#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 -0.29 0.08 1.61 0.15 -1.26 -5.19 113.70 108.81 2eec s SER 2 Ca 0.00 -0.21 -0.26 0.00 0.70 0.00 0.00 55.95 56.18 2eec s SER 2 Cb 0.00 0.46 0.09 0.00 -1.71 0.00 0.00 66.02 64.86 2eec s SER 2 CO 0.00 -0.80 1.15 -0.55 1.20 0.00 0.00 173.24 174.24 2eec s SER 3 N -2.73 -0.04 0.00 5.45 0.15 -1.26 -5.19 113.70 110.08 2eec s SER 3 Ca 0.08 -0.39 0.00 0.00 0.70 0.00 0.00 55.95 56.34 2eec s SER 3 Cb -0.01 0.33 0.00 0.00 -1.71 0.00 0.00 66.02 64.62 2eec s SER 3 CO -0.04 -0.64 0.00 0.61 1.20 0.00 0.00 173.24 174.38 2eec n GLY 4 N -0.67 2.96 2.66 9.45 0.00 -1.26 -5.12 105.19 113.21 2eec n GLY 4 Ca -0.03 -1.12 -0.23 0.00 0.00 0.00 0.00 46.02 44.64 2eec n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2eec s SER 5 N 0.00 2.00 -0.22 1.61 0.15 -1.26 -5.13 113.70 110.85 2eec s SER 5 Ca 0.00 -0.49 -0.14 0.00 0.70 0.00 0.00 55.95 56.01 2eec s SER 5 Cb 0.00 0.01 -0.04 0.00 -1.71 0.00 0.00 66.02 64.28 2eec s SER 5 CO 0.00 -0.35 0.34 -0.44 1.20 0.00 0.00 173.24 173.99 2eec s SER 6 N 2.22 6.33 0.00 5.45 0.01 -1.26 -4.85 113.70 121.59 2eec s SER 6 Ca 0.04 0.38 0.00 0.00 1.31 0.00 0.00 55.95 57.68 2eec s SER 6 Cb -0.16 -2.20 0.00 0.00 0.21 0.00 0.00 66.02 63.87 2eec s SER 6 CO -0.12 -0.07 0.00 0.61 0.41 0.00 0.00 173.24 174.07 2eec n GLY 7 N 4.16 1.16 2.99 3.44 0.00 -1.26 -5.15 105.19 110.53 2eec n GLY 7 Ca -0.10 -0.31 -0.27 0.00 0.00 0.00 0.00 46.02 45.34 2eec n GLY 7 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2eec s PHE 8 N 0.00 1.73 -0.70 1.61 -0.71 -1.26 -5.08 117.98 113.56 2eec s PHE 8 Ca 0.00 -0.82 -0.26 0.00 -1.04 0.00 0.00 56.93 54.80 2eec s PHE 8 Cb 0.00 -1.31 -0.00 0.00 -1.21 0.00 0.00 43.02 40.50 2eec s PHE 8 CO 0.00 -0.48 1.65 0.15 -1.34 0.00 0.00 175.22 175.20 2eec s LYS 9 N 1.23 2.86 -0.03 1.99 1.02 -1.26 -4.95 119.74 120.61 2eec s LYS 9 Ca -0.03 0.15 0.00 0.00 0.02 0.00 0.00 55.97 56.11 2eec s LYS 9 Cb -0.14 -4.43 0.03 0.00 -0.52 0.00 0.00 37.83 32.76 2eec s LYS 9 CO -0.04 -2.57 0.01 0.08 -0.92 0.00 0.00 175.35 171.91 2eec s VAL 10 N 7.81 0.13 -0.35 3.17 1.01 -1.26 -5.12 120.40 125.79 2eec s VAL 10 Ca 0.55 0.13 -0.22 0.00 0.00 0.00 0.00 61.98 62.44 2eec s VAL 10 Cb -0.10 -0.24 0.01 0.00 0.00 0.00 0.00 36.38 36.05 2eec s VAL 10 CO 0.15 0.14 0.75 -0.13 0.00 0.00 0.00 175.10 176.01 2eec s ARG 11 N 1.11 3.77 -0.44 2.72 0.52 -1.26 -4.98 118.95 120.39 2eec s ARG 11 Ca -0.09 0.29 -0.31 0.00 -0.52 0.00 0.00 55.73 55.11 2eec s ARG 11 Cb -0.13 -3.79 -0.10 0.00 0.52 0.00 0.00 34.95 31.44 2eec s ARG 11 CO -0.02 -0.79 2.32 0.28 0.02 0.00 0.00 175.30 177.11 2eec n VAL 12 N 5.69 0.12 -3.08 3.52 0.31 -1.26 -4.90 118.33 118.73 2eec n VAL 12 Ca 0.02 -0.42 -0.42 0.00 -0.01 0.00 0.00 64.34 63.51 2eec n VAL 12 Cb 0.48 -1.99 -0.06 0.00 -0.91 0.00 0.00 33.84 31.35 2eec n VAL 12 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2eec s GLY 13 N 9.08 1.71 0.71 2.92 0.00 -1.26 -5.04 107.32 115.43 2eec s GLY 13 Ca 1.08 -1.01 -0.15 0.00 0.00 0.00 0.00 44.72 44.64 2eec s GLY 13 CO 0.40 1.57 1.18 -1.83 0.00 0.00 0.00 173.10 174.42 2eec s GLU 14 N 2.87 2.31 0.19 2.90 1.03 -1.26 -4.95 118.70 121.79 2eec s GLU 14 Ca 0.25 1.68 -0.05 0.00 0.03 0.00 0.00 54.97 56.87 2eec s GLU 14 Cb -0.14 -1.86 0.11 0.00 -0.80 0.00 0.00 34.13 31.44 2eec s GLU 14 CO 0.18 -1.68 1.54 -1.00 -1.33 0.00 0.00 175.26 172.96 2eec h PRO 15 N -0.18 0.71 -1.66 -4.83 0.13 -2.04 -3.48 132.00 120.64 2eec h PRO 15 Ca -0.47 -0.37 0.00 0.00 -0.87 0.00 0.00 66.00 64.28 2eec h PRO 15 Cb 1.28 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.43 2eec h PRO 15 CO 0.51 0.99 0.00 0.41 -0.23 0.00 0.00 178.00 179.68 2eec n GLY 16 N 0.07 0.21 3.09 1.56 0.00 -1.26 -5.11 105.19 103.75 2eec n GLY 16 Ca -0.02 -0.44 -0.23 0.00 0.00 0.00 0.00 46.02 45.33 2eec n GLY 16 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2eec s GLN 17 N -2.55 1.31 -0.46 1.61 -1.52 -1.26 -5.07 119.66 111.71 2eec s GLN 17 Ca 0.00 -0.49 -0.43 0.00 -1.95 0.00 0.00 55.36 52.49 2eec s GLN 