NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 17 A 4.3274 8.2644 123.5830 52.0314 18.8399 176.1749 18 R 3.8545 8.5240 122.2428 58.1238 30.4183 174.4656 19 S 4.5886 7.5313 108.9242 56.9566 66.8054 173.9135 20 L 4.4336 8.7509 122.7249 55.0628 42.2498 175.9854 21 S 4.7719 8.6543 119.7014 57.2362 66.6738 172.7406 22 I 4.9695 8.1630 121.2985 59.9874 39.2480 175.5476 23 T 3.9614 8.5832 123.0684 64.4888 68.9386 173.0249 24 T 3.2583 8.7858 126.9592 63.2062 65.3229 169.8314 25 P 4.5866 0.0000 0.0000 63.7412 32.8170 175.4008 26 E 5.3899 7.7961 120.4236 54.6836 32.8732 173.5580 27 E 4.7942 8.5344 124.8108 55.3048 33.3909 172.9043 28 M 5.2676 8.6758 124.8155 53.8592 35.0739 174.6967 29 I 4.6474 8.8153 125.8522 59.6854 41.0774 173.9099 30 E 5.1139 8.9090 126.4886 54.7374 31.3361 175.6709 31 K 4.7652 8.6791 121.8384 54.5732 37.0924 175.8209 32 A 4.3286 9.0001 125.3015 51.3102 19.8891 176.9015 33 K 3.9323 8.6784 122.8183 58.0312 32.0418 175.4494 34 G 4.2034 8.9068 115.6542 45.8812 0.0000 173.7529 35 E 4.2114 7.9127 118.2565 56.5371 30.8338 176.2623 36 T 5.0626 8.3581 111.1153 60.1834 71.1545 173.4937 37 A 4.6566 8.3393 125.6556 50.5066 21.5543 175.1135 38 Y 4.7358 8.6142 123.9179 56.4000 39.8577 175.3127 39 L 4.3997 8.5468 129.6123 52.3579 42.5132 174.1534 40 P 4.2041 0.0000 0.0000 62.6729 32.4496 177.8669 41 C 5.0165 9.3325 123.0954 55.5605 46.0012 172.1920 42 K 5.2555 8.3046 122.2927 55.0053 34.2405 175.4338 43 F 5.4340 8.3919 117.4955 55.8905 40.8066 173.9368 44 T 4.4737 8.6719 117.7341 62.6653 70.5395 174.2964 45 L 4.6835 8.3462 124.2042 53.5077 44.5915 175.1946 46 S 4.8796 8.5187 113.2903 55.9305 65.4235 173.0620 47 P 4.3155 0.0000 0.0000 65.5753 31.2381 177.9548 48 E 4.0679 8.1576 115.2227 58.6719 29.5911 177.2495 49 D 4.8008 7.7654 120.2309 53.3295 39.1984 175.6956 50 Q 4.4447 8.1370 120.0311 55.3152 30.3098 176.1583 51 G 3.8882 7.9284 107.7423 44.1591 0.0000 171.3748 52 P 4.4210 0.0000 0.0000 62.0932 32.0088 175.2477 53 L 4.2443 8.3493 123.2270 55.4704 42.9810 176.4951 54 D 4.8912 9.2460 125.9008 52.9457 42.6725 172.8374 55 I 4.9220 8.9117 124.7743 59.5380 39.6546 174.3234 56 E 5.3509 8.8610 122.6654 54.7576 33.6203 173.8408 57 W 5.1669 9.0933 121.0949 55.0941 31.9713 175.0100 58 L 5.2897 9.1610 123.5350 52.8729 45.5797 175.0527 59 I 4.3640 8.5646 120.7394 59.2382 41.1838 174.4806 60 S 4.9129 9.0522 126.2983 56.1779 63.8933 171.7556 61 P 4.8588 0.0000 0.0000 62.4220 31.7295 176.5963 62 A 3.8125 8.8543 123.5949 54.3760 18.6022 177.9741 63 D 4.1242 8.6553 114.7820 56.7656 41.1759 177.2917 64 N 5.2092 7.5981 113.5931 50.5229 40.9775 175.3291 65 Q 4.1379 8.8909 116.9927 58.9410 28.7225 178.4373 66 K 4.2314 7.1685 115.7086 57.0254 33.1112 175.9281 67 V 4.3209 7.8116 117.6314 60.8918 34.5913 173.9254 68 D 4.2347 8.0875 118.3695 55.6440 38.4486 173.4092 69 Q 4.5950 8.1611 117.5675 53.4657 32.0006 176.8976 70 V 4.0759 8.5617 124.7640 63.6553 31.6013 175.0673 71 I 4.6705 8.6508 119.6704 62.0773 39.7955 175.3875 72 I 5.2099 7.7575 120.5266 59.2907 42.0093 173.6112 73 L 5.5185 9.6363 125.3439 53.3912 46.8338 174.8462 74 Y 5.3708 9.5571 124.0260 56.0791 41.3629 174.3546 75 S 4.6020 8.7513 120.4159 57.1687 67.1129 174.1186 76 G 4.0999 9.5913 107.9046 46.5613 0.0000 172.5854 77 D 4.4599 7.6362 113.4356 54.4042 39.7636 173.2028 78 K 4.5194 7.4479 114.6974 53.9584 35.9483 175.3201 79 I 4.9385 7.9651 121.8328 59.9512 38.7950 174.8317 80 Y 4.7651 8.9131 123.2886 56.4289 39.7340 175.9126 81 D 4.8746 8.5940 120.9725 52.9846 41.1416 175.0289 82 D 4.8910 7.4725 118.5683 54.4916 41.7639 176.7970 83 Y 4.4003 8.1159 116.6232 59.7999 39.0091 175.7555 84 Y 4.6282 7.9182 123.3090 