#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pew s PHE 2 N 0.00 0.48 0.29 -2.53 -0.12 -1.26 -4.74 117.98 110.10 1pew s PHE 2 Ca 0.00 -0.82 0.11 0.00 -0.05 0.00 0.00 56.93 56.17 1pew s PHE 2 Cb 0.00 -0.00 -0.05 0.00 -0.63 0.00 0.00 43.02 42.33 1pew s PHE 2 CO 0.00 -0.84 -0.15 0.00 -0.05 0.00 0.00 175.22 174.18 1pew s MET 3 N -4.02 1.80 -0.17 1.99 0.23 -1.26 -4.97 119.30 112.90 1pew s MET 3 Ca 0.23 -1.76 0.00 0.00 -1.03 0.00 0.00 55.69 53.13 1pew s MET 3 Cb 0.02 -1.81 0.01 0.00 -1.53 0.00 0.00 34.83 31.51 1pew s MET 3 CO 0.06 0.29 -0.17 -0.51 -2.03 0.00 0.00 175.02 172.66 1pew s LEU 4 N -3.56 2.35 -0.14 0.18 1.43 -1.26 -1.73 118.68 115.94 1pew s LEU 4 Ca 0.31 -0.54 -0.02 0.00 -1.03 0.00 0.00 54.13 52.85 1pew s LEU 4 Cb -0.03 -1.54 -0.02 0.00 0.03 0.00 0.00 46.19 44.63 1pew s LEU 4 CO 0.16 0.05 -0.08 0.21 0.23 0.00 0.00 176.35 176.92 1pew s ASN 5 N 1.03 4.43 0.16 2.29 3.84 0.12 -3.83 114.94 122.98 1pew s ASN 5 Ca -0.01 -0.22 0.07 0.00 0.21 0.00 0.00 52.86 52.90 1pew s ASN 5 Cb -0.15 -1.70 -0.04 0.00 -0.55 0.00 0.00 41.25 38.81 1pew s ASN 5 CO -0.04 0.16 -0.14 0.00 -2.79 0.00 0.00 177.10 174.29 1pew s GLN 6 N 0.37 1.19 0.88 0.43 -2.07 -1.26 -0.72 119.66 118.47 1pew s GLN 6 Ca -0.07 -1.43 -0.10 0.00 -1.82 0.00 0.00 55.36 51.93 1pew s GLN 6 Cb -0.15 -1.01 0.12 0.00 -1.09 0.00 0.00 33.01 30.88 1pew s GLN 6 CO 0.04 0.18 1.12 -1.25 -1.32 0.00 0.00 175.29 174.06 1pew s PRO 7 N -3.22 1.37 0.07 9.60 0.04 -1.26 -4.80 135.00 136.79 1pew s PRO 7 Ca 0.16 1.32 0.19 0.00 0.04 0.00 0.00 61.00 62.71 1pew s PRO 7 Cb -0.02 -1.78 -0.13 0.00 0.04 0.00 0.00 34.50 32.60 1pew s PRO 7 CO 0.05 -2.31 0.78 -2.39 0.04 0.00 0.00 177.00 173.17 1pew n HIS 8 N -3.99 0.78 -4.14 0.56 1.44 -1.26 -4.06 115.22 104.54 1pew n HIS 8 Ca 0.10 0.25 -0.15 0.00 -2.01 0.00 0.00 57.72 55.90 1pew n HIS 8 Cb 0.53 -0.97 -0.14 0.00 0.12 0.00 0.00 29.99 29.53 1pew n HIS 8 CO 0.00 0.00 0.00 -1.12 -2.81 0.00 0.00 176.34 172.41 1pew s SER 9 N -5.47 0.67 0.03 4.39 0.01 -1.26 0.17 113.70 112.24 1pew s SER 9 Ca -0.03 -0.19 0.01 0.00 1.31 0.00 0.00 55.95 57.05 1pew s SER 9 Cb 0.09 -0.05 -0.02 0.00 0.21 0.00 0.00 66.02 66.25 1pew s SER 9 CO 0.82 0.01 -0.05 -0.69 0.41 0.00 0.00 173.24 173.75 1pew s VAL 11 N -0.37 0.27 0.05 3.43 1.01 -0.10 -4.90 120.40 119.78 1pew s VAL 11 Ca -0.00 -1.09 -0.03 0.00 0.00 0.00 0.00 61.98 60.86 1pew s VAL 11 Cb -0.04 -0.54 -0.03 0.00 0.00 0.00 0.00 36.38 35.77 1pew s VAL 11 CO -0.00 -0.53 0.02 -0.94 0.00 0.00 0.00 175.10 173.65 1pew s SER 12 N -1.71 0.33 -0.04 3.32 1.04 -1.26 -1.19 113.70 114.19 1pew s SER 12 Ca -0.11 -0.76 -0.30 0.00 0.48 0.00 0.00 55.95 55.26 1pew s SER 12 Cb -0.08 0.20 0.11 0.00 0.10 0.00 0.00 66.02 66.36 1pew s SER 12 CO -0.02 -0.54 1.00 -0.70 0.98 0.00 0.00 173.24 173.97 1pew s GLU 13 N -3.15 0.69 0.42 4.02 2.56 -1.02 -4.99 118.70 117.23 1pew s GLU 13 Ca -0.00 -0.28 -0.10 0.00 0.00 0.00 0.00 54.97 54.59 1pew s GLU 13 Cb 0.02 0.30 -0.06 0.00 2.00 0.00 0.00 34.13 36.39 1pew s GLU 13 CO -0.07 -0.30 0.78 -1.12 -0.56 0.00 0.00 175.26 173.98 1pew s SER 14 N -2.46 6.49 0.46 -1.70 0.01 -1.26 -0.32 113.70 114.92 1pew s SER 14 Ca 0.07 1.12 -0.24 0.00 1.31 0.00 0.00 55.95 58.21 1pew s SER 14 Cb -0.01 -2.32 -0.09 0.00 0.21 0.00 0.00 66.02 63.82 1pew s SER 14 CO -0.07 -0.43 1.23 -2.65 0.41 0.00 0.00 173.24 171.73 1pew n PRO 15 N -1.42 1.73 0.00 12.44 -0.02 -1.26 -2.45 135.00 144.02 1pew n PRO 15 Ca 0.02 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 1pew n PRO 15 Cb 0.54 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.67 