NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1D H 4.8286 8.4449 117.8271 55.4329 30.5382 172.3744 1E H 4.8957 7.8412 115.3834 52.1606 32.6600 171.2632 1F H 4.6205 9.1281 117.3454 55.9571 29.9347 174.1193 1G F 4.7562 8.4123 119.8583 57.7715 39.9591 174.5910 2 N 4.6370 8.3569 117.5014 52.3637 38.9241 174.4666 3 L 4.7615 8.0877 123.5843 52.0542 43.7875 174.8251 4 P 4.4596 0.0000 0.0000 61.6355 32.1855 174.1539 5 P 4.3968 0.0000 0.0000 62.0435 32.4610 175.6707 6 G 3.8899 8.9770 104.7702 45.0636 0.0000 171.9314 7 N 4.5036 7.8351 114.8393 51.4925 40.2178 174.0640 8 Y 4.8475 8.0520 114.9666 58.1059 38.5941 177.0105 9 K 4.0946 8.4636 122.1138 58.9530 32.1997 177.2801 10 K 4.7120 7.6011 114.8397 53.2214 35.2938 173.6794 11 P 4.8252 0.0000 0.0000 63.3184 32.3608 174.7981 12 K 4.7429 9.4354 118.9749 56.2052 36.6851 174.2301 13 L 4.9879 9.4296 120.3371 53.0674 44.5741 176.2677 14 L 4.9669 8.6121 122.8905 53.5159 42.8156 174.6527 15 Y 4.6150 9.3043 127.4911 56.8229 40.3152 173.6914 16 C 4.0943 8.6732 128.8519 57.8736 32.1106 173.9971 17 S 3.4782 7.9967 122.5110 62.5996 62.5383 175.3115 18 N 3.5317 8.2273 112.8578 56.9798 38.0445 174.3913 19 G 3.7205 8.4412 107.5959 45.2669 0.0000 174.2103 20 G 3.3448 7.6041 107.5760 43.8665 0.0000 173.3125 21 H 4.7428 7.3613 115.6408 54.3192 31.2173 174.0965 22 F 5.1010 8.9571 120.5635 55.9334 40.6819 175.3063 23 L 4.4623 9.0010 126.5744 55.5887 42.7348 176.1528 24 R 4.8593 9.5018 126.0442 54.5957 33.5506 173.9352 25 I 4.3433 8.3705 126.9664 59.5330 38.6538 175.6592 26 L 4.1589 8.6526 127.8885 53.1852 42.5514 176.5678 27 P 4.1583 0.0000 0.0000 66.0304 31.2477 177.2334 28 D 4.5340 7.9921 113.8432 53.5045 39.4986 177.0507 29 G 3.9893 8.5677 109.2694 45.5099 0.0000 173.6759 30 T 4.3322 7.2910 115.3968 61.5953 68.0459 173.1160 31 I 4.9497 7.9573 127.9993 59.6726 39.9814 174.7773 32 D 4.5832 8.3427 123.5352 53.0319 42.6433 174.2570 33 G 4.5609 8.8656 104.8802 45.4879 0.0000 172.2665 34 T 5.0099 8.8438 114.7542 60.5654 70.9924 174.7265 35 R 4.4253 8.8947 124.5182 56.8878 31.1669 176.2435 36 D 4.5141 8.3162 119.1733 53.6961 40.4201 176.4354 37 R 3.7982 8.5325 127.0886 57.4299 30.3079 176.9268 38 S 4.3684 8.2923 111.1087 59.5225 63.8436 174.2145 39 D 4.3009 7.5424 120.7989 55.3110 41.0834 176.0271 40 Q 4.4098 8.5572 123.5747 56.6956 29.2267 175.7020 41 H 4.9616 9.0932 116.3772 55.5251 29.2025 175.5370 42 I 4.5008 7.2807 113.1828 60.8458 39.0477 175.4873 43 Q 4.1878 7.9372 121.6875 55.8924 29.6092 174.8896 44 L 5.0665 8.9947 124.5884 52.8055 45.4669 175.3262 45 Q 4.7579 9.1877 124.7888 54.5676 30.6949 174.2438 46 L 5.6767 8.8574 126.4432 52.9016 43.7927 176.0471 47 S 4.5667 8.2585 114.6874 56.7285 67.0094 172.1176 48 A 5.0888 8.1899 122.4318 50.5612 20.2058 174.8300 49 E 3.8663 9.0869 125.0571 56.7108 29.7824 177.9104 50 S 4.6875 6.6504 112.4462 56.3422 65.7160 173.9130 51 V 3.8387 8.1429 121.4703 64.6486 31.6626 176.3844 52 G 3.9220 9.1339 114.4905 45.2695 0.0000 172.0326 53 E 5.2074 8.1993 120.0000 54.7088 32.0352 175.6358 54 V 4.8722 8.9577 116.4905 59.9162 36.7717 173.9149 55 Y 5.1283 8.7669 119.8119 56.5618 41.0293 175.4017 56 I 4.3072 8.5909 122.4616 59.6532 40.2133 173.9427 57 K 4.5525 8.8186 129.3505 54.2281 34.8636 175.2483 58 S 4.5963 8.7256 122.6919 57.8976 62.4033 174.7617 59 T 3.8186 8.2697 119.0697 64.8017 68.6336 175.9443 60 E 4.0166 8.3971 122.5825 58.9592 29.8183 177.2720 61 T 4.2595 7.7996 105.7156 60.8710 69.8054 175.6302 62 G 3.8118 