NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 P 4.4291 0.0000 0.0000 65.2000 32.8320 178.6975 13 K 4.1640 7.5716 118.7702 57.2184 32.9767 176.3814 14 G 3.8711 8.9186 105.4705 47.3758 0.0000 173.7113 15 V 4.6724 8.7520 115.1462 60.8521 33.1492 176.7775 16 S 4.4971 9.2225 119.8354 56.6301 64.4425 171.7769 17 V 4.0898 8.1603 121.8296 62.2758 31.5733 174.3797 18 E 4.5799 9.0805 128.7337 55.1666 31.3131 175.7326 19 V 4.6077 8.3655 122.4641 61.3025 34.4210 174.3706 20 A 4.7602 8.1110 129.1640 49.7783 21.4388 172.6886 21 P 3.9218 0.0000 0.0000 65.8870 31.5291 176.5013 22 G 4.2721 8.0784 102.0177 46.1403 0.0000 171.7296 23 R 5.0072 7.9578 117.8219 54.1053 35.3955 174.2991 24 V 4.5430 8.0130 119.3956 61.4234 35.0091 174.3023 25 K 4.8245 8.6699 128.1286 55.2329 33.2973 175.6071 26 V 4.5209 8.3566 126.7644 61.4092 32.9724 175.0155 27 K 4.8022 8.5883 128.0171 55.1458 35.1387 175.8576 28 G 4.5625 7.8634 106.6512 45.5582 0.0000 172.3082 29 P 4.4109 0.0000 0.0000 64.9065 31.5685 177.5786 30 K 4.2763 7.9795 115.6713 56.0487 33.7034 176.5941 31 G 4.0509 7.1114 105.1330 46.2272 0.0000 170.4760 32 E 5.5264 8.4212 120.7631 54.5332 31.0671 175.1100 33 L 4.8837 8.2076 123.8901 53.1669 46.8417 174.8898 34 E 4.6684 8.7438 120.8679 54.6839 30.3076 177.2422 35 V 4.4649 8.1102 127.8582 60.2032 30.2844 173.2005 36 P 4.5772 0.0000 0.0000 63.8711 32.0434 177.2381 37 V 4.5459 9.2908 122.6107 60.9595 35.6388 174.4670 38 S 4.2505 8.5271 115.8613 57.6884 62.6353 172.8223 39 P 4.4623 0.0000 0.0000 63.5538 30.8433 175.8756 40 E 4.5931 8.0153 118.4224 56.3322 31.2202 174.1515 41 M 3.5707 8.6561 120.8345 54.3600 29.8881 177.2924 42 R 3.7715 7.7920 114.6501 57.0274 28.6778 175.7801 43 V 3.7809 7.9355 109.2312 60.3106 31.5715 175.8088 44 V 4.3318 8.0602 126.1915 63.2218 34.3897 177.4736 45 V 4.4832 8.6293 122.7296 60.8601 32.6895 174.3832 46 E 4.4104 8.3946 125.3268 57.4288 30.4953 175.5851 47 E 4.0126 8.7223 123.5010 55.1064 27.8265 176.6920 48 G 3.8845 8.4159 112.1887 46.6083 0.0000 173.6787 49 V 4.3394 7.5830 113.1860 60.2123 35.3309 172.7949 50 V 4.6546 8.2245 119.3844 61.9157 33.7551 175.7050 51 R 4.8607 8.2069 125.0499 54.6254 34.2270 174.9289 52 V 4.3848 8.1243 118.7790 62.1196 34.4417 173.2085 53 E 4.9870 8.3666 129.3196 55.5465 32.1631 174.0022 54 R 4.5386 8.3593 113.3747 55.2956 32.0411 171.4842 55 P 4.3429 0.0000 0.0000 64.2686 32.1400 180.9180 56 S 4.4502 7.5507 119.6699 57.4904 64.6494 175.0003 57 D 4.7959 8.4337 122.2806 54.2053 42.9771 175.1840 58 E 4.0442 8.1462 120.8121 56.3035 29.7789 178.0770 59 R 3.8768 8.8655 123.2560 59.4438 29.8285 178.8875 60 R 3.9372 7.8623 117.3425 59.7334 30.0010 178.2955 61 H 4.1274 8.4260 115.9447 58.7790 28.6057 177.8319 62 K 3.9968 8.0295 118.8157 59.8701 31.6048 178.7123 63 S 4.2961 7.7939 114.7864 61.8019 62.2204 176.9601 64 L 4.1442 7.9628 121.3024 56.5125 41.2222 177.0114 65 H 4.6632 9.1917 117.8793 56.0420 31.2793 174.7586 66 G 4.3061 8.2678 115.6456 46.6729 0.0000 175.7124 67 L 3.9310 7.1676 118.0162 58.4882 41.9677 179.3250 68 T 3.9670 7.4187 112.1134 66.0631 68.1845 176.6344 69 R 3.8525 7.9013 119.7367 60.1087 30.0208 178.1405 70 T 4.0699 8.3714 114.9868 67.8356 68.6431 177.2263 71 L 3.4804 8.1433 117.3661 57.1708 41.6434 179.3435 72 I 3.6361 8.3912 119.5736 64.9856 37.4948 178.4480 73 A 4.0955 7.6336 121.2566 55.3168 18.0133 179.1441 74 N 4.3836 8.2763 114.5043 55.7324 38.8972 177.3987 75 A 4.0609 8.5352 122.6161 55.3194 18.4122 