17 Cb 0.00 -1.20 -0.18 0.00 -0.22 0.00 0.00 33.01 31.41 2eec s GLN 17 CO 0.00 0.24 2.01 0.00 -0.25 0.00 0.00 175.29 177.29 2eec n ALA 18 N 3.00 0.01 -0.49 6.09 0.00 -1.26 -4.26 120.51 123.60 2eec n ALA 18 Ca -0.16 0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2eec n ALA 18 Cb 0.54 -2.13 0.00 0.00 0.00 0.00 0.00 19.45 17.86 2eec n ALA 18 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2eec n GLY 19 N 6.40 -3.75 3.09 0.00 0.00 -1.26 -5.03 105.19 104.64 2eec n GLY 19 Ca 0.46 -0.84 -0.30 0.00 0.00 0.00 0.00 46.02 45.34 2eec n GLY 19 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2eec s ASN 20 N -1.36 2.62 0.07 1.61 2.47 -1.26 -5.00 114.94 114.09 2eec s ASN 20 Ca 0.00 -0.47 -0.18 0.00 0.42 0.00 0.00 52.86 52.63 2eec s ASN 20 Cb 0.00 -1.19 -0.12 0.00 -1.45 0.00 0.00 41.25 38.50 2eec s ASN 20 CO 0.00 0.04 1.38 1.55 -3.72 0.00 0.00 177.10 176.35 2eec h PRO 21 N 7.32 0.51 -0.99 0.43 0.13 -1.93 -3.22 132.00 134.26 2eec h PRO 21 Ca -0.31 -0.27 0.32 0.00 -0.87 0.00 0.00 66.00 64.88 2eec h PRO 21 Cb 1.18 0.01 -0.18 0.00 0.13 0.00 0.00 31.00 32.14 2eec h PRO 21 CO 0.50 0.85 0.23 0.00 -0.23 0.00 0.00 178.00 179.35 2eec h ALA 22 N 0.65 1.55 -0.93 -0.56 0.00 -1.94 1.11 119.26 119.15 2eec h ALA 22 Ca 0.03 0.31 0.02 0.00 0.00 0.00 0.00 54.91 55.27 2eec h ALA 22 Cb 0.75 0.48 -0.05 0.00 0.00 0.00 0.00 17.79 18.97 2eec h ALA 22 CO 0.05 -0.71 0.61 -0.07 0.00 0.00 0.00 179.25 179.14 2eec h LEU 23 N 0.02 1.05 -9.75 0.00 3.38 -1.94 -3.43 115.31 104.63 2eec h LEU 23 Ca 0.69 -0.02 -0.53 0.00 0.09 0.00 0.00 57.88 58.11 2eec h LEU 23 Cb 1.60 -0.26 0.06 0.00 0.09 0.00 0.00 40.66 42.16 2eec h LEU 23 CO -0.85 0.75 0.82 -0.69 0.09 0.00 0.00 178.44 178.55 2eec s VAL 24 N -6.12 2.44 0.13 1.22 1.01 0.38 -4.88 120.40 114.59 2eec s VAL 24 Ca -0.13 0.37 -0.00 0.00 0.00 0.00 0.00 61.98 62.21 2eec s VAL 24 Cb 0.17 -3.23 -0.04 0.00 0.00 0.00 0.00 36.38 33.28 2eec s VAL 24 CO 0.81 0.06 0.03 -0.55 0.00 0.00 0.00 175.10 175.44 2eec s SER 25 N 0.48 0.55 -0.06 3.32 0.15 -0.90 -4.45 113.70 112.79 2eec s SER 25 Ca 0.62 -1.16 0.03 0.00 0.70 0.00 0.00 55.95 56.13 2eec s SER 25 Cb -0.44 0.24 0.01 0.00 -1.71 0.00 0.00 66.02 64.12 2eec s SER 25 CO 0.44 -0.67 -0.14 0.00 1.20 0.00 0.00 173.24 174.07 2eec s ALA 26 N -3.94 1.35 0.11 5.45 0.00 -1.26 0.89 121.76 124.37 2eec s ALA 26 Ca 0.21 -0.51 -0.11 0.00 0.00 0.00 0.00 51.96 51.55 2eec s ALA 26 Cb 0.07 -0.55 0.01 0.00 0.00 0.00 0.00 23.12 22.65 2eec s ALA 26 CO 0.00 0.17 0.27 1.52 0.00 0.00 0.00 175.76 177.72 2eec s TYR 27 N 0.46 0.09 -4.67 0.00 1.13 -0.02 -4.97 117.35 109.36 2eec s TYR 27 Ca -0.11 -0.48 0.00 0.00 -1.41 0.00 0.00 57.07 55.07 2eec s TYR 27 Cb -0.14 0.04 0.00 0.00 -1.10 0.00 0.00 41.96 40.75 2eec s TYR 27 CO 0.03 -0.62 0.00 0.41 -2.51 0.00 0.00 175.55 172.86 2eec n GLY 28 N -0.14 -0.43 0.00 5.49 0.00 -1.26 0.73 105.19 109.59 2eec n GLY 28 Ca -0.14 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.08 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 8.40 0.00 0.12 2.61 -1.04 -1.24 -4.67 114.28 118.46 2eec n THR 29 Ca 0.00 -0.19 -0.01 0.00 -2.04 0.00 0.00 64.05 61.81 2eec n THR 29 Cb 0.00 0.69 0.24 0.00 -1.82 0.00 0.00 70.33 69.43 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 0.00 0.16 2.00 3.41 0.00 -1.87 -2.84 103.07 103.92 2eec h GLY 30 Ca 0.00 -0.16 -0.08 0.00 0.00 0.00 0.00 47.33 47.10 2eec h GLY 30 CO 0.00 0.14 -0.36 1.41 0.00 0.00 0.00 176.54 177.73 2eec h LEU 31 N 0.12 0.00 -1.85 3.11 3.38 -1.93 -2.90 115.31 115.23 2eec h LEU 31 Ca 0.01 0.00 0.21 0.00 0.09 0.00 0.00 57.88 58.19 2eec h LEU 31 Cb 0.85 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.57 2eec h LEU 31 CO 0.07 0.36 0.67 -0.33 0.09 0.00 0.00 178.44 179.30 2eec h GLU 32 N 0.00 0.00 0.00 1.13 5.08 -1.79 -3.46 114.58 115.55 2eec h GLU 32 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2eec h GLU 32 Cb 0.75 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.00 2eec h GLU 32 CO 0.05 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.47 