#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eec s SER 2 N 0.00 -0.33 0.26 1.61 0.15 -1.26 -5.16 113.70 108.97 2eec s SER 2 Ca 0.00 0.25 -0.29 0.00 0.70 0.00 0.00 55.95 56.61 2eec s SER 2 Cb 0.00 0.29 -0.09 0.00 -1.71 0.00 0.00 66.02 64.51 2eec s SER 2 CO 0.00 -0.38 0.93 -0.94 1.20 0.00 0.00 173.24 174.05 2eec s SER 3 N -1.53 7.55 -0.27 5.45 1.04 -1.26 -5.05 113.70 119.64 2eec s SER 3 Ca 0.02 1.90 -0.00 0.00 0.48 0.00 0.00 55.95 58.34 2eec s SER 3 Cb -0.01 -2.59 0.15 0.00 0.10 0.00 0.00 66.02 63.67 2eec s SER 3 CO -0.02 0.11 0.43 -0.83 0.98 0.00 0.00 173.24 173.90 2eec s GLY 4 N -1.29 -0.59 0.31 7.32 0.00 -1.26 -5.15 107.32 106.66 2eec s GLY 4 Ca 0.43 0.77 -0.06 0.00 0.00 0.00 0.00 44.72 45.86 2eec s GLY 4 CO 0.30 2.95 0.60 -0.45 0.00 0.00 0.00 173.10 176.49 2eec s SER 5 N 2.60 6.47 0.01 1.64 0.15 -1.26 -5.10 113.70 118.20 2eec s SER 5 Ca 0.12 0.82 -0.03 0.00 0.70 0.00 0.00 55.95 57.56 2eec s SER 5 Cb -0.14 -2.19 -0.01 0.00 -1.71 0.00 0.00 66.02 61.97 2eec s SER 5 CO -0.22 -0.24 0.05 -0.94 1.20 0.00 0.00 173.24 173.09 2eec s SER 6 N -3.12 0.11 0.00 5.45 1.04 -1.26 -5.13 113.70 110.79 2eec s SER 6 Ca 0.46 -0.30 0.00 0.00 0.48 0.00 0.00 55.95 56.59 2eec s SER 6 Cb -0.11 0.15 0.00 0.00 0.10 0.00 0.00 66.02 66.16 2eec s SER 6 CO 0.30 -0.30 0.00 0.61 0.98 0.00 0.00 173.24 174.83 2eec n GLY 7 N 1.71 1.77 3.55 7.32 0.00 -1.26 -5.11 105.19 113.17 2eec n GLY 7 Ca -0.22 -2.14 -0.26 0.00 0.00 0.00 0.00 46.02 43.40 2eec n GLY 7 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2eec s PHE 8 N -1.73 1.91 -0.57 1.61 0.40 -1.26 -5.06 117.98 113.28 2eec s PHE 8 Ca 0.00 -1.07 0.01 0.00 -0.60 0.00 0.00 56.93 55.26 2eec s PHE 8 Cb 0.00 -1.33 0.44 0.00 0.51 0.00 0.00 43.02 42.64 2eec s PHE 8 CO 0.00 -0.04 1.78 0.36 0.70 0.00 0.00 175.22 178.01 2eec n LYS 9 N -0.91 2.97 -4.07 0.44 2.85 -1.26 -4.95 118.16 113.24 2eec n LYS 9 Ca -0.07 -3.59 -0.16 0.00 -1.05 0.00 0.00 58.31 53.44 2eec n LYS 9 Cb 0.66 -2.28 -0.15 0.00 -0.65 0.00 0.00 35.03 32.60 2eec n LYS 9 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 2eec s VAL 10 N -4.81 0.32 -0.52 0.58 1.01 -1.26 -5.11 120.40 110.61 2eec s VAL 10 Ca 0.60 -0.10 -0.18 0.00 0.00 0.00 0.00 61.98 62.30 2eec s VAL 10 Cb 0.47 -0.32 0.08 0.00 0.00 0.00 0.00 36.38 36.61 2eec s VAL 10 CO -0.03 0.13 0.58 -0.13 0.00 0.00 0.00 175.10 175.64 2eec s ARG 11 N 0.37 3.06 0.26 2.72 0.52 -1.26 -5.05 118.95 119.56 2eec s ARG 11 Ca -0.04 -1.18 -0.30 0.00 -0.52 0.00 0.00 55.73 53.70 2eec s ARG 11 Cb -0.07 -4.17 -0.09 0.00 0.52 0.00 0.00 34.95 31.14 2eec s ARG 11 CO -0.01 -1.26 1.14 0.54 0.02 0.00 0.00 175.30 175.73 2eec s VAL 12 N 2.31 3.46 0.00 3.52 0.11 -1.26 -4.89 120.40 123.65 2eec s VAL 12 Ca 0.10 1.39 0.00 0.00 -2.93 0.00 0.00 61.98 60.55 2eec s VAL 12 Cb -0.23 -3.89 0.00 0.00 -1.53 0.00 0.00 36.38 30.74 2eec s VAL 12 CO 0.08 0.30 0.00 0.61 -3.33 0.00 0.00 175.10 172.77 2eec n GLY 13 N 1.44 0.01 3.74 6.54 0.00 -1.26 -5.11 105.19 110.54 2eec n GLY 13 Ca 0.00 -0.01 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 2eec n GLY 13 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2eec s GLU 14 N -1.00 2.71 -0.42 1.61 8.01 -1.26 -5.06 118.70 123.29 2eec s GLU 14 Ca 0.00 -0.87 -0.28 0.00 0.01 0.00 0.00 54.97 53.83 2eec s GLU 14 Cb 0.00 -2.58 -0.01 0.00 -4.31 0.00 0.00 34.13 27.23 2eec s GLU 14 CO 0.00 0.51 1.74 -1.25 0.01 0.00 0.00 175.26 176.27 2eec s PRO 15 N -2.72 3.21 0.00 0.39 0.04 -1.26 -4.77 135.00 129.88 2eec s PRO 15 Ca 0.29 1.13 0.00 0.00 0.04 0.00 0.00 61.00 62.45 2eec s PRO 15 Cb -0.11 -4.21 0.00 0.00 0.04 0.00 0.00 34.50 30.22 2eec s PRO 15 CO 0.21 -2.02 0.00 0.41 0.04 0.00 0.00 177.00 175.64 2eec n GLY 16 N 5.43 -0.43 3.74 0.56 0.00 -1.26 -4.92 105.19 108.30 2eec n GLY 16 Ca 0.21 -1.80 -0.39 0.00 0.00 0.00 0.00 46.02 44.04 2eec n GLY 16 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2eec s GLN 17 N -1.27 4.39 0.28 1.61 0.74 -1.26 -5.01 119.66 119.14 2eec s GLN 17 Ca 0.00 0.81 -0.24 0.00 0.05 0.00 0.00 55.36 55.98 2eec s GLN 17 Cb 0.00 -3.39 -0.09 0.00 