NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3992 8.3044 120.3244 54.5845 33.4108 174.6456 2 K 3.9066 8.3772 122.6238 56.0081 32.7638 175.6033 3 K 4.0362 9.5035 127.4464 58.8121 33.2582 176.0137 4 H 4.8720 7.8872 112.9606 54.4058 31.8582 173.6269 5 G 4.0368 8.5578 107.9397 45.2563 0.0000 172.8881 6 I 3.7834 7.9121 118.1581 60.9336 38.4129 175.8566 7 L 4.0684 8.4441 128.5077 57.6740 42.5772 177.5421 8 N 4.4456 8.0588 118.0174 53.2274 39.8095 175.4559 9 S 4.1186 8.6346 123.4728 61.8555 63.0380 176.3083 10 H 4.2157 7.9901 119.2328 58.7204 28.5535 177.6466 11 L 4.0247 8.6338 120.8263 57.6053 41.3011 179.3778 12 A 4.0185 8.1552 120.8139 55.2508 18.1029 179.8784 13 K 3.9442 7.6718 115.7725 59.4957 32.2247 179.5085 14 I 3.9063 7.5149 120.2799 64.3995 37.1127 178.4449 15 L 3.9917 8.3732 120.0643 57.7165 41.1942 179.2558 16 A 4.0504 8.1253 120.1845 55.0530 18.3683 178.5442 17 D 4.6265 7.6107 114.4854 53.5943 41.6256 177.0843 18 L 4.1437 7.4350 121.1045 54.9096 42.2832 176.6830 19 G 4.1757 9.4926 111.7573 43.0290 0.0000 171.6958 20 H 4.3149 8.5529 119.1946 58.0435 29.8133 175.3870 21 T 3.4640 8.7211 116.7087 61.2851 68.4703 171.8715 22 D 4.6038 7.9622 122.5246 54.5912 42.2758 175.4100 23 K 5.2542 8.5669 119.7497 54.6326 36.1079 175.1271 24 I 5.0037 8.4900 115.7344 59.1429 41.5008 174.1020 25 V 4.8936 8.7182 122.9933 61.2658 34.6566 174.1322 26 I 5.1829 8.7562 127.6889 59.6600 39.4996 174.5810 27 A 5.5159 9.2945 128.5994 49.9085 23.2138 175.0324 28 D 5.1073 9.5551 119.8007 52.4276 41.1484 177.1962 29 A 4.2279 8.7594 121.2589 53.9055 18.2422 178.3962 30 G 3.8356 8.3288 103.5851 44.8741 0.0000 174.1208 31 L 4.0021 7.4099 121.5270 54.5062 42.5122 174.8041 32 P 4.4555 0.0000 0.0000 62.3018 32.3314 175.4929 33 V 4.2064 8.0191 120.4150 60.3974 32.9195 173.9692 34 P 4.3980 0.0000 0.0000 62.3693 31.9055 175.5364 35 D 4.5545 8.3782 121.3599 55.9889 41.1556 177.1620 36 G 3.9279 9.0629 112.1261 44.7912 0.0000 173.0227 37 V 4.2113 7.0645 119.5901 60.9494 32.7617 175.5239 38 L 4.1054 8.5815 130.0715 55.1998 43.3408 175.1310 39 K 4.9156 8.6444 126.8142 54.7491 34.4631 174.8687 40 I 4.3267 8.6988 128.9799 59.7146 39.3856 174.3282 41 D 5.0235 8.7164 128.0631 53.0773 41.4819 175.8030 42 L 4.6758 8.7974 126.4190 54.6156 42.5724 177.7539 43 S 4.4185 8.2138 114.5439 58.5685 63.4838 173.5784 44 L 4.5312 8.6535 123.8998 56.1844 43.9968 176.2395 45 K 4.3097 7.6158 114.3648 54.9674 34.7027 172.2875 46 P 3.8485 0.0000 0.0000 64.4353 31.1645 177.2209 47 G 3.8832 9.9685 112.3563 45.1979 0.0000 172.7736 48 L 4.7347 8.2279 122.4661 52.5636 45.0126 174.1820 49 P 4.9181 0.0000 0.0000 62.2056 33.5450 175.2226 50 A 4.6303 8.3166 121.6960 51.1849 20.2293 178.2764 51 F 4.0955 9.6177 122.1352 61.7610 39.4201 177.7463 52 Q 2.9650 7.9567 116.7969 58.7977 28.4527 178.6562 53 D 4.3141 7.8252 119.0771 57.6393 40.9259 178.8899 54 T 3.7984 7.8243 115.8611 66.6669 68.5284 176.6067 55 A 3.9744 8.0155 122.7533 55.0846 17.9016 179.5992 56 A 3.9358 8.1100 119.3150 55.2628 18.3122 180.0367 57 V 3.8280 7.6262 117.9730 65.7068 31.6085 178.3164 58 L 4.1155 8.0517 118.5669 57.6871 41.2165 179.2496 59 A 4.1970 8.0442 120.2604 54.8926 18.4244 178.8462 60 E 4.2011 8.0595 114.4908 57.6724 30.0366 177.6355 61 E 4.6294 7.7638 116.9395 56.2357 31.0754 175.0740 62 M 4.7414 7.9285 117.6905 53.2620 35.3201 174.3235 63 A 4.4184 8.4759 126.6545 51.2550 20.0550 176.1165 64 V 4.8438 8.4417 123.0275 61.9086 32.4707 175.2895 65 E 4.4883 8.8713 125.9541 57.2281 30.9268 176.0289 66 K 4.6656 7.5676 119.9351 55.2693 35.8877 174.1101 67 V 4.6708 8.7417 125.6633 61.0241 34.8010 174.1666 68 I 5.0196 8.6850 127.4238 59.6005 40.5026 174.4536 69 A 4.8633 8.8039 126.5579 50.1868 23.4853 174.8611 70 A 4.6579 8.0062 121.6883 51.2959 19.8693 178.5531 71 A 3.9781 9.6848 126.4461 55.6634 