178.8067 76 V 3.7066 8.1085 116.9805 64.1247 31.1100 177.4138 77 K 4.0000 7.2087 123.0269 59.6760 32.9852 178.8092 78 G 3.7498 8.6291 106.1676 48.1114 0.0000 176.3148 79 V 3.7043 7.3801 113.9408 63.3704 32.3881 177.6636 80 S 4.4222 7.9537 115.5850 58.4986 61.8981 174.5942 81 E 3.9111 8.0719 120.1894 56.5935 26.0343 172.9149 82 G 4.2702 8.6685 107.3310 43.8138 0.0000 169.2013 83 Y 4.6846 9.3131 121.0876 56.1963 38.2025 179.0184 84 S 3.2677 9.8183 112.9950 59.6314 63.9203 171.1927 85 K 4.2176 7.1061 130.5854 56.3375 33.8121 173.2229 86 E 4.9387 7.6268 123.2146 54.7909 32.5567 174.9799 87 L 5.7879 9.3286 120.7225 53.0113 46.8324 174.6560 88 L 5.2685 8.0425 119.6176 54.3396 44.9924 175.3070 89 I 4.1648 8.4276 118.6546 62.5857 41.5180 174.4948 90 K 4.2709 9.6285 117.5937 55.8747 32.4611 173.2403 91 G 4.0502 8.4446 106.7063 44.7335 0.0000 172.2452 92 I 4.6232 7.4573 130.7489 60.5892 35.6016 179.3052 93 G 4.1405 8.9680 116.2584 46.4951 0.0000 173.6992 94 Y 5.0573 9.3803 120.6376 55.9441 37.6897 175.5224 95 R 5.1892 8.1731 119.6043 56.5465 32.9969 173.1543 96 A 4.9368 8.4489 119.3661 50.5666 22.3640 176.5146 97 R 4.2569 8.4740 119.9983 53.6282 30.9701 174.9389 98 L 3.7835 8.4703 124.6782 55.7558 42.0544 177.6805 99 V 4.1131 8.5675 128.2765 61.5299 31.2160 177.0756 100 G 4.0504 7.8185 118.7986 46.4605 0.0000 173.8199 101 R 4.2401 8.8321 123.8475 56.1374 30.5173 175.0860 102 A 4.5533 7.6349 120.9957 49.7824 22.2344 174.1579 103 L 5.0308 7.3005 118.0883 54.0438 44.3590 175.8027 104 E 5.5779 8.5284 119.0467 53.5889 29.5696 173.1910 105 L 4.6403 7.9322 123.8509 54.7477 43.0263 176.2189 106 T 4.5509 8.3733 112.2927 60.5131 71.5540 174.6771 107 V 3.2918 8.0116 116.2021 60.8138 33.6162 173.3492 108 G 4.5251 8.6344 117.2658 45.9903 0.0000 172.4369 109 F 4.1197 8.4322 118.3152 57.7986 39.1826 176.2426 110 S 4.4016 8.7309 118.1949 59.7775 62.8544 173.5788 111 H 4.7027 8.1797 121.1409 53.8701 31.7718 170.8920 112 P 4.1537 0.0000 0.0000 63.3454 31.5894 175.3207 113 V 4.0988 7.9852 119.5831 61.4997 33.1974 174.7399 114 V 4.4823 8.2740 128.6890 61.3837 32.3054 175.2167 115 V 3.8353 8.6436 130.4538 61.5298 32.1640 175.1315 116 E 3.8853 8.8591 129.1338 56.0538 29.8591 174.5839 117 P 4.5455 0.0000 0.0000 60.8068 31.5881 174.0911 118 P 4.4533 0.0000 0.0000 62.0892 32.1184 175.5628 119 E 4.1184 8.5737 121.2481 57.0430 29.6173 177.5609 120 G 4.0548 9.0515 113.8412 44.9415 0.0000 172.4369 121 I 4.6560 6.9954 118.6420 59.7060 39.5737 175.1990 122 T 4.6855 9.4728 124.0844 61.8331 71.2071 173.1615 123 F 4.5939 8.9133 124.7141 55.9889 40.6284 174.9159 124 E 4.5785 8.6646 123.1598 54.6938 32.1423 175.5150 125 V 4.4579 8.4929 126.0321 60.7089 30.7169 173.4283 126 P 4.4024 0.0000 0.0000 65.3139 31.7178 176.1326 127 E 4.6646 7.3225 115.5427 54.7750 33.7802 172.7233 128 P 4.4899 0.0000 0.0000 65.9337 32.9158 178.0481 129 T 3.8475 8.1851 108.1540 62.8406 67.2952 175.7095 130 R 4.2787 8.8400 118.3038 57.0625 32.0877 175.2298 131 V 4.8253 8.4758 122.9943 61.8338 35.7337 172.6931 132 R 5.0028 8.5490 122.3654 54.5976 33.2416 173.7755 133 V 4.0632 8.8320 122.1106 61.2595 32.9332 174.9994 134 S 4.8662 9.2972 124.2088 56.1301 65.8405 173.7280 135 G 4.0930 7.6640 110.9463 46.4687 0.0000 171.3632 136 I 4.6006 8.2839 118.3519 59.8640 38.2022 175.9031 137 D 5.0655 8.7469 130.0452 53.6743 40.3843 178.6681 138 K 5.0060 6.8537 126.5368 57.5201 32.0084 175.8997 139 Q 4.2335 7.5525 120.5793 58.9741 29.4418 