1.10 0.00 0.00 33.01 30.62 2eec s GLN 17 CO 0.00 0.22 0.86 0.00 -0.55 0.00 0.00 175.29 175.82 2eec s ALA 18 N 0.28 3.30 -0.24 1.58 0.00 -1.26 -5.06 121.76 120.36 2eec s ALA 18 Ca 0.34 0.39 -0.03 0.00 0.00 0.00 0.00 51.96 52.66 2eec s ALA 18 Cb -0.18 -3.05 0.08 0.00 0.00 0.00 0.00 23.12 19.97 2eec s ALA 18 CO 0.18 0.23 0.09 0.20 0.00 0.00 0.00 175.76 176.46 2eec s GLY 19 N -1.59 0.60 -0.20 0.00 0.00 -1.25 -4.59 107.32 100.28 2eec s GLY 19 Ca 0.47 -0.88 -0.20 0.00 0.00 0.00 0.00 44.72 44.11 2eec s GLY 19 CO 0.23 1.76 0.59 0.21 0.00 0.00 0.00 173.10 175.89 2eec s ASN 20 N 1.98 6.65 0.08 1.64 2.47 -1.26 -4.27 114.94 122.23 2eec s ASN 20 Ca 0.05 0.78 -0.17 0.00 0.42 0.00 0.00 52.86 53.95 2eec s ASN 20 Cb -0.16 -2.33 -0.11 0.00 -1.45 0.00 0.00 41.25 37.20 2eec s ASN 20 CO -0.21 -0.24 1.39 1.55 -3.72 0.00 0.00 177.10 175.88 2eec h PRO 21 N 7.46 0.58 -0.81 0.43 0.13 -1.95 -3.24 132.00 134.60 2eec h PRO 21 Ca -0.32 -0.31 0.18 0.00 -0.87 0.00 0.00 66.00 64.67 2eec h PRO 21 Cb 1.15 0.01 -0.15 0.00 0.13 0.00 0.00 31.00 32.14 2eec h PRO 21 CO 0.76 0.90 -0.11 0.00 -0.23 0.00 0.00 178.00 179.33 2eec h ALA 22 N 0.67 0.69 -0.40 -0.56 0.00 -1.92 0.16 119.26 117.90 2eec h ALA 22 Ca 0.04 0.29 0.03 0.00 0.00 0.00 0.00 54.91 55.27 2eec h ALA 22 Cb 0.80 0.54 -0.03 0.00 0.00 0.00 0.00 17.79 19.10 2eec h ALA 22 CO 0.06 -0.43 0.19 -0.07 0.00 0.00 0.00 179.25 179.00 2eec h LEU 23 N 0.04 0.27 -9.31 0.00 3.38 -1.96 -3.39 115.31 104.34 2eec h LEU 23 Ca 0.42 0.02 -0.66 0.00 0.09 0.00 0.00 57.88 57.75 2eec h LEU 23 Cb 0.71 -0.03 0.07 0.00 0.09 0.00 0.00 40.66 41.49 2eec h LEU 23 CO -0.78 0.20 0.38 0.52 0.09 0.00 0.00 178.44 178.84 2eec n VAL 24 N -4.93 0.43 -4.36 1.22 0.31 0.56 -4.97 118.33 106.59 2eec n VAL 24 Ca 0.02 -0.11 -0.18 0.00 -0.01 0.00 0.00 64.34 64.06 2eec n VAL 24 Cb 0.10 -0.86 -0.10 0.00 -0.91 0.00 0.00 33.84 32.07 2eec n VAL 24 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 2eec s SER 25 N 0.26 1.91 -0.02 4.52 0.01 -1.14 -4.31 113.70 114.93 2eec s SER 25 Ca 0.79 -1.28 -0.01 0.00 1.31 0.00 0.00 55.95 56.76 2eec s SER 25 Cb -0.90 0.00 0.02 0.00 0.21 0.00 0.00 66.02 65.36 2eec s SER 25 CO 0.49 -0.56 0.04 0.00 0.41 0.00 0.00 173.24 173.62 2eec s ALA 26 N -3.42 -0.01 0.11 1.44 0.00 -1.26 -1.98 121.76 116.63 2eec s ALA 26 Ca 0.32 0.28 -0.18 0.00 0.00 0.00 0.00 51.96 52.38 2eec s ALA 26 Cb 0.07 -0.21 0.04 0.00 0.00 0.00 0.00 23.12 23.02 2eec s ALA 26 CO 0.11 -0.08 0.45 1.52 0.00 0.00 0.00 175.76 177.76 2eec s TYR 27 N 0.74 -0.29 -5.00 0.00 -0.85 -1.03 -5.04 117.35 105.89 2eec s TYR 27 Ca -0.06 0.08 0.00 0.00 -0.52 0.00 0.00 57.07 56.57 2eec s TYR 27 Cb -0.09 0.31 0.00 0.00 0.38 0.00 0.00 41.96 42.57 2eec s TYR 27 CO -0.02 -0.70 0.00 0.41 -1.52 0.00 0.00 175.55 173.71 2eec n GLY 28 N -0.08 -0.05 0.07 5.49 0.00 -1.26 -1.60 105.19 107.76 2eec n GLY 28 Ca -0.17 -1.07 -0.06 0.00 0.00 0.00 0.00 46.02 44.72 2eec n GLY 28 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2eec n THR 29 N 9.00 0.92 -0.33 2.61 -1.04 -1.19 -4.24 114.28 120.02 2eec n THR 29 Ca 0.00 -0.58 0.01 0.00 -2.04 0.00 0.00 64.05 61.44 2eec n THR 29 Cb 0.00 -0.62 0.18 0.00 -1.82 0.00 0.00 70.33 68.07 2eec n THR 29 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 2eec h GLY 30 N 2.72 1.36 1.87 3.41 0.00 -1.84 -2.14 103.07 108.44 2eec h GLY 30 Ca -0.37 -0.47 -0.19 0.00 0.00 0.00 0.00 47.33 46.31 2eec h GLY 30 CO 0.02 0.41 -0.85 1.41 0.00 0.00 0.00 176.54 177.53 2eec h LEU 31 N 1.19 0.15 -1.33 3.11 3.38 -1.92 -3.22 115.31 116.68 2eec h LEU 31 Ca 0.37 -0.12 0.25 0.00 0.09 0.00 0.00 57.88 58.47 2eec h LEU 31 Cb -0.00 -0.05 -0.09 0.00 0.09 0.00 0.00 40.66 40.61 2eec h LEU 31 CO -0.11 0.93 0.66 -0.33 0.09 0.00 0.00 178.44 179.67 2eec h GLU 32 N 0.06 0.42 0.00 1.13 4.39 -1.56 -3.45 114.58 115.57 2eec h GLU 32 Ca -0.03 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.65 2eec h GLU 32 Cb 1.47 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 30.02 2eec h GLU 32 CO 0.12 0.28 0.00 0.41 -1.16 0.00 0.00 179.01 178.66 2eec n GLY 33 N -1.46 -1.35 