#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eec n SER 2 N 0.00 0.37 -3.64 1.61 2.88 -1.26 -4.91 113.62 108.67 2eec n SER 2 Ca 0.00 -1.20 -0.10 0.00 -1.33 0.00 0.00 58.87 56.25 2eec n SER 2 Cb 0.00 -2.03 -0.03 0.00 -0.75 0.00 0.00 64.21 61.40 2eec n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2eec s SER 3 N -4.31 0.09 -0.14 -3.46 1.04 -1.26 -5.19 113.70 100.49 2eec s SER 3 Ca 0.06 -1.02 -0.34 0.00 0.48 0.00 0.00 55.95 55.13 2eec s SER 3 Cb -0.03 0.67 0.14 0.00 0.10 0.00 0.00 66.02 66.89 2eec s SER 3 CO 0.97 -1.30 1.27 -0.83 0.98 0.00 0.00 173.24 174.32 2eec s GLY 4 N -3.05 -0.33 -0.19 7.32 0.00 -1.26 -5.19 107.32 104.61 2eec s GLY 4 Ca 0.21 1.29 -0.34 0.00 0.00 0.00 0.00 44.72 45.88 2eec s GLY 4 CO 0.11 0.39 1.20 -0.45 0.00 0.00 0.00 173.10 174.35 2eec s SER 5 N -2.48 -0.15 0.30 1.64 0.15 -1.26 -5.19 113.70 106.71 2eec s SER 5 Ca 0.12 0.03 -0.17 0.00 0.70 0.00 0.00 55.95 56.62 2eec s SER 5 Cb 0.01 0.15 0.02 0.00 -1.71 0.00 0.00 66.02 64.49 2eec s SER 5 CO -0.04 -0.23 0.66 -0.94 1.20 0.00 0.00 173.24 173.88 2eec s SER 6 N -2.03 -0.10 0.02 5.45 1.04 -1.26 -5.10 113.70 111.71 2eec s SER 6 Ca 0.09 -0.84 0.00 0.00 0.48 0.00 0.00 55.95 55.67 2eec s SER 6 Cb -0.01 0.71 0.00 0.00 0.10 0.00 0.00 66.02 66.82 2eec s SER 6 CO -0.05 -1.36 0.00 0.61 0.98 0.00 0.00 173.24 173.43 2eec n GLY 7 N -0.46 -1.92 3.97 7.32 0.00 -1.26 -5.16 105.19 107.68 2eec n GLY 7 Ca -0.04 0.53 -0.22 0.00 0.00 0.00 0.00 46.02 46.29 2eec n GLY 7 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2eec s PHE 8 N -1.05 2.61 0.42 1.61 5.36 -1.26 -5.12 117.98 120.55 2eec s PHE 8 Ca 0.00 -0.02 0.07 0.00 -0.96 0.00 0.00 56.93 56.03 2eec s PHE 8 Cb 0.00 -2.85 -0.03 0.00 -0.34 0.00 0.00 43.02 39.80 2eec s PHE 8 CO 0.00 -1.10 0.29 0.15 -1.46 0.00 0.00 175.22 173.10 2eec s LYS 9 N -4.89 2.38 -0.09 10.12 1.02 -1.26 -5.13 119.74 121.89 2eec s LYS 9 Ca 0.59 -1.69 -0.02 0.00 0.02 0.00 0.00 55.97 54.88 2eec s LYS 9 Cb -0.09 -2.19 0.03 0.00 -0.52 0.00 0.00 37.83 35.06 2eec s LYS 9 CO 0.40 -0.17 0.01 0.14 -0.92 0.00 0.00 175.35 174.81 2eec s VAL 10 N -2.54 0.41 0.25 3.17 -7.23 -1.26 -5.14 120.40 108.05 2eec s VAL 10 Ca 0.45 0.01 0.10 0.00 -1.81 0.00 0.00 61.98 60.73 2eec s VAL 10 Cb 0.00 -0.62 -0.04 0.00 0.56 0.00 0.00 36.38 36.28 2eec s VAL 10 CO 0.25 0.19 -0.05 -0.13 -0.31 0.00 0.00 175.10 175.05 2eec s ARG 11 N 1.95 2.15 -0.16 4.82 0.52 -1.26 -5.14 118.95 121.83 2eec s ARG 11 Ca 0.04 -1.44 -0.08 