1pew n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pew n GLY 16 N 0.89 2.34 3.98 -1.23 0.00 0.15 -4.89 105.19 106.45 1pew n GLY 16 Ca 0.08 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.89 1pew n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pew s LYS 17 N -0.44 2.28 -0.11 1.61 1.02 -1.03 -3.92 119.74 119.16 1pew s LYS 17 Ca 0.00 -0.96 -0.02 0.00 0.02 0.00 0.00 55.97 55.01 1pew s LYS 17 Cb 0.00 -2.46 -0.03 0.00 -0.52 0.00 0.00 37.83 34.82 1pew s LYS 17 CO 0.00 -0.93 -0.03 0.99 -0.92 0.00 0.00 175.35 174.47 1pew s THR 18 N -2.85 4.03 0.07 2.17 2.01 -1.26 -1.26 115.64 118.55 1pew s THR 18 Ca 0.60 -0.34 0.07 0.00 0.31 0.00 0.00 61.69 62.33 1pew s THR 18 Cb -0.08 -2.71 -0.03 0.00 0.01 0.00 0.00 72.50 69.68 1pew s THR 18 CO 0.40 0.56 -0.18 0.54 -0.69 0.00 0.00 174.62 175.25 1pew s VAL 19 N -0.39 1.43 -0.05 3.82 0.11 -0.40 -4.99 120.40 119.93 1pew s VAL 19 Ca 0.07 -1.34 0.04 0.00 -2.93 0.00 0.00 61.98 57.82 1pew s VAL 19 Cb -0.12 -1.31 0.00 0.00 -1.53 0.00 0.00 36.38 33.42 1pew s VAL 19 CO 0.02 -0.06 -0.17 -0.89 -3.33 0.00 0.00 175.10 170.67 1pew s THR 20 N -1.09 1.47 -0.18 5.04 2.01 -1.26 -0.71 115.64 120.91 1pew s THR 20 Ca 0.03 -0.72 -0.01 0.00 0.31 0.00 0.00 61.69 61.31 1pew s THR 20 Cb -0.09 -1.27 0.00 0.00 0.01 0.00 0.00 72.50 71.14 1pew s THR 20 CO 0.03 0.42 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.61 1pew s ILE 21 N 0.20 2.70 0.20 1.82 1.01 0.49 -4.98 121.20 122.64 1pew s ILE 21 Ca -0.08 -0.74 0.05 0.00 0.00 0.00 0.00 60.65 59.88 1pew s ILE 21 Cb -0.13 -2.16 -0.04 0.00 0.01 0.00 0.00 42.46 40.14 1pew s ILE 21 CO 0.03 0.50 0.22 -0.94 0.00 0.00 0.00 174.94 174.75 1pew s SER 22 N 1.06 5.81 -0.23 3.58 1.04 -1.26 -0.62 113.70 123.08 1pew s SER 22 Ca -0.00 -0.08 -0.03 0.00 0.48 0.00 0.00 55.95 56.32 1pew s SER 22 Cb -0.15 -1.59 0.08 0.00 0.10 0.00 0.00 66.02 64.46 1pew s SER 22 CO -0.04 0.01 0.08 0.00 0.98 0.00 0.00 173.24 174.28 1pew s THR 24 N 1.95 5.27 -0.02 0.00 2.01 0.10 -0.48 115.64 124.46 1pew s THR 24 Ca 0.04 0.67 -0.20 0.00 0.31 0.00 0.00 61.69 62.51 1pew s THR 24 Cb -0.17 -3.68 -0.05 0.00 0.01 0.00 0.00 72.50 68.61 1pew s THR 24 CO -0.18 0.38 0.56 -0.60 -0.69 0.00 0.00 174.62 174.09 1pew s ARG 25 N 0.44 4.29 0.08 4.92 3.52 -0.53 -0.70 118.95 130.96 1pew s ARG 25 Ca 0.19 0.67 0.02 0.00 -0.13 0.00 0.00 55.73 56.48 1pew s ARG 25 Cb -0.14 -3.35 -0.25 0.00 -1.56 0.00 0.00 34.95 29.65 1pew s ARG 25 CO 0.06 0.35 1.13 0.66 -0.81 0.00 0.00 175.30 176.69 1pew h SER 26 N 5.77 0.21 -5.18 -2.12 4.64 -1.65 -3.47 113.55 111.75 1pew h SER 26 Ca -0.45 -0.24 -0.09 0.00 -0.47 0.00 0.00 61.79 60.53 1pew h SER 26 Cb 1.20 -0.07 -0.14 0.00 -0.31 0.00 0.00 62.40 63.08 1pew h SER 26 CO 0.70 1.19 -0.44 -0.94 -0.87 0.00 0.00 176.83 176.48 1pew s SER 27 N -6.87 0.20 0.39 4.97 1.04 -1.26 -4.99 113.70 107.18 1pew s SER 27 Ca -0.03 -0.74 0.00 0.00 0.48 0.00 0.00 55.95 55.67 1pew s SER 27 Cb 0.08 0.31 0.00 0.00 0.10 0.00 0.00 66.02 66.52 1pew s SER 27 CO 0.85 -0.71 0.00 0.61 0.98 0.00 0.00 173.24 174.97 1pew n GLY 27 N -0.03 -1.71 3.64 7.32 0.00 -1.26 -4.83 105.19 108.32 1pew n GLY 27 Ca -0.14 -1.25 -0.35 0.00 0.00 0.00 0.00 46.02 44.28 1pew n GLY 27 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1pew s ASN 27 N -4.23 5.67 0.48 1.61 -0.87 -1.26 -4.98 114.94 111.37 1pew s ASN 27 Ca 0.00 0.09 0.20 0.00 -1.57 0.00 0.00 52.86 51.58 1pew s ASN 27 Cb 0.00 -1.97 1.23 0.00 -0.02 0.00 0.00 41.25 40.48 1pew s ASN 27 CO 0.00 0.17 1.98 -0.29 -2.57 0.00 0.00 177.10 