NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4723 8.3049 120.3482 54.8902 34.1773 175.8993 2 N 4.8276 7.8827 115.2387 52.1813 39.4172 173.0740 3 Q 4.3243 8.7822 119.0841 53.9630 30.5375 174.4168 4 P 4.3073 0.0000 0.0000 62.3717 32.2418 176.0196 5 E 3.8788 8.3439 120.6129 56.1159 30.0682 178.3782 6 R 3.8671 8.5540 123.6255 59.3446 30.4406 178.5757 7 Y 4.5145 7.6507 115.9465 59.4830 37.5056 176.7691 8 E 4.4110 7.0748 119.9333 56.5365 29.6559 176.7683 9 L 4.3703 8.1895 120.8184 55.1092 43.7756 176.7017 10 I 4.4361 6.8566 118.7858 59.2892 37.3027 176.3188 11 E 4.5178 7.5527 115.1193 55.2068 31.9308 174.9676 12 L 4.1482 8.6987 128.1641 55.8690 40.8390 178.1403 13 M 4.3484 8.6161 125.6014 56.2791 29.3536 176.3589 14 G 4.0207 8.0731 108.0414 45.9569 0.0000 170.3159 15 L 4.4800 7.1122 117.1859 51.8358 42.9162 174.8259 16 P 4.2409 0.0000 0.0000 62.8610 30.7664 176.0779 17 K 3.9665 8.1691 124.5188 58.5526 32.2952 175.4669 18 V 4.7604 7.5737 120.3118 61.6600 33.8744 174.7182 19 T 4.6760 8.0840 116.0981 60.4022 72.1998 171.6950 20 Y 4.7955 8.7818 127.2600 55.7913 40.8489 174.5947 21 E 4.6430 8.2169 125.0854 54.6065 34.2334 175.6269 22 L 3.9032 8.6150 124.5002 56.7203 42.4217 175.2894 23 D 4.4480 8.4626 118.1256 54.3791 41.5215 175.7609 24 S 4.5354 5.8100 111.3421 55.7076 70.0800 173.4389 25 K 3.7020 7.7157 116.0641 57.5628 29.1497 174.2954 26 S 4.8098 7.5734 115.5173 56.3308 64.8243 172.3443 27 P 4.3559 0.0000 0.0000 63.2710 32.4120 176.4802 28 N 4.1283 8.7918 119.6688 53.2295 35.3474 173.9705 29 A 5.3632 7.3823 116.2298 52.1818 23.2582 176.8428 30 A 4.5303 8.5165 123.1933 49.8282 23.1591 174.7211 31 V 4.6931 8.1665 117.8408 61.3562 34.6111 174.3051 32 V 4.5473 9.3260 129.4514 61.7756 33.0833 174.7911 33 T 5.1726 8.1885 123.6952 60.1673 68.9339 172.3339 34 L 4.4152 7.3615 124.8471 54.5311 43.4932 175.6343 35 E 4.5092 8.8374 121.5414 54.0482 33.6518 175.7831 36 K 4.2856 8.6830 117.2403 56.6195 30.4463 175.0613 37 E 4.5588 8.1171 118.9535 55.9193 30.5937 173.6079 38 D 4.5194 8.6112 125.3057 53.5950 41.9055 174.5326 39 H 4.2813 8.4301 111.5094 56.6263 26.9845 174.8195 40 T 4.4021 6.6914 118.2620 64.4004 76.4400 175.8347 41 L 3.9700 7.7118 120.7363 57.8117 41.5202 179.6532 42 A 3.5884 7.2838 119.1711 55.0516 18.7613 178.7709 43 N 3.6710 7.5192 114.8433 56.6387 38.5460 176.7876 44 M 4.0522 7.3229 119.2959 58.0221 32.4832 180.0138 45 L 4.1564 7.1187 117.8933 53.6382 40.2300 177.2144 46 A 4.5653 6.9422 121.0684 53.0094 25.3193 177.6484 47 N 4.4428 7.5428 114.6837 54.0884 39.7887 175.8095 48 Q 4.3292 7.9116 118.1087 57.0416 31.5516 177.0372 49 L 3.9404 7.8076 119.2169 57.8982 42.2379 177.8170 50 L 4.2088 8.3312 118.4116 56.2687 41.9501 177.1807 51 S 4.2509 7.8182 111.7942 60.4372 62.7991 173.3563 52 D 4.6719 7.8010 121.4331 53.4129 40.8470 177.1582 53 E 4.0025 8.9085 124.6797 59.1853 29.6227 178.7675 54 R 4.0365 7.9309 116.3726 58.0402 30.4032 176.8174 55 V 4.2419 7.7316 117.7288 62.0956 32.5464 175.3298 56 L 4.9137 8.0101 121.2076 53.9669 44.1504 175.9455 57 F 4.4669 7.9654 118.7856 57.7869 42.7390 172.7621 58 A 4.8287 7.0921 125.5153 49.3727 19.7864 177.7100 59 G 4.0016 9.6473 109.8887 45.8488 0.0000 171.0124 60 Y 4.5018 10.4078 134.2533 58.9115 36.7390 166.8941 61 K 3.7776 7.9983 122.7626 55.2147 35.1242 174.1538 62 V 3.8827 8.4875 126.8836 62.5183 31.9018 174.1449 63 P 4.4246 0.0000 0.0000 65.3465 32.0469 176.2580 64 H 4.3970 7.5817 113.6994 54.9659 32.4152 172.2381 65 P 4.5290 0.0000 0.0000 63.5905 31.3002 176.9776 66 L 4.3198 7.7969 119.3154 56.9125 