3.23 -3.84 0.00 -1.21 -4.93 105.19 95.63 2eec n GLY 33 Ca 0.25 -0.98 -0.39 0.00 0.00 0.00 0.00 46.02 44.90 2eec n GLY 33 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2eec s GLY 34 N 0.00 1.95 -0.43 -0.02 0.00 0.23 -4.68 107.32 104.36 2eec s GLY 34 Ca 0.00 -2.16 -0.13 0.00 0.00 0.00 0.00 44.72 42.43 2eec s GLY 34 CO 0.00 0.94 0.31 -0.51 0.00 0.00 0.00 173.10 173.85 2eec s THR 35 N 1.36 4.85 -0.03 0.90 -4.23 -1.26 -2.67 115.64 114.55 2eec s THR 35 Ca 0.03 -1.06 -0.30 0.00 -1.18 0.00 0.00 61.69 59.18 2eec s THR 35 Cb -0.22 -3.85 -0.04 0.00 1.34 0.00 0.00 72.50 69.73 2eec s THR 35 CO 0.01 -0.46 1.19 -0.89 -0.54 0.00 0.00 174.62 173.92 2eec s THR 36 N 1.57 4.25 0.00 3.99 2.01 -1.26 -3.12 115.64 123.08 2eec s THR 36 Ca 0.03 1.59 0.00 0.00 0.31 0.00 0.00 61.69 63.62 2eec s THR 36 Cb -0.22 -4.02 0.00 0.00 0.01 0.00 0.00 72.50 68.27 2eec s THR 36 CO 0.06 0.03 0.00 0.61 -0.69 0.00 0.00 174.62 174.63 2eec n GLY 37 N 3.31 2.69 3.89 4.40 0.00 -1.18 -4.62 105.19 113.68 2eec n GLY 37 Ca 0.10 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.91 2eec n GLY 37 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2eec s ILE 38 N -2.63 4.39 -0.25 -0.61 1.01 -1.18 -5.07 121.20 116.86 2eec s ILE 38 Ca 0.00 -1.25 -0.06 0.00 0.00 0.00 0.00 60.65 59.34 2eec s ILE 38 Cb 0.00 -3.46 -0.02 0.00 0.01 0.00 0.00 42.46 38.99 2eec s ILE 38 CO 0.00 -0.28 0.04 -1.58 0.00 0.00 0.00 174.94 173.12 2eec s GLN 39 N -3.95 3.51 0.27 2.79 0.74 -1.26 -4.58 119.66 117.18 2eec s GLN 39 Ca 0.36 -0.56 0.07 0.00 0.05 0.00 0.00 55.36 55.28 2eec s GLN 39 Cb -0.08 -3.24 -0.03 0.00 1.10 0.00 0.00 33.01 30.76 2eec s GLN 39 CO 0.27 -0.22 0.27 -1.12 -0.55 0.00 0.00 175.29 173.94 2eec s SER 40 N 1.56 5.74 -0.15 6.67 0.01 -1.22 -5.00 113.70 121.32 2eec s SER 40 Ca 0.06 -0.19 -0.08 0.00 1.31 0.00 0.00 55.95 57.05 2eec s SER 40 Cb -0.15 -1.46 0.05 0.00 0.21 0.00 0.00 66.02 64.68 2eec s SER 40 CO 0.01 -0.12 0.35 -1.83 0.41 0.00 0.00 173.24 172.07 2eec s GLU 41 N -3.93 0.33 -0.10 12.44 1.03 -1.26 -2.90 118.70 124.31 2eec s GLU 41 Ca 0.35 0.68 0.01 0.00 0.03 0.00 0.00 54.97 56.05 2eec s GLU 41 Cb -0.08 -0.05 0.02 0.00 -0.80 0.00 0.00 34.13 33.22 2eec s GLU 41 CO 0.27 -0.15 -0.11 -0.59 -1.33 0.00 0.00 175.26 173.34 2eec s PHE 42 N 1.29 1.63 0.56 4.83 -0.12 -0.52 -3.16 117.98 122.49 2eec s PHE 42 Ca -0.09 -0.74 -0.07 0.00 -0.05 0.00 0.00 56.93 55.98 2eec s PHE 42 Cb -0.09 -1.24 -0.01 0.00 -0.63 0.00 0.00 43.02 41.04 2eec s PHE 42 CO -0.11 -0.44 0.89 -0.06 -0.05 0.00 0.00 175.22 175.46 2eec s PHE 43 N 1.18 3.43 -0.27 3.49 0.40 -0.63 -2.68 117.98 122.90 2eec s PHE 43 Ca -0.04 0.84 0.00 0.00 -0.60 0.00 0.00 56.93 57.13 2eec s PHE 43 Cb -0.14 -2.60 0.08 0.00 0.51 0.00 0.00 43.02 40.87 2eec s PHE 43 CO -0.03 -0.63 0.03 0.42 0.70 0.00 0.00 175.22 175.71 2eec s ILE 44 N -2.96 1.25 -0.60 0.64 1.01 0.33 -2.45 121.20 118.42 2eec s ILE 44 Ca 0.52 -1.36 -0.26 0.00 0.00 0.00 0.00 60.65 59.55 2eec s ILE 44 Cb -0.11 -1.77 -0.08 0.00 0.01 0.00 0.00 42.46 40.52 2eec s ILE 44 CO 0.47 -0.41 2.31 0.21 0.00 0.00 0.00 174.94 177.52 2eec s ASN 45 N 1.47 4.45 -0.09 3.58 3.84 -0.84 -3.43 114.94 123.92 2eec s ASN 45 Ca 0.03 0.63 0.13 0.00 0.21 0.00 0.00 52.86 53.87 2eec s ASN 45 Cb -0.18 -2.52 0.20 0.00 -0.55 0.00 0.00 41.25 38.20 2eec s ASN 45 CO -0.14 -3.06 1.09 1.07 -2.79 0.00 0.00 177.10 173.28 2eec n THR 46 N 8.08 1.41 0.20 -5.21 5.66 -1.26 -2.87 114.28 120.29 2eec n THR 46 Ca 0.37 -1.68 0.04 0.00 -3.05 0.00 0.00 64.05 59.74 2eec n THR 46 Cb 0.51 -0.01 0.42 0.00 -1.55 0.00 0.00 70.33 69.71 2eec n THR 46 CO 0.00 0.00 0.00 0.71 -3.05 0.00 0.00 175.07 172.73 2eec h THR 47 N 1.39 1.11 0.01 1.09 1.35 -1.84 -1.66 112.91 114.37 2eec h THR 47 Ca 0.00 -1.15 -0.31 0.00 -0.55 0.00 0.00 66.41 64.40 2eec h THR 47 Cb 1.03 1.64 -0.05 0.00 -1.73 0.00 0.00 68.15 69.04 2eec h THR 47 CO 0.00 0.32 -1.80 0.54 -0.25 0.00 0.00 175.52 174.32 2eec n ARG 48 N -3.98 0.65 -0.14 4.72 5.12 -1.26 -4.18 116.66 117.59 2eec n ARG 48 Ca -0.02 0.27 -0.11 0.00 -1.93 0.00 0.00 57.85 56.06 2eec n