176.39 1pew h ILE 28 N 4.87 0.80 0.00 0.60 6.09 -1.88 -1.35 117.51 126.63 1pew h ILE 28 Ca -0.37 -0.07 0.00 0.00 -1.37 0.00 0.00 64.86 63.05 1pew h ILE 28 Cb 1.17 0.59 0.00 0.00 0.47 0.00 0.00 36.82 39.05 1pew h ILE 28 CO 0.71 0.03 0.00 0.00 -3.07 0.00 0.00 178.15 175.82 1pew h ALA 29 N 1.72 1.00 0.00 0.18 0.00 -1.94 -3.28 119.26 116.93 1pew h ALA 29 Ca 0.27 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.13 1pew h ALA 29 Cb 0.82 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1pew h ALA 29 CO -0.05 0.00 -0.28 0.77 0.00 0.00 0.00 179.25 179.69 1pew h SER 30 N 0.00 0.00 -4.34 0.00 0.02 -1.66 -3.44 113.55 104.13 1pew h SER 30 Ca 0.00 0.00 -0.27 0.00 -0.84 0.00 0.00 61.79 60.68 1pew h SER 30 Cb 0.41 0.00 -0.25 0.00 0.14 0.00 0.00 62.40 62.70 1pew h SER 30 CO 0.00 0.28 -0.73 0.20 -1.14 0.00 0.00 176.83 175.44 1pew s ASN 31 N -6.28 0.54 0.45 3.07 0.01 -1.24 -5.11 114.94 106.39 1pew s ASN 31 Ca 0.01 -0.30 -0.24 0.00 -0.71 0.00 0.00 52.86 51.62 1pew s ASN 31 Cb 0.10 0.00 -0.08 0.00 0.41 0.00 0.00 41.25 41.69 1pew s ASN 31 CO 0.66 -0.09 1.33 -0.31 -1.51 0.00 0.00 177.10 177.17 1pew s TYR 32 N -0.74 2.62 -0.11 2.20 2.02 -1.26 -4.90 117.35 117.18 1pew s TYR 32 Ca -0.05 1.38 -0.00 0.00 -0.37 0.00 0.00 57.07 58.03 1pew s TYR 32 Cb -0.06 -3.73 -0.02 0.00 -0.40 0.00 0.00 41.96 37.76 1pew s TYR 32 CO -0.00 -2.41 -0.10 0.08 -1.57 0.00 0.00 175.55 171.55 1pew s VAL 33 N -1.29 3.38 0.13 0.71 1.01 -1.26 -4.35 120.40 118.73 1pew s VAL 33 Ca 0.62 -0.57 0.08 0.00 0.00 0.00 0.00 61.98 62.11 1pew s VAL 33 Cb -0.39 -2.41 -0.04 0.00 0.00 0.00 0.00 36.38 33.54 1pew s VAL 33 CO 0.49 0.55 -0.10 -1.10 0.00 0.00 0.00 175.10 174.93 1pew s GLN 34 N -0.10 2.08 -0.04 2.72 1.11 -0.02 -0.07 119.66 125.33 1pew s GLN 34 Ca -0.00 -1.13 0.05 0.00 0.01 0.00 0.00 55.36 54.29 1pew s GLN 34 Cb -0.13 -2.24 -0.01 0.00 -1.01 0.00 0.00 33.01 29.62 1pew s GLN 34 CO 0.03 0.48 -0.20 -1.58 0.01 0.00 0.00 175.29 174.03 1pew s TRP 35 N -1.39 1.93 0.08 0.91 0.52 0.52 -0.77 118.94 120.75 1pew s TRP 35 Ca 0.22 -0.52 0.10 0.00 0.02 0.00 0.00 56.10 55.92 1pew s TRP 35 Cb -0.10 -1.28 -0.03 0.00 -1.15 0.00 0.00 33.47 30.91 1pew s TRP 35 CO 0.14 -0.15 -0.26 0.71 0.02 0.00 0.00 176.95 177.41 1pew s TYR 36 N -0.14 2.34 -0.09 -1.98 2.02 0.38 -0.50 117.35 119.38 1pew s TYR 36 Ca -0.01 -0.39 -0.00 0.00 -0.37 0.00 0.00 57.07 56.30 1pew s TYR 36 Cb -0.11 -1.34 -0.03 0.00 -0.40 0.00 0.00 41.96 40.08 1pew s TYR 36 CO 0.02 0.22 -0.08 -1.14 -1.57 0.00 0.00 175.55 173.00 1pew s GLN 37 N -1.58 3.01 0.16 -0.62 0.74 0.83 -1.02 119.66 121.18 1pew s GLN 37 Ca 0.13 -0.57 0.06 0.00 0.05 0.00 0.00 55.36 55.02 1pew s GLN 37 Cb -0.10 -2.65 -0.04 0.00 1.10 0.00 0.00 33.01 31.32 1pew s GLN 37 CO 0.04 0.51 -0.12 -1.14 -0.55 0.00 0.00 175.29 174.03 1pew s GLN 38 N -0.40 1.14 0.04 1.67 0.74 0.18 -0.40 119.66 122.63 1pew s GLN 38 Ca 0.06 -1.47 0.00 0.00 0.05 0.00 0.00 55.36 54.00 1pew s GLN 38 Cb -0.12 -0.83 0.00 0.00 1.10 0.00 0.00 33.01 33.16 1pew s GLN 38 CO 0.02 0.13 0.00 -1.13 -0.55 0.00 0.00 175.29 173.76 1pew n SER 42 N -0.15 -0.70 -4.68 6.67 3.41 -1.26 -2.50 113.62 114.41 1pew n SER 42 Ca -0.10 0.08 -0.30 0.00 -0.26 0.00 0.00 58.87 58.29 1pew n SER 42 Cb 0.60 -1.76 0.15 0.00 -0.26 0.00 0.00 64.21 62.94 1pew n SER 42 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1pew s ALA 43 N -3.08 1.40 0.47 7.33 0.00 -1.26 -4.97 121.76 121.65 1pew s ALA 43 Ca 0.00 0.21 -0.24 0.00 0.00 0.00 0.00 51.96 51.93 1pew s ALA 43 Cb 0.00 -3.30 -0.07 0.00 0.00 0.00 0.00 23.12 19.75 