NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 L 4.2202 8.1849 122.4766 55.0351 43.2227 175.6948 3 T 4.3736 8.3296 122.3643 59.8174 70.7368 172.0890 4 S 4.6554 9.2843 121.8923 57.1135 65.3208 173.8529 5 C 5.0043 8.3424 121.1808 54.0293 38.3377 171.8061 6 P 4.5511 0.0000 0.0000 61.2612 31.7415 174.2142 7 P 4.3592 0.0000 0.0000 64.6716 31.4752 177.3117 8 L 3.8895 8.7638 120.3468 54.4418 40.0870 174.3493 9 W 4.8396 7.6574 117.1742 55.2254 31.5401 175.5740 10 T 4.7477 9.1189 116.3345 60.5081 70.2460 172.9229 11 G 4.5109 8.8872 115.2409 45.0342 0.0000 173.0108 12 F 4.5030 9.1786 124.5748 57.4016 42.2418 174.0442 13 N 3.8468 9.2036 126.7990 54.5441 36.8847 174.7400 14 G 3.9191 8.4605 104.6008 44.5270 0.0000 174.0089 15 K 4.5462 7.9892 118.8928 54.5100 36.0240 174.3501 16 C 5.4420 8.1431 119.4091 55.3516 44.1889 173.0794 17 F 5.9834 9.6887 122.1944 56.1844 43.2417 174.1202 18 R 4.3698 8.6291 119.1831 55.0282 33.6057 173.2323 19 L 4.6047 7.9161 128.1928 53.7594 43.3511 175.2110 20 F 4.5244 8.4100 125.0545 56.1493 40.8454 176.4207 21 H 4.4797 8.9486 119.1608 56.5848 29.4795 175.2769 22 N 4.9113 8.0604 116.9558 52.7567 38.4977 174.3540 23 H 5.0908 8.9855 118.4498 55.3858 30.1096 174.6983 24 L 5.0024 9.4010 122.5845 52.7837 46.6011 176.0719 25 N 5.7056 8.6865 118.9441 51.8954 38.5755 175.8040 26 F 3.1611 8.7594 119.8294 61.3834 39.2647 176.6137 27 D 4.2969 8.1482 117.7735 57.6861 40.6213 178.6664 28 N 4.2838 8.0182 115.9151 55.7560 38.5286 177.3937 29 A 3.1505 7.4600 122.4690 54.8650 18.4787 179.1049 30 E 3.6420 7.6189 117.9373 59.3299 29.3026 178.6192 31 N 4.1322 7.7810 115.8056 56.4774 39.4636 176.1452 32 A 3.9939 7.8903 122.3895 55.6968 18.5476 179.0455 33 C 4.6660 8.2031 114.6036 60.2121 40.0770 176.1048 34 R 4.0125 7.6713 117.6628 57.8655 29.6779 178.0735 35 Q 3.9399 7.5772 117.1371 56.3887 29.4400 175.5472 36 F 4.9221 7.4129 119.4959 56.2601 41.3825 175.4915 37 G 4.2529 8.3857 107.7802 45.1078 0.0000 170.8268 38 L 5.0279 8.5117 120.1095 53.2302 45.3698 175.6656 39 A 5.1932 8.3296 125.5196 50.1301 22.3971 176.2920 40 S 4.2760 8.9055 116.1599 58.3598 63.6664 175.5410 41 C 4.2474 8.5458 119.2385 62.3076 28.0434 174.8123 42 S 4.4630 7.9061 112.3034 57.7327 63.1176 173.8544 43 G 3.9796 7.6942 111.3244 46.3886 0.0000 174.8019 44 D 4.4082 8.0480 121.3181 53.7257 41.2961 175.1735 45 E 4.4429 8.7169 125.4075 56.2146 30.0638 175.7378 46 L 4.5494 8.8955 126.5110 56.3112 43.5839 175.9767 47 A 4.6526 7.5056 118.2298 51.3803 22.9436 174.8713 48 T 4.8832 8.2256 113.9971 61.6115 72.4191 175.1729 49 G 4.0254 9.0579 111.9775 45.3197 0.0000 172.2360 50 H 4.9062 8.6861 113.5441 54.8584 32.4819 174.3848 51 L 4.5818 9.0576 121.9198 55.1171 42.4125 177.2924 52 A 4.2187 8.9829 125.3499 53.1450 18.8218 177.2664 53 S 3.0947 8.1792 116.3049 55.9527 65.0832 173.8762 54 I 4.4715 6.1838 120.6395 60.3218 40.1003 174.9990 55 H 5.2533 8.5315 120.9322 54.7867 30.0364 173.8655 56 S 4.2253 7.1371 112.4260 56.2811 66.1863 176.2350 57 A 3.8263 7.9098 124.6772 55.1815 18.0298 180.1579 58 E 3.9533 7.9956 116.8651 59.7373 29.7305 179.1993 59 S 3.8708 8.0838 115.2279 61.6179 62.7910 176.7557 60 Q 3.9200 7.8916 121.5534 59.1840 28.8443 178.0857 61 A 3.8210 7.9404 121.8257 54.8148 18.4449 179.4651 62 F 3.8389 7.8003 119.3337 61.3330 39.3925 177.4772 63 L 3.2420 7.6166 118.6442 57.5863 41.2304 179.4056 64 T 3.6600 7.7254 115.8814 66.7887 68.4102 176.1973 65 E 3.7660 8.0001 120.9277 58.9359 29.1930 178.6371 66 L 3.6949 7.2341 120.3373 57.7184 42.1718 179.0940 67 V 3.4305 7.4811 118.1111 65.8891 31.3288 177.9826 68 K 3.8519 7.8834 117.4070 59.7724 32.0567 178.7551 69 T 3.9750 8.0552 107.9545 64.0531 68.9303 175.5197 70 S 4.3932 7.4811 116.9807 59.6338 64.0139 