0.00 -0.52 0.00 0.00 55.73 53.74 2eec s ARG 11 Cb -0.13 -2.10 0.06 0.00 0.52 0.00 0.00 34.95 33.30 2eec s ARG 11 CO -0.06 0.38 0.38 0.08 0.02 0.00 0.00 175.30 176.10 2eec s VAL 12 N -2.21 -0.13 -0.08 3.52 1.01 -1.26 -5.14 120.40 116.11 2eec s VAL 12 Ca 0.30 0.12 -0.03 0.00 0.00 0.00 0.00 61.98 62.37 2eec s VAL 12 Cb -0.07 -0.58 0.04 0.00 0.00 0.00 0.00 36.38 35.77 2eec s VAL 12 CO 0.18 0.05 0.06 -0.83 0.00 0.00 0.00 175.10 174.56 2eec s GLY 13 N 1.60 0.31 0.57 4.51 0.00 -1.26 -5.14 107.32 107.90 2eec s GLY 13 Ca -0.08 -0.02 -0.18 0.00 0.00 0.00 0.00 44.72 44.45 2eec s GLY 13 CO -0.12 1.44 1.09 -0.54 0.00 0.00 0.00 173.10 174.97 2eec s GLU 14 N 2.12 3.32 0.30 2.90 2.02 -1.26 -5.00 118.70 123.11 2eec s GLU 14 Ca 0.04 1.43 -0.29 0.00 0.02 0.00 0.00 54.97 56.17 2eec s GLU 14 Cb -0.13 -2.02 -0.10 0.00 0.10 0.00 0.00 34.13 31.98 2eec s GLU 14 CO -0.05 -0.84 1.23 -1.25 0.02 0.00 0.00 175.26 174.38 2eec s PRO 15 N -3.61 4.46 0.00 0.39 0.04 -1.26 -5.02 135.00 130.01 2eec s PRO 15 Ca 0.68 2.06 0.00 0.00 0.04 0.00 0.00 61.00 63.78 2eec s PRO 15 Cb -0.20 -3.12 0.00 0.00 0.04 0.00 0.00 34.50 31.22 2eec s PRO 15 CO 0.31 -0.05 0.00 0.41 0.04 0.00 0.00 177.00 177.70 2eec n GLY 16 N 1.08 3.28 3.54 0.56 0.00 -1.26 -5.08 105.19 107.32 2eec n GLY 16 Ca 0.00 -1.11 -0.37 0.00 0.00 0.00 0.00 46.02 44.54 2eec n GLY 16 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2eec n GLN 17 N 0.00 0.96 -1.62 1.61 -0.06 -1.26 -4.87 117.38 112.14 2eec n GLN 17 Ca 0.00 0.03 -0.47 0.00 -2.00 0.00 0.00 57.00 54.56 2eec n GLN 17 Cb 0.00 -3.16 -0.03 0.00 -4.06 0.00 0.00 30.24 22.98 2eec n GLN 17 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2eec n ALA 18 N 14.87 0.10 0.00 1.69 0.00 -1.26 -4.71 120.51 131.21 2eec n ALA 18 Ca 0.41 0.44 0.00 0.00 0.00 0.00 0.00 53.44 54.29 2eec n ALA 18 Cb 0.47 -2.14 0.00 0.00 0.00 0.00 0.00 19.45 17.77 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 2.12 1.62 2.77 0.00 0.00 -1.26 -4.86 105.19 105.58 2eec n GLY 19 Ca 0.14 -1.00 -0.20 0.00 0.00 0.00 0.00 46.02 44.95 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 0.00 1.11 0.31 1.61 2.47 -1.25 -5.00 114.94 114.20 2eec s ASN 20 Ca 0.00 -0.03 0.10 0.00 0.42 0.00 0.00 52.86 53.35 2eec s ASN 20 Cb 0.00 -0.31 0.52 0.00 -1.45 0.00 0.00 41.25 40.00 2eec s ASN 20 CO 0.00 -0.17 1.71 1.55 -3.72 0.00 0.00 177.10 176.47 2eec h PRO 21 N 7.97 0.05 -0.31 0.43 0.13 -1.93 -3.16 132.00 135.18 2eec h PRO 21 Ca -0.26 -0.03 -0.04 0.00 -0.87 0.00 0.00 66.00 64.81 2eec h PRO 21 Cb 1.13 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.25 2eec h PRO 21 CO 0.31 0.52 0.04 0.00 -0.23 0.00 0.00 178.00 178.65 2eec h ALA 22 N 1.47 0.41 -0.47 -0.56 0.00 -1.93 -3.10 119.26 115.07 2eec h ALA 22 Ca -0.00 -0.20 0.08 0.00 0.00 0.00 0.00 54.91 54.79 2eec h ALA 22 Cb 0.87 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 18.48 2eec h ALA 22 CO 0.07 0.11 0.06 -0.07 0.00 0.00 0.00 179.25 179.42 2eec h LEU 23 N 0.34 -0.07 -9.04 0.00 3.38 -1.92 -3.37 115.31 104.63 2eec h LEU 23 Ca 0.09 0.09 -0.70 0.00 0.09 0.00 0.00 57.88 57.46 2eec h LEU 23 Cb 0.36 0.14 0.09 0.00 0.09 0.00 0.00 40.66 41.35 2eec h LEU 23 CO 0.01 -0.00 -0.28 0.52 0.09 0.00 0.00 178.44 178.77 2eec n VAL 24 N -5.15 1.36 -4.24 1.22 0.31 -1.17 -4.84 118.33 105.83 2eec n VAL 24 Ca 0.05 -0.34 -0.13 0.00 -0.01 0.00 0.00 64.34 63.90 2eec n VAL 24 Cb 0.24 -0.10 -0.10 0.00 -0.91 0.00 0.00 33.84 32.96 2eec n VAL 24 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 2eec s SER 25 N -0.63 1.36 -0.04 4.52 0.15 -1.10 -4.54 113.70 113.41 2eec s SER 25 Ca 0.72 -1.12 -0.01 0.00 0.70 0.00 0.00 55.95 56.24 2eec s SER 25 Cb -1.01 0.08 0.03 0.00 -1.71 0.00 0.00 66.02 63.41 2eec s SER 25 CO 0.56 -0.50 0.08 0.00 1.20 0.00 0.00 173.24 174.58 2eec s ALA 26 N -3.57 -0.09 0.15 5.45 0.00 -1.26 0.22 121.76 122.66 2eec s ALA 26 Ca 0.21 0.45 -0.14 0.00 0.00 0.00 0.00 51.96 52.47 2eec s ALA 26 Cb 0.05 -0.32 0.02 0.00 0.00 0.00 0.00 23.12 22.88 2eec s ALA 26 CO 0.02 -0.12 0.40 1.52 0.00 0.00 0.00 175.76 177.58 2eec s TYR 27 N 0.98 -0.03 -5.00 0.00 -0.85 -1.17 -5.02 117.35 106.26 2eec s TYR 27 Ca -0.08 -0.32 0.00 0.00 -0.52 0.00 0.00 57.07 56.15 2eec s TYR 27 Cb -0.11 0.21 0.00 0.00 0.38 0.00 0.00 41.96 42.44 2eec s TYR 27 CO -0.04 -0.76 0.00 0.41 -1.52 0.00 0.00 175.55 173.64 2eec n GLY 28 N -0.25 -0.31 0.00 5.49 0.00 -1.26 -2.04 105.19 106.82 2eec n GLY 28 Ca -0.12 -1.02 0.08 0.00 0.00 0.00 0.00 46.02 44.95 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 0.00 1.19 2.61 -1.04 -0.87 -4.15 114.28 121.02 2eec n THR 29 Ca 0.00 -0.29 0.12 0.00 -2.04 0.00 0.00 64.05 61.85 2eec n THR 29 Cb 0.00 0.43 0.27 0.00 -1.82 0.00 0.00 70.33 69.21 2eec n THR 29 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2eec n GLY 30 N 1.52 -0.24 0.00 3.41 0.00 -1.25 -3.99 105.19 104.64 2eec n GLY 30 Ca -0.01 -0.50 0.07 0.00 0.00 0.00 0.00 46.02 45.58 2eec n GLY 30 