1pew s ALA 43 CO 0.00 -2.56 1.37 -2.14 0.00 0.00 0.00 175.76 172.44 1pew s PRO 44 N -4.77 3.58 0.03 0.00 0.02 -1.26 -5.02 135.00 127.58 1pew s PRO 44 Ca 0.65 2.29 0.06 0.00 0.02 0.00 0.00 61.00 64.02 1pew s PRO 44 Cb -0.20 -2.55 -0.03 0.00 0.02 0.00 0.00 34.50 31.74 1pew s PRO 44 CO 0.58 -0.86 -0.15 0.96 -0.33 0.00 0.00 177.00 177.20 1pew s ILE 45 N -1.26 3.00 0.06 2.83 -4.36 0.47 -4.92 121.20 117.02 1pew s ILE 45 Ca 0.63 -1.07 -0.31 0.00 -0.26 0.00 0.00 60.65 59.65 1pew s ILE 45 Cb -0.41 -2.27 -0.07 0.00 1.25 0.00 0.00 42.46 40.96 1pew s ILE 45 CO 0.51 0.36 1.42 -0.89 0.24 0.00 0.00 174.94 176.59 1pew s THR 46 N -0.93 3.46 -0.05 8.37 2.01 -1.26 -0.12 115.64 127.11 1pew s THR 46 Ca 0.15 0.96 0.08 0.00 0.31 0.00 0.00 61.69 63.20 1pew s THR 46 Cb -0.11 -3.62 -0.12 0.00 0.01 0.00 0.00 72.50 68.66 1pew s THR 46 CO 0.06 0.03 0.11 1.33 -0.69 0.00 0.00 174.62 175.46 1pew n VAL 47 N 4.34 0.33 -3.93 3.82 0.24 0.35 -4.77 118.33 118.70 1pew n VAL 47 Ca 0.13 -0.30 -0.13 0.00 -2.04 0.00 0.00 64.34 62.00 1pew n VAL 47 Cb 0.43 -0.29 -0.14 0.00 -1.47 0.00 0.00 33.84 32.37 1pew n VAL 47 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1pew s ILE 48 N -2.41 0.09 0.15 1.34 -1.09 -0.92 -4.24 121.20 114.12 1pew s ILE 48 Ca -0.04 -0.07 0.01 0.00 -2.23 0.00 0.00 60.65 58.33 1pew s ILE 48 Cb 0.04 -0.09 -0.04 0.00 -1.58 0.00 0.00 42.46 40.79 1pew s ILE 48 CO 0.37 0.01 -0.01 -0.72 -1.23 0.00 0.00 174.94 173.36 1pew s TYR 49 N -0.06 1.08 -1.43 3.97 1.13 0.37 -0.35 117.35 122.06 1pew s TYR 49 Ca 0.00 -1.01 -0.01 0.00 -1.41 0.00 0.00 57.07 54.64 1pew s TYR 49 Cb -0.01 -0.62 0.01 0.00 -1.10 0.00 0.00 41.96 40.25 1pew s TYR 49 CO -0.00 -0.22 0.42 0.39 -2.51 0.00 0.00 175.55 173.62 1pew n GLU 50 N -0.17 -3.17 0.00 -3.49 1.02 -1.20 -0.42 120.64 113.21 1pew n GLU 50 Ca -0.08 0.39 0.00 0.00 -0.02 0.00 0.00 57.16 57.45 1pew n GLU 50 Cb 0.63 -4.52 0.00 0.00 -0.02 0.00 0.00 31.44 27.53 1pew n GLU 50 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1pew n ASP 51 N -2.96 0.00 -0.08 1.62 8.00 0.90 -4.02 116.55 120.01 1pew n ASP 51 Ca -0.29 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.21 1pew n ASP 51 Cb 0.67 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.77 1pew n ASP 51 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1pew n ASN 52 N 2.09 0.00 -4.73 -2.24 0.23 -1.08 -3.54 115.26 106.00 1pew n ASN 52 Ca 0.00 -1.06 -0.39 0.00 -0.53 0.00 0.00 54.58 52.60 1pew n ASN 52 Cb 0.00 -0.01 -0.05 0.00 -2.08 0.00 0.00 39.78 37.63 1pew n ASN 52 CO 0.00 0.00 0.00 -1.10 -0.93 0.00 0.00 177.26 175.23 1pew s GLN 53 N 0.00 4.37 -0.18 -3.83 -1.52 0.44 -4.56 119.66 114.38 1pew s GLN 53 Ca 0.00 0.65 -0.16 0.00 -1.95 0.00 0.00 55.36 53.90 1pew s GLN 53 Cb 0.00 -3.42 -0.04 0.00 -0.22 0.00 0.00 33.01 29.33 1pew s GLN 53 CO 0.00 0.16 0.40 1.03 -0.25 0.00 0.00 175.29 176.63 1pew s ARG 54 N 0.56 4.23 0.89 2.91 0.52 -1.26 -0.48 118.95 126.31 1pew s ARG 54 Ca 0.31 0.25 -0.10 0.00 -0.52 0.00 0.00 55.73 55.67 1pew s ARG 54 Cb -0.17 -3.50 0.13 0.00 0.52 0.00 0.00 34.95 31.94 1pew s ARG 54 CO 0.14 0.05 1.15 -2.14 0.02 0.00 0.00 175.30 174.52 1pew s PRO 55 N 1.03 1.19 0.14 3.54 0.02 -1.26 -4.91 135.00 134.76 1pew s PRO 55 Ca 0.20 1.54 -0.34 0.00 0.02 0.00 0.00 61.00 62.43 1pew s PRO 55 Cb -0.15 -1.75 -0.16 0.00 0.02 0.00 0.00 34.50 32.47 1pew s PRO 55 CO 0.08 -2.50 1.25 0.43 -0.33 0.00 0.00 177.00 175.93 1pew n SER 56 N -4.06 1.58 0.00 2.53 7.64 -1.26 -2.20 113.62 117.85 1pew n SER 56 Ca 0.12 1.13 0.00 0.00 1.01 0.00 0.00 58.87 61.13 1pew