ARG 48 Cb 0.38 -1.76 0.01 0.00 -1.16 0.00 0.00 32.46 29.93 2eec n ARG 48 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2eec h ALA 49 N 0.88 0.69 0.00 7.54 0.00 -1.80 -3.46 119.26 123.11 2eec h ALA 49 Ca -0.32 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.18 2eec h ALA 49 Cb 2.03 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.67 2eec h ALA 49 CO 0.07 0.67 0.00 0.41 0.00 0.00 0.00 179.25 180.41 2eec n GLY 50 N -0.08 2.63 3.64 0.00 0.00 -0.64 -3.97 105.19 106.77 2eec n GLY 50 Ca -0.00 -1.70 -0.29 0.00 0.00 0.00 0.00 46.02 44.03 2eec n GLY 50 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2eec s PRO 51 N -4.24 -0.32 0.00 1.61 0.04 -1.26 -4.94 135.00 125.88 2eec s PRO 51 Ca 0.00 0.26 0.00 0.00 0.04 0.00 0.00 61.00 61.30 2eec s PRO 51 Cb 0.00 -1.67 0.00 0.00 0.04 0.00 0.00 34.50 32.87 2eec s PRO 51 CO 0.00 -3.18 0.00 0.41 0.04 0.00 0.00 177.00 174.27 2eec n GLY 52 N -1.02 -0.36 3.49 0.56 0.00 -1.26 -5.01 105.19 101.60 2eec n GLY 52 Ca 0.08 0.03 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 2eec n GLY 52 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2eec s THR 53 N 0.00 3.28 -0.11 2.61 2.01 -1.26 -5.12 115.64 117.05 2eec s THR 53 Ca 0.00 -0.63 -0.05 0.00 0.31 0.00 0.00 61.69 61.32 2eec s THR 53 Cb 0.00 -2.32 -0.04 0.00 0.01 0.00 0.00 72.50 70.15 2eec s THR 53 CO 0.00 0.58 0.07 -0.76 -0.69 0.00 0.00 174.62 173.82 2eec s LEU 54 N -0.54 3.95 -0.15 4.42 2.01 -1.26 -4.89 118.68 122.22 2eec s LEU 54 Ca 0.08 0.27 -0.03 0.00 0.01 0.00 0.00 54.13 54.45 2eec s LEU 54 Cb -0.12 -1.94 0.05 0.00 0.01 0.00 0.00 46.19 44.19 2eec s LEU 54 CO 0.02 0.36 0.04 -0.44 1.01 0.00 0.00 176.35 177.34 2eec s SER 55 N -0.76 2.32 -0.05 2.29 0.01 -1.26 -5.12 113.70 111.13 2eec s SER 55 Ca 0.12 -0.53 -0.00 0.00 1.31 0.00 0.00 55.95 56.86 2eec s SER 55 Cb -0.12 -0.43 0.03 0.00 0.21 0.00 0.00 66.02 65.70 2eec s SER 55 CO 0.03 -0.29 -0.01 0.54 0.41 0.00 0.00 173.24 173.92 2eec s VAL 56 N 1.98 0.34 -0.10 3.43 0.11 -1.26 -3.49 120.40 121.41 2eec s VAL 56 Ca 0.02 0.05 -0.00 0.00 -2.93 0.00 0.00 61.98 59.11 2eec s VAL 56 Cb -0.15 -0.44 0.02 0.00 -1.53 0.00 0.00 36.38 34.28 2eec s VAL 56 CO -0.07 0.21 -0.07 -0.89 -3.33 0.00 0.00 175.10 170.95 2eec s THR 57 N 1.33 0.91 0.16 5.04 2.01 -1.15 -5.04 115.64 118.90 2eec s THR 57 Ca -0.05 -0.24 0.09 0.00 0.31 0.00 0.00 61.69 61.80 2eec s THR 57 Cb -0.13 -0.93 -0.04 0.00 0.01 0.00 0.00 72.50 71.40 2eec s THR 57 CO -0.02 0.34 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.46 2eec s ILE 58 N 1.54 2.87 0.39 1.82 1.01 -1.26 -1.58 121.20 125.98 2eec s ILE 58 Ca 0.01 -1.69 0.06 0.00 0.00 0.00 0.00 60.65 59.03 2eec s ILE 58 Cb -0.13 -2.37 -0.02 0.00 0.01 0.00 0.00 42.46 39.94 2eec s ILE 58 CO -0.05 -0.04 0.21 -1.83 0.00 0.00 0.00 174.94 173.23 2eec s GLU 59 N -2.54 1.90 0.00 2.79 -1.05 0.31 -4.94 118.70 115.17 2eec s GLU 59 Ca 0.21 -2.15 0.00 0.00 -0.15 0.00 0.00 54.97 52.89 2eec s GLU 59 Cb -0.09 -0.16 0.00 0.00 -0.44 0.00 0.00 34.13 33.43 2eec s GLU 59 CO 0.12 -0.59 0.00 0.41 0.95 0.00 0.00 175.26 176.15 2eec n GLY 60 N -0.82 2.50 0.27 -3.83 0.00 -1.26 -2.67 105.19 99.38 2eec n GLY 60 Ca -0.00 -1.39 -0.13 0.00 0.00 0.00 0.00 46.02 44.50 2eec n GLY 60 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eec h PRO 61 N 0.00 0.94 -5.71 1.61 0.13 -1.89 -3.44 132.00 123.64 2eec h PRO 61 Ca 0.00 -0.50 -0.64 0.00 -0.87 0.00 0.00 66.00 63.99 2eec h PRO 61 Cb 0.00 0.02 -0.07 0.00 0.13 0.00 0.00 31.00 31.08 2eec h PRO 61 CO 0.00 1.15 -0.39 0.45 -0.23 0.00 0.00 178.00 178.98 2eec s SER 62 N -6.84 6.50 -0.40 1.44 0.15 -1.26 -5.05 113.70 108.24 2eec s SER 62 Ca -0.11 0.60 -0.29 0.00 0.70 0.00 0.00 55.95 56.85 2eec s SER 62 Cb 0.11 -2.13 0.01 0.00 -1.71 0.00 0.00 66.02 62.30 2eec s SER 62 CO 0.88 0.35 1.31 -0.75 1.20 0.00 0.00 173.24 176.24 2eec s LYS 63 N -0.86 3.69 -0.22 5.44 2.47 -1.26 -4.94 119.74 124.07 2eec s LYS 63 Ca 0.17 0.91 -0.09 0.00 -1.56 0.00 0.00 55.97 55.40 2eec s LYS 63 Cb -0.13 -3.96 -0.05 0.00 -1.46 0.00 0.00 37.83 32.23 2eec s LYS 63 CO 0.06 -1.42 0.12 0.14 0.16 0.00 0.00 175.35 174.42 2eec s VAL 64 N 4.93 5.16 -0.37 4.02 -7.23 -1.26 -4.88 120.40 120.77 2eec s VAL 64 Ca 0.56 0.10 0.02 0.00 -1.81 0.00 0.00 61.98 60.86 2eec s VAL 64 Cb -0.13 -3.37 0.18 0.00 0.56 0.00 0.00 36.38 33.62 2eec s VAL 64 CO 0.30 0.40 1.08 0.29 -0.31 0.00 0.00 175.10 176.85 2eec n LYS 65 N 3.96 1.56 -1.22 4.82 5.02 -1.26 -4.96 118.16 126.08 2eec n LYS 65 Ca -0.16 -0.77 -0.38 0.00 -2.02 0.00 0.00 58.31 54.98 2eec n LYS 65 Cb 0.52 -1.44 0.01 0.00 -0.02 0.00 0.00 35.03 34.10 2eec n LYS 65 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2eec n MET 66 N 0.11 0.00 -3.79 1.97 0.00 -1.26 -4.99 117.12 109.17 2eec n MET 66 Ca 0.12 0.00 -0.14 0.00 0.00 0.00 0.00 57.70 57.68 2eec n MET 66 Cb 0.68 -0.98 -0.15 0.00 0.00 0.00 0.00 33.22 32.77 2eec n MET 66 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 2eec s ASP 67 N -0.98 0.03 -0.00 3.17 2.15 -1.07 -5.02 116.67 114.94 2eec s ASP 67 Ca 0.56 0.07 0.05 0.00 0.43 0.00 0.00 52.55 53.66 2eec s ASP 67 Cb -0.49 -0.01 -0.01 0.00 -0.30 0.00 0.00 42.92 42.11 2eec s ASP 67 CO 0.65 -0.10 -0.17 0.00 -0.17 0.00 0.00 175.17 175.37 2eec s GLN 69 N -0.52 1.68 0.50 0.00 0.00 -1.19 -5.03 119.66 115.09 2eec s GLN 69 Ca 0.06 -1.87 -0.20 0.00 -0.00 0.00 0.00 55.36 53.35 2eec s GLN 69 Cb -0.07 -1.36 -0.08 0.00 0.00 0.00 0.00 33.01 31.51 2eec s GLN 69 CO -0.00 0.05 1.03 -1.83 0.00 0.00 0.00 175.29 174.54 2eec s GLU 70 N -3.70 3.77 0.07 9.60 1.03 -1.26 -3.68 118.70 124.53 2eec s GLU 70 Ca 0.31 1.32 0.04 0.00 0.03 0.00 0.00 54.97 56.67 2eec s GLU 70 Cb 0.04 -2.09 -0.03 0.00 -0.80 0.00 0.00 34.13 31.25 2eec s GLU 70 CO 0.14 -0.45 -0.11 0.95 -1.33 0.00 0.00 175.26 174.46 2eec s THR 71 N -2.07 0.87 -1.78 1.83 -4.23 -1.26 -4.92 115.64 104.09 2eec s THR 71 Ca 0.66 -1.33 0.15 0.00 -1.18 0.00 0.00 61.69 59.99 2eec s THR 71 Cb -0.16 -1.01 0.38 0.00 1.34 0.00 0.00 72.50 73.05 2eec s THR 71 CO 0.22 -0.38 1.37 -0.81 -0.54 0.00 0.00 174.62 174.49 2eec n PRO 72 N 1.12 0.38 -0.10 3.99 -0.04 -1.26 -2.97 135.00 136.13 2eec n PRO 72 Ca -0.20 0.06 -0.17 0.00 -0.04 0.00 0.00 63.50 63.15 2eec n PRO 72 Cb 0.55 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.43 2eec n PRO 72 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2eec n GLU 73 N -1.11 0.46 0.00 0.54 4.07 -1.26 -5.08 120.64 118.26 2eec n GLU 73 Ca 0.10 0.14 0.00 0.00 -0.06 0.00 0.00 57.16 57.34 2eec n GLU 73 Cb 0.08 -1.32 0.00 0.00 -0.06 0.00 0.00 31.44 30.13 2eec n GLU 73 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2eec n GLY 74 N 2.25 -2.44 3.64 8.31 0.00 -1.16 -4.03 105.19 111.76 2eec n GLY 74 Ca -0.36 0.80 -0.10 0.00 0.00 0.00 0.00 46.02 46.36 2eec n GLY 74 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2eec s TYR 75 N 0.00 -0.58 -0.07 1.61 5.04 -1.22 -4.16 117.35 117.96 2eec s TYR 75 Ca 0.00 1.39 0.00 0.00 -2.44 0.00 0.00 57.07 56.02 2eec s TYR 75 Cb 0.00 0.35 0.02 0.00 0.35 0.00 0.00 41.96 42.68 2eec s TYR 75 CO 0.00 -0.28 -0.06 0.21 -1.34 0.00 0.00 175.55 174.08 2eec s LYS 76 N 0.39 1.12 -0.03 4.97 2.20 -1.24 -0.52 119.74 126.64 2eec s LYS 76 Ca 0.01 -0.15 0.05 0.00 -0.36 0.00 0.00 55.97 55.52 2eec s LYS 76 Cb -0.05 -1.17 -0.01 0.00 -1.51 0.00 0.00 37.83 35.10 2eec s LYS 76 CO -0.05 -0.16 -0.18 0.08 -0.36 0.00 0.00 175.35 174.68 2eec s VAL 77 N 1.30 1.47 -0.04 4.02 1.01 -1.09 -3.16 120.40 123.91 2eec s VAL 77 Ca -0.04 -0.76 0.01 0.00 0.00 0.00 0.00 61.98 61.18 2eec s VAL 77 Cb -0.14 -1.25 0.02 0.00 0.00 0.00 0.00 36.38 35.02 2eec s VAL 77 CO -0.03 0.42 -0.03 -0.04 0.00 0.00 0.00 175.10 175.43 2eec s MET 78 N -0.16 0.61 0.02 2.72 -1.94 -1.24 -1.44 119.30 117.87 2eec s MET 78 Ca 0.01 -0.04 0.03 0.00 -1.71 0.00 0.00 55.69 53.98 2eec s MET 78 Cb -0.10 -0.68 -0.02 0.00 2.01 0.00 0.00 34.83 36.05 2eec s MET 78 CO 0.01 -0.09 -0.09 1.52 -0.01 0.00 0.00 175.02 176.35 2eec s TYR 79 N 0.92 0.83 -0.34 -0.03 1.13 -1.14 -2.61 117.35 116.10 2eec s TYR 79 Ca -0.11 -0.29 0.02 0.00 -1.41 0.00 0.00 57.07 55.28 2eec s TYR 79 Cb -0.14 -0.51 0.10 0.00 -1.10 0.00 0.00 41.96 40.32 2eec