8.4136 110.4997 45.5595 0.0000 173.6926 63 Q 4.5324 7.5303 119.0500 55.7856 30.4350 174.4354 64 Y 4.7384 8.9311 119.1084 55.8878 40.8671 175.3172 65 L 4.4158 8.9012 125.7483 55.3862 43.5350 175.5710 66 A 5.0252 8.6340 125.6914 50.7510 23.2674 174.4638 67 M 5.3683 8.8261 119.2431 53.9416 35.0504 175.5606 68 D 5.2525 9.5195 126.0008 51.7690 41.3895 176.9295 69 T 4.1183 8.5238 108.2527 64.1878 68.6715 174.4509 70 D 4.6389 8.3862 121.0261 53.9085 41.3217 176.9538 71 G 2.9425 8.3962 108.3847 45.4539 0.0000 172.8789 72 L 4.7562 7.6847 118.9746 52.7393 43.3503 175.8826 73 L 5.1051 8.2947 122.7460 54.9990 42.9518 175.4062 74 Y 4.8938 8.6820 118.8337 56.1936 41.9689 173.3704 75 G 4.1997 8.9542 108.6436 45.3689 0.0000 173.3071 76 S 4.9853 9.1957 121.5616 57.0374 63.8179 175.3269 77 Q 4.3825 8.9978 125.1570 58.0929 28.9832 176.3551 78 T 4.5895 7.5705 106.1040 58.7437 71.6593 171.7242 79 P 3.9590 0.0000 0.0000 61.5253 31.7033 174.4876 80 N 5.0388 8.0761 122.0543 51.0559 40.3921 174.1630 81 E 3.9184 8.7932 114.1098 59.8806 29.4824 178.2271 82 E 4.2308 8.5978 117.8038 57.7805 29.6850 177.4580 83 C 4.9007 7.7445 114.9308 58.8072 29.3125 173.4290 84 L 4.3786 7.1098 120.2464 53.6592 42.7691 175.8480 85 F 5.1944 8.8893 121.5834 55.5601 43.4131 174.4924 86 L 4.8454 9.3018 122.8784 53.8551 42.5259 175.6122 87 E 4.5051 8.7171 126.9462 55.2967 30.0818 175.7256 88 R 4.8048 8.5064 125.5135 53.9729 34.6069 174.8530 89 L 4.6787 8.7716 123.8086 55.2176 43.1354 175.8101 90 E 4.6893 9.1027 124.6217 55.2435 33.5696 174.9489 91 E 3.9969 9.7595 123.6761 57.5719 27.3086 174.2301 92 N 4.3086 8.4956 110.9349 54.1505 36.4814 174.0229 93 H 4.8056 8.5694 116.9892 57.6022 37.3304 173.4630 94 Y 4.7273 7.7089 116.0947 57.4337 40.1054 173.6021 95 N 5.5607 9.5786 118.3379 51.9016 41.2438 174.5520 96 T 5.2843 8.7469 112.8855 60.1506 72.9848 172.7389 97 Y 5.0206 8.6363 118.8638 56.6510 41.4981 174.2219 98 I 4.6657 8.5158 125.9081 59.1481 39.9536 175.5407 99 S 4.0443 8.9769 121.7272 58.6906 62.8795 174.8658 100 K 3.9303 8.8012 129.3120 59.4168 32.2283 178.7734 101 K 3.8246 7.9147 118.0342 58.9756 32.2274 176.6019 102 H 4.7553 8.1456 115.2660 54.9838 29.5900 176.1056 103 A 4.0463 8.0688 125.5060 54.5723 18.2438 180.7306 104 E 4.0449 8.0128 111.9031 58.3755 29.8218 177.6141 105 K 3.9636 7.7214 117.8224 55.5837 32.8722 175.7718 106 N 3.8502 7.4162 115.6144 53.8987 36.4318 174.8106 107 W 5.0438 7.6676 117.6493 55.8582 30.9598 177.5139 108 F 5.4005 9.1985 124.0196 55.7084 40.9511 175.7295 109 V 4.0377 8.8824 121.2733 62.8922 32.6085 175.1890 110 G 4.4456 8.5559 112.4210 45.3408 0.0000 171.5532 111 L 5.2749 8.1709 121.4739 52.5114 44.7404 177.0896 112 K 4.2740 9.2143 122.7389 55.3394 33.0741 178.4500 113 K 3.9104 8.4203 119.7004 59.5257 31.9544 178.0449 114 N 4.5308 8.0380 113.4898 52.9023 37.6238 175.8704 115 G 3.5251 8.2388 108.6050 45.3023 0.0000 173.6811 116 S 4.7150 8.1505 115.2055 57.0753 64.3397 173.6147 117 C 4.7373 8.3087 117.1758 58.3618 30.2939 172.7404 118 K 4.4535 8.8693 122.2148 55.4874 33.5382 176.0759 119 R 4.1189 8.3741 123.8267 55.3408 31.3046 177.3276 120 G 3.5075 9.0828 114.2927 48.3476 0.0000 174.0348 121 P 4.3378 0.0000 0.0000 64.3739 31.3677 177.3161 122 R 4.4665 7.9750 116.0992 55.9649 30.2929 176.0708 123 T 5.0968 7.7612 108.6081 59.8055 70.9316 173.4116 124 H 4.6932 7.8465 114.9902 54.9658 30.4798 173.1625 125 Y 3.9055 8.6413 118.4795 59.9648 38.1222 177.1116 126 G 4.0646 9.0406 111.1281 45.4627 