NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2971 8.2644 123.5878 53.1678 19.9389 174.8640 2 S 5.3729 8.0367 120.0359 57.0389 64.3980 175.4745 3 N 4.7532 8.8680 124.5522 53.3499 38.9502 175.4179 4 F 4.9515 7.6507 122.5034 57.3129 37.6863 173.9529 5 T 4.8868 7.9541 113.0213 58.8553 72.1352 174.6028 6 Q 4.8946 8.5785 120.4040 56.7266 29.8621 174.7913 7 F 4.9310 8.4653 114.4270 55.7948 42.0875 173.3224 8 V 4.1278 8.3708 119.9729 62.0658 31.0236 175.4657 9 L 4.0685 8.2987 131.4906 56.9553 42.4301 176.9605 10 V 4.0930 7.3103 118.6016 60.8044 33.0727 173.6552 11 D 4.8808 8.6484 128.0126 53.6180 40.7637 175.3636 12 N 4.8778 9.5664 126.1980 52.9827 39.6075 174.9293 13 G 3.6240 8.9628 104.1023 46.8048 0.0000 176.5736 14 G 4.0315 8.6823 109.3805 44.9019 0.0000 173.8203 15 T 4.2918 7.8808 109.3398 62.3220 69.4755 173.9609 16 G 3.9229 8.8972 114.6048 45.0133 0.0000 171.9754 17 D 4.5590 7.7444 119.0229 54.0840 41.7549 175.8393 18 V 3.9997 8.3534 123.4909 61.7603 33.1780 174.5732 19 T 4.9146 8.2548 124.0356 61.7211 71.8648 173.4489 20 V 4.8204 8.0723 117.7015 59.4845 35.1903 174.6129 21 A 5.2604 8.8044 124.6351 49.1408 22.8442 173.6873 22 P 4.1567 0.0000 0.0000 63.4110 31.1437 176.4771 23 S 4.5850 8.9011 116.5953 57.7414 64.7775 173.4336 24 N 4.4816 7.5841 116.2745 53.0590 41.8939 174.3139 25 F 5.4961 9.0945 122.9967 56.9243 41.1138 174.2983 26 A 4.0822 8.9763 123.2842 53.2172 18.5418 178.1984 27 N 4.3144 9.4223 117.8475 54.3948 36.1105 174.8996 28 G 3.8393 8.3606 102.2851 46.3115 0.0000 174.3071 29 V 4.5238 7.6218 119.9804 60.4148 33.3739 174.6844 30 A 3.7668 8.5365 131.2193 51.7104 19.4108 175.6959 31 E 5.3746 9.2520 122.4303 54.3318 33.6371 174.3461 32 W 5.6910 9.9744 125.4959 55.1748 33.5152 174.3180 33 I 5.8368 8.8599 114.8312 59.1098 40.8407 174.5316 34 S 5.0520 8.6052 117.8702 56.8314 64.1410 174.9752 35 S 4.4555 8.1787 115.9514 58.3114 59.7463 171.4783 36 N 5.1102 7.4017 119.3093 51.0206 43.3549 174.4506 37 S 4.3292 8.3182 112.9809 58.0638 63.7451 175.1063 38 R 3.9630 8.7388 123.2287 59.5436 29.7774 177.6982 39 S 4.3172 7.7287 111.4334 60.0577 63.3468 174.8391 40 Q 4.4203 8.2134 117.9389 55.2532 29.3022 175.2422 41 A 4.4623 7.7069 119.7836 51.7479 19.8225 177.3403 42 Y 4.3255 9.5515 118.7147 57.5455 39.7060 174.7770 43 K 5.1576 8.8075 123.2619 54.7120 36.0874 174.9508 44 V 5.2151 9.1327 126.5082 61.4568 34.7410 174.2493 45 T 5.5535 9.2269 117.3532 60.5888 72.7003 172.2529 46 C 5.4721 9.1820 121.7075 58.7508 35.6922 172.7234 47 S 5.0152 8.9567 118.3558 57.2656 66.3343 173.1093 48 V 4.7936 8.2377 120.9281 61.2380 34.3310 174.6278 49 R 4.5265 8.3852 121.8164 55.0085 33.2529 174.3689 50 Q 4.5589 8.5613 122.9149 54.4414 27.4778 175.4550 51 S 4.1274 7.9192 117.7985 60.3062 63.2853 176.2137 52 S 4.8021 7.4478 115.1540 55.2495 65.4337 173.2986 53 A 4.1297 8.4913 121.6651 54.7463 18.4989 178.2418 54 Q 4.6095 8.8017 113.7712 55.4657 30.6921 174.8754 55 N 5.5849 8.0721 115.9231 51.5480 43.4079 173.3557 56 R 4.8841 8.8859 119.2545 54.2703 34.3839 174.3364 57 K 5.0963 9.1479 124.3619 54.8762 35.3063 174.0658 58 Y 5.0579 9.4255 125.1800 56.7192 40.6010 174.7746 59 T 5.0106 9.2986 120.5938 62.0273 71.5840 172.9640 60 I 5.1199 8.9033 127.8167 59.4263 40.5674 175.1327 61 K 5.2165 9.1354 124.4057 54.7859 36.5743 175.5017 62 V 4.9874 8.9105 122.9381 61.2106 35.5658 173.8689 63 E 4.8324 9.4869 126.8117 54.5995 32.7077 174.9570 64 V 4.1145 8.4753 126.1006 60.4771 33.0783 173.1108 65 P 4.5971 0.0000 0.0000 61.6991 33.3503 175.8695 66 K 3.8035 7.6750 123.2701 54.0878 32.3771 175.3199 67 V 4.1174 7.7804 119.2640 61.5934 32.3745 175.0983 68 A 4.5100 8.8018 124.3997 51.4744 23.4199 175.3642 69 T 4.7653 8.3806 115.6758 62.0876 70.3822 173.8397 70 Q 4.4304 8.6445 128.3655 55.1861 