2eec n GLY 33 N -1.61 -0.31 3.40 -3.84 0.00 -1.10 -4.96 105.19 96.79 2eec n GLY 33 Ca 0.15 -1.20 -0.44 0.00 0.00 0.00 0.00 46.02 44.53 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 1.90 -0.51 -0.02 0.00 -0.70 -4.79 107.32 103.20 2eec s GLY 34 Ca 0.00 -2.00 -0.17 0.00 0.00 0.00 0.00 44.72 42.55 2eec s GLY 34 CO 0.00 1.32 0.51 -1.59 0.00 0.00 0.00 173.10 173.34 2eec s THR 35 N 2.21 5.08 0.24 0.90 2.01 -1.26 -2.61 115.64 122.20 2eec s THR 35 Ca 0.10 -0.96 -0.30 0.00 0.31 0.00 0.00 61.69 60.84 2eec s THR 35 Cb -0.23 -4.25 -0.09 0.00 0.01 0.00 0.00 72.50 67.95 2eec s THR 35 CO 0.09 -0.75 1.12 -0.89 -0.69 0.00 0.00 174.62 173.50 2eec s THR 36 N 2.04 3.57 0.00 -0.82 2.01 -1.26 -3.11 115.64 118.06 2eec s THR 36 Ca 0.08 1.47 0.00 0.00 0.31 0.00 0.00 61.69 63.55 2eec s THR 36 Cb -0.24 -3.94 0.00 0.00 0.01 0.00 0.00 72.50 68.34 2eec s THR 36 CO 0.08 0.31 0.00 0.61 -0.69 0.00 0.00 174.62 174.92 2eec n GLY 37 N 1.57 3.08 3.80 4.40 0.00 -1.26 -4.94 105.19 111.84 2eec n GLY 37 Ca 0.01 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.81 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 -1.90 4.34 -0.24 -0.61 1.01 -1.18 -5.11 121.20 117.51 2eec s ILE 38 Ca 0.00 -1.45 -0.04 0.00 0.00 0.00 0.00 60.65 59.17 2eec s ILE 38 Cb 0.00 -3.34 0.00 0.00 0.01 0.00 0.00 42.46 39.13 2eec s ILE 38 CO 0.00 -0.34 -0.03 -1.58 0.00 0.00 0.00 174.94 172.99 2eec s GLN 39 N -3.79 3.23 0.27 2.79 0.74 -1.26 -4.64 119.66 117.00 2eec s GLN 39 Ca 0.33 -0.73 0.07 0.00 0.05 0.00 0.00 55.36 55.08 2eec s GLN 39 Cb -0.08 -3.05 -0.03 0.00 1.10 0.00 0.00 33.01 30.95 2eec s GLN 39 CO 0.24 -0.27 0.23 -1.12 -0.55 0.00 0.00 175.29 173.82 2eec s SER 40 N 1.45 5.50 -0.07 6.67 0.01 -1.26 -5.02 113.70 120.98 2eec s SER 40 Ca 0.04 -0.30 -0.04 0.00 1.31 0.00 0.00 55.95 56.96 2eec s SER 40 Cb -0.15 -1.31 0.03 0.00 0.21 0.00 0.00 66.02 64.80 2eec s SER 40 CO -0.03 -0.12 0.16 -1.83 0.41 0.00 0.00 173.24 171.83 2eec s GLU 41 N -3.89 0.14 -0.05 12.44 1.03 -1.26 -3.56 118.70 123.55 2eec s GLU 41 Ca 0.35 0.33 0.06 0.00 0.03 0.00 0.00 54.97 55.74 2eec s GLU 41 Cb -0.07 -0.07 -0.01 0.00 -0.80 0.00 0.00 34.13 33.17 2eec s GLU 41 CO 0.26 -0.11 -0.22 -0.59 -1.33 0.00 0.00 175.26 173.27 2eec s PHE 42 N 0.77 2.11 0.10 4.83 -0.12 -1.15 -3.63 117.98 120.90 2eec s PHE 42 Ca -0.06 -0.59 -0.11 0.00 -0.05 0.00 0.00 56.93 56.12 2eec s PHE 42 Cb -0.07 -1.39 -0.06 0.00 -0.63 0.00 0.00 43.02 40.87 2eec s PHE 42 CO -0.04 -0.17 0.45 -0.06 -0.05 0.00 0.00 175.22 175.35 2eec s PHE 43 N -0.15 3.59 -0.26 3.49 0.08 0.22 -3.15 117.98 121.80 2eec s PHE 43 Ca -0.02 0.88 -0.06 0.00 0.12 0.00 0.00 56.93 57.85 2eec s PHE 43 Cb -0.12 -2.23 -0.01 0.00 -0.57 0.00 0.00 43.02 40.09 2eec s PHE 43 CO 0.02 0.48 0.04 0.42 -0.10 0.00 0.00 175.22 176.09 2eec s ILE 44 N -1.43 3.91 -1.09 0.64 1.01 -1.25 -0.84 121.20 122.14 2eec s ILE 44 Ca 0.35 -0.46 -0.23 0.00 0.00 0.00 0.00 60.65 60.31 2eec s ILE 44 Cb -0.14 -2.88 -0.07 0.00 0.01 0.00 0.00 42.46 39.38 2eec s ILE 44 CO 0.18 0.27 1.93 0.21 0.00 0.00 0.00 174.94 177.53 2eec s ASN 45 N 1.53 5.13 -0.34 3.58 3.84 0.26 -4.55 114.94 124.39 2eec s ASN 45 Ca 0.05 -1.36 0.13 0.00 0.21 0.00 0.00 52.86 51.89 2eec s ASN 45 Cb -0.16 -2.58 0.46 0.00 -0.55 0.00 0.00 41.25 38.42 2eec s ASN 45 CO 0.01 -2.91 1.07 1.07 -2.79 0.00 0.00 177.10 173.56 2eec n THR 46 N 7.78 1.73 -0.09 -5.21 5.66 -1.26 -2.11 114.28 120.78 2eec n THR 46 Ca 0.43 -3.79 -0.10 0.00 -3.05 0.00 0.00 64.05 57.54 2eec n THR 46 Cb 0.47 -0.10 -0.10 0.00 -1.55 0.00 0.00 70.33 69.04 2eec n THR 46 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 2eec n THR 47 N -0.41 1.06 1.32 1.09 -2.24 -1.26 -4.42 114.28 109.42 2eec n THR 47 Ca 0.24 -0.53 0.13 0.00 -2.27 0.00 0.00 64.05 61.62 2eec n THR 47 Cb 0.80 -0.90 0.41 0.00 -2.10 0.00 0.00 70.33 68.53 2eec n THR 47 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 2eec n ARG 48 N -2.81 1.18 0.05 -0.78 1.85 -1.26 -4.03 116.66 110.86 2eec n ARG 48 Ca -0.29 -0.72 -0.22 0.00 -1.00 0.00 0.00 57.85 55.62 2eec n ARG 48 Cb 0.92 -1.49 -0.15 0.00 -1.05 0.00 0.00 32.46 30.70 2eec n ARG 48 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2eec h ALA 49 N 3.95 0.06 0.00 2.89 0.00 -1.88 -3.51 119.26 120.77 2eec h ALA 49 Ca 0.00 -0.98 0.00 0.00 0.00 0.00 0.00 54.91 53.93 2eec h ALA 49 Cb 0.53 0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2eec h ALA 49 CO 0.00 0.75 0.00 0.41 0.00 0.00 0.00 179.25 180.41 2eec n GLY 50 N 1.75 1.13 3.59 0.00 0.00 -1.26 -4.56 105.19 105.85 2eec n GLY 50 Ca -0.21 -0.38 -0.30 0.00 0.00 0.00 0.00 46.02 45.13 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 0.00 -1.24 -0.20 1.61 0.04 -1.26 -4.90 135.00 129.05 2eec s PRO 51 Ca 0.00 -0.07 0.24 0.00 0.04 0.00 0.00 61.00 61.21 2eec s PRO 51 Cb 0.00 -1.59 0.49 0.00 0.04 0.00 0.00 34.50 33.43 2eec s PRO 51 CO 0.00 -3.72 1.13 0.41 0.04 0.00 0.00 177.00 174.86 2eec n GLY 52 N -0.95 1.63 2.94 0.56 0.00 -1.26 -4.82 105.19 103.29 2eec n GLY 52 Ca 0.13 -1.02 -0.31 0.00 0.00 0.00 0.00 46.02 44.82 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 -2.88 1.70 0.25 2.61 2.01 -1.26 -4.94 115.64 113.12 2eec s THR 53 Ca 0.29 -1.61 0.06 0.00 0.31 0.00 0.00 61.69 60.75 2eec s THR 53 Cb 0.34 -2.07 -0.05 0.00 0.01 0.00 0.00 72.50 70.72 2eec s THR 53 CO -0.07 -0.33 -0.08 -1.48 -0.69 0.00 0.00 174.62 171.97 2eec s LEU 54 N 1.26 2.47 -0.49 4.42 -0.00 -1.26 -4.56 118.68 120.52 2eec s LEU 54 Ca 0.01 -1.14 -0.10 0.00 -0.00 0.00 0.00 54.13 52.90 2eec s LEU 54 Cb -0.19 -0.59 0.12 0.00 -0.00 0.00 0.00 46.19 45.53 2eec s LEU 54 CO -0.10 -0.31 0.38 -0.55 -0.00 0.00 0.00 176.35 175.77 2eec s SER 55 N -3.38 5.80 -0.22 1.48 0.15 -0.31 -4.97 113.70 112.26 2eec s SER 55 Ca 0.27 -1.92 -0.10 0.00 0.70 0.00 0.00 55.95 54.90 2eec s SER 55 Cb 0.03 -2.05 -0.05 0.00 -1.71 0.00 0.00 66.02 62.24 2eec s SER 55 CO 0.10 -0.72 0.14 0.54 1.20 0.00 0.00 173.24 174.50 2eec s VAL 56 N 1.37 5.35 0.00 4.45 0.11 -1.26 -2.39 120.40 128.03 2eec s VAL 56 Ca 0.06 0.17 0.01 0.00 -2.93 0.00 0.00 61.98 59.29 2eec s VAL 56 Cb -0.27 -3.46 -0.00 0.00 -1.53 0.00 0.00 36.38 31.12 2eec s VAL 56 CO -0.00 0.40 -0.03 -0.89 -3.33 0.00 0.00 175.10 171.25 2eec s THR 57 N 0.67 0.20 0.08 5.04 2.01 -0.99 -5.04 115.64 117.60 2eec s THR 57 Ca 0.08 -0.18 0.07 0.00 0.31 0.00 0.00 61.69 61.97 2eec s THR 57 Cb -0.12 -0.19 -0.04 0.00 0.01 0.00 0.00 72.50 72.16 2eec s THR 57 CO 0.01 0.01 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.18 2eec s ILE 58 N -0.17 3.08 -0.06 1.82 1.01 -1.26 -2.01 121.20 123.61 2eec s ILE 58 Ca -0.00 -1.25 0.02 0.00 0.00 0.00 0.00 60.65 59.41 2eec s ILE 58 Cb -0.02 -2.38 0.02 0.00 0.01 0.00 0.00 42.46 40.09 2eec s ILE 58 CO -0.00 0.21 -0.09 -0.70 0.00 0.00 0.00 174.94 174.35 2eec s GLU 59 N -1.87 1.41 0.13 2.79 -6.30 -0.04 -4.95 118.70 109.88 2eec s GLU 59 Ca 0.18 -0.30 -0.15 0.00 -2.50 0.00 0.00 54.97 52.20 2eec s GLU 59 Cb -0.11 -1.24 0.05 0.00 0.00 0.00 0.00 34.13 32.84 2eec s GLU 59 CO 0.09 -0.03 0.72 0.41 0.02 0.00 0.00 175.26 176.47 2eec n GLY 60 N 3.97 0.83 0.09 -1.50 0.00 -1.26 0.73 105.19 108.05 2eec n GLY 60 Ca -0.23 -1.08 -0.13 0.00 0.00 0.00 0.00 46.02 44.58 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 0.18 -6.18 1.61 0.13 -1.91 -3.46 132.00 122.37 2eec h PRO 61 Ca -0.19 -0.09 -0.52 0.00 -0.87 0.00 0.00 66.00 64.33 2eec h PRO 61 Cb 0.84 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.91 2eec h PRO 61 CO 0.26 0.61 -0.53 -1.12 -0.23 0.00 0.00 178.00 176.99 2eec s SER 62 N -5.90 5.13 0.55 1.44 0.01 -1.26 -5.11 113.70 108.55 2eec s SER 62 Ca -0.15 -0.48 -0.18 0.00 1.31 0.00 0.00 55.95 56.44 2eec s SER 62 Cb 0.03 -1.06 -0.06 0.00 0.21 0.00 0.00 66.02 65.14 2eec s SER 62 CO 0.71 -0.16 1.07 -0.75 0.41 0.00 0.00 173.24 174.52 2eec s LYS 63 N -3.85 3.46 -0.40 12.44 2.47 -1.26 -4.97 119.74 127.62 2eec s LYS 63 Ca 0.36 1.38 0.01 0.00 -1.56 0.00 0.00 55.97 56.16 2eec s LYS 63 Cb -0.06 -2.04 0.14 0.00 -1.46 0.00 0.00 37.83 34.41 2eec s LYS 63 CO 0.24 -0.72 0.23 0.14 