174.1487 71 L 4.8976 7.5766 119.7273 53.1870 41.9967 176.3632 72 P 4.3392 0.0000 0.0000 65.7262 31.9390 178.0222 73 D 4.4589 7.9670 116.1279 55.0892 41.1505 176.6600 74 L 4.3347 7.5930 118.3983 55.2721 42.4553 176.8356 75 I 3.6004 7.0668 120.3396 61.9930 37.1661 175.7001 76 T 4.4847 8.4068 116.6942 60.1479 70.9070 175.1301 77 G 4.0647 8.5995 108.6431 45.8742 0.0000 174.4227 78 G 4.1253 7.7669 107.6885 46.4402 0.0000 177.1583 79 W 4.8098 9.2175 123.2102 58.1315 30.8757 175.8383 80 A 4.5496 8.1730 121.4351 51.2810 19.2745 175.0023 81 P 4.7167 0.0000 0.0000 62.2887 33.3967 174.7528 82 Q 4.8691 8.0503 120.9203 54.4816 30.6318 175.1849 83 V 4.4821 8.2255 122.3441 60.9687 35.2996 174.2565 84 Y 5.3039 9.1990 126.2658 58.4977 39.0515 175.1835 85 I 4.9814 8.7011 116.4183 58.3244 42.1909 175.4859 86 G 4.4695 9.3263 106.9106 47.1921 0.0000 172.8037 87 M 4.3230 8.2005 121.2621 54.1613 33.8013 174.9584 88 K 4.6173 8.7969 125.2315 54.5201 35.6724 175.0601 89 V 4.4119 8.1217 125.9632 60.8000 32.9477 173.9851 90 G 4.2664 8.8796 123.4332 46.7141 0.0000 177.0088 91 S 4.2748 8.9912 119.4840 60.6339 63.3793 173.8148 92 T 4.7315 7.4585 108.3246 59.2053 71.6086 174.6108 93 N 4.2807 8.6046 119.1832 56.1703 38.6092 177.0037 94 S 4.2655 7.8837 111.1975 60.3835 63.6322 174.4436 95 D 4.6990 7.7096 122.2642 53.2048 39.7252 173.5510 96 Q 5.2152 8.2787 119.9579 53.9976 31.3603 174.6883 97 T 4.7353 8.8105 113.3507 59.7482 73.0044 172.6165 98 W 5.5220 8.5160 121.6695 55.2259 31.3762 177.6180 99 T 3.9627 8.8485 114.0885 64.8426 68.3394 175.4188 100 D 3.9470 7.9738 118.8993 53.6841 39.2678 176.9978 101 G 3.9509 8.3515 108.5279 45.8710 0.0000 173.9479 102 S 4.5465 8.4210 114.8696 57.3512 64.0526 173.7360 103 S 4.6191 8.3846 115.1846 57.6874 63.7892 174.9385 104 V 4.4445 8.3982 123.3482 62.1878 29.8442 174.6919 105 D 5.1083 8.8809 122.2301 52.5035 40.0207 175.6749 106 Y 4.7693 8.1075 119.9906 56.3692 41.4111 173.9578 107 D 4.3029 8.5046 127.3963 53.2435 40.6353 175.4150 108 G 2.1988 5.6752 114.1641 43.8749 0.0000 171.6706 109 W 4.8498 6.7031 120.3496 56.2649 29.8299 176.5126 110 V 3.8684 9.0606 124.7720 62.6524 32.3326 175.3976 111 S 4.2960 8.5894 122.6241 59.9303 62.5339 173.5926 112 G 4.1671 9.2352 112.7842 45.6576 0.0000 173.6673 113 E 4.3317 8.2880 119.0737 54.3973 30.7414 174.2630 114 P 4.3461 0.0000 0.0000 62.3304 32.3816 175.9558 115 N 4.8942 8.7188 114.0953 53.1431 39.0131 174.3287 116 N 4.8669 8.3120 115.2233 53.1210 39.2799 174.8446 117 G 3.7450 7.7561 107.8539 44.2317 0.0000 171.8936 118 P 4.4867 0.0000 0.0000 62.3960 32.5287 175.5379 119 N 4.3360 8.5545 113.3643 53.5024 36.1702 172.7835 120 S 4.7477 7.1852 113.0123 56.7379 67.1785 174.4595 121 R 4.5747 8.6133 117.1475 54.4167 34.3338 175.4772 122 G 4.3754 8.9916 109.2271 46.2751 0.0000 172.5269 123 A 5.1226 8.7432 122.6199 50.2673 23.5328 175.6817 124 I 4.3647 9.1255 123.0755 61.4229 38.5578 175.2422 125 A 5.0214 8.9603 129.6870 50.6292 19.2925 176.5415 126 A 4.3861 9.0272 122.1257 53.0572 19.6160 177.8461 127 G 3.8535 8.3436 103.9561 46.1268 0.0000 174.7805 128 D 4.4712 8.9252 121.1566 57.2627 40.7015 177.7471 129 Y 4.1701 8.1008 119.8827 59.4844 39.0692 176.6682 130 S 4.3074 7.9636 111.1798 56.7702 64.8495 174.4100 131 R 3.6092 9.1306 118.9108 57.0743 27.8792 177.2025 132 G 3.8712 8.6616 108.2630 45.2154 0.0000 174.8134 133 F 4.4727 7.4543 118.0191 57.3445 40.5846 174.3835 134 W 5.5085 9.0105 120.6002 56.3368 30.5055 175.7677 135 A 5.7117 9.4091 125.7303 50.4073 21.7489 174.8686 136 D 5.6466 8.9044 119.3098 52.1172 41.7385 175.9637 137 V 4.3750 8.6241 113.6086 59.8081 37.2634 173.6715 138 Y 4.3544 7.9720 118.0149 57.6814 38.5264 177.8680 139 S 4.2759 9.1913 118.4028 60.3063 63.2173 174.9759 140 N 