0.0000 173.9839 127 Q 4.2515 7.3845 118.7987 55.1402 29.9262 177.1300 128 K 3.8439 8.2953 119.1189 58.6692 32.8436 179.4750 129 A 3.8910 7.7821 121.8278 54.4516 18.3806 178.4499 130 I 4.4312 7.1880 106.0359 60.4009 38.4989 175.2767 131 L 4.3826 7.3090 123.0698 54.0265 42.6271 175.7869 132 F 5.3592 9.4114 122.7937 55.4604 43.1699 174.1337 133 L 5.2575 9.2193 123.1060 52.7726 45.0713 173.6598 134 P 5.1736 0.0000 0.0000 62.4771 31.7427 175.2626 135 L 4.8921 9.0322 126.1571 52.2031 43.9654 174.9289 136 P 4.7079 0.0000 0.0000 62.6822 32.4025 176.7508 137 V 3.7624 8.1870 113.2959 61.8590 31.5690 176.2867 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 1D H 8.44 4.83 0.00 3.10 3.30 0.00 5.62 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E H 7.84 4.90 0.00 3.25 3.26 0.00 5.71 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1F H 9.13 4.62 0.00 3.32 3.38 0.00 5.66 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 1G F 8.41 4.76 0.00 2.91 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 2 N 8.36 4.64 0.00 2.97 2.79 0.00 0.00 6.89 6.74 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 3 L 8.09 4.76 0.00 1.50 1.43 0.69 0.39 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 4 P 0.00 4.46 0.00 2.17 2.09 0.00 3.68 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.91 0.00 5 P 0.00 4.40 0.00 2.17 2.08 0.00 3.70 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 1.95 1.93 0.00 6 G 8.98 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 N 7.84 4.50 0.00 2.63 2.66 0.00 0.00 5.88 7.55 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 8 Y 8.05 4.85 0.00 3.04 3.25 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 9 K 8.46 4.09 0.00 1.84 1.91 0.00 1.64 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.51 1.57 7.81 10 K 7.60 4.71 0.00 1.71 1.69 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.39 7.81 11 P 0.00 4.83 0.00 2.07 2.06 0.00 3.78 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 12 K 9.44 4.74 0.00 2.00 1.97 0.00 1.36 0.00 0.00 1.77 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.37 1.51 7.81 13 L 9.43 4.99 0.00 1.77 1.84 0.57 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.61 4.97 0.00 1.59 1.67 0.35 0.89 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 15 Y 9.30 4.62 0.00 3.11 3.08 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 16 C 8.67 4.09 0.00 2.38 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 17 S 8.00 3.48 0.00 3.75 3.69 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 18 N 8.23 3.53 0.00 2.49 2.46 0.00 0.00 6.88 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 19 G 8.44 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 0.00 0.00 0.00 20 G 7.60 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 0.00 0.00 0.00 21 H 7.36 4.74 0.00 3.03 3.19 0.00 5.80 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 22 F 8.96 5.10 0.00 3.12 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 23 L 9.00 4.46 0.00 1.72 1.60 0.89 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 24 R 9.50 4.86 0.00 1.90 2.08 0.00 3.22 0.00 0.00 3.33 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.82 0.00 25 I 8.37 4.34 1.84 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.72 0.88 0.00 0.00 26 L 8.65 4.16 0.00 1.80 1.51 0.97 0.74 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 27 P 0.00 4.16 0.00 1.99 2.12 0.00 3.53 0.00 0.00 3.25 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 