NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 C 5.0033 8.2976 118.1038 56.3338 42.0463 172.5384 4 S 3.9755 7.6941 111.2315 55.4442 66.0648 167.9423 5 V 4.4548 8.8633 119.9431 60.3839 35.3890 174.4024 6 D 5.1771 8.5045 122.2447 52.8613 42.5384 175.6462 7 I 4.8179 8.6937 123.0826 59.2738 42.0102 173.7794 8 Q 5.3233 9.5404 126.3601 54.0812 32.4564 174.6741 9 G 4.7630 9.0862 109.5038 44.4139 0.0000 171.9042 10 N 5.8414 8.2103 121.3684 50.2184 40.6593 174.5923 11 D 4.6042 8.9013 116.8156 56.2628 41.0861 177.0280 12 Q 4.4392 8.2466 117.7335 55.2615 28.9905 175.3677 13 M 3.0261 7.5602 115.6813 56.9215 30.1610 177.1034 14 Q 4.5882 7.7643 115.9662 53.9679 32.0913 175.8135 15 F 5.7417 8.8670 120.8721 56.8192 39.8212 175.2139 16 N 4.8164 8.8859 119.8031 53.4992 37.7188 174.5912 17 T 4.7344 7.8277 114.3979 61.8568 70.6417 173.2118 18 N 5.2894 8.8961 122.5827 52.6405 39.8551 174.6488 19 A 5.2692 8.3920 120.2070 51.8910 22.6252 176.1159 20 I 4.6429 9.3678 123.8590 59.7514 40.4156 174.8426 21 T 5.1440 8.5890 122.1403 61.6926 71.5596 173.4837 22 V 4.0701 8.2943 125.4539 60.5993 34.1090 174.5220 23 D 4.6687 8.7021 127.7592 54.0859 41.6907 176.9904 24 K 4.1485 8.5692 125.1763 58.7523 32.2993 178.4038 25 S 4.2583 8.6593 115.0645 60.7685 62.9628 173.9954 26 C 4.4693 8.1198 121.5020 57.3259 41.7764 174.3507 27 K 4.2905 8.7316 128.2819 57.0336 32.6719 173.4444 28 Q 5.0255 7.8918 115.5847 54.2311 32.0621 174.8143 29 F 4.7922 8.4420 121.2289 56.7060 43.4313 173.2805 30 T 4.7793 7.3951 121.1346 61.5571 71.8712 172.8648 31 V 4.2587 8.4537 126.4586 61.0528 33.8203 174.0555 32 N 4.9237 8.7293 126.2990 51.6796 40.0209 173.4624 33 L 5.0502 8.6821 127.5949 53.8873 44.3015 175.5389 34 S 5.0269 8.9379 119.2082 57.5321 67.6647 172.8719 35 H 6.2614 8.4429 118.0931 53.4814 30.4739 170.4947 36 P 4.6002 0.0000 0.0000 62.9282 33.0152 174.4726 37 G 4.0014 8.2404 106.4366 44.3235 0.0000 173.0662 38 N 4.9374 9.6094 114.9397 52.0602 38.6617 174.3269 39 L 4.4523 7.9467 120.3840 53.2319 43.1111 174.7830 40 P 4.8238 0.0000 0.0000 61.8009 33.4507 177.2302 41 K 3.9627 8.4754 118.2479 59.4621 31.8029 177.9509 42 N 4.6042 8.1647 115.5951 54.6807 37.6267 176.2951 43 V 4.4643 7.1462 108.9448 61.0897 34.1951 175.6463 44 M 4.8171 8.3026 119.3253 53.7725 32.4081 174.8999 45 G 3.9837 8.1151 105.5162 46.5326 0.0000 173.5633 46 H 5.4871 9.3401 120.5881 53.7680 32.4579 172.3595 47 N 5.6866 8.8747 117.4314 50.8914 41.6899 172.4673 48 W 5.3707 9.2201 128.0084 55.6906 33.7452 173.9814 49 V 4.4959 7.8919 126.6168 60.6903 34.6048 173.6279 50 L 4.8389 8.1966 129.3465 53.1286 44.5926 175.2803 51 S 5.2218 8.8006 119.7701 57.0570 67.1086 173.6259 52 T 4.2595 8.5860 109.9019 61.2982 69.1493 174.7197 53 A 4.0257 8.7644 125.0739 55.4702 18.0707 180.2324 54 A 3.9129 7.7885 117.6964 55.0826 18.8506 178.7717 55 D 4.4945 7.8933 115.7264 55.9290 41.0337 178.4277 56 M 3.7375 7.6056 119.7477 58.4455 32.0425 177.6853 57 Q 3.8901 7.9396 119.2667 59.2424 29.1760 178.5215 58 G 3.5434 7.9420 106.1606 47.6142 0.0000 175.5996 59 V 3.7742 7.8218 120.6450 65.8117 31.4860 178.3489 60 V 3.6049 7.9427 118.0156 66.3115 31.4208 178.0547 61 T 3.8323 8.0714 115.6618 66.9640 68.1262 176.4899 62 D 4.5195 8.2129 119.5609 57.0754 41.0752 178.7808 63 G 4.2498 8.2954 107.9652 47.7324 0.0000 175.7665 64 M 4.2307 8.4929 121.3672 57.9680 31.7212 178.6744 65 A 3.9571 7.9257 119.9454 54.7176 18.6371 179.2711 66 S 4.3500 8.1590 114.0655 58.7586 63.2735 175.2694 67 G 4.1453 7.8098 107.9545 44.3098 0.0000 173.8782 68 L 2.6637 8.0205 118.8962 57.8537 41.9475 178.7404 69 D 4.3539 7.8606 115.7257 56.2294 41.2229 