42.2345 177.2986 67 N 4.5004 8.0640 115.5305 53.4924 39.5023 175.8063 68 H 4.6969 8.6987 126.4095 54.5295 28.9334 172.4547 69 N 5.2324 7.1483 118.3657 54.2790 40.2417 175.0419 70 F 5.0459 7.5271 114.4378 57.3686 41.6375 173.6024 71 I 4.8614 7.4888 114.0606 59.2570 40.8029 174.3461 72 L 4.9204 8.1339 123.4145 54.3389 45.1666 173.4963 73 R 5.1591 8.9888 126.9716 54.6582 32.8289 174.6329 74 V 5.1634 8.9201 125.2984 60.0083 35.1792 173.6244 75 Q 5.0467 9.5274 127.8053 53.3562 31.9947 173.7545 76 T 4.5717 8.9984 130.4483 63.2402 71.6067 168.8504 77 V 3.2175 8.8643 134.2565 62.6590 28.9506 169.9754 78 E 4.5777 8.1902 125.8176 53.3293 30.0463 173.3398 79 D 4.9276 7.9998 132.5920 53.4774 40.3044 177.5236 80 C 4.8952 7.3799 110.7421 57.9950 31.3298 172.3141 81 S 4.4792 8.9414 115.2100 59.2343 64.4481 173.1836 82 P 4.9536 0.0000 0.0000 62.2323 30.9131 176.5749 83 K 4.2969 8.1679 119.2309 59.3870 32.8799 178.2946 84 Q 4.3039 7.9104 118.2480 57.4524 29.8484 178.0208 85 V 3.6217 7.6456 118.0666 65.8382 31.4250 178.0731 86 I 3.8330 7.7228 112.4919 63.6662 37.6825 178.3450 87 V 3.5463 7.3009 116.8267 66.0499 31.2429 177.6240 88 D 4.5552 8.1268 117.1829 57.3950 40.9543 178.7911 89 A 4.0745 7.7713 121.1800 54.9660 18.5682 179.1142 90 A 3.9525 8.5806 119.4120 55.5146 18.2990 180.0165 91 K 3.8997 8.6129 116.8715 59.7297 31.8276 179.5162 92 S 4.2193 7.9231 112.2576 60.7242 62.1768 175.6358 93 L 4.1951 7.6932 121.8835 57.1545 41.9227 178.3289 94 I 3.6874 7.8545 112.8097 64.9584 37.2382 177.8995 95 T 3.9332 7.8166 114.2631 64.8857 66.9688 175.8250 96 H 4.3437 7.7573 118.8723 58.5393 30.0800 177.1272 97 L 4.1115 8.4024 121.6225 57.9526 41.4940 178.8184 98 E 3.9355 8.0315 117.9023 59.8372 28.9480 179.2633 99 E 3.9062 7.6825 117.1374 59.1266 29.4042 179.0414 100 I 3.9120 8.2131 112.2168 62.3729 38.6642 177.7572 101 K 3.9022 7.9617 120.7552 58.9515 31.9680 178.6452 102 V 3.7662 8.1550 118.8175 65.7547 31.7399 177.5610 103 N 4.3682 7.6804 115.8914 56.3453 38.3321 177.1289 104 F 4.1192 8.7275 122.2811 61.6678 39.4852 176.8703 105 M 4.2753 7.8339 115.5599 56.7354 31.7273 177.5930 106 R 4.3136 7.5335 118.4854 58.1963 31.4625 177.0501 107 E 4.2343 8.5364 117.9388 57.7955 29.7250 176.8527 108 W 3.9014 8.2543 128.9135 60.6025 30.2233 176.9369 109 E 4.0992 8.4590 119.3696 59.0778 29.0971 179.0509 110 L 4.0567 7.3135 119.2285 56.8422 42.1601 177.8624 111 K 4.3978 7.7408 116.0616 56.3516 32.5020 176.8649 112 M 4.0307 7.2380 119.8997 56.6723 32.4112 177.8146 113 I 3.9504 7.5798 119.9909 63.8433 37.6145 178.0731 114 S 3.9372 7.9297 113.3080 60.2533 63.4323 174.4486 115 V 3.9509 6.8859 122.4690 62.5264 30.6999 175.5464 116 E 3.9174 8.0240 120.4545 56.4090 30.1516 174.7007 117 G 4.3440 7.9000 111.6180 45.7270 0.0000 175.8615 118 V 4.4108 7.9845 127.1646 60.3575 31.4995 175.0980 119 E 4.5018 8.6940 117.6240 57.0919 30.2970 175.5086 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 4.47 0.00 1.99 2.16 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.57 0.00 2 N 7.88 4.83 0.00 2.76 2.75 0.00 0.00 6.89 6.81 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 3 Q 8.78 4.32 0.00 2.02 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.96 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 4 P 0.00 4.31 0.00 1.98 1.95 0.00 3.65 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 2.01 2.10 0.00 5 E 8.34 3.88 0.00 1.20 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 2.23 2.10 0.00 6 R 8.55 3.87 0.00 1.87 1.96 0.00 3.12 0.00 0.00 3.39 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.59 