28 D 7.99 4.53 0.00 2.79 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 29 G 8.57 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 T 7.29 4.33 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 1.41 0.00 0.00 31 I 7.96 4.95 1.88 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.10 0.88 0.00 0.00 32 D 8.34 4.58 0.00 2.85 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 33 G 8.87 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 34 T 8.84 5.01 4.32 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 1.34 0.00 0.00 35 R 8.89 4.43 0.00 1.91 2.04 0.00 3.24 0.00 0.00 3.13 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.53 0.00 36 D 8.32 4.51 0.00 2.81 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 37 R 8.53 3.80 0.00 1.72 1.84 0.00 3.18 0.00 0.00 3.21 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.05 0.00 38 S 8.29 4.37 0.00 3.98 3.94 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 39 D 7.54 4.30 0.00 2.83 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 40 Q 8.56 4.41 0.00 1.88 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 7.25 0.00 0.00 0.00 0.00 0.00 2.27 2.25 0.00 41 H 9.09 4.96 0.00 3.29 3.48 0.00 5.76 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 42 I 7.28 4.50 1.91 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.55 1.02 0.00 0.00 43 Q 7.94 4.19 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.89 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 44 L 8.99 5.07 0.00 1.50 1.44 0.82 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 9.19 4.76 0.00 2.08 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.78 0.00 0.00 0.00 0.00 0.00 2.26 2.36 0.00 46 L 8.86 5.68 0.00 1.77 1.48 0.92 1.08 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 S 8.26 4.57 0.00 3.89 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 48 A 8.19 5.09 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 49 E 9.09 3.87 0.00 1.70 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 2.23 2.37 0.00 50 S 6.65 4.69 0.00 4.10 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.14 3.84 2.31 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 0.97 0.00 0.00 1.03 0.00 0.00 52 G 9.13 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 53 E 8.20 5.21 0.00 1.90 1.71 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 0.00 2.23 2.28 0.00 54 V 8.96 4.87 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 0.69 0.00 0.00 1.17 0.00 0.00 55 Y 8.77 5.13 0.00 3.00 3.08 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 56 I 8.59 4.31 1.73 0.00 0.00 -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 0.99 0.77 0.68 0.00 0.00 57 K 8.82 4.55 0.00 1.21 1.45 0.00 1.15 0.00 0.00 0.91 0.00 0.00 2.64 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.91 0.38 7.81 58 S 8.73 4.60 0.00 3.84 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 59 T 8.27 3.82 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 1.17 0.00 0.00 60 E 8.40 4.02 0.00 1.99 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 0.00 2.27 2.37 0.00 61 T 7.80 4.26 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 1.24 0.00 0.00 62 G 8.41 3.81 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 0.00 0.00 0.00 63 Q 7.53 4.53 0.00 1.93 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 6.71 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 64 Y 8.93 4.74 0.00 2.87 2.90 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 0.00 