179.3746 140 K 4.2008 8.1891 115.7956 58.9796 33.0164 178.5467 141 V 3.7272 7.5910 118.1962 65.7005 31.6176 177.8251 142 G 3.6971 8.6322 105.5257 48.1309 0.0000 175.1134 143 Q 4.3135 7.6170 121.7018 58.0891 28.6440 177.1415 144 V 4.3301 8.2346 119.5423 62.5342 33.0361 176.6302 145 A 4.4826 8.4319 121.1374 52.5220 20.2721 179.4697 146 A 3.9425 7.8521 119.0173 55.6093 18.3355 179.2820 147 N 4.3146 7.7233 113.5826 55.8096 38.5359 175.5389 148 I 4.3680 7.7971 119.2237 60.6944 39.3807 177.5701 149 R 3.3472 7.0421 121.7895 59.7347 30.0311 178.8808 150 A 4.1871 7.9523 119.4669 53.9377 18.6720 178.3738 151 I 3.9023 8.6678 118.1218 63.3540 37.4494 176.7345 152 R 4.8250 7.3409 116.9472 53.9151 34.1116 176.7331 153 K 4.4105 8.3460 124.8165 56.4194 32.6705 173.7573 154 P 4.5880 0.0000 0.0000 64.3284 33.5737 176.9618 155 S 4.3105 7.7806 115.8095 57.0187 62.3865 175.3342 156 A 4.3251 8.0577 119.7383 53.3127 16.9711 178.3173 157 Y 3.5541 8.5388 116.2042 60.4161 36.0626 171.5518 158 H 3.7298 8.9008 113.9857 57.0095 27.9419 173.5125 159 E 4.3878 8.0141 125.9834 55.8758 29.5718 176.6361 160 K 4.0557 7.0488 117.9686 56.2948 32.8900 175.7392 161 G 4.2046 9.2982 109.2399 45.2080 0.0000 173.0694 162 I 4.7028 7.9396 112.8883 60.0675 39.9812 174.0964 163 Y 4.7056 8.4844 119.3138 58.7923 42.6102 174.4076 164 Y 4.5358 9.7255 120.2343 58.8207 36.9754 176.7072 165 A 4.6186 9.4248 128.8211 53.0899 24.5650 177.9919 166 G 3.9784 8.1191 104.4298 44.9425 0.0000 172.2447 167 E 4.6864 8.3038 117.9771 53.4947 31.9226 174.6305 168 P 4.6518 0.0000 0.0000 62.4398 32.3062 176.0235 169 V 4.3548 7.9624 117.7004 60.7519 33.4907 176.2406 170 R 3.6411 8.4757 124.5910 59.2792 30.1917 176.6777 *171 L 4.1254 7.7378 122.7758 53.6614 41.6082 178.2719 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 12 P 0.00 4.43 0.00 2.20 2.11 0.00 3.60 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 2.01 2.11 0.00 13 K 7.57 4.16 0.00 1.84 1.84 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.44 7.81 14 G 8.92 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 0.00 0.00 0.00 0.00 15 V 8.75 4.67 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 0.76 0.00 0.00 0.95 0.00 0.00 16 S 9.22 4.50 0.00 3.66 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 17 V 8.16 4.09 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 0.77 0.00 0.00 0.93 0.00 0.00 18 E 9.08 4.58 0.00 2.08 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 2.48 2.39 0.00 19 V 8.37 4.61 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 0.80 0.00 0.00 0.93 0.00 0.00 20 A 8.11 4.76 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 21 P 0.00 3.92 0.00 2.05 1.99 0.00 3.62 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 2.04 2.12 0.00 22 G 8.08 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 0.00 0.00 0.00 0.00 23 R 7.96 5.01 0.00 1.71 1.77 0.00 3.07 0.00 0.00 3.26 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 24 V 8.01 4.54 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 1.12 0.00 0.00 0.93 0.00 0.00 25 K 8.67 4.82 0.00 1.71 1.94 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.56 1.36 7.81 26 V 8.36 4.52 2.07 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 1.08 0.00 0.00 0.93 0.00 0.00 27 K 8.59 4.80 0.00 1.72 1.68 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.53 1.47 7.81 28 G 7.86 4.56 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 0.00 0.00 0.00 29 P 0.00 4.41 0.00 2.07 