55.4072 39.2911 173.9420 85 P 4.2240 0.0000 0.0000 65.6174 31.7446 178.8151 86 D 4.3024 7.4131 116.8728 56.5899 41.0845 176.9480 87 L 4.6572 7.7321 117.8267 54.0061 41.9300 175.8273 88 K 4.0337 7.5218 120.6165 58.1679 32.1829 177.1799 89 G 3.9907 9.0776 113.5079 45.9183 0.0000 173.4042 90 R 4.7046 8.2165 116.0049 55.2400 32.8540 174.5632 91 V 4.7767 7.7520 119.2306 61.4223 33.6823 174.4510 92 H 4.8613 8.4309 122.9443 54.2563 33.6199 172.8350 93 F 4.7145 8.7577 120.9527 57.8291 39.0869 175.7688 94 T 4.1642 9.0396 113.6328 63.5950 69.4824 175.2443 95 S 4.4828 8.0439 117.2243 57.1092 62.6406 172.6680 96 N 4.8202 8.7056 125.4627 53.0762 37.8434 175.7084 97 D 4.6837 7.6502 117.6074 53.7811 41.7639 175.1928 98 L 4.1634 7.6695 124.8007 56.7517 42.9246 177.8390 99 K 4.3844 7.8566 115.0792 57.6831 32.9421 177.0449 100 S 4.4648 7.2567 114.6869 58.8638 62.8882 174.3760 101 G 2.6095 7.5226 109.9773 44.9074 0.0000 173.4639 102 D 4.8811 7.6121 118.9256 52.1228 41.4057 174.4084 103 A 4.7510 9.2313 124.8179 51.8775 19.4385 177.4439 104 S 4.6785 9.0843 114.9794 59.5737 64.1006 173.7572 105 I 4.8879 7.8233 116.4943 58.8512 40.9032 173.8602 106 N 5.7628 8.7541 119.4452 50.2094 41.0797 173.7661 107 V 4.5458 8.0311 121.2024 61.3196 32.6812 174.8369 108 T 4.1973 8.4634 118.0889 61.0138 69.7131 173.9176 109 N 4.3151 8.3858 118.4265 52.9000 37.1764 174.0879 110 L 4.3057 7.8129 119.3443 55.7321 43.1569 177.2449 111 Q 4.7419 8.6818 118.4311 53.9286 33.2222 176.2259 112 L 4.0500 8.6243 119.3453 58.0931 41.7209 179.9578 113 S 4.6576 7.8917 110.7964 60.0552 63.1508 174.6386 114 D 4.7004 8.1321 119.9605 55.4659 41.0729 176.5594 115 I 4.0074 7.8023 121.7077 61.2021 38.2026 175.9877 116 G 4.2925 8.0200 114.3961 46.6411 0.0000 170.9505 117 T 5.0739 7.9403 116.9693 62.8288 69.9555 174.2383 118 Y 5.1346 9.4336 124.6148 56.5529 40.9405 174.6199 119 Q 4.7454 9.3834 123.3064 54.7248 33.0049 172.9865 120 C 4.0130 8.7309 127.4248 54.3909 40.2708 171.7425 121 K 4.6388 8.2764 125.3987 55.4951 33.1521 176.1553 122 V 4.1921 8.7006 124.3615 61.0568 34.4148 174.0523 123 K 4.7521 8.4951 127.6167 54.6732 35.2082 175.9960 124 K 4.9232 9.0785 125.5564 54.7441 34.3957 174.1678 125 A 4.4066 8.6657 128.4688 51.5270 19.3440 175.5605 126 P 4.7354 0.0000 0.0000 62.7292 31.9084 176.4101 127 G 3.8768 7.9949 108.9609 45.7612 0.0000 173.3160 128 V 4.8864 7.7619 120.6355 61.5548 34.8649 173.4371 129 A 4.6704 8.3551 124.8468 51.4255 22.8788 174.9422 130 N 5.9359 8.7236 116.5697 51.8790 40.5302 173.3150 131 K 4.8835 8.3046 117.7037 55.1615 37.1593 174.7404 132 K 5.0790 8.8389 119.4164 54.6430 35.9127 175.3915 133 I 4.9160 9.0557 124.7316 59.8676 40.4133 174.1954 134 H 5.1258 9.4609 125.4538 54.7621 30.2342 173.9958 135 L 5.1263 8.9234 125.8431 53.1935 44.9688 174.9498 136 V 4.4878 8.3359 126.1393 61.1805 33.4989 174.8016 137 V 4.7378 8.3540 127.7133 61.7122 32.8355 174.8897 138 L 4.8876 8.0884 123.8992 52.7858 46.4855 176.8724 139 V 3.7023 8.1680 119.7253 62.9730 31.5091 175.7851 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 17 A 8.26 4.33 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 18 R 8.52 3.85 0.00 1.87 1.97 0.00 3.28 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 19 S 7.53 4.59 0.00 3.91 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 20 L 8.75 4.43 0.00 1.87 1.65 0.90 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.65 4.77 0.00 3.90 3.89 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 22 I 8.16 4.97 1.87 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.62 1.01 0.00 0.00 23 T 8.58 3.96 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 1.24 0.00 0.00 24 T 