0.00 0.00 65 L 8.90 4.42 0.00 1.64 1.49 0.81 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 66 A 8.63 5.03 0.62 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 67 M 8.83 5.37 0.00 2.18 2.22 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.61 0.00 68 D 9.52 5.25 0.00 2.97 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 69 T 8.52 4.12 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 1.34 0.00 0.00 70 D 8.39 4.64 0.00 2.78 2.65 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 0.00 0.00 0.00 0.00 71 G 8.40 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 0.00 0.00 0.00 72 L 7.68 4.76 0.00 2.03 1.60 0.87 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.29 5.11 0.00 1.56 1.61 0.90 0.88 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 74 Y 8.68 4.89 0.00 3.02 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 75 G 8.95 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 76 S 9.20 4.99 0.00 3.74 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 77 Q 9.00 4.38 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.56 0.00 0.00 0.00 0.00 0.00 2.43 2.33 0.00 78 T 7.57 4.59 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 1.20 0.00 0.00 79 P 0.00 3.96 0.00 0.88 0.49 0.00 3.40 0.00 0.00 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.20 0.00 80 N 8.08 5.04 0.00 2.90 2.92 0.00 0.00 5.95 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 81 E 8.79 3.92 0.00 2.12 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 0.00 2.36 2.33 0.00 82 E 8.60 4.23 0.00 2.26 2.29 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 2.39 2.46 0.00 83 C 7.74 4.90 0.00 3.28 3.22 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 0.00 84 L 7.11 4.38 0.00 1.41 1.31 0.77 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 85 F 8.89 5.19 0.00 3.13 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 86 L 9.30 4.85 0.00 1.52 1.60 0.90 0.97 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 87 E 8.72 4.51 0.00 2.18 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 2.19 1.88 0.00 88 R 8.51 4.80 0.00 1.78 1.77 0.00 3.06 0.00 0.00 2.84 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.61 0.00 89 L 8.77 4.68 0.00 1.57 1.69 0.99 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 90 E 9.10 4.69 0.00 2.22 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.45 0.00 91 E 9.76 4.00 0.00 2.38 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 0.00 2.29 2.40 0.00 92 N 8.50 4.31 0.00 2.84 2.88 0.00 0.00 6.86 8.16 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 93 H 8.57 4.81 0.00 2.80 2.85 0.00 5.94 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 7.71 4.73 0.00 3.00 2.96 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 95 N 9.58 5.56 0.00 3.00 2.53 0.00 0.00 6.95 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 96 T 8.75 5.28 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 1.39 0.00 0.00 97 Y 8.64 5.02 0.00 2.74 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 I 8.52 4.67 1.69 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 -0.30 0.45 0.68 0.00 0.00 99 S 8.98 4.04 0.00 4.10 4.04 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 0.00 100 K 8.80 3.93 0.00 1.71 1.68 0.00 1.71 0.00 0.00 1.46 0.00 0.00 2.79 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.31 7.81 101 K 7.91 3.82 0.00 1.62 1.67 0.00 1.73 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.00 1.31 7.81 102 H 8.15 4.76 0.00 