2.18 0.00 3.66 0.00 0.00 3.91 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 30 K 7.98 4.28 0.00 1.74 1.78 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.55 1.44 7.81 31 G 7.11 4.05 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 0.00 32 E 8.42 5.53 0.00 1.98 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 2.23 2.17 0.00 33 L 8.21 4.88 0.00 1.56 1.45 0.90 0.90 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 34 E 8.74 4.67 0.00 1.84 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 2.23 2.23 0.00 35 V 8.11 4.46 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 0.99 0.00 0.00 0.92 0.00 0.00 36 P 0.00 4.58 0.00 2.11 2.06 0.00 3.85 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 37 V 9.29 4.55 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 0.76 0.00 0.00 0.99 0.00 0.00 38 S 8.53 4.25 0.00 3.89 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 39 P 0.00 4.46 0.00 2.09 2.07 0.00 3.72 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 2.03 2.11 0.00 40 E 8.02 4.59 0.00 2.00 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 2.29 2.47 0.00 41 M 8.66 3.57 0.00 2.08 2.52 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.66 0.00 42 R 7.79 3.77 0.00 1.91 1.96 0.00 3.24 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.63 0.00 43 V 7.94 3.78 2.27 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 0.71 0.00 0.00 0.93 0.00 0.00 44 V 8.06 4.33 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 0.93 0.00 0.00 1.02 0.00 0.00 45 V 8.63 4.48 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 0.99 0.00 0.00 0.98 0.00 0.00 46 E 8.39 4.41 0.00 2.15 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 2.21 2.39 0.00 47 E 8.72 4.01 0.00 2.12 2.38 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 2.24 2.24 0.00 48 G 8.42 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 49 V 7.58 4.34 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 0.71 0.00 0.00 0.93 0.00 0.00 50 V 8.22 4.65 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 0.88 0.00 0.00 0.93 0.00 0.00 51 R 8.21 4.86 0.00 1.89 1.79 0.00 3.21 0.00 0.00 3.15 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.53 0.00 52 V 8.12 4.38 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 0.65 0.00 0.00 0.91 0.00 0.00 53 E 8.37 4.99 0.00 1.94 1.85 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 2.19 2.20 0.00 54 R 8.36 4.54 0.00 1.89 1.96 0.00 3.04 0.00 0.00 2.98 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.47 0.00 55 P 0.00 4.34 0.00 2.08 1.94 0.00 3.64 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 1.41 1.64 0.00 56 S 7.55 4.45 0.00 3.99 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 57 D 8.43 4.80 0.00 2.61 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.15 4.04 0.00 2.15 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 2.28 0.00 59 R 8.87 3.88 0.00 1.87 1.96 0.00 3.18 0.00 0.00 3.34 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.76 0.00 60 R 7.86 3.94 0.00 1.87 1.88 0.00 3.17 0.00 0.00 3.31 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.71 0.00 61 H 8.43 4.13 0.00 3.34 3.36 0.00 5.85 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 62 K 8.03 4.00 0.00 1.73 1.92 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.43 1.58 7.81 63 S 7.79 4.30 0.00 4.05 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 64 L 7.96 4.14 0.00 1.83 1.72 0.87 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 