18.3444 179.9447 72 E 3.6217 7.9619 115.9816 59.1351 29.2402 179.2161 73 I 3.6612 7.8073 119.2125 63.8955 37.7752 177.9941 74 K 3.9786 7.7681 118.1977 58.5566 31.7885 178.7544 75 A 4.2242 7.5264 119.8927 54.4065 19.3865 178.7352 76 S 4.6065 7.7337 109.7503 58.3594 64.7495 174.5800 77 N 4.9653 8.2612 120.9104 50.7441 39.5913 174.7626 78 Q 3.9906 8.2676 122.7530 59.7964 29.5118 176.8691 79 E 4.0007 8.3128 118.6755 60.1289 29.5804 179.1812 80 N 4.5887 8.3948 115.8599 56.1360 38.6630 177.5248 81 A 4.1925 8.1650 122.5594 55.1433 18.4107 179.8803 82 K 4.0123 8.4859 117.2578 59.4138 32.1670 179.1379 83 F 4.0485 8.2814 120.8238 61.4204 39.2935 176.9859 84 L 4.1991 8.4210 119.6649 58.3852 41.7444 178.7468 85 E 4.1138 8.0694 117.2374 59.4282 29.4473 178.9805 86 N 4.4016 8.1062 115.6757 56.2117 38.7819 176.7889 87 L 3.6206 7.6283 120.5089 57.1287 42.8657 178.5605 88 F 5.3081 8.1359 118.9873 55.8381 38.2528 177.6742 89 S 4.2641 7.9225 114.6613 61.5126 63.3420 175.7819 90 E 4.1334 8.1101 118.9285 58.2297 29.7493 176.7306 91 Q 4.5246 7.6442 117.6991 54.5044 31.1883 174.7859 92 E 4.2903 8.6121 122.4956 56.2464 30.9013 175.1753 93 I 4.8112 8.3948 127.6728 59.4620 39.5016 174.4048 94 E 4.6777 8.9710 128.3859 54.4817 32.3313 173.8953 95 Y 5.1605 8.6403 123.6634 56.4537 40.0595 174.7632 96 L 5.1292 8.8603 122.8895 52.4301 46.7688 176.1431 97 S 4.3404 8.5374 114.0411 58.2285 63.9910 174.7081 98 H 4.1986 9.0876 121.5359 59.6689 29.3064 177.6722 99 E 3.9768 8.1998 119.8681 59.4666 29.4649 178.7589 100 E 3.9588 8.0757 119.0888 58.9741 29.4435 178.3273 101 F 4.0321 8.2882 120.1992 61.4930 39.6026 176.9333 102 K 4.0562 8.2800 117.8138 59.3699 31.8925 179.2024 103 L 3.9437 7.6060 118.9867 57.9897 41.6289 179.6918 104 L 3.9689 7.8738 118.8068 57.6728 41.5721 179.4305 105 T 3.8450 7.3349 109.3409 63.9236 68.3220 176.5041 106 K 4.0402 7.7221 120.8004 58.7698 32.0974 177.7223 107 D 4.6415 7.7281 116.6329 53.2565 41.4425 176.6134 108 A 4.3516 6.8712 122.5579 51.9998 18.9900 178.0046 109 K 4.3079 8.8647 119.6186 58.5055 32.8718 176.9622 110 A 4.6068 7.3269 119.1273 51.2562 22.6843 175.1283 111 V 4.6535 8.4378 119.2164 61.2265 34.7110 174.4290 112 I 4.7264 9.3963 130.5283 59.9902 38.7951 174.6980 113 R 4.7279 9.0724 129.6652 55.6849 31.3412 176.0145 114 T 4.8835 8.6674 117.6760 60.1927 71.5784 174.5428 115 G 4.1392 8.7237 107.0005 46.1602 0.0000 173.0816 116 E 4.6356 8.1708 123.1873 56.0056 30.5693 177.7435 117 F 5.0011 8.8320 129.2023 57.6853 39.7175 175.8563 118 T 4.6968 7.5034 108.7698 58.7548 71.6656 171.9284 119 P 3.9241 0.0000 0.0000 64.2289 31.8147 175.4902 120 Y 3.4236 7.6321 117.2782 59.0584 35.8984 171.6767 121 A 3.9083 7.0434 121.2564 50.5311 16.0361 177.4481 122 N 5.5465 7.3270 117.1100 51.2776 43.6132 174.5384 123 C 5.1978 9.3798 115.1868 57.4436 33.8674 172.5029 124 I 4.9593 9.2589 121.7173 59.7207 39.4642 174.4888 125 L 4.6430 8.7453 127.4560 53.1187 43.8214 175.1611 126 Q 4.8306 8.6723 126.1384 54.0879 30.7227 174.6687 127 A 4.4415 9.2367 129.5773 52.9001 19.5345 177.0985 128 G 4.6790 9.1737 111.5746 44.7557 0.0000 173.1725 129 V 4.4170 7.9042 118.2196 59.6983 34.0461 175.5938 130 L 4.2873 8.2403 120.8300 55.8281 42.0916 177.0630 131 F 4.4798 6.8940 118.9685 57.0299 37.8227 174.1673 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 M 8.30 4.40 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.53 0.00 2 K 8.38 3.91 0.00 1.78 1.71 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.62 1.52 7.81 3 K 9.50 4.04 0.00 1.50 1.48 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.37 1.39 7.81 4 H 7.89 4.87 0.00 3.12 3.18 0.00 5.72 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 5 G 8.56 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 0.00 0.00 0.00 6 I 7.91 3.78 1.89 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 