n SER 56 Cb 0.52 -1.22 0.00 0.00 -1.01 0.00 0.00 64.21 62.49 1pew n SER 56 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1pew n GLY 57 N 2.26 2.73 3.68 0.23 0.00 -1.26 -5.02 105.19 107.80 1pew n GLY 57 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 1pew n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pew s VAL 58 N -2.19 4.61 0.42 1.61 1.01 -0.93 -4.99 120.40 119.93 1pew s VAL 58 Ca 0.00 1.90 -0.25 0.00 0.00 0.00 0.00 61.98 63.63 1pew s VAL 58 Cb 0.00 -4.22 -0.10 0.00 0.00 0.00 0.00 36.38 32.06 1pew s VAL 58 CO 0.00 -0.04 1.19 -2.65 0.00 0.00 0.00 175.10 173.60 1pew n PRO 59 N 5.36 1.74 0.34 2.72 -0.02 -1.26 -4.86 135.00 139.02 1pew n PRO 59 Ca 0.10 0.62 0.23 0.00 -2.02 0.00 0.00 63.50 62.43 1pew n PRO 59 Cb 0.47 -2.27 1.21 0.00 -0.02 0.00 0.00 33.50 32.90 1pew n PRO 59 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1pew h ASP 60 N 1.91 0.00 0.13 2.55 3.32 -1.99 -1.93 116.42 120.42 1pew h ASP 60 Ca -0.47 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.58 1pew h ASP 60 Cb 1.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.86 1pew h ASP 60 CO 0.59 0.00 0.00 -2.11 -1.72 0.00 0.00 179.24 176.00 1pew n ARG 61 N -3.09 0.11 -3.37 3.56 1.85 -1.26 -4.52 116.66 109.94 1pew n ARG 61 Ca -0.03 0.56 -0.39 0.00 -1.00 0.00 0.00 57.85 56.99 1pew n ARG 61 Cb 0.08 -1.82 -0.08 0.00 -1.05 0.00 0.00 32.46 29.58 1pew n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1pew s PHE 62 N -3.37 3.30 -0.05 2.89 0.40 -0.73 -1.34 117.98 119.08 1pew s PHE 62 Ca -0.00 0.52 0.02 0.00 -0.60 0.00 0.00 56.93 56.86 1pew s PHE 62 Cb 0.05 -2.57 0.02 0.00 0.51 0.00 0.00 43.02 41.03 1pew s PHE 62 CO 0.18 -0.16 -0.07 0.00 0.70 0.00 0.00 175.22 175.88 1pew s ALA 63 N 1.83 0.85 -0.04 5.36 0.00 -0.38 -4.94 121.76 124.44 1pew s ALA 63 Ca 0.17 -0.17 -0.04 0.00 0.00 0.00 0.00 51.96 51.92 1pew s ALA 63 Cb -0.15 -0.44 -0.04 0.00 0.00 0.00 0.00 23.12 22.48 1pew s ALA 63 CO 0.09 0.04 0.18 0.20 0.00 0.00 0.00 175.76 176.28 1pew s GLY 64 N 0.76 2.18 0.10 0.00 0.00 -1.26 -0.27 107.32 108.83 1pew s GLY 64 Ca -0.12 -0.70 -0.06 0.00 0.00 0.00 0.00 44.72 43.83 1pew s GLY 64 CO 0.01 -0.54 0.15 -1.35 0.00 0.00 0.00 173.10 171.37 1pew s SER 65 N -1.67 0.20 -0.07 1.64 1.04 -0.19 -4.52 113.70 110.13 1pew s SER 65 Ca 0.24 -0.81 0.04 0.00 0.48 0.00 0.00 55.95 55.90 1pew s SER 65 Cb -0.13 0.32 -0.00 0.00 0.10 0.00 0.00 66.02 66.32 1pew s SER 65 CO 0.15 -0.73 -0.20 -0.63 0.98 0.00 0.00 173.24 172.80 1pew s ILE 66 N -3.91 1.73 -0.35 -1.02 -1.09 -1.26 -1.22 121.20 114.07 1pew s ILE 66 Ca 0.09 -0.85 0.04 0.00 -2.23 0.00 0.00 60.65 57.69 1pew s ILE 66 Cb 0.05 -1.49 0.10 0.00 -1.58 0.00 0.00 42.46 39.55 1pew s ILE 66 CO -0.08 0.49 0.07 -0.62 -1.23 0.00 0.00 174.94 173.57 1pew s ASP 66 N 0.19 4.67 0.44 3.58 2.15 0.40 -4.99 116.67 123.11 1pew s ASP 66 Ca -0.10 -2.18 0.12 0.00 0.43 0.00 0.00 52.55 50.81 1pew s ASP 66 Cb -0.15 -1.56 0.99 0.00 -0.30 0.00 0.00 42.92 41.90 1pew s ASP 66 CO 0.05 -0.37 2.03 0.03 -0.17 0.00 0.00 175.17 176.74 1pew h ARG 66 N 7.56 0.19 -0.29 4.34 3.08 -1.96 -0.62 114.38 126.68 1pew h ARG 66 Ca -0.05 -0.02 -0.08 0.00 0.07 0.00 0.00 59.98 59.90 1pew h ARG 66 Cb 1.01 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 31.01 1pew h ARG 66 CO 0.53 0.22 -0.14 0.66 -1.07 0.00 0.00 179.97 180.16 1pew h SER 67 N 0.19 0.49 -0.38 7.04 4.64 -1.94 -2.75 113.55 120.85 1pew h SER 67 Ca 0.05 -0.13 0.00 0.00 -0.47 0.00 0.00 61.79 61.23 1pew h SER 67 Cb 0.15 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 1pew h