65 H 9.19 4.66 0.00 3.15 3.36 0.00 5.84 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 G 8.27 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 0.00 0.00 0.00 0.00 67 L 7.17 3.93 0.00 1.97 1.90 0.92 0.83 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 68 T 7.42 3.97 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 1.20 0.00 0.00 69 R 7.90 3.85 0.00 1.65 2.12 0.00 3.24 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.73 0.00 70 T 8.37 4.07 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 1.21 0.00 0.00 71 L 8.14 3.48 0.00 1.80 1.55 0.95 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 72 I 8.39 3.64 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 1.45 0.71 0.91 0.00 0.00 73 A 7.63 4.10 1.43 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 0.00 0.00 0.00 0.00 0.00 0.00 74 N 8.28 4.38 0.00 2.89 2.86 0.00 0.00 6.72 7.09 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 75 A 8.54 4.06 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 76 V 8.11 3.71 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 1.07 0.00 0.00 0.93 0.00 0.00 77 K 7.21 4.00 0.00 1.73 1.92 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.73 7.81 78 G 8.63 3.75 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 0.00 0.00 0.00 79 V 7.38 3.70 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 0.90 0.00 0.00 0.99 0.00 0.00 80 S 7.95 4.42 0.00 3.90 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 81 E 8.07 3.91 0.00 2.20 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 2.37 2.37 0.00 82 G 8.67 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 0.00 0.00 0.00 0.00 83 Y 9.31 4.68 0.00 2.75 2.44 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 0.00 0.00 0.00 0.00 84 S 9.82 3.27 0.00 4.03 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 85 K 7.11 4.22 0.00 1.81 1.89 0.00 1.48 0.00 0.00 1.50 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.97 0.87 7.81 86 E 7.63 4.94 0.00 2.03 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 2.28 2.27 0.00 87 L 9.33 5.79 0.00 1.54 1.68 0.94 0.39 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 88 L 8.04 5.27 0.00 1.67 1.58 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 89 I 8.43 4.16 2.16 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.62 1.08 0.00 0.00 90 K 9.63 4.27 0.00 2.16 2.05 0.00 1.62 0.00 0.00 1.80 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.32 1.13 7.81 91 G 8.44 4.05 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 0.00 92 I 7.46 4.62 1.96 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 1.37 0.70 0.98 0.00 0.00 93 G 8.97 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 0.00 0.00 0.00 0.00 94 Y 9.38 5.06 0.00 2.61 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.17 5.19 0.00 1.93 2.06 0.00 3.13 0.00 0.00 3.35 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.45 0.00 96 A 8.45 4.94 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 97 R 8.47 4.26 0.00 1.75 1.87 0.00 3.24 0.00 0.00 3.15 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 98 L 8.47 3.78 0.00 1.61 1.66 1.09 1.12 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 99 V 8.57 4.11 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 0.88 0.00 0.00 0.93 0.00 0.00 100 G 7.82 4.05 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 0.00 101 R 8.83 4.24 0.00 1.82 2.01 0.00 3.16 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 