176.9570 70 K 4.3676 7.7867 117.9599 55.7708 32.2645 176.3137 71 D 4.4131 8.2653 116.6060 55.1602 39.0486 173.3209 72 Y 4.0945 7.6631 114.1460 59.0614 36.0890 170.4427 73 L 5.0152 7.7250 116.4517 52.4814 45.7227 176.8736 74 K 4.3033 8.4849 123.5247 54.8947 32.7704 174.4501 75 P 4.2629 0.0000 0.0000 64.2591 31.6901 175.5487 76 D 4.3826 8.7921 120.3888 55.1811 38.5955 173.3638 77 D 4.4324 7.7300 119.5227 54.1951 41.0965 176.8803 78 S 4.4203 8.6280 121.3997 60.0171 63.4265 175.2276 79 R 4.0415 8.3039 119.9368 57.7135 30.1792 176.5582 80 V 4.1264 7.4564 118.2518 61.7407 31.2415 175.5262 81 I 4.0310 8.5114 129.8122 64.2992 37.5852 176.6986 82 A 4.8526 7.6877 120.8606 51.3931 22.3140 174.9892 83 H 5.5052 8.5493 114.7002 54.7887 31.5199 173.3120 84 T 4.6488 8.8426 111.8955 60.5785 70.6526 173.9495 85 K 4.4797 9.2219 122.5272 56.0313 34.1096 176.2595 86 L 4.7088 8.8943 123.6063 54.8318 42.6632 175.9475 87 I 4.7982 9.1692 119.6635 59.3282 41.1918 175.4429 88 G 4.5781 9.2212 112.6396 44.4021 0.0000 172.9234 89 S 4.4168 8.0758 114.7548 59.4871 63.2257 174.9974 90 G 4.0052 8.7386 111.4224 45.7704 0.0000 173.7849 91 E 4.4531 7.6761 118.4405 55.7269 30.6019 175.6422 92 K 4.9965 8.0732 118.1042 55.3063 36.3917 175.4559 93 D 4.7834 8.9768 121.2663 53.1799 45.0687 174.0340 94 S 5.3757 8.6692 120.1289 56.6689 66.0082 173.7718 95 V 4.5739 8.5302 121.8149 60.2513 34.6233 174.4323 96 T 5.2302 8.6205 119.2817 61.8199 71.4331 173.1336 97 F 5.0844 8.5546 119.3591 54.9638 42.4964 173.2995 98 D 4.8609 8.7898 119.4430 53.5836 41.5660 177.4197 99 V 3.8084 8.5737 127.6161 65.6004 31.7014 177.7048 100 S 4.3799 8.3409 113.2984 60.0261 62.8848 175.4475 101 K 4.0740 8.1259 120.4688 58.3266 31.9579 176.7848 102 L 4.0609 7.7482 119.6975 53.3008 42.1644 176.1703 103 K 4.6587 9.1681 124.2215 54.2072 33.9724 176.1895 104 E 4.1275 8.6429 121.5796 58.3228 29.7111 177.9745 105 G 3.9244 8.9865 111.2095 45.3064 0.0000 172.9201 106 E 4.1661 7.5889 119.4975 54.9487 30.9252 174.7854 107 Q 4.4285 8.3628 125.1529 54.6571 31.1017 173.6700 108 Y 5.1648 8.4012 124.1079 56.6392 40.8154 174.7193 109 M 5.3282 9.2471 122.5662 53.4772 36.2791 174.5314 110 F 5.0267 8.3309 116.9521 55.3603 41.2024 174.2342 111 F 5.3620 7.8076 113.4350 56.6303 41.3976 171.9054 112 C 5.4981 9.0758 120.6307 57.5591 32.5540 174.7917 113 T 3.9636 9.3918 117.8401 64.2284 68.6442 174.1586 114 P 4.0854 0.0000 0.0000 63.9511 31.7043 175.3027 115 H 5.0424 7.2799 115.1229 53.1779 32.4378 172.4948 116 P 4.6046 0.0000 0.0000 62.1539 29.7866 174.6432 117 M 4.9496 7.6540 121.7040 54.2183 36.1214 175.0213 118 K 4.9976 8.7726 121.4570 56.5439 36.0326 174.5547 119 G 3.5139 8.0346 107.6164 45.8924 0.0000 171.8038 120 T 5.1030 8.4687 109.7325 59.8083 71.5056 173.4511 121 L 5.4332 8.6201 125.1518 53.8320 44.7356 175.7372 122 T 4.8529 8.7962 121.9031 61.5843 72.7006 173.2031 123 L 4.5179 8.6101 125.5182 54.1525 42.6427 177.1592 124 K 4.2177 8.9183 122.5205 56.7993 31.5860 176.8884 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 3 C 8.30 5.00 0.00 2.80 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 S 7.69 3.98 0.00 3.60 3.40 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 5 V 8.86 4.45 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 0.69 0.00 0.00 0.89 0.00 0.00 6 D 8.50 5.18 0.00 2.51 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.69 4.82 1.62 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 1.26 1.66 0.55 0.00 0.00 8 Q 9.54 5.32 0.00 2.08 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.53 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 9 G 9.09 4.76 