s TYR 79 CO -0.00 -0.02 0.09 0.99 -2.51 0.00 0.00 175.55 174.10 2eec s THR 80 N -0.69 1.64 0.30 -3.49 2.01 -1.26 -3.43 115.64 110.72 2eec s THR 80 Ca -0.01 -1.99 -0.29 0.00 0.31 0.00 0.00 61.69 59.71 2eec s THR 80 Cb -0.06 -2.22 -0.10 0.00 0.01 0.00 0.00 72.50 70.13 2eec s THR 80 CO 0.00 -0.66 1.23 -2.16 -0.69 0.00 0.00 174.62 172.35 2eec s PRO 81 N 1.14 4.46 -0.07 4.92 0.04 -1.26 -4.78 135.00 139.44 2eec s PRO 81 Ca 0.11 2.06 0.14 0.00 0.04 0.00 0.00 61.00 63.35 2eec s PRO 81 Cb -0.19 -3.12 -0.23 0.00 0.04 0.00 0.00 34.50 31.00 2eec s PRO 81 CO -0.15 -0.05 0.54 -0.12 0.04 0.00 0.00 177.00 177.26 2eec n MET 82 N 1.11 0.64 -4.13 4.56 1.56 -1.26 -3.10 117.12 116.50 2eec n MET 82 Ca 0.00 0.23 -0.15 0.00 -0.27 0.00 0.00 57.70 57.50 2eec n MET 82 Cb 0.43 -1.73 -0.12 0.00 2.15 0.00 0.00 33.22 33.95 2eec n MET 82 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 2eec s ALA 83 N -2.59 0.81 1.22 -5.12 0.00 -1.26 -1.56 121.76 113.26 2eec s ALA 83 Ca -0.06 -0.82 -0.20 0.00 0.00 0.00 0.00 51.96 50.89 2eec s ALA 83 Cb 0.08 -0.03 0.29 0.00 0.00 0.00 0.00 23.12 23.46 2eec s ALA 83 CO 0.83 0.07 1.11 -1.25 0.00 0.00 0.00 175.76 176.51 2eec s PRO 84 N -1.52 -1.36 0.00 0.00 0.04 -1.26 -4.71 135.00 126.19 2eec s PRO 84 Ca -0.06 -0.11 0.00 0.00 0.04 0.00 0.00 61.00 60.87 2eec s PRO 84 Cb -0.09 -1.58 0.00 0.00 0.04 0.00 0.00 34.50 32.86 2eec s PRO 84 CO 0.01 -3.80 0.00 0.41 0.04 0.00 0.00 177.00 173.66 2eec n GLY 85 N -0.93 0.48 2.86 0.56 0.00 0.27 -4.80 105.19 103.63 2eec n GLY 85 Ca 0.14 -1.32 -0.29 0.00 0.00 0.00 0.00 46.02 44.55 2eec n GLY 85 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2eec s ASN 86 N -4.00 3.42 0.35 1.61 4.22 -1.26 -2.90 114.94 116.37 2eec s ASN 86 Ca 0.00 -1.00 0.07 0.00 -2.14 0.00 0.00 52.86 49.79 2eec s ASN 86 Cb 0.00 -0.94 -0.01 0.00 1.28 0.00 0.00 41.25 41.58 2eec s ASN 86 CO 0.00 -0.26 0.44 -0.31 -2.04 0.00 0.00 177.10 174.93 2eec s TYR 87 N 1.59 3.02 -0.01 1.54 1.51 -1.19 -4.29 117.35 119.51 2eec s TYR 87 Ca -0.04 -0.27 0.01 0.00 -1.01 0.00 0.00 57.07 55.77 2eec s TYR 87 Cb -0.18 -2.01 -0.00 0.00 -0.11 0.00 0.00 41.96 39.66 2eec s TYR 87 CO -0.07 -0.02 -0.04 -1.17 -1.11 0.00 0.00 175.55 173.14 2eec s LEU 88 N -4.16 1.96 -0.16 -1.29 2.96 -1.09 -3.78 118.68 113.12 2eec s LEU 88 Ca 0.45 -0.07 -0.01 0.00 -0.22 0.00 0.00 54.13 54.28 2eec s LEU 88 Cb -0.09 -0.22 0.04 0.00 0.50 0.00 0.00 46.19 46.43 2eec s LEU 88 CO 0.30 0.04 -0.04 -0.63 -1.32 0.00 0.00 176.35 174.71 2eec s ILE 89 N -0.03 0.99 -0.14 6.68 1.01 -0.70 -0.53 121.20 128.49 2eec s ILE 89 Ca 0.01 -0.57 -0.03 0.00 0.00 0.00 0.00 60.65 60.05 2eec s ILE 89 Cb -0.02 -1.20 -0.03 0.00 0.01 0.00 0.00 42.46 41.21 2eec s ILE 89 CO -0.00 0.10 -0.02 -0.44 0.00 0.00 0.00 174.94 174.57 2eec s SER 90 N 1.68 4.97 -0.10 3.58 0.01 -0.61 -0.65 113.70 122.57 2eec s SER 90 Ca 0.01 -0.04 0.03 0.00 1.31 0.00 0.00 55.95 57.26 2eec s SER 90 Cb -0.15 -1.70 0.01 0.00 0.21 0.00 0.00 66.02 64.39 2eec s SER 90 CO -0.07 0.23 -0.21 -0.69 0.41 0.00 0.00 173.24 172.90 2eec s VAL 91 N 0.03 1.86 0.04 3.43 1.01 -1.26 -2.95 120.40 122.56 2eec s VAL 91 Ca 0.01 -0.89 0.08 0.00 0.00 0.00 0.00 61.98 61.19 2eec s VAL 91 Cb -0.13 -1.63 -0.03 0.00 0.00 0.00 0.00 36.38 34.59 2eec s VAL 91 CO 0.02 0.51 -0.23 -0.54 0.00 0.00 0.00 175.10 174.87 2eec s LYS 92 N 0.56 1.58 -0.13 2.72 1.02 -1.23 -3.20 119.74 121.07 2eec s LYS 92 Ca -0.14 -0.99 -0.09 0.00 0.02 0.00 0.00 55.97 54.78 2eec s LYS 92 Cb -0.17 -1.70 0.05 0.00 -0.52 0.00 0.00 37.83 35.49 2eec s LYS 92 CO 0.05 0.44 0.33 0.71 -0.92 0.00 0.00 175.35 175.96 2eec s TYR 93 N -0.77 -0.43 0.00 3.18 1.51 -1.25 -4.39 117.35 115.19 2eec s TYR 93 Ca 0.09 0.99 0.00 0.00 -1.01 0.00 0.00 57.07 57.14 2eec s TYR 93 Cb -0.09 0.15 0.00 0.00 -0.11 0.00 0.00 41.96 41.91 2eec s TYR 93 CO 0.02 -0.25 0.00 0.41 -1.11 0.00 0.00 175.55 174.61 2eec n GLY 94 N 3.81 1.63 0.00 0.71 0.00 -1.26 -4.28 105.19 105.80 2eec n GLY 94 Ca -0.21 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.79 2eec n GLY 94 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2eec