4.7952 7.9948 116.8886 52.7333 38.2206 174.8252 141 N 4.2129 8.1685 118.5220 53.7691 39.7075 173.7762 142 N 4.9935 8.4953 120.9560 52.2988 39.5035 174.2933 143 F 5.4046 8.9954 122.0200 55.2283 43.9753 174.8442 144 K 5.0182 8.4696 119.8977 57.2051 33.5597 175.2777 145 Y 5.4402 8.0565 117.7381 56.5458 41.8248 173.4036 146 I 4.9552 8.6714 121.4262 60.0110 39.9758 174.4237 147 C 5.6142 9.4970 125.0749 55.8810 40.9470 172.6824 148 Q 5.3380 9.3762 119.7277 54.4321 31.2308 175.1326 149 L 4.2810 8.1109 121.1801 53.3617 42.9860 174.9331 150 P 4.1710 0.0000 0.0000 63.1970 31.7842 175.8893 151 C 4.1984 8.5855 125.7115 59.0472 32.0811 172.9844 152 V 4.4695 7.8631 119.2088 60.1124 35.2968 173.5930 153 H 4.8322 7.9088 116.7831 53.6171 31.6750 172.6351 154 Y 4.4154 8.3199 118.2215 58.0117 38.4683 175.2541 155 T 4.5910 8.4701 113.4511 59.8384 70.7132 174.0202 156 L 4.6137 8.4753 124.5593 53.8799 43.8596 176.2469 157 E 4.7188 8.6207 120.8259 57.1577 28.8630 176.7969 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 2 L 8.18 4.22 0.00 1.57 1.62 0.89 0.59 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 3 T 8.33 4.37 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 1.20 0.00 0.00 4 S 9.28 4.66 0.00 3.95 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 5 C 8.34 5.00 0.00 3.00 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 6 P 0.00 4.55 0.00 2.14 1.94 0.00 3.35 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.91 0.00 7 P 0.00 4.36 0.00 2.11 2.06 0.00 3.78 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 2.08 2.17 0.00 8 L 8.76 3.89 0.00 1.75 1.67 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 9 W 7.66 4.84 0.00 3.26 3.14 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 10 T 9.12 4.75 4.35 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 1.56 0.00 0.00 11 G 8.89 4.51 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 12 F 9.18 4.50 0.00 1.56 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 13 N 9.20 3.85 0.00 1.92 2.75 0.00 0.00 7.39 7.98 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 14 G 8.46 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 15 K 7.99 4.55 0.00 1.82 1.00 0.00 1.65 0.00 0.00 1.82 0.00 0.00 2.91 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.17 1.30 7.81 16 C 8.14 5.44 0.00 2.56 2.92 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 17 F 9.69 5.98 0.00 3.21 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 18 R 8.63 4.37 0.00 0.67 0.66 0.00 2.21 0.00 0.00 2.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.64 0.00 19 L 7.92 4.60 0.00 1.42 1.22 0.74 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 20 F 8.41 4.52 0.00 1.57 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 21 H 8.95 4.48 0.00 3.13 3.36 0.00 5.69 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 N 8.06 4.91 0.00 2.88 2.94 0.00 0.00 6.07 7.90 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 23 H 8.99 5.09 0.00 3.11 3.46 0.00 5.85 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 L 9.40 5.00 0.00 1.56 1.40 0.98 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 25 N 8.69 5.71 0.00 3.23 3.00 0.00 0.00 6.36 8.12 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 26 F 8.76 3.16 0.00 2.58 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 27 D 8.15 4.30 0.00 2.71 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 N 8.02 4.28 0.00 2.67 2.77 0.00 0.00 6.99 7.46 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 29 A 7.46 3.15 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 E 7.62 3.64 0.00 1.53 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 2.24 2.29 0.00 31 N 7.78 4.13 0.00 2.88 2.76 0.00 0.00 7.19 7.26 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 