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2eec n LEU 31 N -0.24 0.15 -0.13 0.99 4.77 -1.26 -4.36 117.00 116.92 2eec n LEU 31 Ca 0.12 -0.12 0.13 0.00 -0.03 0.00 0.00 56.01 56.12 2eec n LEU 31 Cb 0.40 0.00 0.45 0.00 -2.33 0.00 0.00 43.42 41.94 2eec n LEU 31 CO 0.25 0.04 0.72 -1.84 -1.33 0.00 0.00 177.39 175.22 2eec n GLU 32 N -1.82 0.54 0.00 3.23 0.28 -1.26 -4.81 120.64 116.81 2eec n GLU 32 Ca -0.01 -0.25 0.00 0.00 -0.16 0.00 0.00 57.16 56.73 2eec n GLU 32 Cb 0.32 -1.49 0.00 0.00 1.43 0.00 0.00 31.44 31.69 2eec n GLU 32 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2eec n GLY 33 N 1.37 1.67 3.28 -1.84 0.00 -1.26 -4.94 105.19 103.47 2eec n GLY 33 Ca 0.11 -0.95 -0.40 0.00 0.00 0.00 0.00 46.02 44.78 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 1.97 -0.47 -0.02 0.00 -0.70 -4.50 107.32 103.59 2eec s GLY 34 Ca 0.00 -2.12 -0.16 0.00 0.00 0.00 0.00 44.72 42.44 2eec s GLY 34 CO 0.00 0.96 0.42 -0.51 0.00 0.00 0.00 173.10 173.97 2eec s THR 35 N 1.44 5.18 -0.21 0.90 -4.23 -1.26 -2.02 115.64 115.43 2eec s THR 35 Ca 0.03 -0.92 -0.29 0.00 -1.18 0.00 0.00 61.69 59.33 2eec s THR 35 Cb -0.23 -4.13 -0.01 0.00 1.34 0.00 0.00 72.50 69.47 2eec s THR 35 CO 0.02 -0.58 1.25 -0.89 -0.54 0.00 0.00 174.62 173.88 2eec s THR 36 N 1.80 4.29 0.00 3.99 2.01 -1.25 -3.06 115.64 123.42 2eec s THR 36 Ca 0.06 1.53 0.00 0.00 0.31 0.00 0.00 61.69 63.59 2eec s THR 36 Cb -0.23 -4.08 0.00 0.00 0.01 0.00 0.00 72.50 68.20 2eec s THR 36 CO 0.08 -0.24 0.00 0.61 -0.69 0.00 0.00 174.62 174.38 2eec n GLY 37 N 3.79 1.95 3.62 4.40 0.00 -1.23 -4.97 105.19 112.74 2eec n GLY 37 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 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 -1.99 3.82 -0.50 -0.61 1.01 -1.17 -5.08 121.20 116.68 2eec s ILE 38 Ca 0.00 -0.69 -0.23 0.00 0.00 0.00 0.00 60.65 59.73 2eec s ILE 38 Cb 0.00 -2.67 0.04 0.00 0.01 0.00 0.00 42.46 39.84 2eec s ILE 38 CO 0.00 0.41 0.84 -1.58 0.00 0.00 0.00 174.94 174.61 2eec s GLN 39 N -1.41 3.36 0.50 2.79 0.74 -1.26 -4.70 119.66 119.67 2eec s GLN 39 Ca 0.17 -0.22 -0.03 0.00 0.05 0.00 0.00 55.36 55.34 2eec s GLN 39 Cb -0.11 -4.00 -0.01 0.00 1.10 0.00 0.00 33.01 29.99 2eec s GLN 39 CO 0.08 -1.28 0.76 -1.54 -0.55 0.00 0.00 175.29 172.75 2eec s SER 40 N 2.48 5.85 -0.12 6.67 1.04 -1.24 -4.98 113.70 123.41 2eec s SER 40 Ca 0.29 0.55 -0.11 0.00 0.48 0.00 0.00 55.95 57.17 2eec s SER 40 Cb -0.13 -1.74 0.03 0.00 0.10 0.00 0.00 66.02 64.28 2eec s SER 40 CO 