31.3944 174.8914 71 T 4.8688 8.4631 121.6876 62.0972 69.7078 173.4324 72 V 4.1085 8.5594 127.2386 61.7182 32.5719 176.1813 73 G 4.0651 9.4766 116.4587 46.8176 0.0000 174.3230 74 G 3.9168 8.5603 106.6351 44.8683 0.0000 174.0753 75 V 4.4469 7.4060 119.4784 60.9530 34.3037 174.1665 76 E 5.0060 8.6872 126.4747 55.5993 30.7016 175.6940 77 L 4.9751 9.0181 124.2283 52.0289 46.1928 173.9590 78 P 4.7113 0.0000 0.0000 62.9518 32.2669 175.6762 79 V 4.5744 8.8830 117.1440 59.7531 36.8193 173.3603 80 A 4.7983 8.3303 122.1121 50.3495 20.1279 176.1828 81 A 4.2163 8.9947 126.3561 54.8932 19.1332 176.9940 82 W 4.9288 6.9113 109.6717 56.1638 31.4860 173.3202 83 R 5.0785 8.8064 117.6481 54.5740 33.7152 174.7401 84 S 4.8369 9.1703 117.3207 56.9514 64.5939 172.1962 85 Y 5.1031 8.7566 124.2464 56.1335 40.2785 174.5467 86 L 4.7690 9.0383 126.7627 53.3546 44.5327 174.6154 87 N 5.6607 8.9416 123.5095 51.6549 41.3624 173.6868 88 M 4.9576 9.2907 121.2440 53.4331 34.9687 174.1881 89 E 5.2007 8.8579 119.7984 54.5178 33.2558 174.7874 90 L 4.7238 9.1735 126.1676 53.6178 45.0137 174.9501 91 T 5.0965 8.7085 123.2123 62.0746 70.3177 173.8749 92 I 4.7318 8.7730 128.2354 58.4763 40.4789 173.7082 93 P 4.9613 0.0000 0.0000 62.4699 32.1666 177.5345 94 I 3.6341 8.1061 115.6262 63.2462 37.4281 176.8787 95 F 4.4247 7.5445 117.9502 58.0611 39.2691 175.3675 96 A 4.3423 7.9619 125.7825 52.0372 18.6874 178.4995 97 T 4.3877 9.1935 115.1676 60.7963 71.6604 175.6599 98 N 4.3739 8.5640 117.5869 56.4101 38.4648 177.7009 99 S 4.1183 8.0419 115.2761 61.5577 62.8632 176.0190 100 D 4.3666 7.9489 122.2432 57.5057 40.5690 178.7573 101 C 4.1748 8.0609 117.0807 62.7436 28.0418 175.9599 102 E 3.9400 8.4852 120.6812 59.0629 28.8668 179.0926 103 L 3.9237 7.8823 120.5066 58.1524 42.1502 179.0629 104 I 3.6406 7.3092 119.4870 64.4470 37.1154 178.4515 105 V 3.5142 7.8048 118.9373 65.9786 31.2610 178.1311 106 K 4.1596 8.6377 119.5406 58.9048 31.8427 179.0680 107 A 3.9982 8.2161 121.2020 55.5867 18.0565 179.6315 108 M 4.0039 7.9445 116.0427 58.5096 32.3922 178.7806 109 Q 4.2058 8.1603 118.4153 58.9199 29.0134 179.0111 110 G 3.6721 8.5005 107.2429 47.5882 0.0000 175.2573 111 L 3.9979 8.0377 122.2072 57.4658 42.0656 178.2451 112 L 4.5301 7.0878 114.3721 53.2217 42.6159 176.5921 113 K 4.0343 7.3403 121.5728 56.0250 32.7588 175.9694 114 D 4.5976 8.5298 125.0036 56.3331 41.1247 176.6606 115 G 4.0251 8.9649 111.9092 45.6592 0.0000 174.1757 116 N 4.6200 7.9863 116.8945 52.3793 40.5451 173.2354 117 P 4.0590 0.0000 0.0000 66.5453 31.3823 178.5260 118 I 3.6894 7.7275 117.4493 64.3719 37.3069 176.6587 119 P 4.2975 0.0000 0.0000 65.9226 30.8716 178.5476 120 S 4.0649 8.0193 114.3772 61.3244 62.8016 176.3450 121 A 3.9834 8.1505 123.4906 55.2604 18.1823 179.4691 122 I 3.6178 7.8060 117.9599 64.7749 37.0874 178.6296 123 A 4.1342 8.0881 119.1897 54.1067 18.1878 178.3736 124 A 4.4694 7.4116 116.9970 50.7400 19.9764 176.2666 125 N 4.1427 8.1695 114.5323 54.2976 36.5626 173.3534 126 S 4.6389 8.1633 110.3520 57.1443 66.7864 172.8101 127 G 4.1490 8.3666 109.2379 44.3037 0.0000 172.5435 128 I 4.3844 7.9303 119.5663 60.1591 38.7036 175.6203 129 Y 4.3825 7.7534 120.9884 57.7913 37.1438 173.9498 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 A 8.26 4.30 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 2 S 8.04 5.37 0.00 4.08 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 3 N 8.87 4.75 0.00 2.92 2.96 0.00 0.00 6.21 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 F 7.65 4.95 0.00 2.97 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 5 T 7.95 4.89 4.38 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 1.37 0.00 0.00 6 Q 8.58 4.89 0.00 2.32 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.79 