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 0.00 0.00 0.00 10 N 8.21 5.84 0.00 2.86 2.99 0.00 0.00 6.76 8.07 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 11 D 8.90 4.60 0.00 2.72 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 12 Q 8.25 4.44 0.00 2.16 2.09 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 2.31 2.35 0.00 13 M 7.56 3.03 0.00 1.99 2.05 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 2.40 2.11 0.00 14 Q 7.76 4.59 0.00 2.20 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.82 7.08 0.00 0.00 0.00 0.00 0.00 2.33 2.51 0.00 15 F 8.87 5.74 0.00 3.22 3.06 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 0.00 0.00 0.00 16 N 8.89 4.82 0.00 2.89 3.00 0.00 0.00 5.77 7.71 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 17 T 7.83 4.73 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 1.27 0.00 0.00 18 N 8.90 5.29 0.00 2.42 2.73 0.00 0.00 6.30 7.21 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 19 A 8.39 5.27 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 20 I 9.37 4.64 2.02 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 1.18 1.01 0.93 0.00 0.00 21 T 8.59 5.14 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 1.22 0.00 0.00 22 V 8.29 4.07 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 0.67 0.00 0.00 -0.04 0.00 0.00 23 D 8.70 4.67 0.00 2.74 2.55 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 24 K 8.57 4.15 0.00 1.79 1.86 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.63 7.81 25 S 8.66 4.26 0.00 3.96 3.93 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 26 C 8.12 4.47 0.00 3.07 3.29 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 27 K 8.73 4.29 0.00 1.45 1.80 0.00 1.73 0.00 0.00 1.87 0.00 0.00 2.80 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.42 1.00 7.81 28 Q 7.89 5.03 0.00 1.97 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.69 0.00 0.00 0.00 0.00 0.00 2.13 2.19 0.00 29 F 8.44 4.79 0.00 2.70 1.83 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 30 T 7.40 4.78 3.87 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 1.02 0.00 0.00 31 V 8.45 4.26 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 -0.21 0.00 0.00 0.10 0.00 0.00 32 N 8.73 4.92 0.00 2.66 2.64 0.00 0.00 6.17 7.17 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 33 L 8.68 5.05 0.00 1.72 1.69 1.23 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 34 S 8.94 5.03 0.00 3.92 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 35 H 8.44 6.26 0.00 3.26 3.27 0.00 5.72 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 36 P 0.00 4.60 0.00 2.16 2.00 0.00 3.83 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.15 0.00 37 G 8.24 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 38 N 9.61 4.94 0.00 2.73 2.88 0.00 0.00 6.95 8.19 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 39 L 7.95 4.45 0.00 1.84 1.62 0.94 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 4.82 0.00 2.26 2.18 0.00 3.70 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 2.17 2.01 0.00 41 K 8.48 3.96 0.00 1.86 1.86 0.00 1.93 0.00 0.00 1.89 0.00 0.00 2.97 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.52 1.54 7.81 42 N 8.16 4.60 0.00 2.95 2.95 0.00 0.00 5.82 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 43 V 7.15 4.46 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 0.80 0.00 0.00 0.95 0.00 0.00 44 M 8.30 4.82 0.00 1.94 1.97 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.55 0.00 45 G 8.12 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 0.00 0.00 0.00 46 H 9.34 5.49 0.00 3.16 3.21 0.00 5.56 