NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 42 S 4.4288 8.1885 115.4171 57.8295 64.6888 174.2129 43 A 3.8965 8.3652 121.3185 54.7568 17.9649 176.5110 44 E 4.0224 8.9677 118.1231 59.5077 30.0991 177.9072 45 K 4.0327 7.8354 118.1135 59.7719 32.1560 179.5182 46 T 3.8834 7.8135 115.5291 66.7722 68.4504 176.7038 47 R 3.9533 8.1697 120.5212 59.3365 29.9702 178.1862 48 E 4.2490 8.3544 119.4521 59.1356 29.6313 178.8260 49 V 3.8075 7.8943 118.3935 65.9243 31.4429 177.9928 50 L 3.9265 7.7921 118.2106 57.7433 41.4364 179.6228 51 W 4.2592 8.1482 118.6989 59.6716 29.0137 178.5263 52 Q 4.2140 8.6682 118.4415 59.4506 28.2856 179.2137 53 Q 4.0785 8.2587 118.8696 58.8065 28.4664 178.1187 54 Y 3.9899 8.0731 120.1083 61.1401 38.9979 177.5916 55 Y 4.2625 8.1369 115.9476 60.7097 38.0180 177.8055 56 A 4.1528 7.9419 121.4948 54.0835 18.9289 178.4418 57 S 4.0774 6.9553 110.2489 58.9543 63.3905 174.0206 58 N 4.5863 8.2075 120.8861 51.8664 40.5324 172.4097 59 P 4.4642 0.0000 0.0000 61.3301 32.2695 174.2769 60 P 3.7967 0.0000 0.0000 63.1898 31.6482 176.3371 61 D 4.5595 8.5214 122.8577 53.6350 41.6611 176.7697 62 H 4.5223 8.6243 125.1256 58.2374 28.8924 177.5401 63 A 3.9622 8.1324 123.2573 54.9420 18.1690 179.8450 64 V 3.4341 7.8954 116.3827 66.0584 31.6879 177.9157 65 L 3.4363 7.7269 119.6555 57.7590 41.8016 178.5729 66 E 3.7705 8.3779 119.8137 58.9964 29.3377 178.7886 67 V 3.4673 7.3362 117.2601 66.1115 31.6296 177.5601 68 L 3.7913 7.3324 116.9037 57.6798 41.6004 179.0594 69 A 4.0024 7.8905 119.7834 54.1520 18.4374 179.4732 70 T 3.7032 7.3311 114.8275 66.3599 68.6099 174.8163 71 P 4.3835 0.0000 0.0000 65.5899 31.2345 178.6512 72 V 2.9843 6.9994 117.7982 65.4993 31.5129 177.6291 73 R 3.8124 8.0208 118.8144 59.5667 29.9026 178.1122 74 E 3.9279 8.1337 117.9572 59.6009 29.2683 179.4068 75 A 4.0644 8.0884 120.5762 55.0750 18.4112 179.7454 76 L 4.0832 8.1961 117.7227 57.9209 41.6668 179.6633 77 L 4.0504 8.5272 119.2142 57.6206 41.2752 179.3966 78 A 3.9519 7.8411 120.1511 54.7435 18.3182 179.2486 79 R 3.8905 7.2701 115.4840 57.4806 30.7328 177.2720 80 F 4.6606 8.1352 114.0146 56.4945 40.9912 177.0132 81 G 3.6203 8.4594 110.6130 47.9421 0.0000 174.4162 82 Q 4.3912 7.8947 118.1392 55.8700 29.2447 174.3511 83 H 4.2491 7.8329 114.8015 55.4182 29.1235 174.5992 84 Q 4.7126 8.0197 122.0503 54.6740 32.8822 176.3911 85 G 3.9095 8.5597 105.4844 46.0152 0.0000 172.8574 86 S 4.5607 8.5250 116.9073 57.2239 64.1913 174.6629 87 V 3.3592 7.7517 116.8581 60.8300 32.0306 176.5727 88 V 4.2907 8.4162 121.9812 59.4388 31.7275 174.0631 89 P 4.1963 0.0000 0.0000 65.4112 31.2133 177.7172 90 A 4.1049 8.0423 116.9803 54.3294 18.5292 178.7856 91 I 4.1758 7.5858 117.5116 63.8238 38.1343 177.7681 92 D 4.7358 8.5434 120.0058 57.0163 40.6178 178.9874 93 L 3.9601 7.9750 119.6503 57.3917 41.7144 177.5134 94 P 4.3141 0.0000 0.0000 65.7558 31.2301 178.4791 95 E 4.0272 7.9849 115.8097 59.3361 29.4621 179.0725 96 L 4.1075 8.4000 120.6840 58.4640 42.1221 179.3342 97 R 3.5329 8.3757 118.2762 58.9435 29.7106 178.9694 98 S 4.1192 7.9536 112.4648 61.2580 62.8096 176.1029 99 V 3.7743 7.8047 120.8962 66.0761 31.3570 177.8614 100 L 3.8823 7.6619 118.6706 57.9485 40.9176 179.4416 101 Q 4.6702 8.2030 120.4950 58.6418 28.7341 178.1622 102 Q 4.0717 7.8193 118.1437 57.9607 28.6187 177.0659 103 F 4.7883 7.5991 117.2683 58.3996 40.5982 175.7793 104 D 5.0672 8.5406 118.6490 52.3729 44.8226 175.3524 105 S 4.3536 8.6086 118.4023 58.0218 63.5795 174.1449 106 F 2.3000 8.5342 125.1652 57.4047 40.1596 176.2590 107 G 3.1949 6.1352 112.8601 44.7048 0.0000 173.2486 108 K 4.1278 8.0439 119.1722 