n GLY 95 N 0.00 5.43 0.26 -0.02 0.00 -1.26 -5.03 105.19 104.57 2eec n GLY 95 Ca 0.00 -1.44 0.17 0.00 0.00 0.00 0.00 46.02 44.75 2eec n GLY 95 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eec h PRO 96 N 0.00 0.00 -7.23 1.61 0.13 -2.00 -3.45 132.00 121.06 2eec h PRO 96 Ca 0.00 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.66 2eec h PRO 96 Cb 0.00 0.00 0.19 0.00 0.13 0.00 0.00 31.00 31.32 2eec h PRO 96 CO 0.00 0.00 0.12 -0.80 -0.23 0.00 0.00 178.00 177.09 2eec s ASN 97 N -5.47 2.03 0.08 1.44 -0.87 -1.26 -4.96 114.94 105.92 2eec s ASN 97 Ca 0.01 1.62 0.06 0.00 -1.57 0.00 0.00 52.86 52.98 2eec s ASN 97 Cb 0.09 -2.29 -0.04 0.00 -0.02 0.00 0.00 41.25 38.99 2eec s ASN 97 CO 0.52 -3.57 -0.06 -1.38 -2.57 0.00 0.00 177.10 170.04 2eec s HIS 98 N -2.64 2.84 0.99 2.20 -3.43 -1.26 -3.95 115.29 110.04 2eec s HIS 98 Ca 0.67 -0.09 -0.13 0.00 -0.80 0.00 0.00 55.06 54.71 2eec s HIS 98 Cb -0.22 -1.50 0.18 0.00 -1.43 0.00 0.00 32.58 29.61 2eec s HIS 98 CO 0.61 0.43 1.11 0.96 -2.00 0.00 0.00 174.74 175.85 2eec s ILE 99 N -1.19 1.98 0.33 -5.38 -4.36 -1.19 -4.82 121.20 106.56 2eec s ILE 99 Ca 0.22 0.00 -0.29 0.00 -0.26 0.00 0.00 60.65 60.32 2eec s ILE 99 Cb -0.11 -2.57 -0.12 0.00 1.25 0.00 0.00 42.46 40.91 2eec s ILE 99 CO 0.14 0.00 1.45 0.52 0.24 0.00 0.00 174.94 177.28 2eec n VAL 100 N -4.12 1.60 0.00 8.37 0.31 -1.26 -2.66 118.33 120.58 2eec n VAL 100 Ca 0.06 -0.40 0.00 0.00 -0.01 0.00 0.00 64.34 63.99 2eec n VAL 100 Cb 0.58 -1.78 0.00 0.00 -0.91 0.00 0.00 33.84 31.73 2eec n VAL 100 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2eec n GLY 101 N 1.22 2.20 3.69 2.92 0.00 -1.26 -4.84 105.19 109.11 2eec n GLY 101 Ca 0.06 -0.37 -0.37 0.00 0.00 0.00 0.00 46.02 45.33 2eec n GLY 101 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2eec n SER 102 N 2.71 1.54 -4.77 1.61 2.88 -1.09 -4.40 113.62 112.11 2eec n SER 102 Ca 0.00 0.80 -0.33 0.00 -1.33 0.00 0.00 58.87 58.01 2eec n SER 102 Cb 0.00 -1.50 0.05 0.00 -0.75 0.00 0.00 64.21 62.01 2eec n SER 102 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 2eec s PRO 103 N -3.23 2.80 -0.23 -1.46 0.04 -1.26 -4.77 135.00 126.88 2eec s PRO 103 Ca 0.80 1.39 -0.08 0.00 0.04 0.00 0.00 61.00 63.15 2eec s PRO 103 Cb -0.38 -1.95 -0.04 0.00 0.04 0.00 0.00 34.50 32.17 2eec s PRO 103 CO 0.43 -1.25 0.08 -0.06 0.04 0.00 0.00 177.00 176.24 2eec s PHE 104 N -2.34 3.15 -0.18 0.56 0.08 0.17 -4.99 117.98 114.44 2eec s PHE 104 Ca 0.67 -0.19 -0.07 0.00 0.12 0.00 0.00 56.93 57.46 2eec s PHE 104 Cb -0.20 -2.20 -0.04 0.00 -0.57 0.00 0.00 43.02 40.01 2eec s PHE 104 CO 0.42 -0.16 0.06 -1.59 -0.10 0.00 0.00 175.22 173.85 2eec s LYS 105 N 1.21 3.95 -0.00 0.44 -2.85 -1.26 -1.71 119.74 119.51 2eec s LYS 105 Ca 0.05 -0.33 0.06 0.00 -1.00 0.00 0.00 55.97 54.74 2eec s LYS 105 Cb -0.14 -3.21 -0.02 0.00 -2.06 0.00 0.00 37.83 32.40 2eec s LYS 105 CO 0.04 0.30 -0.18 0.00 0.10 0.00 0.00 175.35 175.61 2eec s ALA 106 N 0.29 1.51 -0.23 0.59 0.00 -1.25 -4.99 121.76 117.68 2eec s ALA 106 Ca 0.04 -0.81 -0.09 0.00 0.00 0.00 0.00 51.96 51.10 2eec s ALA 106 Cb -0.12 -0.37 -0.04 0.00 0.00 0.00 0.00 23.12 22.59 2eec s ALA 106 CO 0.00 0.36 0.10 0.21 0.00 0.00 0.00 175.76 176.44 2eec s LYS 107 N -0.55 3.88 -0.33 0.00 2.20 -1.26 -3.20 119.74 120.49 2eec s LYS 107 Ca 0.07 -0.37 -0.09 0.00 -0.36 0.00 0.00 55.97 55.22 2eec s LYS 107 Cb -0.07 -3.38 0.01 0.00 -1.51 0.00 0.00 37.83 32.88 2eec s LYS 107 CO -0.00 0.01 0.14 0.08 -0.36 0.00 0.00 175.35 175.21 2eec s VAL 108 N 1.14 4.30 0.01 4.02 1.01 -1.14 0.74 120.40 130.48 2eec s VAL 108 Ca 0.05 -0.70 -0.05 0.00 0.00 0.00 0.00 61.98 61.28 2eec s VAL 108 Cb -0.14 -3.28 -0.00 0.00 0.00 0.00 0.00 36.38 32.95 2eec s VAL 108 CO 0.04 -0.04 0.09 0.42 0.00 0.00 0.00 175.10 175.61 2eec s THR 109 N 1.54 0.09 0.00 3.92 -4.23 -1.09 -0.56 115.64 115.31 2eec s THR 109 Ca 0.03 -0.75 0.00 0.00 -1.18 0.00 0.00 61.69 59.79 2eec s THR 109 Cb -0.18 -0.38 0.00 0.00 1.34 0.00 0.00 72.50 73.28 2eec s THR 109 CO 0.05 -0.41 0.00 0.61 -0.54 0.00 0.00 174.62 174.33 