102 A 7.63 4.55 1.17 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 0.00 103 L 7.30 5.03 0.00 1.74 1.63 1.05 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 104 E 8.53 5.58 0.00 1.85 1.76 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 2.10 2.11 0.00 105 L 7.93 4.64 0.00 1.77 1.75 0.84 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 106 T 8.37 4.55 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 1.16 0.00 0.00 107 V 8.01 3.29 1.17 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 -0.03 0.00 0.00 0.30 0.00 0.00 108 G 8.63 4.53 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 F 8.43 4.12 0.00 2.96 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 0.00 110 S 8.73 4.40 0.00 4.01 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 0.00 111 H 8.18 4.70 0.00 3.08 3.28 0.00 5.98 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 P 0.00 4.15 0.00 2.25 2.01 0.00 3.61 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 1.78 1.90 0.00 113 V 7.99 4.10 2.07 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 0.65 0.00 0.00 0.65 0.00 0.00 114 V 8.27 4.48 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 0.75 0.00 0.00 0.87 0.00 0.00 115 V 8.64 3.84 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 0.63 0.00 0.00 0.81 0.00 0.00 116 E 8.86 3.89 0.00 1.92 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 2.28 2.30 0.00 117 P 0.00 4.55 0.00 2.21 2.10 0.00 3.77 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.91 0.00 118 P 0.00 4.45 0.00 2.24 2.14 0.00 3.92 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.11 0.00 119 E 8.57 4.12 0.00 2.02 1.85 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 2.36 2.30 0.00 120 G 9.05 4.05 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 0.00 121 I 7.00 4.66 1.92 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 1.20 0.86 0.94 0.00 0.00 122 T 9.47 4.69 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 1.25 0.00 0.00 123 F 8.91 4.59 0.00 3.13 3.01 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 0.00 124 E 8.66 4.58 0.00 1.86 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 2.24 2.38 0.00 125 V 8.49 4.46 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 0.93 0.00 0.00 1.04 0.00 0.00 126 P 0.00 4.40 0.00 2.22 2.16 0.00 3.92 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 2.14 1.99 0.00 127 E 7.32 4.66 0.00 1.78 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 2.26 2.39 0.00 128 P 0.00 4.49 0.00 2.24 2.32 0.00 3.70 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.97 0.00 129 T 8.19 3.85 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 1.24 0.00 0.00 130 R 8.84 4.28 0.00 1.92 1.88 0.00 3.20 0.00 0.00 3.26 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 131 V 8.48 4.83 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 0.91 0.00 0.00 1.05 0.00 0.00 132 R 8.55 5.00 0.00 1.79 1.89 0.00 2.76 0.00 0.00 3.06 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.50 0.00 133 V 8.83 4.06 1.81 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 0.44 0.00 0.00 0.31 0.00 0.00 134 S 9.30 4.87 0.00 3.78 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 0.00 135 G 7.66 4.09 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 0.00 0.00 0.00 136 I 8.28 4.60 1.78 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.27 0.86 0.00 0.00 137 D 8.75 5.07 0.00 2.70 1.79 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 