0.00 7 Y 7.65 4.51 0.00 3.19 3.26 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 0.00 8 E 7.07 4.41 0.00 1.67 1.92 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 2.31 2.32 0.00 9 L 8.19 4.37 0.00 1.57 1.70 0.92 0.74 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 10 I 6.86 4.44 1.90 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 1.17 0.78 0.93 0.00 0.00 11 E 7.55 4.52 0.00 1.93 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 2.13 2.20 0.00 12 L 8.70 4.15 0.00 1.91 1.72 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 13 M 8.62 4.35 0.00 2.10 2.09 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.53 0.00 14 G 8.07 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 0.00 0.00 0.00 15 L 7.11 4.48 0.00 1.71 1.72 1.00 0.97 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 16 P 0.00 4.24 0.00 2.04 2.04 0.00 3.72 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 17 K 8.17 3.97 0.00 1.84 1.78 0.00 1.71 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.52 1.50 7.81 18 V 7.57 4.76 2.09 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 0.89 0.00 0.00 0.93 0.00 0.00 19 T 8.08 4.68 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 1.25 0.00 0.00 20 Y 8.78 4.80 0.00 2.92 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 21 E 8.22 4.64 0.00 1.88 1.72 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 2.23 2.30 0.00 22 L 8.61 3.90 0.00 1.50 1.63 0.95 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 23 D 8.46 4.45 0.00 2.57 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 S 5.81 4.54 0.00 3.83 3.63 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 25 K 7.72 3.70 0.00 1.92 1.72 0.00 1.68 0.00 0.00 1.80 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.41 7.81 26 S 7.57 4.81 0.00 3.77 3.71 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 0.00 0.00 0.00 27 P 0.00 4.36 0.00 2.03 1.97 0.00 3.80 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 2.00 2.08 0.00 28 N 8.79 4.13 0.00 2.99 2.92 0.00 0.00 6.84 7.37 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 29 A 7.38 5.36 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 30 A 8.52 4.53 0.64 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 0.00 0.00 31 V 8.17 4.69 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 0.89 0.00 0.00 0.90 0.00 0.00 32 V 9.33 4.55 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 0.95 0.00 0.00 0.98 0.00 0.00 33 T 8.19 5.17 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 1.13 0.00 0.00 34 L 7.36 4.42 0.00 0.95 1.48 1.07 0.82 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 35 E 8.84 4.51 0.00 1.90 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 2.16 2.44 0.00 36 K 8.68 4.29 0.00 1.88 1.98 0.00 1.85 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.44 1.53 7.81 37 E 8.12 4.56 0.00 1.99 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 2.31 2.28 0.00 38 D 8.61 4.52 0.00 2.90 3.27 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 39 H 8.43 4.28 0.00 3.41 3.47 0.00 5.56 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 40 T 6.69 4.40 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 1.17 0.00 0.00 41 L 7.71 3.97 0.00 1.71 1.76 1.02 0.80 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 42 A 7.28 3.59 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 N 7.52 3.67 0.00 2.69 2.68 0.00 0.00 7.13 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 M 7.32 4.05 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.51 0.00 