1.31 0.87 0.97 0.00 0.00 7 L 8.44 4.07 0.00 1.63 1.68 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 8 N 8.06 4.45 0.00 2.81 2.70 0.00 0.00 6.97 7.63 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 9 S 8.63 4.12 0.00 4.02 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 10 H 7.99 4.22 0.00 3.33 3.38 0.00 5.62 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 11 L 8.63 4.02 0.00 1.82 1.74 0.95 1.29 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 12 A 8.16 4.02 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 K 7.67 3.94 0.00 1.86 1.90 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.69 7.81 14 I 7.51 3.91 2.03 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 1.75 0.97 0.92 0.00 0.00 15 L 8.37 3.99 0.00 1.67 1.73 0.94 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 16 A 8.13 4.05 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.61 4.63 0.00 2.63 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 18 L 7.44 4.14 0.00 1.76 1.62 0.93 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 19 G 9.49 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 0.00 0.00 0.00 0.00 20 H 8.55 4.31 0.00 3.00 3.20 0.00 5.78 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 T 8.72 3.46 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 0.91 0.00 0.00 22 D 7.96 4.60 0.00 2.72 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 23 K 8.57 5.25 0.00 1.61 1.59 0.00 1.54 0.00 0.00 1.79 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.52 7.81 24 I 8.49 5.00 1.88 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 1.12 0.76 0.91 0.00 0.00 25 V 8.72 4.89 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.87 0.00 0.00 26 I 8.76 5.18 2.07 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 1.21 0.66 0.95 0.00 0.00 27 A 9.29 5.52 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 28 D 9.56 5.11 0.00 2.87 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 29 A 8.76 4.23 1.31 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 30 G 8.33 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 31 L 7.41 4.00 0.00 1.82 1.63 1.09 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 32 P 0.00 4.46 0.00 2.22 2.02 0.00 3.83 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 2.00 1.96 0.00 33 V 8.02 4.21 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 0.84 0.00 0.00 0.94 0.00 0.00 34 P 0.00 4.40 0.00 2.19 1.94 0.00 3.64 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.09 0.00 35 D 8.38 4.55 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 36 G 9.06 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 0.00 0.00 0.00 37 V 7.06 4.21 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 0.74 0.00 0.00 0.96 0.00 0.00 38 L 8.58 4.11 0.00 1.81 1.68 0.91 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 39 K 8.64 4.92 0.00 1.77 1.65 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.31 1.43 7.81 40 I 8.70 4.33 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.65 0.94 0.00 0.00 41 D 8.72 5.02 0.00 2.69 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 42 L 8.80 4.68 0.00 1.59 1.71 0.95 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 43 S 8.21 4.42 0.00 4.06 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 44 L 8.65 4.53 0.00 1.52 1.76 0.92 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 45 K 7.62 4.31 0.00 1.83 1.80 0.00 1.53 0.00 0.00 1.78 0.00 0.00 2.89 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.30 1.33 7.81 46 P 0.00 3.85 0.00 1.60 0.75 0.00 3.50 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.15 0.00 47 G 9.97 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 48 L 8.23 4.73 0.00 1.67 1.58 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 49 P 0.00 4.92 0.00 2.16 2.17 0.00 3.79 