0.00 138 K 6.85 5.01 0.00 1.98 1.79 0.00 1.74 0.00 0.00 1.58 0.00 0.00 3.11 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.22 1.09 7.81 139 Q 7.55 4.23 0.00 2.12 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.25 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 140 K 8.19 4.20 0.00 1.73 1.81 0.00 1.78 0.00 0.00 1.61 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.46 7.81 141 V 7.59 3.73 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 0.80 0.00 0.00 0.85 0.00 0.00 142 G 8.63 3.70 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 0.00 0.00 0.00 143 Q 7.62 4.31 0.00 2.46 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.92 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 144 V 8.23 4.33 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 1.11 0.00 0.00 1.05 0.00 0.00 145 A 8.43 4.48 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 0.00 146 A 7.85 3.94 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 N 7.72 4.31 0.00 2.91 2.98 0.00 0.00 6.96 7.20 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 0.00 148 I 7.80 4.37 1.91 0.00 0.00 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 1.66 1.40 0.96 0.00 0.00 149 R 7.04 3.35 0.00 2.16 2.41 0.00 2.83 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.74 0.00 150 A 7.95 4.19 1.44 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 0.00 0.00 0.00 0.00 0.00 0.00 151 I 8.67 3.90 1.72 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.73 0.45 0.00 0.00 152 R 7.34 4.82 0.00 1.63 1.86 0.00 3.23 0.00 0.00 2.97 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.69 0.00 153 K 8.35 4.41 0.00 1.89 1.87 0.00 1.54 0.00 0.00 1.92 0.00 0.00 3.05 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.50 1.40 7.81 154 P 0.00 4.59 0.00 2.11 1.89 0.00 3.67 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.84 0.00 155 S 7.78 4.31 0.00 3.84 3.91 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 0.00 0.00 0.00 156 A 8.06 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 0.00 157 Y 8.54 3.55 0.00 2.98 3.03 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 0.00 158 H 8.90 3.73 0.00 3.23 3.30 0.00 5.68 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 E 8.01 4.39 0.00 2.11 2.27 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 2.15 2.23 0.00 160 K 7.05 4.06 0.00 1.92 2.05 0.00 1.76 0.00 0.00 2.02 0.00 0.00 2.81 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.47 1.43 7.81 161 G 9.30 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 0.00 162 I 7.94 4.70 1.98 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 1.34 0.73 1.00 0.00 0.00 163 Y 8.48 4.71 0.00 2.93 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 0.00 164 Y 9.73 4.54 0.00 2.80 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 0.00 165 A 9.42 4.62 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 0.00 166 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 0.00 167 E 8.30 4.69 0.00 1.93 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 0.00 2.17 2.24 0.00 168 P 0.00 4.65 0.00 2.06 2.24 0.00 3.64 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.76 0.00 169 V 7.96 4.35 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 0.86 0.00 0.00 0.95 0.00 0.00 170 R 8.48 3.64 0.00 1.80 1.97 0.00 3.20 0.00 0.00 3.25 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 *171 L 7.74 4.13 0.00 1.43 1.52 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.