45 L 7.12 4.16 0.00 1.69 1.66 0.97 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 46 A 6.94 4.57 1.10 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 0.00 0.00 47 N 7.54 4.44 0.00 2.72 2.86 0.00 0.00 6.87 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 48 Q 7.91 4.33 0.00 1.97 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.80 0.00 0.00 0.00 0.00 0.00 2.17 2.31 0.00 49 L 7.81 3.94 0.00 1.69 1.65 0.99 0.55 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 50 L 8.33 4.21 0.00 1.56 1.78 0.87 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 51 S 7.82 4.25 0.00 3.87 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 52 D 7.80 4.67 0.00 2.74 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 8.91 4.00 0.00 1.96 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 2.33 2.35 0.00 54 R 7.93 4.04 0.00 1.82 2.01 0.00 3.20 0.00 0.00 3.16 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 55 V 7.73 4.24 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 0.83 0.00 0.00 1.08 0.00 0.00 56 L 8.01 4.91 0.00 1.73 1.69 0.95 0.77 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 57 F 7.97 4.47 0.00 3.13 2.98 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 58 A 7.09 4.83 1.08 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 0.00 0.00 59 G 9.65 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 0.00 0.00 0.00 60 Y 10.41 4.50 0.00 2.98 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 K 8.00 3.78 0.00 1.58 1.53 0.00 1.34 0.00 0.00 1.50 0.00 0.00 2.89 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.18 1.26 7.81 62 V 8.49 3.88 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 0.98 0.00 0.00 1.05 0.00 0.00 63 P 0.00 4.42 0.00 2.12 2.12 0.00 3.83 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 2.13 2.11 0.00 64 H 7.58 4.40 0.00 3.17 3.11 0.00 5.86 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 P 0.00 4.53 0.00 2.01 2.02 0.00 3.29 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.03 0.00 66 L 7.80 4.32 0.00 1.87 1.77 0.98 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 67 N 8.06 4.50 0.00 2.76 2.80 0.00 0.00 6.82 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 68 H 8.70 4.70 0.00 3.26 3.24 0.00 5.84 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 N 7.15 5.23 0.00 2.84 2.78 0.00 0.00 6.25 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 F 7.53 5.05 0.00 3.28 3.27 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 71 I 7.49 4.86 1.89 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.17 0.92 0.00 0.00 72 L 8.13 4.92 0.00 1.94 1.61 1.01 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 73 R 8.99 5.16 0.00 1.98 1.93 0.00 3.30 0.00 0.00 2.73 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.70 0.00 74 V 8.92 5.16 2.15 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 1.29 0.00 0.00 1.01 0.00 0.00 75 Q 9.53 5.05 0.00 2.13 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.01 0.00 0.00 0.00 0.00 0.00 2.33 2.30 0.00 76 T 9.00 4.57 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 1.26 0.00 0.00 77 V 8.86 3.22 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 0.79 0.00 0.00 0.97 0.00 0.00 78 E 8.19 4.58 0.00 1.91 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 2.19 2.22 0.00 79 D 8.00 4.93 0.00 2.83 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 80 C 7.38 4.90 0.00 3.07 2.91 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 81 S 8.94 4.48 0.00 3.81 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 82 P 0.00 4.95 