2eec n GLY 110 N 1.50 0.61 3.62 3.99 0.00 -1.26 -4.53 105.19 109.11 2eec n GLY 110 Ca -0.23 -1.84 -0.20 0.00 0.00 0.00 0.00 46.02 43.75 2eec n GLY 110 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2eec n GLN 111 N 0.85 -0.95 -1.90 1.61 1.13 -1.26 -4.39 117.38 112.45 2eec n GLN 111 Ca 0.00 0.06 -0.38 0.00 -1.94 0.00 0.00 57.00 54.74 2eec n GLN 111 Cb 0.00 -2.26 -0.03 0.00 0.11 0.00 0.00 30.24 28.06 2eec n GLN 111 CO 0.00 0.00 0.00 -0.98 -1.44 0.00 0.00 177.06 174.64 2eec s ARG 112 N -5.68 2.52 -1.49 -1.09 1.70 -1.26 -4.51 118.95 109.14 2eec s ARG 112 Ca 0.03 0.88 -0.11 0.00 -0.47 0.00 0.00 55.73 56.06 2eec s ARG 112 Cb -0.02 -4.43 0.01 0.00 -0.57 0.00 0.00 34.95 29.94 2eec s ARG 112 CO 0.62 -2.83 2.49 1.28 -1.08 0.00 0.00 175.30 175.77 2eec n LEU 113 N 13.49 7.67 -4.69 -1.89 4.77 -0.60 -4.96 117.00 130.79 2eec n LEU 113 Ca 0.25 -4.34 -0.30 0.00 -0.03 0.00 0.00 56.01 51.59 2eec n LEU 113 Cb 0.53 -1.58 0.15 0.00 -2.33 0.00 0.00 43.42 40.19 2eec n LEU 113 CO 0.71 1.58 0.65 0.68 -1.33 0.00 0.00 177.39 179.68 2eec s VAL 114 N 2.16 2.52 -0.15 4.08 -7.23 -1.26 -4.61 120.40 115.91 2eec s VAL 114 Ca 0.55 0.17 -0.29 0.00 -1.81 0.00 0.00 61.98 60.60 2eec s VAL 114 Cb 0.15 -2.56 0.09 0.00 0.56 0.00 0.00 36.38 34.63 2eec s VAL 114 CO -0.07 -0.22 0.82 -0.44 -0.31 0.00 0.00 175.10 174.88 2eec s SER 115 N -3.25 -0.57 0.52 4.85 0.01 -1.26 -5.03 113.70 108.97 2eec s SER 115 Ca 0.64 0.77 0.31 0.00 1.31 0.00 0.00 55.95 58.98 2eec s SER 115 Cb -0.19 0.67 1.29 0.00 0.21 0.00 0.00 66.02 68.00 2eec s SER 115 CO 0.58 -0.42 1.96 1.55 0.41 0.00 0.00 173.24 177.32 2eec h PRO 116 N 3.36 0.00 0.00 12.44 0.13 -2.06 -3.45 132.00 142.43 2eec h PRO 116 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 2eec h PRO 116 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 2eec h PRO 116 CO 0.28 0.08 0.00 0.41 -0.23 0.00 0.00 178.00 178.53 2eec n GLY 117 N -0.03 1.38 3.33 1.56 0.00 -1.26 -5.13 105.19 105.03 2eec n GLY 117 Ca 0.00 0.46 -0.40 0.00 0.00 0.00 0.00 46.02 46.09 2eec n GLY 117 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2eec s SER 118 N 0.00 5.59 -0.12 1.61 0.15 -1.26 -5.06 113.70 114.61 2eec s SER 118 Ca 0.00 -1.12 -0.13 0.00 0.70 0.00 0.00 55.95 55.41 2eec s SER 118 Cb 0.00 -1.97 0.03 0.00 -1.71 0.00 0.00 66.02 62.37 2eec s SER 118 CO 0.00 -0.39 0.35 0.00 1.20 0.00 0.00 173.24 174.41 2eec s ALA 119 N 1.49 -0.88 -0.30 5.45 0.00 -1.26 -5.14 121.76 121.11 2eec s ALA 119 Ca 0.01 0.94 -0.11 0.00 0.00 0.00 0.00 51.96 52.79 2eec s ALA 119 Cb -0.20 -0.51 0.18 0.00 0.00 0.00 0.00 23.12 22.59 2eec s ALA 119 CO 0.05 -0.18 0.93 1.21 0.00 0.00 0.00 175.76 177.77 2eec s ASN 120 N 0.01 -0.70 -0.01 0.00 3.84 -1.26 -5.17 114.94 111.65 2eec s ASN 120 Ca -0.02 0.58 0.03 0.00 0.21 0.00 0.00 52.86 53.66 2eec s ASN 120 Cb -0.03 1.64 -0.01 0.00 -0.55 0.00 0.00 41.25 42.31 2eec s ASN 120 CO 0.01 -0.13 -0.11 -1.83 -2.79 0.00 0.00 177.10 172.25 2eec s GLU 121 N 2.79 0.97 0.24 0.43 -1.05 -1.26 -5.14 118.70 115.69 2eec s GLU 121 Ca 0.03 -0.40 -0.30 0.00 -0.15 0.00 0.00 54.97 54.16 2eec s GLU 121 Cb -0.10 -0.93 -0.09 0.00 -0.44 0.00 0.00 34.13 32.57 2eec s GLU 121 CO -0.15 0.22 0.94 -0.08 0.95 0.00 0.00 175.26 177.14 2eec s THR 122 N -0.16 4.06 0.39 1.83 -1.32 -1.26 -5.06 115.64 114.13 2eec s THR 122 Ca 0.02 2.07 0.03 0.00 -1.21 0.00 0.00 61.69 62.61 2eec s THR 122 Cb -0.06 -4.32 -0.01 0.00 -1.51 0.00 0.00 72.50 66.61 2eec s THR 122 CO -0.00 0.49 0.58 -0.94 -2.21 0.00 0.00 174.62 172.54 2eec s SER 123 N -1.16 5.93 0.37 8.08 1.04 -1.26 -5.12 113.70 121.59 2eec s SER 123 Ca 0.41 0.11 -0.10 0.00 0.48 0.00 0.00 55.95 56.85 2eec s SER 123 Cb -0.26 -1.47 0.04 0.00 0.10 0.00 0.00 66.02 64.43 2eec s SER 123 CO 0.32 -0.55 0.67 -1.54 0.98 0.00 0.00 173.24 173.12 2eec n SER 124 N -1.87 -1.94 0.00 7.02 3.41 -1.26 -5.37 113.62 113.61 2eec n SER 124 Ca -0.00 -2.68 0.10 0.00 -0.26 0.00 0.00 58.87 56.04 2eec n SER 124 Cb 0.58 3.33 0.62 0.00 -0.26 0.00 0.00 64.21 68.47 2eec n SER 124 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50