32 A 7.89 3.99 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 C 8.20 4.67 0.00 3.20 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 R 7.67 4.01 0.00 1.89 1.90 0.00 3.10 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.76 0.00 35 Q 7.58 3.94 0.00 1.35 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.89 6.67 0.00 0.00 0.00 0.00 0.00 2.43 2.30 0.00 36 F 7.41 4.92 0.00 3.08 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 37 G 8.39 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 38 L 8.51 5.03 0.00 1.62 1.41 0.86 1.10 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 39 A 8.33 5.19 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 40 S 8.91 4.28 0.00 4.01 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 41 C 8.55 4.25 0.00 2.99 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 42 S 7.91 4.46 0.00 3.97 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 43 G 7.69 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 44 D 8.05 4.41 0.00 2.66 2.60 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 45 E 8.72 4.44 0.00 1.89 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 2.27 2.37 0.00 46 L 8.90 4.55 0.00 1.48 1.67 0.90 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 47 A 7.51 4.65 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 T 8.23 4.88 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 49 G 9.06 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 50 H 8.69 4.91 0.00 3.12 3.18 0.00 5.65 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 9.06 4.58 0.00 1.63 1.72 0.24 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.98 4.22 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 53 S 8.18 3.09 0.00 2.72 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 54 I 6.18 4.47 2.27 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.48 1.19 0.00 0.00 55 H 8.53 5.25 0.00 3.12 3.36 0.00 5.93 0.00 0.00 0.00 0.00 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 S 7.14 4.23 0.00 4.05 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 57 A 7.91 3.83 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 58 E 8.00 3.95 0.00 2.23 2.35 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 2.49 2.53 0.00 59 S 8.08 3.87 0.00 4.04 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 60 Q 7.89 3.92 0.00 2.39 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.61 2.31 0.00 61 A 7.94 3.82 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 F 7.80 3.84 0.00 2.17 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 L 7.62 3.24 0.00 1.49 1.41 0.66 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 64 T 7.73 3.66 4.17 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 1.05 0.00 0.00 65 E 8.00 3.77 0.00 2.03 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 2.21 2.23 0.00 66 L 7.23 3.69 0.00 1.04 1.23 0.74 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 67 V 7.48 3.43 2.05 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 0.87 0.00 0.00 0.83 0.00 0.00 68 K 7.88 3.85 0.00 1.65 1.80 0.00 1.67 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.47 7.81 69 T 8.06 3.97 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 1.19 0.00 0.00 70 S 7.48 4.39 0.00 3.82 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 71 L 7.58 4.90 0.00 1.63 1.53 0.83 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 72 P 0.00 4.34 0.00 2.19 2.27 0.00 3.66 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.96 0.00 73 D 7.97 4.46 0.00 2.68 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 74 L 7.59 4.33 0.00 1.74 1.71 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 75 I 7.07 3.60 1.85 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.70 