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 7 F 8.47 4.93 0.00 3.04 3.10 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 8 V 8.37 4.13 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 0.78 0.00 0.00 0.91 0.00 0.00 9 L 8.30 4.07 0.00 1.25 1.36 1.00 0.78 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 10 V 7.31 4.09 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 0.91 0.00 0.00 0.78 0.00 0.00 11 D 8.65 4.88 0.00 2.66 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 12 N 9.57 4.88 0.00 2.77 2.89 0.00 0.00 7.07 8.27 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 13 G 8.96 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 G 8.68 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 0.00 0.00 0.00 15 T 7.88 4.29 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 16 G 8.90 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 17 D 7.74 4.56 0.00 2.50 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 18 V 8.35 4.00 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 -0.02 0.00 0.00 0.57 0.00 0.00 19 T 8.25 4.91 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 1.18 0.00 0.00 20 V 8.07 4.82 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 0.58 0.00 0.00 -0.14 0.00 0.00 21 A 8.80 5.26 1.20 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 22 P 0.00 4.16 0.00 1.25 0.49 0.00 3.55 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 1.76 1.78 0.00 23 S 8.90 4.59 0.00 3.79 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 24 N 7.58 4.48 0.00 2.85 2.68 0.00 0.00 6.58 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 25 F 9.09 5.50 0.00 3.13 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.98 4.08 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 27 N 9.42 4.31 0.00 2.92 2.93 0.00 0.00 6.96 7.65 0.00 0.00 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 G 8.36 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 0.00 0.00 0.00 29 V 7.62 4.52 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 1.03 0.00 0.00 1.03 0.00 0.00 30 A 8.54 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 E 9.25 5.37 0.00 2.07 1.90 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 2.33 2.40 0.00 32 W 9.97 5.69 0.00 3.26 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 33 I 8.86 5.84 1.93 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 1.02 0.99 0.00 0.00 34 S 8.61 5.05 0.00 3.97 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 35 S 8.18 4.46 0.00 3.83 3.83 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 36 N 7.40 5.11 0.00 2.69 2.69 0.00 0.00 7.26 7.57 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 37 S 8.32 4.33 0.00 4.00 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 38 R 8.74 3.96 0.00 1.78 2.04 0.00 3.30 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 39 S 7.73 4.32 0.00 3.97 3.97 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 40 Q 8.21 4.42 0.00 1.96 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.96 0.00 0.00 0.00 0.00 0.00 2.29 2.22 0.00 41 A 7.71 4.46 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 42 Y 9.55 4.33 0.00 2.85 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 43 K 8.81 5.16 0.00 1.87 1.66 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.46 7.81 44 V 9.13 5.22 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 0.90 0.00 0.00 0.98 0.00 0.00 45 T 9.23 5.55 4.37 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 1.35 0.00 0.00 46 C 9.18 5.47 0.00 3.15 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 47 S 8.96 5.02 0.00 3.96 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 48 V 8.24 4.79 1.82 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 -0.30 0.00 0.00 0.77 0.00 0.00 49 R 8.39 4.53 0.00 1.85 1.90 