0.21 -0.78 0.32 -1.83 0.98 0.00 0.00 173.24 172.13 2eec s GLU 41 N -4.72 0.36 -0.04 4.02 -1.05 -1.26 -3.15 118.70 112.86 2eec s GLU 41 Ca 0.49 0.46 -0.01 0.00 -0.15 0.00 0.00 54.97 55.76 2eec s GLU 41 Cb -0.10 0.15 0.03 0.00 -0.44 0.00 0.00 34.13 33.77 2eec s GLU 41 CO 0.41 -0.05 0.02 -0.59 0.95 0.00 0.00 175.26 176.00 2eec s PHE 42 N 0.27 0.28 0.08 4.83 -0.12 -0.88 -2.06 117.98 120.38 2eec s PHE 42 Ca -0.01 0.06 -0.11 0.00 -0.05 0.00 0.00 56.93 56.82 2eec s PHE 42 Cb -0.03 -0.49 -0.06 0.00 -0.63 0.00 0.00 43.02 41.81 2eec s PHE 42 CO -0.01 -0.18 0.43 -0.06 -0.05 0.00 0.00 175.22 175.35 2eec s PHE 43 N 1.57 3.60 -0.23 3.49 0.40 -0.87 -2.81 117.98 123.13 2eec s PHE 43 Ca -0.02 0.86 -0.14 0.00 -0.60 0.00 0.00 56.93 57.03 2eec s PHE 43 Cb -0.13 -2.21 -0.04 0.00 0.51 0.00 0.00 43.02 41.15 2eec s PHE 43 CO -0.03 0.52 0.30 0.42 0.70 0.00 0.00 175.22 177.13 2eec s ILE 44 N -1.37 5.25 -1.23 0.64 1.01 -1.23 -3.05 121.20 121.22 2eec s ILE 44 Ca 0.33 0.48 -0.20 0.00 0.00 0.00 0.00 60.65 61.26 2eec s ILE 44 Cb -0.14 -3.64 0.04 0.00 0.01 0.00 0.00 42.46 38.73 2eec s ILE 44 CO 0.18 0.26 1.73 0.21 0.00 0.00 0.00 174.94 177.32 2eec s ASN 45 N 1.21 6.47 -0.01 3.58 2.47 0.13 -4.24 114.94 124.55 2eec s ASN 45 Ca 0.14 -2.13 0.10 0.00 0.42 0.00 0.00 52.86 51.39 2eec s ASN 45 Cb -0.15 -2.58 -0.16 0.00 -1.45 0.00 0.00 41.25 36.92 2eec s ASN 45 CO 0.07 -1.55 0.22 1.07 -3.72 0.00 0.00 177.10 173.19 2eec n THR 46 N 6.73 0.00 0.33 -5.21 5.66 -1.16 -2.73 114.28 117.89 2eec n THR 46 Ca 0.46 -0.23 0.22 0.00 -3.05 0.00 0.00 64.05 61.45 2eec n THR 46 Cb 0.47 0.28 1.15 0.00 -1.55 0.00 0.00 70.33 70.68 2eec n THR 46 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2eec h THR 47 N 0.00 0.00 0.00 1.09 1.03 -1.70 -1.55 112.91 111.78 2eec h THR 47 Ca 0.00 -0.06 0.00 0.00 -0.01 0.00 0.00 66.41 66.34 2eec h THR 47 Cb 0.46 1.05 0.00 0.00 -1.07 0.00 0.00 68.15 68.59 2eec h THR 47 CO 0.00 0.00 -0.75 -2.11 -0.01 0.00 0.00 175.52 172.65 2eec n ARG 48 N -3.06 2.83 -0.01 0.00 -4.01 -1.26 -4.76 116.66 106.38 2eec n ARG 48 Ca -0.03 -0.03 -0.00 0.00 -1.04 0.00 0.00 57.85 56.75 2eec n ARG 48 Cb 0.10 -1.00 -0.00 0.00 -3.04 0.00 0.00 32.46 28.52 2eec n ARG 48 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 2eec h ALA 49 N 1.03 0.00 0.00 2.89 0.00 -1.46 -3.48 119.26 118.23 2eec h ALA 49 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2eec h ALA 49 Cb 0.26 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2eec