0.16 0.00 0.00 175.35 175.40 2eec s VAL 64 N -2.10 0.90 0.30 4.02 -7.23 -1.26 -4.24 120.40 110.79 2eec s VAL 64 Ca 0.68 -2.22 -0.18 0.00 -1.81 0.00 0.00 61.98 58.44 2eec s VAL 64 Cb -0.18 -1.64 -0.13 0.00 0.56 0.00 0.00 36.38 34.99 2eec s VAL 64 CO 0.29 -0.93 0.14 2.29 -0.31 0.00 0.00 175.10 176.57 2eec n LYS 65 N 3.74 0.00 -3.80 4.82 0.00 -1.26 -4.73 118.16 116.93 2eec n LYS 65 Ca 0.10 0.00 -0.26 0.00 -0.00 0.00 0.00 58.31 58.15 2eec n LYS 65 Cb 0.36 -0.82 -0.17 0.00 -0.00 0.00 0.00 35.03 34.40 2eec n LYS 65 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.40 175.76 2eec s MET 66 N -0.82 0.87 0.24 -1.58 -1.94 -1.26 -4.09 119.30 110.72 2eec s MET 66 Ca 0.49 -0.21 -0.02 0.00 -1.71 0.00 0.00 55.69 54.24 2eec s MET 66 Cb -0.57 -1.58 0.26 0.00 2.01 0.00 0.00 34.83 34.95 2eec s MET 66 CO 0.50 -0.43 1.67 0.22 -0.01 0.00 0.00 175.02 176.97 2eec h ASP 67 N 8.25 0.70 -5.89 3.03 1.82 -1.93 -3.47 116.42 118.93 2eec h ASP 67 Ca -0.20 -0.24 -0.39 0.00 -0.39 0.00 0.00 57.03 55.81 2eec h ASP 67 Cb 1.12 -0.19 0.11 0.00 0.68 0.00 0.00 39.33 41.05 2eec h ASP 67 CO 0.32 0.90 -0.77 0.00 -1.61 0.00 0.00 179.24 178.08 2eec s GLN 69 N -5.85 4.77 -0.13 0.00 2.00 -1.24 -5.04 119.66 114.18 2eec s GLN 69 Ca 0.16 1.51 -0.06 0.00 -2.00 0.00 0.00 55.36 54.97 2eec s GLN 69 Cb -0.08 -3.31 -0.04 0.00 0.80 0.00 0.00 33.01 30.39 2eec s GLN 69 CO 0.77 0.36 0.11 -2.00 -0.50 0.00 0.00 175.29 174.02 2eec s GLU 70 N -0.72 3.47 0.25 1.67 2.12 -1.26 -2.85 118.70 121.38 2eec s GLU 70 Ca 0.44 -0.21 0.10 0.00 0.36 0.00 0.00 54.97 55.66 2eec s GLU 70 Cb -0.26 -3.14 -0.05 0.00 0.26 0.00 0.00 34.13 30.95 2eec s GLU 70 CO 0.32 0.67 -0.10 0.95 -0.54 0.00 0.00 175.26 176.56 2eec s THR 71 N -0.74 2.99 -0.63 -1.70 -4.23 -1.26 -4.89 115.64 105.18 2eec s THR 71 Ca 0.13 -2.04 0.21 0.00 -1.18 0.00 0.00 61.69 58.81 2eec s THR 71 Cb -0.12 -2.56 0.21 0.00 1.34 0.00 0.00 72.50 71.37 2eec s THR 71 CO 0.03 -0.31 1.63 -0.81 -0.54 0.00 0.00 174.62 174.62 2eec n PRO 72 N -0.54 0.14 -0.10 3.99 -0.04 -1.26 -3.39 135.00 133.80 2eec n PRO 72 Ca -0.07 0.38 -0.17 0.00 -0.04 0.00 0.00 63.50 63.59 2eec n PRO 72 Cb 0.58 -1.76 -0.08 0.00 -0.04 0.00 0.00 33.50 32.20 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 -2.02 0.53 0.00 0.54 4.07 -1.26 -5.06 120.64 117.45 2eec n GLU 73 Ca 0.02 0.52 0.00 0.00 -0.06 0.00 0.00 57.16 57.64 2eec n GLU 73 Cb 0.21 -1.69 0.00 0.00 -0.06 0.00 0.00 31.44 29.89 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 1.47 -0.53 3.20 8.31 0.00 -1.22 -4.65 105.19 111.76 2eec n GLY 74 Ca -0.26 0.35 0.04 0.00 0.00 0.00 0.00 46.02 46.15 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 0.04 -0.78 0.17 1.61 5.04 -1.26 -4.14 117.35 118.02 2eec s TYR 75 Ca 0.00 0.92 -0.19 0.00 -2.44 0.00 0.00 57.07 55.36 2eec s TYR 75 Cb 0.00 0.31 -0.08 0.00 0.35 0.00 0.00 41.96 42.54 2eec s TYR 75 CO 0.00 -0.42 0.65 0.21 -1.34 0.00 0.00 175.55 174.65 2eec s LYS 76 N 2.84 4.19 -0.01 4.97 2.20 -1.13 -3.82 119.74 128.98 2eec s LYS 76 Ca 0.03 0.76 0.07 0.00 -0.36 0.00 0.00 55.97 56.47 2eec s LYS 76 Cb -0.11 -2.99 -0.02 0.00 -1.51 0.00 0.00 37.83 33.21 2eec s LYS 76 CO -0.14 0.48 -0.22 0.08 -0.36 0.00 0.00 175.35 175.18 2eec s VAL 77 N -1.40 1.76 -0.02 4.02 1.01 -1.19 -3.66 120.40 120.92 2eec s VAL 77 Ca 0.38 -0.97 0.01 0.00 0.00 0.00 0.00 61.98 61.40 2eec s VAL 77 Cb -0.17 -1.46 0.01 0.00 0.00 0.00 0.00 36.38 34.76 2eec s VAL 77 CO 0.21 0.48 -0.03 -0.04 0.00 0.00 0.00 175.10 175.71 2eec s MET 78 N -0.57 0.50 -0.27 2.72 -1.94 -1.26 -2.91 119.30 115.57 2eec s MET 78 Ca 0.09 -0.07 -0.19 0.00 -1.71 0.00 0.00 55.69 53.80 2eec s MET 78 Cb -0.09 -0.56 0.07 0.00 2.01 0.00 0.00 34.83 36.27 2eec s MET 78 CO -0.01 -0.03 0.68 1.52 -0.01 0.00 0.00 175.02 177.17 2eec s TYR 79 N 0.57 -0.91 -0.20 -0.03 -0.85 -1.23 -3.38 117.35 111.32 2eec s TYR 79 Ca -0.06 1.97 0.01 0.00 -0.52 0.00 0.00 57.07 58.47 2eec s TYR 79 Cb -0.10 0.46 0.03 0.00 0.38 0.00 0.00 41.96 42.73 2eec s TYR 79 CO -0.01 -0.45 -0.16 0.99 -1.52 0.00 0.00 