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 N 8.87 5.69 0.00 2.95 3.05 0.00 0.00 5.51 8.88 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 48 W 9.22 5.37 0.00 3.48 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 49 V 7.89 4.50 1.06 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 0.58 0.00 0.00 0.89 0.00 0.00 50 L 8.20 4.84 0.00 1.01 1.22 0.87 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 51 S 8.80 5.22 0.00 4.11 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 52 T 8.59 4.26 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 1.16 0.00 0.00 53 A 8.76 4.03 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 54 A 7.79 3.91 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 55 D 7.89 4.49 0.00 2.88 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 56 M 7.61 3.74 0.00 1.69 1.66 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.79 0.00 57 Q 7.94 3.89 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.68 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 58 G 7.94 3.54 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 0.00 0.00 0.00 0.00 0.00 0.00 59 V 7.82 3.77 2.36 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 1.27 0.00 0.00 1.07 0.00 0.00 60 V 7.94 3.60 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 1.08 0.00 0.00 0.79 0.00 0.00 61 T 8.07 3.83 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 1.20 0.00 0.00 62 D 8.21 4.52 0.00 2.74 2.75 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 0.00 0.00 0.00 0.00 63 G 8.30 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 0.00 0.00 0.00 0.00 64 M 8.49 4.23 0.00 1.99 2.11 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.80 0.00 65 A 7.93 3.96 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 66 S 8.16 4.35 0.00 4.10 3.93 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 67 G 7.81 4.15 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 0.00 68 L 8.02 2.66 0.00 1.42 1.47 0.76 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 69 D 7.86 4.35 0.00 2.64 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 70 K 7.79 4.37 0.00 1.96 1.92 0.00 1.92 0.00 0.00 1.82 0.00 0.00 2.82 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.44 1.00 7.81 71 D 8.27 4.41 0.00 2.84 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 72 Y 7.66 4.09 0.00 3.18 2.88 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 73 L 7.73 5.02 0.00 1.74 1.46 0.81 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 74 K 8.48 4.30 0.00 1.81 1.70 0.00 1.78 0.00 0.00 1.79 0.00 0.00 3.10 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.52 1.44 7.81 75 P 0.00 4.26 0.00 2.09 1.99 0.00 3.89 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 76 D 8.79 4.38 0.00 2.84 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 77 D 7.73 4.43 0.00 2.89 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.63 4.42 0.00 4.04 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 79 R 8.30 4.04 0.00 1.98 2.15 0.00 3.17 0.00 0.00 3.16 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.58 0.00 80 V 7.46 4.13 2.23 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 0.82 0.00 0.00 0.96 0.00 0.00 81 I 8.51 4.03 1.77 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 1.15 0.66 0.64 0.00 0.00 82 A 7.69 4.85 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 83 H 8.55 5.51 0.00 3.15 3.25 0.00 5.72 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 84 T 8.84 4.65 4.48 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 1.33 0.00 0.00 85 K 9.22 4.48 0.00 2.19 1.93 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.82 