h ALA 49 CO 0.00 0.03 0.00 0.41 0.00 0.00 0.00 179.25 179.69 2eec n GLY 50 N 1.89 1.43 3.65 0.00 0.00 -0.77 -3.97 105.19 107.42 2eec n GLY 50 Ca -0.00 -1.42 -0.29 0.00 0.00 0.00 0.00 46.02 44.31 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 -1.86 -0.04 0.00 1.61 0.04 -1.26 -4.83 135.00 128.65 2eec s PRO 51 Ca 0.00 0.36 0.00 0.00 0.04 0.00 0.00 61.00 61.40 2eec s PRO 51 Cb 0.00 -1.70 0.00 0.00 0.04 0.00 0.00 34.50 32.84 2eec s PRO 51 CO 0.00 -3.02 0.00 0.41 0.04 0.00 0.00 177.00 174.43 2eec n GLY 52 N -1.03 3.29 3.61 0.56 0.00 -1.26 -4.67 105.19 105.68 2eec n GLY 52 Ca 0.07 -1.45 -0.43 0.00 0.00 0.00 0.00 46.02 44.21 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 -2.00 3.66 -0.28 2.61 2.01 -1.26 -4.66 115.64 115.71 2eec s THR 53 Ca 0.00 0.68 -0.19 0.00 0.31 0.00 0.00 61.69 62.49 2eec s THR 53 Cb 0.00 -3.83 -0.02 0.00 0.01 0.00 0.00 72.50 68.66 2eec s THR 53 CO 0.00 -0.49 0.58 -0.22 -0.69 0.00 0.00 174.62 173.79 2eec s LEU 54 N 6.08 4.11 -0.00 4.42 1.98 -1.26 -2.71 118.68 131.30 2eec s LEU 54 Ca 0.72 0.46 0.07 0.00 -2.89 0.00 0.00 54.13 52.49 2eec s LEU 54 Cb -0.20 -2.74 -0.02 0.00 0.66 0.00 0.00 46.19 43.89 2eec s LEU 54 CO 0.32 -0.39 -0.21 -0.44 -1.89 0.00 0.00 176.35 173.74 2eec s SER 55 N 1.59 2.48 -0.10 3.68 0.01 -1.14 -5.04 113.70 115.19 2eec s SER 55 Ca 0.23 -0.42 0.04 0.00 1.31 0.00 0.00 55.95 57.11 2eec s SER 55 Cb -0.15 -0.26 0.00 0.00 0.21 0.00 0.00 66.02 65.82 2eec s SER 55 CO 0.10 0.24 -0.22 -0.69 0.41 0.00 0.00 173.24 173.08 2eec s VAL 56 N -0.57 1.89 -0.07 3.43 1.01 -1.26 -3.76 120.40 121.06 2eec s VAL 56 Ca 0.08 -0.92 -0.08 0.00 0.00 0.00 0.00 61.98 61.06 2eec s VAL 56 Cb -0.08 -1.65 0.02 0.00 0.00 0.00 0.00 36.38 34.67 2eec s VAL 56 CO -0.00 0.52 0.22 -0.89 0.00 0.00 0.00 175.10 174.96 2eec s THR 57 N 0.45 0.01 0.06 3.92 2.01 -1.17 -5.04 115.64 115.88 2eec s THR 57 Ca -0.17 -0.10 0.02 0.00 0.31 0.00 0.00 61.69 61.76 2eec s THR 57 Cb -0.17 -0.35 -0.03 0.00 0.01 0.00 0.00 72.50 71.95 2eec s THR 57 CO 0.07 -0.05 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.24 2eec s ILE 58 N -0.11 0.62 0.01 1.82 1.01 -1.26 -1.85 121.20 121.44 2eec s ILE 58 Ca -0.02 -1.41 -0.01 0.00 0.00 0.00 0.00 60.65 59.21 2eec s ILE 58 Cb -0.02 -1.03 -0.01 0.00 0.01 0.00 0.00 42.46 41.41 2eec s ILE 58 CO 0.01 -0.56 0.00 -0.70 0.00 0.00 0.00 174.94 173.69 2eec s GLU 59 N -2.43 0.21 0.00 2.79 2.12 0.37 -4.95 118.70 116.81 2eec s GLU 59 Ca -0.02 -0.34 