0.00 2.41 2.28 0.00 3.77 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 2.04 2.09 0.00 83 K 8.17 4.30 0.00 1.19 1.82 0.00 1.31 0.00 0.00 1.53 0.00 0.00 2.13 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.37 1.30 7.81 84 Q 7.91 4.30 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.96 0.00 0.00 0.00 0.00 0.00 2.37 2.31 0.00 85 V 7.65 3.62 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 1.08 0.00 0.00 0.98 0.00 0.00 86 I 7.72 3.83 1.92 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.70 1.05 0.00 0.00 87 V 7.30 3.55 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 1.01 0.00 0.00 0.96 0.00 0.00 88 D 8.13 4.56 0.00 2.90 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 89 A 7.77 4.07 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 90 A 8.58 3.95 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 91 K 8.61 3.90 0.00 1.85 1.87 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.53 7.81 92 S 7.92 4.22 0.00 3.97 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 93 L 7.69 4.20 0.00 1.95 1.64 0.88 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 94 I 7.85 3.69 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.71 0.91 0.00 0.00 95 T 7.82 3.93 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 1.28 0.00 0.00 96 H 7.76 4.34 0.00 3.24 3.51 0.00 6.00 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 L 8.40 4.11 0.00 1.87 1.68 0.91 0.87 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 98 E 8.03 3.94 0.00 2.03 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 0.00 2.34 2.38 0.00 99 E 7.68 3.91 0.00 2.20 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.51 0.00 100 I 8.21 3.91 1.89 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 1.65 1.26 0.87 0.00 0.00 101 K 7.96 3.90 0.00 1.83 1.99 0.00 1.69 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.53 1.50 7.81 102 V 8.16 3.77 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 1.00 0.00 0.00 1.01 0.00 0.00 103 N 7.68 4.37 0.00 2.78 2.93 0.00 0.00 6.73 8.01 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 0.00 104 F 8.73 4.12 0.00 3.27 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 0.00 105 M 7.83 4.28 0.00 2.00 2.15 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.84 0.00 106 R 7.53 4.31 0.00 2.02 2.13 0.00 3.27 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 107 E 8.54 4.23 0.00 2.03 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 2.22 2.28 0.00 108 W 8.25 3.90 0.00 3.25 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 0.00 109 E 8.46 4.10 0.00 2.14 2.09 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 2.77 2.58 0.00 110 L 7.31 4.06 0.00 1.92 1.84 0.91 0.57 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 0.00 111 K 7.74 4.40 0.00 1.54 1.64 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.50 7.81 112 M 7.24 4.03 0.00 1.88 2.02 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.57 0.00 113 I 7.58 3.95 1.84 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 1.06 0.89 0.00 0.00 114 S 7.93 3.94 0.00 3.93 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 0.00 115 V 6.89 3.95 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.88 0.00 0.00 116 E 8.02 3.92 0.00 2.13 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 2.20 2.26 0.00 117 G 7.90 4.34 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 0.00 118 V 7.98 4.41 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 0.00 119 E 8.69 4.50 0.00 1.92 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 2.12 2.19 0.00