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.43 1.26 7.81 86 L 8.89 4.71 0.00 1.79 1.71 1.18 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 87 I 9.17 4.80 1.94 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.77 0.98 0.00 0.00 88 G 9.22 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.08 4.42 0.00 4.10 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 G 8.74 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 E 7.68 4.45 0.00 2.16 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 2.33 2.27 0.00 92 K 8.07 5.00 0.00 1.57 1.63 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.43 7.81 93 D 8.98 4.78 0.00 2.80 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 94 S 8.67 5.38 0.00 3.69 3.61 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 95 V 8.53 4.57 2.25 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 1.00 0.00 0.00 1.12 0.00 0.00 96 T 8.62 5.23 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 1.14 0.00 0.00 97 F 8.55 5.08 0.00 3.07 3.16 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 98 D 8.79 4.86 0.00 2.75 2.68 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 99 V 8.57 3.81 2.28 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 0.95 0.00 0.00 0.78 0.00 0.00 100 S 8.34 4.38 0.00 4.05 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 0.00 101 K 8.13 4.07 0.00 2.21 1.90 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.47 1.28 7.81 102 L 7.75 4.06 0.00 1.70 1.47 0.92 -0.25 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 0.00 103 K 9.17 4.66 0.00 1.88 1.78 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.64 1.61 7.81 104 E 8.64 4.13 0.00 1.98 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 2.35 2.29 0.00 105 G 8.99 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 0.00 106 E 7.59 4.17 0.00 1.86 1.77 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 1.92 1.47 0.00 107 Q 8.36 4.43 0.00 2.02 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.55 0.00 0.00 0.00 0.00 0.00 2.18 2.24 0.00 108 Y 8.40 5.16 0.00 3.20 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 0.00 109 M 9.25 5.33 0.00 1.90 2.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.56 0.00 110 F 8.33 5.03 0.00 1.69 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 F 7.81 5.36 0.00 3.14 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 C 9.08 5.50 0.00 3.19 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 0.00 113 T 9.39 3.96 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 1.46 0.00 0.00 114 P 0.00 4.09 0.00 1.67 1.31 0.00 3.74 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.95 0.00 115 H 7.28 5.04 0.00 3.10 3.15 0.00 5.67 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 0.00 116 P 0.00 4.60 0.00 2.16 2.07 0.00 3.73 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.97 0.00 117 M 7.65 4.95 0.00 1.41 1.77 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.40 0.00 118 K 8.77 5.00 0.00 1.75 1.76 0.00 1.52 0.00 0.00 1.63 0.00 0.00 2.72 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.28 1.36 7.81 119 G 8.03 3.51 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 0.00 120 T 8.47 5.10 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 1.19 0.00 0.00 121 L 8.62 5.43 0.00 2.00 1.73 1.19 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 122 T 8.80 4.85 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 1.25 0.00 0.00 123 L 8.61 4.52 0.00 1.56 1.61 0.96 0.90 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 0.00 124 K 8.92 4.22 0.00 1.59 1.74 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.48 1.43 7.81