0.00 2.80 0.00 0.00 3.08 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.54 0.00 50 Q 8.56 4.56 0.00 1.96 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.04 0.00 0.00 0.00 0.00 0.00 2.27 2.65 0.00 51 S 7.92 4.13 0.00 4.04 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 52 S 7.45 4.80 0.00 3.98 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 53 A 8.49 4.13 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 54 Q 8.80 4.61 0.00 1.99 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.65 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 55 N 8.07 5.58 0.00 2.61 2.65 0.00 0.00 6.80 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 56 R 8.89 4.88 0.00 1.69 1.64 0.00 3.00 0.00 0.00 3.06 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.46 0.00 57 K 9.15 5.10 0.00 1.74 1.58 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.42 7.81 58 Y 9.43 5.06 0.00 2.94 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 59 T 9.30 5.01 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 1.27 0.00 0.00 60 I 8.90 5.12 1.91 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.93 0.93 0.00 0.00 61 K 9.14 5.22 0.00 1.76 1.75 0.00 1.69 0.00 0.00 1.73 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.53 1.44 7.81 62 V 8.91 4.99 2.14 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 1.14 0.00 0.00 0.98 0.00 0.00 63 E 9.49 4.83 0.00 1.85 1.62 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 2.09 2.30 0.00 64 V 8.48 4.11 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 0.77 0.00 0.00 1.04 0.00 0.00 65 P 0.00 4.60 0.00 1.77 1.71 0.00 2.20 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.62 0.00 66 K 7.67 3.80 0.00 0.79 0.74 0.00 1.16 0.00 0.00 1.16 0.00 0.00 2.99 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.41 0.86 7.81 67 V 7.78 4.12 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 0.60 0.00 0.00 0.84 0.00 0.00 68 A 8.80 4.51 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 T 8.38 4.77 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 1.24 0.00 0.00 70 Q 8.64 4.43 0.00 2.16 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.77 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 71 T 8.46 4.87 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 1.21 0.00 0.00 72 V 8.56 4.11 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 0.97 0.00 0.00 0.93 0.00 0.00 73 G 9.48 4.07 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 0.00 0.00 0.00 74 G 8.56 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 75 V 7.41 4.45 2.18 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 0.96 0.00 0.00 0.93 0.00 0.00 76 E 8.69 5.01 0.00 1.88 1.86 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 2.27 2.33 0.00 77 L 9.02 4.98 0.00 1.50 1.49 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 78 P 0.00 4.71 0.00 2.05 2.05 0.00 3.70 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 1.97 1.98 0.00 79 V 8.88 4.57 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 0.68 0.00 0.00 0.95 0.00 0.00 80 A 8.33 4.80 1.05 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 0.00 0.00 81 A 8.99 4.22 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 82 W 6.91 4.93 0.00 3.40 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 83 R 8.81 5.08 0.00 1.49 1.10 0.00 3.18 0.00 0.00 3.10 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.47 0.00 84 S 9.17 4.84 0.00 4.07 3.76 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 85 Y 8.76 5.10 0.00 2.87 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 L 9.04 4.77 0.00 1.79 1.57 0.96 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 87 N 8.94 5.66 0.00 2.64 2.73 0.00 0.00 6.91 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 88 M 9.29 4.96 