SER 67 CO 0.00 0.66 0.00 -1.54 -0.87 0.00 0.00 176.83 175.09 1pew n SER 68 N -4.19 3.15 -3.84 4.97 3.41 -1.17 -4.98 113.62 110.97 1pew n SER 68 Ca 0.00 -1.91 -0.26 0.00 -0.26 0.00 0.00 58.87 56.44 1pew n SER 68 Cb 0.34 -0.25 0.02 0.00 -0.26 0.00 0.00 64.21 64.06 1pew n SER 68 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1pew n ASN 69 N 1.09 -2.86 -4.23 4.04 5.15 -0.55 -4.79 115.26 113.12 1pew n ASN 69 Ca 0.16 -0.82 -0.13 0.00 -0.60 0.00 0.00 54.58 53.19 1pew n ASN 69 Cb 0.50 -3.86 -0.10 0.00 -0.53 0.00 0.00 39.78 35.80 1pew n ASN 69 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 1pew s SER 70 N -3.84 1.22 0.13 1.20 1.04 -0.35 -1.45 113.70 111.64 1pew s SER 70 Ca 0.33 -1.14 0.10 0.00 0.48 0.00 0.00 55.95 55.73 1pew s SER 70 Cb -0.17 0.11 -0.04 0.00 0.10 0.00 0.00 66.02 66.02 1pew s SER 70 CO 0.83 -0.54 -0.24 0.00 0.98 0.00 0.00 173.24 174.27 1pew s ALA 71 N -3.64 2.22 0.01 5.32 0.00 0.37 -0.45 121.76 125.60 1pew s ALA 71 Ca 0.21 -1.44 0.02 0.00 0.00 0.00 0.00 51.96 50.76 1pew s ALA 71 Cb 0.06 -0.32 -0.01 0.00 0.00 0.00 0.00 23.12 22.84 1pew s ALA 71 CO 0.02 0.45 -0.07 -1.12 0.00 0.00 0.00 175.76 175.04 1pew s SER 72 N -2.16 0.83 -0.23 0.00 0.01 -0.36 0.26 113.70 112.04 1pew s SER 72 Ca 0.13 -0.29 -0.06 0.00 1.31 0.00 0.00 55.95 57.05 1pew s SER 72 Cb -0.09 -0.04 -0.02 0.00 0.21 0.00 0.00 66.02 66.07 1pew s SER 72 CO 0.06 -0.02 0.03 -0.22 0.41 0.00 0.00 173.24 173.49 1pew s LEU 73 N -0.71 3.26 -0.18 2.44 2.96 0.21 -1.03 118.68 125.63 1pew s LEU 73 Ca -0.02 -0.25 -0.02 0.00 -0.22 0.00 0.00 54.13 53.62 1pew s LEU 73 Cb -0.05 -1.86 -0.01 0.00 0.50 0.00 0.00 46.19 44.77 1pew s LEU 73 CO 0.00 -0.01 -0.09 -0.89 -1.32 0.00 0.00 176.35 174.04 1pew s THR 74 N 1.45 3.13 -0.29 3.68 2.01 0.63 -0.38 115.64 125.87 1pew s THR 74 Ca 0.05 -0.60 -0.04 0.00 0.31 0.00 0.00 61.69 61.41 1pew s THR 74 Cb -0.15 -2.37 0.03 0.00 0.01 0.00 0.00 72.50 70.02 1pew s THR 74 CO 0.01 0.48 0.03 -0.63 -0.69 0.00 0.00 174.62 173.82 1pew s ILE 75 N 0.97 3.40 0.28 1.82 1.01 0.11 -1.25 121.20 127.54 1pew s ILE 75 Ca -0.01 -1.05 -0.00 0.00 0.00 0.00 0.00 60.65 59.59 1pew s ILE 75 Cb -0.15 -2.84 -0.04 0.00 0.01 0.00 0.00 42.46 39.45 1pew s ILE 75 CO -0.01 0.01 0.48 -0.44 0.00 0.00 0.00 174.94 174.98 1pew s SER 76 N 1.37 6.35 -1.50 3.58 0.01 -0.45 -1.27 113.70 121.79 1pew s SER 76 Ca -0.01 0.43 -0.13 0.00 1.31 0.00 0.00 55.95 57.55 1pew s SER 76 Cb -0.18 -2.02 0.07 0.00 0.21 0.00 0.00 66.02 64.10 1pew s SER 76 CO -0.00 -0.18 1.02 0.61 0.41 0.00 0.00 173.24 175.10 1pew n GLY 77 N -1.28 -0.50 2.61 3.44 0.00 -1.08 -4.78 105.19 103.60 1pew n GLY 77 Ca -0.05 0.20 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 1pew n GLY 77 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1pew n LEU 78 N -4.74 -0.29 -4.41 0.99 7.94 -0.39 -4.33 117.00 111.77 1pew n LEU 78 Ca 0.03 0.87 -0.25 0.00 -1.11 0.00 0.00 56.01 55.54 1pew n LEU 78 Cb 0.53 -0.70 -0.11 0.00 0.53 0.00 0.00 43.42 43.67 1pew n LEU 78 CO 0.74 -1.68 -0.51 -0.54 -1.11 0.00 0.00 177.39 174.28 1pew s LYS 79 N -0.23 1.50 0.37 1.96 1.02 -1.26 -0.67 119.74 122.43 1pew s LYS 79 Ca 0.62 -1.54 0.12 0.00 0.02 0.00 0.00 55.97 55.19 1pew s LYS 79 Cb -0.88 -1.73 0.92 0.00 -0.52 0.00 0.00 37.83 35.62 1pew s LYS 79 CO 0.43 0.36 1.83 1.79 -0.92 0.00 0.00 175.35 178.84 1pew h THR 80 N 3.05 0.72 -0.00 2.17 1.35 -1.95 0.21 112.91 118.45 1pew h THR 80 Ca -0.44 -0.20 0.00 0.00 -0.55 0.00 0.00 66.41 65.22 1pew h THR 80 Cb 1.22 0.08 -0.00 0.00 -1.73 0.00 0.00 68.15 67.72 1pew h THR 80 CO 