8.79 3.26 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 1.26 0.00 0.00 25 P 0.00 4.59 0.00 2.18 2.27 0.00 3.41 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.07 0.00 26 E 7.80 5.39 0.00 1.94 1.80 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 2.21 2.11 0.00 27 E 8.53 4.79 0.00 2.06 1.72 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 2.31 2.32 0.00 28 M 8.68 5.27 0.00 2.07 1.96 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 2.64 2.56 0.00 29 I 8.82 4.65 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 1.25 1.16 0.92 0.00 0.00 30 E 8.91 5.11 0.00 1.85 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 31 K 8.68 4.77 0.00 1.64 1.62 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.52 7.81 32 A 9.00 4.33 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.68 3.93 0.00 1.90 1.74 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.41 7.81 34 G 8.91 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 0.00 0.00 0.00 0.00 35 E 7.91 4.21 0.00 2.13 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 2.32 2.26 0.00 36 T 8.36 5.06 4.21 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 1.19 0.00 0.00 37 A 8.34 4.66 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 38 Y 8.61 4.74 0.00 2.87 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 39 L 8.55 4.40 0.00 0.99 1.47 0.24 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 4.20 0.00 2.09 1.96 0.00 3.68 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.98 0.00 41 C 9.33 5.02 0.00 3.14 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 42 K 8.30 5.26 0.00 1.79 1.68 0.00 1.75 0.00 0.00 1.89 0.00 0.00 3.17 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.53 1.51 7.81 43 F 8.39 5.43 0.00 2.98 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 44 T 8.67 4.47 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 1.21 0.00 0.00 45 L 8.35 4.68 0.00 1.56 1.66 1.07 0.91 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 46 S 8.52 4.88 0.00 3.95 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 47 P 0.00 4.32 0.00 2.08 2.12 0.00 3.74 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 48 E 8.16 4.07 0.00 2.09 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 0.00 2.32 2.29 0.00 49 D 7.77 4.80 0.00 2.86 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 8.14 4.44 0.00 2.02 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.99 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 51 G 7.93 3.89 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 0.00 0.00 0.00 52 P 0.00 4.42 0.00 2.24 2.19 0.00 3.70 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 2.07 1.95 0.00 53 L 8.35 4.24 0.00 1.77 1.76 0.95 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 54 D 9.25 4.89 0.00 2.70 2.45 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 55 I 8.91 4.92 2.11 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.85 1.12 0.00 0.00 56 E 8.86 5.35 0.00 2.09 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 0.00 2.14 2.27 0.00 57 W 9.09 5.17 0.00 3.34 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 58 L 9.16 5.29 0.00 1.53 1.44 0.86 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.56 4.36 1.23 0.00 0.00 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 0.77 0.21 0.08 0.00 0.00 60 S 9.05 4.91 0.00 3.68 3.73 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 61 P 0.00 4.86 0.00 2.12 2.05 0.00 3.93 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.05 0.00 62 A 8.85 3.81 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 63 D 8.66 4.12 0.00 2.76 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 64 N 7.60 