3.30 2.68 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 0.00 103 A 8.07 4.05 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 0.00 104 E 8.01 4.04 0.00 1.94 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 0.00 2.11 2.15 0.00 105 K 7.72 3.96 0.00 0.79 0.90 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.52 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.94 0.89 7.81 106 N 7.42 3.85 0.00 2.98 2.97 0.00 0.00 6.90 7.62 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 0.00 107 W 7.67 5.04 0.00 3.32 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 F 9.20 5.40 0.00 2.88 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 0.00 109 V 8.88 4.04 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 0.62 0.00 0.00 0.45 0.00 0.00 110 G 8.56 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 L 8.17 5.27 0.00 1.39 1.45 0.98 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 112 K 9.21 4.27 0.00 1.96 1.67 0.00 1.63 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.44 7.81 113 K 8.42 3.91 0.00 1.70 1.84 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.38 1.43 7.81 114 N 8.04 4.53 0.00 2.78 2.89 0.00 0.00 6.16 7.00 0.00 0.00 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 8.24 3.53 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 0.00 116 S 8.15 4.72 0.00 3.98 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 0.00 117 C 8.31 4.74 0.00 3.00 3.11 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 0.00 0.00 0.00 0.00 118 K 8.87 4.45 0.00 1.82 1.72 0.00 1.72 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.36 7.81 119 R 8.37 4.12 0.00 1.70 1.66 0.00 3.14 0.00 0.00 3.29 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.57 0.00 120 G 9.08 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 0.00 121 P 0.00 4.34 0.00 1.96 2.22 0.00 3.18 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.44 0.00 122 R 7.98 4.47 0.00 1.86 1.93 0.00 3.30 0.00 0.00 3.28 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.66 0.00 123 T 7.76 5.10 4.32 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 1.40 0.00 0.00 124 H 7.85 4.69 0.00 3.43 3.52 0.00 5.67 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 8.64 3.91 0.00 3.13 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 G 9.04 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 0.00 127 Q 7.38 4.25 0.00 1.83 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.76 0.00 0.00 0.00 0.00 0.00 2.19 2.04 0.00 128 K 8.30 3.84 0.00 1.73 1.63 0.00 1.53 0.00 0.00 1.61 0.00 0.00 2.83 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.27 7.81 129 A 7.78 3.89 1.21 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 0.00 0.00 130 I 7.19 4.43 1.69 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.87 0.56 0.00 0.00 131 L 7.31 4.38 0.00 1.18 0.78 0.47 0.77 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 0.00 132 F 9.41 5.36 0.00 3.40 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 0.00 133 L 9.22 5.26 0.00 2.07 1.76 0.89 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 5.17 0.00 2.21 2.25 0.00 3.91 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 2.04 2.09 0.00 135 L 9.03 4.89 0.00 1.76 1.68 0.96 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 136 P 0.00 4.71 0.00 2.07 2.06 0.00 3.79 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.01 0.00 137 V 8.19 3.76 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 0.66 0.00 0.00 0.92 0.00 0.00