175.55 174.40 2eec s THR 80 N 1.08 2.02 -0.90 -3.49 2.01 -1.26 -4.05 115.64 111.05 2eec s THR 80 Ca -0.06 -1.11 -0.25 0.00 0.31 0.00 0.00 61.69 60.59 2eec s THR 80 Cb -0.05 -1.93 -0.05 0.00 0.01 0.00 0.00 72.50 70.48 2eec s THR 80 CO -0.11 0.35 1.95 -2.16 -0.69 0.00 0.00 174.62 173.96 2eec s PRO 81 N 1.26 2.55 0.53 4.92 0.04 -1.26 -4.48 135.00 138.56 2eec s PRO 81 Ca 0.01 -0.27 0.36 0.00 0.04 0.00 0.00 61.00 61.13 2eec s PRO 81 Cb -0.15 -5.05 1.52 0.00 0.04 0.00 0.00 34.50 30.86 2eec s PRO 81 CO -0.10 -3.37 1.79 1.98 0.04 0.00 0.00 177.00 177.34 2eec h MET 82 N 11.35 0.03 -4.75 4.56 4.05 -1.94 -3.39 114.93 124.84 2eec h MET 82 Ca 0.09 -0.00 -0.31 0.00 -0.28 0.00 0.00 59.70 59.20 2eec h MET 82 Cb 1.01 -0.01 -0.21 0.00 -0.80 0.00 0.00 31.60 31.59 2eec h MET 82 CO 1.21 0.02 -0.74 0.00 0.23 0.00 0.00 176.91 177.63 2eec s ALA 83 N -4.99 0.72 1.06 0.39 0.00 -1.26 -3.94 121.76 113.74 2eec s ALA 83 Ca -0.05 -0.83 -0.14 0.00 0.00 0.00 0.00 51.96 50.94 2eec s ALA 83 Cb 0.23 0.01 0.22 0.00 0.00 0.00 0.00 23.12 23.59 2eec s ALA 83 CO 0.81 0.02 1.10 -1.25 0.00 0.00 0.00 175.76 176.44 2eec s PRO 84 N -1.64 -0.11 0.00 0.00 0.04 -1.26 -4.84 135.00 127.19 2eec s PRO 84 Ca -0.08 0.33 0.00 0.00 0.04 0.00 0.00 61.00 61.29 2eec s PRO 84 Cb -0.10 -1.69 0.00 0.00 0.04 0.00 0.00 34.50 32.75 2eec s PRO 84 CO 0.01 -3.05 0.00 0.41 0.04 0.00 0.00 177.00 174.40 2eec n GLY 85 N -1.03 0.94 3.15 0.56 0.00 -1.01 -4.86 105.19 102.93 2eec n GLY 85 Ca 0.07 -1.86 -0.34 0.00 0.00 0.00 0.00 46.02 43.89 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 4.51 0.34 1.61 4.22 -1.26 -0.48 114.94 119.88 2eec s ASN 86 Ca 0.00 -1.14 0.07 0.00 -2.14 0.00 0.00 52.86 49.65 2eec s ASN 86 Cb 0.00 -1.65 -0.03 0.00 1.28 0.00 0.00 41.25 40.86 2eec s ASN 86 CO 0.00 -0.19 0.31 -0.31 -2.04 0.00 0.00 177.10 174.88 2eec s TYR 87 N 1.24 2.90 -0.06 1.54 1.51 -1.02 -4.49 117.35 118.96 2eec s TYR 87 Ca -0.04 -0.31 0.00 0.00 -1.01 0.00 0.00 57.07 55.71 2eec s TYR 87 Cb -0.18 -1.84 0.02 0.00 -0.11 0.00 0.00 41.96 39.84 2eec s TYR 87 CO -0.04 0.14 -0.04 -1.17 -1.11 0.00 0.00 175.55 173.34 2eec s LEU 88 N -4.02 1.10 -0.26 -1.29 2.96 0.22 -2.57 118.68 114.82 2eec s LEU 88 Ca 0.42 -0.15 -0.07 0.00 -0.22 0.00 0.00 54.13 54.10 2eec s LEU 88 Cb -0.06 -0.53 -0.02 0.00 0.50 0.00 0.00 46.19 46.09 2eec s LEU 88 CO 0.27 -0.10 0.08 -0.63 -1.32 0.00 0.00 176.35 174.65 2eec s ILE 89 N 1.34 4.27 -0.12 6.68 1.01 -0.66 -0.86 121.20 132.87 2eec s ILE 89 Ca -0.04 -0.29 0.02 0.00 0.00 0.00 0.00 60.65 60.34 2eec s ILE 89 Cb -0.14 -3.05 -0.01 0.00 0.01 0.00 0.00 42.46 39.28 2eec s ILE 89 CO -0.02 0.27 -0.19 -0.44 0.00 0.00 0.00 174.94 174.56 2eec s SER 90 N 1.59 3.53 -0.16 3.58 0.01 -0.85 -0.66 113.70 120.74 2eec s SER 90 Ca 0.06 -0.46 0.01 0.00 1.31 0.00 0.00 55.95 56.87 2eec s SER 90 Cb -0.16 -1.51 0.01 0.00 0.21 0.00 0.00 66.02 64.57 2eec s SER 90 CO 0.04 0.15 -0.18 -0.69 0.41 0.00 0.00 173.24 172.96 2eec s VAL 91 N 0.41 2.33 -0.06 3.43 1.01 -1.26 -2.36 120.40 123.90 2eec s VAL 91 Ca -0.14 -0.88 0.05 0.00 0.00 0.00 0.00 61.98 61.02 2eec s VAL 91 Cb -0.17 -1.97 -0.02 0.00 0.00 0.00 0.00 36.38 34.23 2eec s VAL 91 CO 0.06 0.53 -0.22 -0.54 0.00 0.00 0.00 175.10 174.93 2eec s LYS 92 N 0.95 2.55 -0.02 2.72 1.02 -1.01 -3.15 119.74 122.81 2eec s LYS 92 Ca -0.03 -0.85 -0.00 0.00 0.02 0.00 0.00 55.97 55.11 2eec s LYS 92 Cb -0.15 -2.23 0.02 0.00 -0.52 0.00 0.00 37.83 34.96 2eec s LYS 92 CO -0.04 0.44 0.03 -0.47 -0.92 0.00 0.00 175.35 174.39 2eec s TYR 93 N -0.30 0.02 -0.92 3.18 6.14 -1.07 -1.16 117.35 123.23 2eec s TYR 93 Ca 0.01 0.11 -0.04 0.00 0.64 0.00 0.00 57.07 57.79 2eec s TYR 93 Cb -0.13 -0.18 0.00 0.00 0.42 0.00 0.00 41.96 42.08 2eec s TYR 93 CO 0.02 -0.07 0.79 0.41 0.64 0.00 0.00 175.55 177.34 2eec n GLY 94 N 3.92 -0.11 0.00 8.97 0.00 -1.26 -4.55 105.19 112.16 2eec n GLY 94 Ca -0.24 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.74 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 -1.40 -0.81 0.22 -0.02 0.00 -1.26 -4.56 105.19 97.37 2eec n GLY 95 Ca -0.07 -2.14 0.15 0.00 0.00 0.00 0.00 46.02 43.97 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 0.16 0.00 -6.55 1.61 0.13 -1.97 -3.45 132.00 121.92 2eec h PRO 96 Ca 0.00 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.61 2eec h PRO 96 Cb 0.00 0.00 0.04 0.00 0.13 0.00 0.00 31.00 31.17 2eec h PRO 96 CO 0.00 0.00 1.05 -0.80 -0.23 0.00 0.00 178.00 178.02 2eec s ASN 97 N -5.10 6.44 0.49 1.44 0.01 -1.26 -4.89 114.94 112.07 2eec s ASN 97 Ca 0.02 2.75 -0.00 0.00 -0.71 0.00 0.00 52.86 54.92 2eec s ASN 97 Cb 0.09 -2.58 0.01 0.00 0.41 0.00 0.00 41.25 39.18 2eec s ASN 97 CO 0.48 -0.97 0.72 -1.38 -1.51 0.00 0.00 177.10 174.44 2eec s HIS 98 N 2.15 3.13 0.50 2.20 -3.43 -1.26 -2.61 115.29 115.96 2eec s HIS 98 Ca 0.77 0.21 0.02 0.00 -0.80 0.00 0.00 55.06 55.26 2eec s HIS 98 Cb -0.46 -2.47 0.02 0.00 -1.43 0.00 0.00 32.58 28.23 2eec s HIS 98 CO 0.34 -0.54 0.72 0.96 -2.00 0.00 0.00 174.74 174.22 2eec s ILE 99 N -2.65 3.17 0.45 -5.38 -4.36 -1.19 -4.74 121.20 106.50 2eec s ILE 99 Ca 0.51 -0.65 -0.25 0.00 -0.26 0.00 0.00 60.65 60.01 2eec s ILE 99 Cb -0.10 -3.17 -0.08 0.00 1.25 0.00 0.00 42.46 40.36 2eec s ILE 99 CO 0.39 -0.11 1.34 -0.69 0.24 0.00 0.00 174.94 176.10 2eec s VAL 100 N -2.64 2.40 0.00 8.37 1.01 -1.26 -2.90 120.40 125.37 2eec s VAL 100 Ca 0.54 0.34 0.00 0.00 0.00 0.00 0.00 61.98 62.86 2eec s VAL 100 Cb -0.10 -3.19 0.00 0.00 0.00 0.00 0.00 36.38 33.09 2eec s VAL 100 CO 0.38 0.03 0.00 0.61 0.00 0.00 0.00 175.10 176.12 2eec n GLY 101 N 0.63 2.44 3.82 4.51 0.00 -1.26 -4.79 105.19 110.54 2eec n GLY 101 Ca 0.06 -0.59 -0.33 0.00 0.00 0.00 0.00 46.02 45.16 2eec n GLY 101 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2eec s SER 102 N 0.00 6.73 1.24 1.61 1.04 -1.14 -4.34 113.70 118.84 2eec s SER 102 Ca 0.00 1.69 -0.20 0.00 0.48 0.00 0.00 55.95 57.91 2eec s SER 102 Cb 0.00 -2.53 0.30 0.00 0.10 0.00 0.00 66.02 63.89 2eec s SER 102 CO 0.00 -0.51 1.06 -0.81 0.98 0.00 0.00 173.24 173.96 2eec n PRO 103 N -1.02 -3.10 -3.90 4.02 -0.04 -1.26 -4.82 135.00 124.87 2eec n PRO 103 Ca 0.07 -1.70 -0.28 0.00 -0.04 0.00 0.00 63.50 61.55 2eec n PRO 103 Cb 0.54 -1.60 -0.16 0.00 -0.04 0.00 0.00 33.50 32.24 2eec n PRO 103 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2eec s PHE 104 N -2.93 1.75 -0.64 0.54 0.08 0.16 -4.96 117.98 111.98 2eec s PHE 104 Ca 0.69 -1.09 -0.22 0.00 0.12 0.00 0.00 56.93 56.44 2eec s PHE 104 Cb -0.07 -1.34 0.07 0.00 -0.57 0.00 0.00 43.02 41.12 2eec s PHE 104 CO 0.53 -0.62 0.93 0.15 -0.10 0.00 0.00 175.22 176.11 2eec s LYS 105 N 1.62 3.11 0.00 0.44 1.02 -1.26 -1.65 119.74 123.02 2eec s LYS 105 Ca 0.01 -0.88 -0.03 0.00 0.02 0.00 0.00 55.97 55.09 2eec s LYS 105 Cb -0.15 -4.23 -0.04 0.00 -0.52 0.00 0.00 37.83 32.89 2eec s LYS 105 CO -0.08 -1.76 0.21 0.00 -0.92 0.00 0.00 175.35 172.80 2eec s ALA 106 N 3.86 3.93 -0.22 5.17 0.00 -1.06 -5.02 121.76 128.42 2eec s ALA 106 Ca 0.21 -0.72 -0.02 0.00 0.00 0.00 0.00 51.96 51.43 2eec s ALA 106 Cb -0.18 -1.93 0.01 0.00 0.00 0.00 0.00 23.12 21.03 2eec s ALA 106 CO 0.10 0.73 -0.08 0.21 0.00 0.00 0.00 175.76 176.72 2eec s LYS 107 N -1.95 3.06 -0.15 0.00 2.20 -1.26 -2.44 119.74 119.19 2eec s LYS 107 Ca 0.28 -0.82 -0.15 0.00 -0.36 0.00 0.00 55.97 54.91 2eec s LYS 107 Cb -0.13 -2.91 -0.04 0.00 -1.51 0.00 0.00 37.83 33.24 2eec s LYS 107 CO 0.19 -0.29 0.36 0.08 -0.36 0.00 0.00 175.35 175.33 2eec s VAL 108 N 1.37 5.26 0.04 4.02 1.01 0.37 -1.72 120.40 130.75 2eec s VAL 108 Ca 0.03 0.70 0.01 0.00 0.00 0.00 0.00 61.98 62.72 2eec s VAL 108 Cb -0.15 -3.70 -0.03 0.00 0.00 0.00 0.00 36.38 32.50 2eec s VAL 108 CO -0.06 0.36 -0.05 0.42 0.00 0.00 0.00 175.10 175.78 2eec s THR 109 N 0.55 0.32 -2.54 3.92 -4.23 -1.07 -2.42 115.64 110.17 2eec s THR 109 Ca 0.20 -1.24 0.00 0.00 -1.18 0.00 0.00 61.69 59.47 2eec s THR 109 Cb -0.14 -0.75 0.00 0.00 1.34 0.00 0.00 72.50 72.95 2eec s THR 109 CO 0.06 -0.60 0.00 0.61 -0.54 0.00 0.00 174.62 174.15 2eec n GLY 110 N 1.10 0.17 3.27 3.99 0.00 -1.26 -4.38 105.19 108.09 2eec n GLY 110 Ca -0.20 -1.11 -0.34 0.00 0.00 0.00 0.00 46.02 44.36 2eec n GLY 110 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2eec s GLN 111 N -2.00 3.29 0.38 1.61 -1.52 -1.26 -5.03 119.66 115.13 2eec s GLN 111 Ca 0.00 -0.67 -0.24 0.00 -1.95 0.00 0.00 55.36 52.49 2eec s GLN 111 Cb 0.00 -2.88 -0.13 0.00 -0.22 0.00 0.00 33.01 29.78 2eec s GLN 111 CO 0.00 -0.17 0.68 -2.13 -0.25 0.00 0.00 175.29 173.42 2eec n ARG 112 N 4.67 0.74 -4.04 2.91 0.63 -1.26 -4.95 116.66 115.36 2eec n ARG 112 Ca -0.19 0.27 -0.36 0.00 -0.92 0.00 0.00 57.85 56.65 2eec n ARG 112 Cb 0.51 -1.58 -0.08 0.00 0.45 0.00 0.00 32.46 31.76 2eec n ARG 112 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2eec s LEU 113 N 1.36 4.08 -0.07 6.15 1.43 -1.25 -5.10 118.68 125.27 2eec s LEU 113 Ca 0.63 0.32 0.05 0.00 -1.03 0.00 0.00 54.13 54.10 2eec s LEU 113 Cb -0.64 -1.98 -0.01 0.00 0.03 0.00 0.00 46.19 43.59 2eec s LEU 113 CO 0.58 0.37 -0.23 0.54 0.23 0.00 0.00 176.35 177.84 2eec s VAL 114 N -0.79 1.93 0.40 -1.59 0.11 -1.26 -4.97 120.40 114.23 2eec s VAL 114 Ca 0.13 -0.98 -0.23 0.00 -2.93 0.00 0.00 61.98 57.97 2eec s VAL 114 Cb -0.12 -1.65 -0.13 0.00 -1.53 0.00 0.00 36.38 32.96 2eec s VAL 114 CO 0.03 0.54 0.62 -1.20 -3.33 0.00 0.00 175.10 171.76 2eec n SER 115 N 3.17 -0.54 -3.17 3.54 7.64 -1.26 -4.96 113.62 118.05 2eec n SER 115 Ca -0.18 0.95 -0.19 0.00 1.01 0.00 0.00 58.87 60.46 2eec n SER 115 Cb 0.52 -1.14 0.16 0.00 -1.01 0.00 0.00 64.21 62.74 2eec n SER 115 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2eec n PRO 116 N 0.57 -2.36 -2.68 1.43 -0.04 -1.26 -5.07 135.00 125.60 2eec n PRO 116 Ca 0.11 -1.10 -0.22 0.00 -0.04 0.00 0.00 63.50 62.25 2eec n PRO 116 Cb 0.38 -1.03 0.07 0.00 -0.04 0.00 0.00 33.50 32.88 2eec n PRO 116 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2eec s GLY 117 N -3.75 1.80 -0.31 0.55 0.00 -1.26 -5.08 107.32 99.27 2eec s GLY 117 Ca 0.45 -1.58 -0.10 0.00 0.00 0.00 0.00 44.72 43.49 2eec s GLY 117 CO 0.34 -1.18 0.15 -0.45 0.00 0.00 0.00 173.10 171.97 2eec s SER 118 N -4.57 5.55 -0.53 1.64 0.15 -1.26 -5.05 113.70 109.63 2eec s SER 118 Ca 0.61 -0.53 -0.05 0.00 0.70 0.00 0.00 55.95 56.69 2eec s SER 118 Cb -0.08 -2.00 0.14 0.00 -1.71 0.00 0.00 66.02 62.37 2eec s SER 118 CO 0.40 -0.20 0.36 0.00 1.20 0.00 0.00 173.24 175.01 2eec s ALA 119 N 1.61 3.43 1.00 5.45 0.00 -1.26 -5.08 121.76 126.90 2eec s ALA 119 Ca 0.05 -2.88 -0.18 0.00 0.00 0.00 0.00 51.96 48.94 2eec s ALA 119 Cb -0.17 -2.65 -0.09 0.00 0.00 0.00 0.00 23.12 20.20 2eec s ALA 119 CO 0.06 -1.97 -0.59 0.27 0.00 0.00 0.00 175.76 173.52 2eec n ASN 120 N 4.16 -4.31 -3.43 0.00 0.23 -1.26 -5.01 115.26 105.63 2eec n ASN 120 Ca 0.02 0.16 -0.08 0.00 -0.53 0.00 0.00 54.58 54.15 2eec n ASN 120 Cb 0.40 -0.83 -0.08 0.00 -2.08 0.00 0.00 39.78 37.19 2eec n ASN 120 CO 0.00 0.00 0.00 -0.70 -0.93 0.00 0.00 177.26 175.63 2eec s GLU 121 N -2.50 0.36 0.56 -3.83 2.56 -1.26 -5.15 118.70 109.44 2eec s GLU 121 Ca 0.44 0.74 -0.19 0.00 0.00 0.00 0.00 54.97 55.97 2eec s GLU 121 Cb -0.13 -0.12 -0.05 0.00 2.00 0.00 0.00 34.13 35.83 2eec s GLU 121 CO 0.75 -0.51 1.13 -0.08 -0.56 0.00 0.00 175.26 175.99 2eec s THR 122 N 2.60 3.15 0.19 -1.70 -1.32 -1.26 -5.05 115.64 112.25 2eec s THR 122 Ca 0.09 0.69 0.05 0.00 -1.21 0.00 0.00 61.69 61.31 2eec s THR 122 Cb -0.14 -3.26 -0.04 0.00 -1.51 0.00 0.00 72.50 67.55 2eec s THR 122 CO -0.15 -0.17 0.22 -0.55 -2.21 0.00 0.00 174.62 171.75 2eec s SER 123 N -1.85 5.85 0.05 8.08 0.15 -1.26 -5.12 113.70 119.60 2eec s SER 123 Ca 0.72 -0.05 0.04 0.00 0.70 0.00 0.00 55.95 57.36 2eec s SER 123 Cb -0.24 -1.61 -0.04 0.00 -1.71 0.00 0.00 66.02 62.42 2eec s SER 123 CO 0.29 0.02 -0.03 -0.94 1.20 0.00 0.00 173.24 173.78 2eec s SER 124 N -3.44 4.86 0.00 5.45 1.04 -1.26 -5.37 113.70 114.97 2eec s SER 124 Ca 0.33 -0.17 0.00 0.00 0.48 0.00 0.00 55.95 56.59 2eec s SER 124 Cb -0.10 -1.14 0.00 0.00 0.10 0.00 0.00 66.02 64.88 2eec s SER 124 CO 0.26 0.22 0.00 2.30 0.98 0.00 0.00 173.24 177.00