5.21 0.00 2.83 2.92 0.00 0.00 5.97 7.44 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 65 Q 8.89 4.14 0.00 2.06 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 7.07 0.00 0.00 0.00 0.00 0.00 2.38 2.33 0.00 66 K 7.17 4.23 0.00 2.02 1.84 0.00 1.66 0.00 0.00 1.80 0.00 0.00 3.24 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.64 1.43 7.81 67 V 7.81 4.32 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 0.69 0.00 0.00 0.90 0.00 0.00 68 D 8.09 4.23 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 69 Q 8.16 4.59 0.00 1.85 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.96 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 70 V 8.56 4.08 1.78 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 0.53 0.00 0.00 0.74 0.00 0.00 71 I 8.65 4.67 1.96 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.94 0.81 0.00 0.00 72 I 7.76 5.21 1.76 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.62 0.60 0.00 0.00 73 L 9.64 5.52 0.00 2.18 1.91 0.95 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 74 Y 9.56 5.37 0.00 2.90 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 75 S 8.75 4.60 0.00 3.95 3.98 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 76 G 9.59 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 D 7.64 4.46 0.00 2.77 2.72 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 78 K 7.45 4.52 0.00 1.49 1.10 0.00 1.68 0.00 0.00 1.53 0.00 0.00 2.92 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.24 1.30 7.81 79 I 7.97 4.94 1.95 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.74 1.29 0.00 0.00 80 Y 8.91 4.77 0.00 3.28 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 D 8.59 4.87 0.00 2.68 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 82 D 7.47 4.89 0.00 2.48 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 83 Y 8.12 4.40 0.00 3.23 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 Y 7.92 4.63 0.00 3.24 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 85 P 0.00 4.22 0.00 2.03 1.99 0.00 3.09 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.05 0.00 86 D 7.41 4.30 0.00 2.34 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 87 L 7.73 4.66 0.00 1.83 1.74 1.13 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 88 K 7.52 4.03 0.00 1.83 1.76 0.00 1.84 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.52 7.81 89 G 9.08 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 90 R 8.22 4.70 0.00 1.86 2.07 0.00 3.24 0.00 0.00 3.10 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.76 0.00 91 V 7.75 4.78 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 0.56 0.00 0.00 0.99 0.00 0.00 92 H 8.43 4.86 0.00 3.04 3.11 0.00 5.86 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 F 8.76 4.71 0.00 2.99 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 94 T 9.04 4.16 4.39 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 1.38 0.00 0.00 95 S 8.04 4.48 0.00 3.92 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 96 N 8.71 4.82 0.00 2.86 2.90 0.00 0.00 5.98 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 97 D 7.65 4.68 0.00 2.59 2.49 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 98 L 7.67 4.16 0.00 1.61 1.28 -0.46 -1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 99 K 7.86 4.38 0.00 1.99 1.97 0.00 1.68 0.00 0.00 1.81 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.47 7.81 100 S 7.26 4.46 0.00 3.93 3.84 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 0.00 101 G 7.52 2.61 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 0.00 0.00 0.00 0.00 0.00 0.00 102 D 7.61 4.88 0.00 2.57 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 0.00 