0.51 0.11 0.01 -0.33 -0.25 0.00 0.00 175.52 175.56 1pew h GLU 81 N 0.59 0.00 0.00 4.72 5.08 -2.00 -2.61 114.58 120.35 1pew h GLU 81 Ca 0.50 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.86 1pew h GLU 81 Cb 0.99 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.24 1pew h GLU 81 CO -0.25 0.00 0.00 -0.25 -1.00 0.00 0.00 179.01 177.51 1pew n ASP 82 N -3.30 0.00 -4.68 1.42 8.00 0.06 -4.79 116.55 113.26 1pew n ASP 82 Ca -0.03 0.17 -0.42 0.00 0.71 0.00 0.00 54.79 55.22 1pew n ASP 82 Cb 0.08 -0.38 -0.03 0.00 -0.02 0.00 0.00 41.12 40.77 1pew n ASP 82 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1pew s GLU 83 N -2.77 4.15 0.00 -1.24 2.02 -0.99 -4.84 118.70 115.04 1pew s GLU 83 Ca 0.20 2.55 0.00 0.00 0.02 0.00 0.00 54.97 57.74 1pew s GLU 83 Cb 0.18 -3.79 0.00 0.00 0.10 0.00 0.00 34.13 30.61 1pew s GLU 83 CO 0.44 -0.87 0.00 0.00 0.02 0.00 0.00 175.26 174.86 1pew n ALA 84 N 6.33 0.00 -2.22 5.21 0.00 -1.11 -5.00 120.51 123.71 1pew n ALA 84 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.24 1pew n ALA 84 Cb 0.40 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.79 1pew n ALA 84 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1pew s ASP 85 N 0.00 7.09 -0.10 0.00 -0.00 -1.04 -1.13 116.67 121.50 1pew s ASP 85 Ca 0.00 1.32 0.03 0.00 -0.00 0.00 0.00 52.55 53.90 1pew s ASP 85 Cb 0.00 -2.38 0.01 0.00 -0.00 0.00 0.00 42.92 40.55 1pew s ASP 85 CO 0.00 0.23 -0.19 -0.31 -0.00 0.00 0.00 175.17 174.90 1pew s TYR 86 N -1.18 2.15 -0.09 4.23 1.51 0.60 -0.65 117.35 123.92 1pew s TYR 86 Ca 0.32 -0.91 0.02 0.00 -1.01 0.00 0.00 57.07 55.48 1pew s TYR 86 Cb -0.19 -1.49 -0.02 0.00 -0.11 0.00 0.00 41.96 40.15 1pew s TYR 86 CO 0.20 -0.41 -0.14 0.71 -1.11 0.00 0.00 175.55 174.80 1pew s TYR 87 N 0.61 2.76 0.37 2.71 2.02 -0.19 -0.46 117.35 125.17 1pew s TYR 87 Ca -0.14 -0.44 -0.01 0.00 -0.37 0.00 0.00 57.07 56.11 1pew s TYR 87 Cb -0.16 -1.75 -0.03 0.00 -0.40 0.00 0.00 41.96 39.61 1pew s TYR 87 CO 0.04 -0.05 0.60 0.00 -1.57 0.00 0.00 175.55 174.57 1pew s GLN 89 N -4.36 0.57 0.00 0.00 -0.44 0.05 -1.30 119.66 114.18 1pew s GLN 89 Ca 0.42 0.68 0.00 0.00 -2.50 0.00 0.00 55.36 53.96 1pew s GLN 89 Cb -0.10 0.27 0.00 0.00 -1.64 0.00 0.00 33.01 31.55 1pew s GLN 89 CO 0.38 -0.07 0.00 0.45 0.50 0.00 0.00 175.29 176.55 1pew n SER 90 N 2.84 0.00 -4.06 6.67 2.88 -0.35 -0.84 113.62 120.76 1pew n SER 90 Ca -0.13 -0.42 -0.16 0.00 -1.33 0.00 0.00 58.87 56.83 1pew n SER 90 Cb 0.57 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.90 1pew n SER 90 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 1pew s TYR 91 N -2.17 0.80 -0.70 0.66 2.02 -1.26 -1.03 117.35 115.66 1pew s TYR 91 Ca 0.00 -0.33 0.05 0.00 -0.37 0.00 0.00 57.07 56.41 1pew s TYR 91 Cb 0.00 -0.48 0.27 0.00 -0.40 0.00 0.00 41.96 41.34 1pew s TYR 91 CO 0.00 -0.02 0.88 -3.47 -1.57 0.00 0.00 175.55 171.37 1pew n ASP 92 N 2.03 4.25 -3.41 2.29 2.03 -0.99 -4.82 116.55 117.93 1pew n ASP 92 Ca -0.18 -3.47 -0.19 0.00 0.52 0.00 0.00 54.79 51.46 1pew n ASP 92 Cb 0.56 -0.75 0.04 0.00 -0.72 0.00 0.00 41.12 40.25 1pew n ASP 92 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1pew n ALA 93 N 0.79 -2.54 0.00 -1.67 0.00 -1.26 -4.04 120.51 111.79 1pew n ALA 93 Ca 0.30 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.68 1pew n ALA 93 Cb 0.40 -4.12 0.00 0.00 0.00 0.00 0.00 19.45 15.72 1pew n ALA 93 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1pew n ARG 94 N -3.30 0.00 -1.72 0.00 5.12 -1.26 -5.08 116.66 110.41 1pew n ARG 94 Ca -0.08 0.00 -0.42 0.00 -1.93 0.00 