0.89 0.00 0.00 76 T 8.41 4.48 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 1.30 0.00 0.00 77 G 8.60 4.06 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 0.00 0.00 0.00 78 G 7.77 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 0.00 0.00 0.00 79 W 9.22 4.81 0.00 3.27 3.34 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 80 A 8.17 4.55 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 P 0.00 4.72 0.00 2.10 2.12 0.00 3.39 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 1.98 2.07 0.00 82 Q 8.05 4.87 0.00 0.93 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.72 0.00 0.00 0.00 0.00 0.00 2.23 2.10 0.00 83 V 8.23 4.48 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.80 0.00 0.00 84 Y 9.20 5.30 0.00 3.21 2.92 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 85 I 8.70 4.98 2.12 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.09 0.93 0.00 0.00 86 G 9.33 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 M 8.20 4.32 0.00 1.75 0.83 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.31 0.00 88 K 8.80 4.62 0.00 1.74 1.56 0.00 1.91 0.00 0.00 1.67 0.00 0.00 2.76 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.12 1.14 7.81 89 V 8.12 4.41 1.96 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 0.82 0.00 0.00 0.87 0.00 0.00 90 G 8.88 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 91 S 8.99 4.27 0.00 3.85 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 92 T 7.46 4.73 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 93 N 8.60 4.28 0.00 2.64 2.78 0.00 0.00 6.95 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 94 S 7.88 4.27 0.00 3.98 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 95 D 7.71 4.70 0.00 2.79 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 Q 8.28 5.22 0.00 1.93 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.50 0.00 97 T 8.81 4.74 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 1.22 0.00 0.00 98 W 8.52 5.52 0.00 3.41 3.21 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 0.00 99 T 8.85 3.96 4.55 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 1.50 0.00 0.00 100 D 7.97 3.95 0.00 2.74 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 G 8.35 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 0.00 0.00 0.00 102 S 8.42 4.55 0.00 4.03 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 0.00 103 S 8.38 4.62 0.00 4.15 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 0.00 104 V 8.40 4.44 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.82 0.00 0.00 105 D 8.88 5.11 0.00 2.93 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 0.00 106 Y 8.11 4.77 0.00 2.98 3.12 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 0.00 107 D 8.50 4.30 0.00 2.66 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 0.00 108 G 5.68 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 6.70 4.85 0.00 3.19 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 0.00 110 V 9.06 3.87 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 1.04 0.00 0.00 1.23 0.00 0.00 111 S 8.59 4.30 0.00 3.90 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 0.00 112 G 9.24 4.17 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 0.00 113 E 8.29 4.33 0.00 2.28 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 2.72 2.98 0.00 114 P 0.00 4.35 0.00 1.75 1.03 0.00 3.20 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.73 0.00 115 N 8.72 4.89 0.00 2.77 3.00 0.00 0.00 6.72 7.58 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 0.00 116 N 8.31 4.87 0.00 2.54 2.46 0.00 0.00 6.86 6.93 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 0.00 117 G 7.76 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 0.00 0.00 0.00 118 P 0.00 4.49 0.00 2.16 2.22 0.00 3.92 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 1.98 1.97 0.00 119 N 8.55 4.34 0.00 2.90 2.81 0.00 0.00 6.54 6.90 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 0.00 120 S 7.19 4.75 0.00 3.75 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 0.00 121 R 8.61 4.57 0.00 1.71 1.35 0.00 2.21 0.00 0.00 2.