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.99 0.00 50 A 8.32 4.63 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 51 F 9.62 4.10 0.00 3.12 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 52 Q 7.96 2.96 0.00 1.74 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.68 0.00 0.00 0.00 0.00 0.00 1.16 2.16 0.00 53 D 7.83 4.31 0.00 2.83 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 54 T 7.82 3.80 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 55 A 8.02 3.97 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 56 A 8.11 3.94 1.52 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 0.00 0.00 57 V 7.63 3.83 2.21 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 1.18 0.00 0.00 0.95 0.00 0.00 58 L 8.05 4.12 0.00 1.77 1.77 0.95 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 59 A 8.04 4.20 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 60 E 8.06 4.20 0.00 2.21 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 0.00 2.46 2.35 0.00 61 E 7.76 4.63 0.00 2.06 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 2.41 2.37 0.00 62 M 7.93 4.74 0.00 2.12 1.90 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.47 0.00 63 A 8.48 4.42 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 64 V 8.44 4.84 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 0.75 0.00 0.00 0.99 0.00 0.00 65 E 8.87 4.49 0.00 2.01 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 0.00 2.40 2.21 0.00 66 K 7.57 4.67 0.00 1.77 1.56 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.72 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.34 1.53 7.81 67 V 8.74 4.67 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 0.77 0.00 0.00 -0.02 0.00 0.00 68 I 8.68 5.02 1.92 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 1.12 0.45 1.08 0.00 0.00 69 A 8.80 4.86 1.04 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 0.00 0.00 70 A 8.01 4.66 1.13 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 71 A 9.68 3.98 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 72 E 7.96 3.62 0.00 1.16 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 1.84 2.08 0.00 73 I 7.81 3.66 1.99 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 1.53 1.39 1.09 0.00 0.00 74 K 7.77 3.98 0.00 1.73 1.71 0.00 1.23 0.00 0.00 1.38 0.00 0.00 2.42 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.22 1.01 7.81 75 A 7.53 4.22 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 76 S 7.73 4.61 0.00 3.99 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 77 N 8.26 4.97 0.00 2.82 2.73 0.00 0.00 6.74 6.68 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 78 Q 8.27 3.99 0.00 2.20 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.61 0.00 0.00 0.00 0.00 0.00 2.45 2.56 0.00 79 E 8.31 4.00 0.00 2.05 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 0.00 2.43 2.39 0.00 80 N 8.39 4.59 0.00 2.79 2.94 0.00 0.00 7.03 7.25 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 81 A 8.16 4.19 1.47 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 82 K 8.49 4.01 0.00 2.07 1.94 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.65 7.81 83 F 8.28 4.05 0.00 3.28 3.44 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 L 8.42 4.20 0.00 2.38 2.00 1.42 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 85 E 8.07 4.11 0.00 2.22 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 0.00 2.71 2.60 0.00 86 N 8.11 4.40 0.00 2.65 2.73 0.00 0.00 6.99 7.93 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 87 L 7.63 3.62 0.00 0.59 1.10 0.46 0.45 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 88 F 8.14 5.31 0.00 3.18 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 89 S 7.92 4.26 0.00 3.97 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 90 E 8.11 4.13 0.00 2.01 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 