59.7470 32.3474 179.0810 109 R 3.7535 7.7064 119.4502 58.9151 29.8292 178.5481 110 W 4.3602 8.1026 118.5380 59.8975 29.0316 178.4025 111 E 4.0093 8.2806 117.7165 59.3494 29.0328 179.1126 112 A 4.0387 7.9678 120.3277 55.2101 18.4986 179.6667 113 I 3.6262 8.1426 118.4436 64.5443 37.2394 178.5661 114 L 3.9469 8.2218 119.9813 57.9108 41.3644 179.6669 115 L 3.9705 7.8725 118.7679 57.8917 41.3323 179.4657 116 Q 3.8840 7.9629 118.4663 58.8421 29.3313 177.7515 117 V 3.6724 8.1497 119.8448 66.1969 31.4984 177.8597 118 L 3.9707 7.8065 118.3779 58.0728 41.2332 179.3815 119 E 4.1160 7.8571 117.6436 58.7305 29.3952 178.6558 120 G 4.0385 7.6809 103.1446 44.8920 0.0000 172.7592 121 I 4.4819 7.3894 114.1074 58.5851 40.8312 173.8767 *130 L 4.0713 8.2318 120.9979 54.5162 42.3314 176.0895 131 P 4.3842 0.0000 0.0000 65.4827 31.1897 177.8571 132 Y 3.8154 7.9819 119.5300 60.7343 38.8351 177.5056 133 L 4.0092 8.0401 120.7822 58.1412 42.2914 178.7765 134 S 4.0701 7.9855 114.8513 61.5620 62.7585 176.3865 135 E 3.8318 8.2824 122.0408 58.9291 29.3794 178.3277 136 L 3.7349 7.6883 120.4148 58.3011 41.9553 179.1022 137 I 3.6380 7.7948 119.5670 64.5787 37.1117 178.2715 138 N 4.3231 8.1064 117.2288 56.1073 38.2412 177.7302 139 K 3.9705 8.0786 120.1357 59.3409 32.1317 179.0076 140 E 3.9999 8.2083 119.6696 59.2886 29.4338 178.8514 141 L 4.0476 8.2837 119.3989 57.9605 41.4030 179.1784 142 M 4.0631 7.8266 117.4101 58.6457 32.2221 178.0843 143 I 3.9367 7.3878 118.9267 64.2233 37.4255 177.9073 144 L 4.2962 7.9085 117.7372 56.1663 41.6285 177.4004 145 L 4.2828 7.5413 125.5195 55.3214 42.2130 175.9501 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 42 S 8.19 4.43 0.00 4.04 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 0.00 43 A 8.37 3.90 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 44 E 8.97 4.02 0.00 2.07 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 2.45 2.43 0.00 45 K 7.84 4.03 0.00 1.97 1.89 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.51 7.81 46 T 7.81 3.88 4.41 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 1.22 0.00 0.00 47 R 8.17 3.95 0.00 2.10 2.22 0.00 3.31 0.00 0.00 3.45 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.67 0.00 48 E 8.35 4.25 0.00 2.39 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 0.00 2.40 2.48 0.00 49 V 7.89 3.81 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 1.00 0.00 0.00 1.04 0.00 0.00 50 L 7.79 3.93 0.00 1.78 1.37 0.80 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 51 W 8.15 4.26 0.00 3.67 3.36 0.00 0.00 0.00 0.00 0.00 0.00 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 8.67 4.21 0.00 2.41 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.50 2.69 0.00 53 Q 8.26 4.08 0.00 2.23 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.81 0.00 0.00 0.00 0.00 0.00 2.54 2.52 0.00 54 Y 8.07 3.99 0.00 2.69 3.02 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 55 Y 8.14 4.26 0.00 3.24 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 56 A 7.94 4.15 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 57 S 6.96 4.08 0.00 3.92 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 58 N 8.21 4.59 0.00 2.62 2.68 0.00 0.00 7.06 7.69 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 59 P 0.00 4.46 0.00 2.17 2.03 0.00 3.81 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 1.94 1.96 0.00 60 P 0.00 3.80 0.00 2.06 1.81 0.00 3.63 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.00 0.00 61 D 8.52 4.56 0.00 2.69 2.58 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 0.00 62 H 8.62 4.52 0.00 3.22 3.31 0.00 5.67 