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.28 0.00 122 G 8.99 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 0.00 0.00 0.00 0.00 123 A 8.74 5.12 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 0.00 124 I 9.13 4.36 1.87 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.84 0.92 0.00 0.00 125 A 8.96 5.02 1.74 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 0.00 0.00 126 A 9.03 4.39 1.24 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 0.00 0.00 0.00 127 G 8.34 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 D 8.93 4.47 0.00 2.56 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 0.00 129 Y 8.10 4.17 0.00 2.91 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 0.00 130 S 7.96 4.31 0.00 4.11 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 0.00 131 R 9.13 3.61 0.00 2.10 2.03 0.00 3.31 0.00 0.00 3.19 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 132 G 8.66 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 0.00 133 F 7.45 4.47 0.00 3.27 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 0.00 134 W 9.01 5.51 0.00 3.02 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 0.00 135 A 9.41 5.71 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 0.00 136 D 8.90 5.65 0.00 2.67 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 V 8.62 4.38 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 0.84 0.00 0.00 1.24 0.00 0.00 138 Y 7.97 4.35 0.00 3.36 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 0.00 139 S 9.19 4.28 0.00 4.01 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 0.00 140 N 7.99 4.80 0.00 2.85 2.99 0.00 0.00 6.10 8.04 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 0.00 141 N 8.17 4.21 0.00 2.38 1.42 0.00 0.00 6.86 6.29 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 0.00 142 N 8.50 4.99 0.00 2.63 2.89 0.00 0.00 6.81 7.45 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 0.00 143 F 9.00 5.40 0.00 2.49 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 0.00 144 K 8.47 5.02 0.00 1.64 1.85 0.00 1.62 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.58 1.24 7.81 145 Y 8.06 5.44 0.00 3.13 3.24 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 0.00 146 I 8.67 4.96 1.97 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.68 1.05 0.00 0.00 147 C 9.50 5.61 0.00 3.42 3.48 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 0.00 148 Q 9.38 5.34 0.00 1.71 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.93 0.00 0.00 0.00 0.00 0.00 2.46 2.26 0.00 149 L 8.11 4.28 0.00 1.17 1.28 -0.05 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 150 P 0.00 4.17 0.00 1.85 1.99 0.00 3.51 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.95 0.00 151 C 8.59 4.20 0.00 2.84 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 0.00 152 V 7.86 4.47 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 0.74 0.00 0.00 153 H 7.91 4.83 0.00 3.16 3.16 0.00 5.52 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 8.32 4.42 0.00 3.02 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 0.00 155 T 8.47 4.59 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 1.26 0.00 0.00 156 L 8.48 4.61 0.00 1.61 1.62 0.94 0.90 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 0.00 157 E 8.62 4.72 0.00 2.06 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 2.04 2.15 0.00