0.00 57.85 55.42 1pew n ARG 94 Cb 0.59 0.00 -0.03 0.00 -1.16 0.00 0.00 32.46 31.86 1pew n ARG 94 CO 0.00 0.00 0.00 0.27 -1.93 0.00 0.00 177.63 175.97 1pew n ASN 95 N 0.00 4.02 -4.74 0.55 0.23 -1.26 -4.97 115.26 109.08 1pew n ASN 95 Ca 0.00 1.06 -0.41 0.00 -0.53 0.00 0.00 54.58 54.70 1pew n ASN 95 Cb 0.00 -1.58 -0.04 0.00 -2.08 0.00 0.00 39.78 36.08 1pew n ASN 95 CO 0.00 0.00 0.00 0.68 -0.93 0.00 0.00 177.26 177.01 1pew s VAL 96 N 1.18 3.72 -0.11 3.53 -7.23 -1.26 -2.34 120.40 117.88 1pew s VAL 96 Ca 0.75 1.54 0.01 0.00 -1.81 0.00 0.00 61.98 62.47 1pew s VAL 96 Cb -0.50 -3.98 -0.02 0.00 0.56 0.00 0.00 36.38 32.44 1pew s VAL 96 CO 0.32 0.29 -0.14 -0.69 -0.31 0.00 0.00 175.10 174.57 1pew s VAL 97 N -0.46 2.99 -0.02 1.32 1.01 -0.20 -4.96 120.40 120.07 1pew s VAL 97 Ca 0.48 -0.70 0.07 0.00 0.00 0.00 0.00 61.98 61.84 1pew s VAL 97 Cb -0.30 -2.23 -0.02 0.00 0.00 0.00 0.00 36.38 33.83 1pew s VAL 97 CO 0.37 0.54 -0.25 -0.36 0.00 0.00 0.00 175.10 175.40 1pew s PHE 98 N 0.14 2.24 1.00 5.22 0.08 -1.26 -1.21 117.98 124.19 1pew s PHE 98 Ca -0.07 -0.45 -0.12 0.00 0.12 0.00 0.00 56.93 56.41 1pew s PHE 98 Cb -0.15 -1.44 0.19 0.00 -0.57 0.00 0.00 43.02 41.05 1pew s PHE 98 CO 0.05 -0.05 1.10 0.20 -0.10 0.00 0.00 175.22 176.41 1pew s GLY 99 N -0.54 1.56 0.00 4.36 0.00 -0.42 -4.46 107.32 107.83 1pew s GLY 99 Ca 0.08 -0.41 0.24 0.00 0.00 0.00 0.00 44.72 44.63 1pew s GLY 99 CO -0.01 0.21 1.77 0.61 0.00 0.00 0.00 173.10 175.69 1pew n GLY 100 N -1.19 -1.25 0.00 0.20 0.00 -1.25 -4.78 105.19 96.92 1pew n GLY 100 Ca 0.05 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1pew n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pew n GLY 101 N 0.89 -2.16 3.05 -0.02 0.00 -1.26 -5.04 105.19 100.64 1pew n GLY 101 Ca 0.07 -1.31 -0.27 0.00 0.00 0.00 0.00 46.02 44.51 1pew n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1pew s THR 102 N -3.00 1.37 -0.22 2.61 2.01 0.39 -4.35 115.64 114.44 1pew s THR 102 Ca 0.00 -0.58 -0.24 0.00 0.31 0.00 0.00 61.69 61.18 1pew s THR 102 Cb 0.00 -1.25 -0.01 0.00 0.01 0.00 0.00 72.50 71.25 1pew s THR 102 CO 0.00 0.41 0.78 -0.60 -0.69 0.00 0.00 174.62 174.53 1pew s ARG 103 N 0.87 4.20 -0.39 4.92 6.06 0.46 -0.29 118.95 134.78 1pew s ARG 103 Ca -0.10 0.88 -0.21 0.00 -2.50 0.00 0.00 55.73 53.80 1pew s ARG 103 Cb -0.15 -3.62 0.01 0.00 0.06 0.00 0.00 34.95 31.25 1pew s ARG 103 CO 0.01 -0.43 0.69 -1.17 -2.50 0.00 0.00 175.30 171.90 1pew s LEU 104 N 2.53 4.28 -0.21 -0.88 2.96 -0.28 -0.92 118.68 126.17 1pew s LEU 104 Ca 0.34 0.03 -0.12 0.00 -0.22 0.00 0.00 54.13 54.17 1pew s LEU 104 Cb -0.16 -2.85 -0.05 0.00 0.50 0.00 0.00 46.19 43.64 1pew s LEU 104 CO 0.09 -0.71 0.22 -0.89 -1.32 0.00 0.00 176.35 173.73 1pew s THR 105 N 2.90 5.34 -0.31 3.68 2.01 -0.33 -2.74 115.64 126.18 1pew s THR 105 Ca 0.26 0.34 -0.12 0.00 0.31 0.00 0.00 61.69 62.49 1pew s THR 105 Cb -0.14 -3.56 -0.03 0.00 0.01 0.00 0.00 72.50 68.79 1pew s THR 105 CO 0.17 0.37 0.21 -0.69 -0.69 0.00 0.00 174.62 173.99 1pew s VAL 106 N 0.77 5.19 0.86 3.82 1.01 -1.26 -2.43 120.40 128.36 1pew s VAL 106 Ca 0.11 -0.09 -0.11 0.00 0.00 0.00 0.00 61.98 61.89 1pew s VAL 106 Cb -0.13 -3.58 0.11 0.00 0.00 0.00 0.00 36.38 32.78 1pew s VAL 106 CO 0.03 0.11 1.09 -0.76 0.00 0.00 0.00 175.10 175.57 1pew s LEU 107 N 1.72 2.53 0.00 3.92 1.02 0.57 -4.96 118.68 123.48 1pew s LEU 107 Ca 0.06 1.67 0.00 0.00 0.02 0.00 0.00 54.13 55.88 1pew s LEU 107 Cb -0.17 -4.16 0.00 0.00 0.02 0.00 0.00 46.19 41.88 1pew s LEU 107 CO 0.10 -2.52 0.00 0.61 0.02 0.00 0.00 176.35 174.56