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 A 8.13 3.96 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.90 3.43 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 1.00 0.00 0.00 0.92 0.00 0.00 65 L 7.73 3.44 0.00 1.44 1.67 0.13 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 66 E 8.38 3.77 0.00 2.10 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 2.26 2.29 0.00 67 V 7.34 3.47 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 0.80 0.00 0.00 0.89 0.00 0.00 68 L 7.33 3.79 0.00 1.27 1.11 -0.91 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 69 A 7.89 4.00 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 70 T 7.33 3.70 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 1.15 0.00 0.00 71 P 0.00 4.38 0.00 2.08 2.31 0.00 3.72 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 1.61 1.93 0.00 72 V 7.00 2.98 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 0.88 0.00 0.00 0.22 0.00 0.00 73 R 8.02 3.81 0.00 1.88 1.99 0.00 3.12 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 74 E 8.13 3.93 0.00 2.19 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 0.00 2.31 2.42 0.00 75 A 8.09 4.06 1.51 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 76 L 8.20 4.08 0.00 1.89 1.88 0.91 0.63 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 77 L 8.53 4.05 0.00 1.72 1.72 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 78 A 7.84 3.95 1.35 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 0.00 0.00 0.00 79 R 7.27 3.89 0.00 1.04 0.89 0.00 3.03 0.00 0.00 3.08 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.57 0.00 80 F 8.14 4.66 0.00 3.16 2.93 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 81 G 8.46 3.62 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 0.00 82 Q 7.89 4.39 0.00 2.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.85 0.00 0.00 0.00 0.00 0.00 2.23 2.34 0.00 83 H 7.83 4.25 0.00 2.68 1.32 0.00 5.84 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 Q 8.02 4.71 0.00 1.99 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.77 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 85 G 8.56 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 0.00 0.00 0.00 86 S 8.53 4.56 0.00 3.90 3.78 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 87 V 7.75 3.36 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 -0.06 0.00 0.00 0.74 0.00 0.00 88 V 8.42 4.29 2.17 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 1.05 0.00 0.00 1.03 0.00 0.00 89 P 0.00 4.20 0.00 2.18 2.09 0.00 3.64 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.12 0.00 90 A 8.04 4.10 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 I 7.59 4.18 2.07 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 1.68 1.51 1.01 0.00 0.00 92 D 8.54 4.74 0.00 2.70 2.58 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 0.00 93 L 7.98 3.96 0.00 1.86 1.74 0.92 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 94 P 0.00 4.31 0.00 2.21 2.16 0.00 3.71 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.24 0.00 95 E 7.98 4.03 0.00 2.54 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 0.00 2.38 2.53 0.00 96 L 8.40 4.11 0.00 1.75 1.88 0.79 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 97 R 8.38 3.53 0.00 1.97 2.15 0.00 3.61 0.00 0.00 3.69 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.95 0.00 98 S 7.95 4.12 0.00 3.99 4.11 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 99 V 7.80 3.77 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 1.02 0.00 0.00 100 L 7.66 3.88 0.00 0.61 0.33 0.13 0.48 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 0.00 101 Q 8.20 