0.00 2.32 2.33 0.00 91 Q 7.64 4.52 0.00 2.11 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.01 0.00 0.00 0.00 0.00 0.00 2.46 2.43 0.00 92 E 8.61 4.29 0.00 2.04 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 2.35 2.33 0.00 93 I 8.39 4.81 1.87 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 1.16 0.95 0.56 0.00 0.00 94 E 8.97 4.68 0.00 1.97 1.70 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 2.20 2.27 0.00 95 Y 8.64 5.16 0.00 2.89 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 96 L 8.86 5.13 0.00 1.69 1.61 1.03 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 97 S 8.54 4.34 0.00 4.04 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 98 H 9.09 4.20 0.00 3.57 3.52 0.00 5.78 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 E 8.20 3.98 0.00 2.06 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 2.46 2.35 0.00 100 E 8.08 3.96 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 101 F 8.29 4.03 0.00 3.15 3.32 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 0.00 102 K 8.28 4.06 0.00 2.00 1.84 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.55 7.81 103 L 7.61 3.94 0.00 1.92 1.68 0.94 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 104 L 7.87 3.97 0.00 1.61 1.51 0.85 0.43 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 0.00 105 T 7.33 3.84 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 0.93 0.00 0.00 106 K 7.72 4.04 0.00 1.81 1.88 0.00 1.66 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.44 1.55 7.81 107 D 7.73 4.64 0.00 2.70 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 0.00 108 A 6.87 4.35 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 0.00 109 K 8.86 4.31 0.00 1.60 1.88 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.56 1.53 7.81 110 A 7.33 4.61 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 0.00 111 V 8.44 4.65 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 1.09 0.00 0.00 0.94 0.00 0.00 112 I 9.40 4.73 1.99 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.54 0.95 0.00 0.00 113 R 9.07 4.73 0.00 1.90 1.83 0.00 3.09 0.00 0.00 3.63 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.60 0.00 114 T 8.67 4.88 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 1.31 0.00 0.00 115 G 8.72 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 0.00 116 E 8.17 4.64 0.00 2.22 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 2.28 2.43 0.00 117 F 8.83 5.00 0.00 2.91 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 0.00 118 T 7.50 4.70 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 1.29 0.00 0.00 119 P 0.00 3.92 0.00 2.16 1.80 0.00 3.82 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.01 0.00 120 Y 7.63 3.42 0.00 2.97 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 0.00 121 A 7.04 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 N 7.33 5.55 0.00 2.27 2.89 0.00 0.00 7.02 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 0.00 123 C 9.38 5.20 0.00 3.22 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 0.00 124 I 9.26 4.96 1.87 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.41 0.83 0.00 0.00 125 L 8.75 4.64 0.00 1.56 1.51 1.00 0.10 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 0.00 126 Q 8.67 4.83 0.00 2.06 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.96 0.00 0.00 0.00 0.00 0.00 2.23 2.41 0.00 127 A 9.24 4.44 1.31 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 0.00 128 G 9.17 4.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 V 7.90 4.42 1.56 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 0.45 0.00 0.00 0.04 0.00 0.00 130 L 8.24 4.29 0.00 1.81 1.84 0.97 0.78 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 0.00 131 F 6.89 4.48 0.00 3.10 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