103 A 9.23 4.75 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.08 4.68 0.00 3.92 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 0.00 105 I 7.82 4.89 1.26 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.07 -0.24 0.00 0.00 106 N 8.75 5.76 0.00 2.79 2.94 0.00 0.00 6.36 8.53 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 0.00 107 V 8.03 4.55 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 0.99 0.00 0.00 0.62 0.00 0.00 108 T 8.46 4.20 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 1.17 0.00 0.00 109 N 8.39 4.32 0.00 2.81 2.83 0.00 0.00 7.35 7.78 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 0.00 110 L 7.81 4.31 0.00 1.82 1.60 0.92 0.59 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 0.00 111 Q 8.68 4.74 0.00 2.11 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.75 0.00 0.00 0.00 0.00 0.00 2.28 2.47 0.00 112 L 8.62 4.05 0.00 1.73 1.76 0.93 0.64 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 0.00 113 S 7.89 4.66 0.00 4.15 4.03 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 0.00 0.00 0.00 0.00 114 D 8.13 4.70 0.00 2.87 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 I 7.80 4.01 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.79 0.95 0.00 0.00 116 G 8.02 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 0.00 0.00 0.00 0.00 117 T 7.94 5.07 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 1.28 0.00 0.00 118 Y 9.43 5.13 0.00 2.96 3.18 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 0.00 119 Q 9.38 4.75 0.00 2.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.77 0.00 0.00 0.00 0.00 0.00 2.12 2.28 0.00 120 C 8.73 4.01 0.00 1.23 2.30 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 0.00 121 K 8.28 4.64 0.00 1.64 1.59 0.00 1.58 0.00 0.00 1.50 0.00 0.00 2.74 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.34 1.28 7.81 122 V 8.70 4.19 1.69 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 -0.05 0.00 0.00 0.46 0.00 0.00 123 K 8.50 4.75 0.00 1.87 1.62 0.00 1.68 0.00 0.00 1.54 0.00 0.00 2.76 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.29 1.27 7.81 124 K 9.08 4.92 0.00 1.81 1.65 0.00 1.79 0.00 0.00 1.89 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.32 7.81 125 A 8.67 4.41 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 P 0.00 4.74 0.00 2.18 2.14 0.00 3.97 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 127 G 7.99 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 V 7.76 4.89 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 0.72 0.00 0.00 0.95 0.00 0.00 129 A 8.36 4.67 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 0.00 130 N 8.72 5.94 0.00 2.56 2.61 0.00 0.00 6.16 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 0.00 131 K 8.30 4.88 0.00 1.81 1.84 0.00 1.52 0.00 0.00 1.93 0.00 0.00 2.86 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.21 1.31 7.81 132 K 8.84 5.08 0.00 1.63 1.63 0.00 1.60 0.00 0.00 1.68 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.31 1.33 7.81 133 I 9.06 4.92 2.02 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 1.27 0.77 0.93 0.00 0.00 134 H 9.46 5.13 0.00 3.10 3.25 0.00 5.56 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 8.92 5.13 0.00 1.75 1.69 0.93 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 136 V 8.34 4.49 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 0.97 0.00 0.00 137 V 8.35 4.74 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 1.20 0.00 0.00 1.03 0.00 0.00 138 L 8.09 4.89 0.00 1.58 1.48 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 139 V 8.17 3.70 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 0.75 0.00 0.00 0.94 0.00 0.00