99 H 9.48 5.34 0.00 3.04 3.16 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 0.00 100 V 8.80 4.87 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 1.10 0.00 0.00 0.98 0.00 0.00 101 M 9.15 5.30 0.00 2.10 1.86 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.49 0.00 102 S 8.99 5.22 0.00 3.95 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 0.00 103 E 9.26 5.00 0.00 2.05 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 2.21 2.23 0.00 104 N 9.33 5.06 0.00 2.78 2.70 0.00 0.00 6.52 7.54 0.00 0.00 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 I 8.53 4.15 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 1.42 0.73 0.93 0.00 0.00 106 L 8.13 4.29 0.00 1.76 1.76 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 107 T 8.27 4.12 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 1.24 0.00 0.00 108 G 8.40 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 0.00 109 T 7.84 4.09 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 1.22 0.00 0.00 110 K 8.66 5.20 0.00 1.59 1.67 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.80 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.31 1.60 7.81 111 K 8.87 4.69 0.00 1.66 1.64 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.82 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.37 7.81 112 L 8.52 4.35 0.00 1.65 1.59 1.04 0.96 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 0.00 113 T 9.20 4.27 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 114 N 7.72 4.82 0.00 2.62 2.52 0.00 0.00 6.90 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 K 8.46 4.97 0.00 1.49 1.47 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.77 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.98 1.28 7.81 116 A 9.11 4.77 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 0.00 117 T 8.43 5.00 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 1.12 0.00 0.00 118 L 9.16 5.28 0.00 1.59 1.37 1.12 0.75 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 0.00 119 W 9.07 5.29 0.00 3.23 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 0.00 120 Y 9.41 5.27 0.00 2.89 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 0.00 121 V 8.74 4.79 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 1.20 0.00 0.00 1.05 0.00 0.00 122 P 0.00 5.02 0.00 2.19 2.20 0.00 3.95 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.05 0.00 123 L 8.81 5.23 0.00 1.61 1.60 1.00 0.99 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 0.00 124 S 8.79 4.49 0.00 3.95 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 0.00 125 L 8.83 4.15 0.00 1.75 1.72 0.92 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 126 K 7.76 4.07 0.00 1.73 1.87 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.37 7.81 127 N 7.70 4.67 0.00 2.72 2.66 0.00 0.00 6.66 7.59 0.00 0.00 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 V 8.38 3.64 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 0.87 0.00 0.00 0.94 0.00 0.00 129 D 8.07 4.53 0.00 2.88 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 0.00 130 K 7.96 4.35 0.00 1.85 1.82 0.00 1.63 0.00 0.00 1.73 0.00 0.00 2.77 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.38 7.81 131 V 8.33 4.41 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 0.85 0.00 0.00 0.94 0.00 0.00 132 L 8.49 4.76 0.00 1.60 1.59 0.95 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 133 E 8.67 4.35 0.00 1.85 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 2.26 2.36 0.00 134 V 8.53 4.20 2.24 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 0.79 0.00 0.00 1.00 0.00 0.00 135 P 0.00 4.36 0.00 1.87 1.88 0.00 3.60 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 2.02 1.99 0.00 136 P 0.00 4.40 0.00 2.16 2.03 0.00 3.71 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 1.96 1.93 0.00 137 I 7.69 4.20 1.47 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 0.89 -0.29 0.56 0.00 0.00 138 V 7.80 3.99 2.01 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 0.83 0.00 0.00 0.90 0.00 0.00 139 Y 8.36 4.54 0.00 3.06 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 0.00 140 L 8.79 4.06 0.00 1.67 1.75 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 141 R 8.38 4.74 0.00 1.88 1.80 0.00 3.16 0.00 0.00 3.29 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 142 Q 8.80 3.96 0.00 2.12 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.86 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 143 E 8.17 4.22 0.00 2.22 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 0.00 2.37 2.28 0.00 144 Q 7.89 4.03 0.00 2.40 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.84 0.00 0.00 0.00 0.00 0.00 2.45 2.41 0.00 145 E 7.52 3.25 0.00 1.16 1.61 0.00 0.00 0.00 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 1.84 0.00 146 E 7.93 3.93 0.00 2.14 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 2.36 2.49 0.00 147 E 8.26 4.10 0.00 2.18 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 2.32 2.39 0.00 148 G 8.24 3.47 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 0.00 0.00 0.00 149 R 7.91 3.45 0.00 2.03 2.07 0.00 3.18 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.85 0.00 150 K 7.89 3.97 0.00 1.97 1.82 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.54 1.61 7.81 151 R 7.81 3.95 0.00 2.15 2.21 0.00 3.23 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.87 0.00 152 Y 8.11 4.01 0.00 3.33 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 0.00 153 E 8.21 3.52 0.00 1.97 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 2.52 2.49 0.00 154 A 7.86 3.90 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 0.00 155 Q 7.83 3.84 0.00 2.08 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.75 0.00 0.00 0.00 0.00 0.00 1.86 2.19 0.00 156 K 7.42 3.72 0.00 1.40 1.57 0.00 1.56 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.04 0.56 7.81 157 L 7.73 4.05 0.00 1.62 1.64 0.86 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 158 E 7.56 4.16 0.00 2.02 2.01 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 2.27 2.30 0.00 159 R 7.43 4.25 0.00 1.76 1.81 0.00 3.07 0.00 0.00 3.12 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.70 0.00 160 M 7.66 4.42 0.00 1.92 2.01 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.64 0.00 161 E 8.19 4.09 0.00 2.10 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 2.18 2.26 0.00