4.67 0.00 2.60 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.79 0.00 0.00 0.00 0.00 0.00 2.52 2.43 0.00 102 Q 7.82 4.07 0.00 1.96 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.51 0.00 0.00 0.00 0.00 0.00 2.26 2.53 0.00 103 F 7.60 4.79 0.00 3.38 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 0.00 104 D 8.54 5.07 0.00 3.09 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 0.00 105 S 8.61 4.35 0.00 3.83 3.79 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 0.00 106 F 8.53 2.30 0.00 2.26 2.56 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 0.00 107 G 6.14 3.19 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 0.00 108 K 8.04 4.13 0.00 2.01 2.02 0.00 1.49 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.35 1.53 7.81 109 R 7.71 3.75 0.00 1.67 1.74 0.00 2.65 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.20 0.00 110 W 8.10 4.36 0.00 3.39 3.16 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 0.00 111 E 8.28 4.01 0.00 2.22 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 2.44 2.40 0.00 112 A 7.97 4.04 1.45 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 0.00 113 I 8.14 3.63 2.14 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.25 0.85 0.00 0.00 114 L 8.22 3.95 0.00 1.88 1.71 0.95 0.58 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 0.00 115 L 7.87 3.97 0.00 1.85 1.71 0.95 0.76 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 0.00 116 Q 7.96 3.88 0.00 2.01 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.89 0.00 0.00 0.00 0.00 0.00 2.31 2.30 0.00 117 V 8.15 3.67 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 0.94 0.00 0.00 0.92 0.00 0.00 118 L 7.81 3.97 0.00 1.94 1.69 0.90 0.94 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 0.00 119 E 7.86 4.12 0.00 2.04 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 0.00 2.46 2.42 0.00 120 G 7.68 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 0.00 121 I 7.39 4.48 1.88 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 1.46 0.77 0.96 0.00 0.00 *130 L 8.23 4.07 0.00 1.81 1.70 1.11 0.99 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 0.00 131 P 0.00 4.38 0.00 2.32 2.31 0.00 3.81 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.05 0.00 132 Y 7.98 3.82 0.00 3.21 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 L 8.04 4.01 0.00 1.91 1.70 0.89 1.02 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 0.00 134 S 7.99 4.07 0.00 4.06 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 0.00 135 E 8.28 3.83 0.00 2.05 1.94 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 2.15 2.18 0.00 136 L 7.69 3.73 0.00 1.78 1.46 0.61 -0.07 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 0.00 137 I 7.79 3.64 1.98 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 1.46 0.61 0.88 0.00 0.00 138 N 8.11 4.32 0.00 2.83 2.84 0.00 0.00 7.08 7.06 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 0.00 139 K 8.08 3.97 0.00 1.90 1.82 0.00 1.58 0.00 0.00 1.52 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.57 7.81 140 E 8.21 4.00 0.00 2.09 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.49 0.00 141 L 8.28 4.05 0.00 1.86 1.72 0.92 1.07 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 0.00 142 M 7.83 4.06 0.00 2.17 2.10 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.63 0.00 143 I 7.39 3.94 2.11 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 1.56 0.78 1.01 0.00 0.00 144 L 7.91 4.30 0.00 1.81 1.93 1.11 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 145 L 7.54 4.28 0.00 1.72 1.78 0.93 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.