0.00 2.04 2.12 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 2.49 2.51 0.00 89 E 8.86 5.20 0.00 1.85 1.90 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 2.23 2.29 0.00 90 L 9.17 4.72 0.00 1.73 1.58 0.92 0.70 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 91 T 8.71 5.10 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 92 I 8.77 4.73 1.98 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 1.33 0.81 0.96 0.00 0.00 93 P 0.00 4.96 0.00 2.35 2.31 0.00 3.75 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 2.17 2.06 0.00 94 I 8.11 3.63 1.55 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 -0.36 0.73 0.00 0.00 95 F 7.54 4.42 0.00 3.12 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 96 A 7.96 4.34 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 97 T 9.19 4.39 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 98 N 8.56 4.37 0.00 2.76 2.91 0.00 0.00 6.58 7.57 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 99 S 8.04 4.12 0.00 4.05 4.13 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 0.00 100 D 7.95 4.37 0.00 3.09 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.06 4.17 0.00 3.14 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 0.00 102 E 8.49 3.94 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 2.31 2.58 0.00 103 L 7.88 3.92 0.00 2.04 1.71 0.91 1.01 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 0.00 104 I 7.31 3.64 2.00 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 1.40 0.68 0.86 0.00 0.00 105 V 7.80 3.51 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 0.96 0.00 0.00 0.86 0.00 0.00 106 K 8.64 4.16 0.00 2.03 1.82 0.00 1.72 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.41 7.81 107 A 8.22 4.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 M 7.94 4.00 0.00 1.96 2.23 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.55 0.00 109 Q 8.16 4.21 0.00 2.26 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.47 0.00 110 G 8.50 3.67 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 0.00 0.00 0.00 111 L 8.04 4.00 0.00 1.71 1.93 0.91 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 112 L 7.09 4.53 0.00 1.66 1.65 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 113 K 7.34 4.03 0.00 1.81 1.66 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.41 7.81 114 D 8.53 4.60 0.00 2.70 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 0.00 115 G 8.96 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 0.00 0.00 0.00 116 N 7.99 4.62 0.00 2.92 2.73 0.00 0.00 6.79 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 0.00 117 P 0.00 4.06 0.00 2.12 2.02 0.00 3.60 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 2.09 2.17 0.00 118 I 7.73 3.69 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 1.69 0.90 0.91 0.00 0.00 119 P 0.00 4.30 0.00 2.26 2.31 0.00 3.63 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 2.25 2.14 0.00 120 S 8.02 4.06 0.00 4.11 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 0.00 121 A 8.15 3.98 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 I 7.81 3.62 2.02 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 1.47 0.84 0.93 0.00 0.00 123 A 8.09 4.13 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 0.00 124 A 7.41 4.47 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.17 4.14 0.00 2.89 2.89 0.00 0.00 6.66 7.31 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 0.00 126 S 8.16 4.64 0.00 4.02 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 0.00 127 G 8.37 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 0.00 128 I 7.93 4.38 1.90 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 1.44 0.49 0.89 0.00 0.00 129 Y 7.75 4.38 0.00 3.05 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