0.00 0.00 0.36 0.00 0.00 54.97 54.97 2eec s GLU 59 Cb -0.04 0.08 0.00 0.00 0.26 0.00 0.00 34.13 34.42 2eec s GLU 59 CO -0.01 -0.04 0.00 0.41 -0.54 0.00 0.00 175.26 175.08 2eec n GLY 60 N 2.17 -0.30 0.19 -1.50 0.00 -1.26 -0.45 105.19 104.04 2eec n GLY 60 Ca -0.19 -1.00 -0.02 0.00 0.00 0.00 0.00 46.02 44.80 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 0.21 -6.24 1.61 0.13 -1.91 -3.44 132.00 122.37 2eec h PRO 61 Ca 0.00 -0.11 -0.68 0.00 -0.87 0.00 0.00 66.00 64.34 2eec h PRO 61 Cb 0.00 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 30.95 2eec h PRO 61 CO 0.00 0.64 -0.70 0.45 -0.23 0.00 0.00 178.00 178.15 2eec s SER 62 N -6.88 4.61 -0.36 1.44 0.15 -1.26 -5.09 113.70 106.31 2eec s SER 62 Ca -0.04 -0.11 -0.26 0.00 0.70 0.00 0.00 55.95 56.24 2eec s SER 62 Cb 0.13 -1.10 0.02 0.00 -1.71 0.00 0.00 66.02 63.36 2eec s SER 62 CO 0.77 0.31 0.95 -0.75 1.20 0.00 0.00 173.24 175.73 2eec s LYS 63 N -1.19 3.88 0.24 5.44 2.36 -1.26 -4.98 119.74 124.24 2eec s LYS 63 Ca 0.15 0.65 0.08 0.00 -2.55 0.00 0.00 55.97 54.31 2eec s LYS 63 Cb -0.11 -3.79 -0.04 0.00 -1.05 0.00 0.00 37.83 32.84 2eec s LYS 63 CO 0.05 -0.94 0.06 0.14 1.55 0.00 0.00 175.35 176.21 2eec s VAL 64 N 3.51 3.83 -0.01 4.02 -7.23 -1.26 -4.93 120.40 118.33 2eec s VAL 64 Ca 0.39 -1.65 -0.02 0.00 -1.81 0.00 0.00 61.98 58.89 2eec s VAL 64 Cb -0.12 -3.04 -0.04 0.00 0.56 0.00 0.00 36.38 33.75 2eec s VAL 64 CO 0.18 -0.32 0.14 -1.59 -0.31 0.00 0.00 175.10 173.21 2eec s LYS 65 N -3.59 3.29 -0.30 4.82 -2.85 -1.26 -5.04 119.74 114.81 2eec s LYS 65 Ca 0.31 -0.38 0.03 0.00 -1.00 0.00 0.00 55.97 54.93 2eec s LYS 65 Cb -0.07 -3.01 0.09 0.00 -2.06 0.00 0.00 37.83 32.77 2eec s LYS 65 CO 0.21 0.67 0.01 -1.64 0.10 0.00 0.00 175.35 174.70 2eec s MET 66 N -1.82 1.55 -0.71 1.78 -1.94 -1.26 -4.33 119.30 112.58 2eec s MET 66 Ca 0.25 -1.53 -0.27 0.00 -1.71 0.00 0.00 55.69 52.43 2eec s MET 66 Cb -0.12 -2.89 0.03 0.00 2.01 0.00 0.00 34.83 33.86 2eec s MET 66 CO 0.16 -0.82 1.32 -0.51 -0.01 0.00 0.00 175.02 175.16 2eec s ASP 67 N 1.11 6.13 0.32 3.03 1.01 -1.23 -4.92 116.67 122.12 2eec s ASP 67 Ca 0.04 -0.30 -0.28 0.00 0.71 0.00 0.00 52.55 52.71 2eec s ASP 67 Cb -0.19 -2.56 -0.10 0.00 1.01 0.00 0.00 42.92 41.09 2eec s ASP 67 CO -0.09 -1.83 1.17 0.00 0.21 0.00 0.00 175.17 174.62 2eec s GLN 69 N -1.72 0.85 0.22 0.00 0.74 -1.20 -5.07 119.66 113.47 2eec s GLN 69 Ca 0.48 -0.80 -0.16 0.00 0.05 0.00 0.00 55.36 54.93 2eec s GLN 69 Cb -0.34 0.35 -0.08 0.00 1.10 0.00 0.00 33.01 34.05 2eec s GLN 69 CO 0.43 -0.28 0.67 -1.83 -0.55 0.00 0.00 175.29 173.73 2eec s GLU 70 N -3.44 4.09 0.03 1.67 1.03 -1.26 -3.14 118.70 117.68 2eec s GLU 70 Ca 0.01 0.68 -0.13 0.00 0.03 0.00 0.00 54.97 55.57 2eec s GLU 70 Cb 0.03 -2.79 0.02 0.00 -0.80 0.00 0.00 34.13 30.58 2eec s GLU 70 CO -0.09 0.36 0.27 0.95 -1.33 0.00 0.00 175.26 175.43 2eec s THR 71 N -1.62 0.08 -0.79 1.83 -4.23 -1.19 -4.81 115.64 104.90 2eec s THR 71 Ca 0.44 -0.68 0.18 0.00 -1.18 0.00 0.00 61.69 60.45 2eec s THR 71 Cb -0.15 -0.84 0.17 0.00 1.34 0.00 0.00 72.50 73.03 2eec s THR 71 CO 0.20 -0.38 1.56 -0.81 -0.54 0.00 0.00 174.62 174.65 2eec n PRO 72 N 0.80 0.08 -0.00 3.99 -0.04 -1.26 -2.12 135.00 136.45 2eec n PRO 72 Ca -0.20 0.32 0.10 0.00 -0.04 0.00 0.00 63.50 63.69 2eec n PRO 72 Cb 0.58 -1.65 -0.13 0.00 -0.04 0.00 0.00 33.50 32.26 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 -1.79 0.38 0.00 0.54 2.13 -1.26 -4.86 120.64 115.77 2eec n GLU 73 Ca 0.03 -0.07 0.00 0.00 0.66 0.00 0.00 57.16 57.78 2eec n GLU 73 Cb 0.19 -1.48 0.00 0.00 0.27 0.00 0.00 31.44 30.42 2eec n GLU 73 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2eec n GLY 74 N 1.42 0.01 2.76 8.31 0.00 -0.90 -2.34 105.19 114.44 2eec n GLY 74 Ca 0.01 -0.01 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 2eec n GLY 74 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2eec s TYR 75 N 0.00 -0.10 -0.08 1.61 2.02 -1.26 -3.20 117.35 116.34 2eec s TYR 75 Ca 0.00 0.33 -0.22 0.00 -0.37 0.00 0.00 57.07 56.80 2eec s TYR 75 Cb 0.00 -0.39 -0.04 0.00 -0.40 0.00 0.00 41.96 41.14 2eec s TYR 75 CO 0.00 -0.36 0.66 0.21 -1.57 0.00 0.00 175.55 174.48 2eec s LYS 76 N 2.25 4.41 -0.04 -0.62 2.20 -1.19 -3.55 119.74 123.20 2eec s LYS 76 Ca 0.04 0.79 0.06 0.00 -0.36 0.00 0.00 55.97 56.50 2eec s LYS 76 Cb -0.13 -3.45 -0.01 0.00 -1.51 0.00 0.00 37.83 32.72 2eec s LYS 76 CO -0.07 0.06 -0.24 0.08 -0.36 0.00 0.00 175.35 174.82 2eec s VAL 77 N 0.85 1.91 0.07 4.02 1.01 -1.12 -3.26 120.40 123.88 2eec s VAL 77 Ca 0.35 -1.00 0.06 0.00 0.00 0.00 0.00 61.98 61.39 2eec s VAL 77 Cb -0.17 -1.61 -0.03 0.00 0.00 0.00 0.00 36.38 34.57 2eec s VAL 77 CO 0.16 0.54 -0.17 -0.04 0.00 0.00 0.00 175.10 175.59 2eec s MET 78 N -0.25 0.97 -0.22 2.72 -1.94 -1.26 -2.08 119.30 117.23 2eec s MET 78 Ca 0.00 -0.98 -0.17 0.00 -1.71 0.00 0.00 55.69 52.83 2eec s MET 78 Cb -0.12 -1.06 0.06 0.00 2.01 0.00 0.00 34.83 35.72 2eec s MET 78 CO 0.02 0.25 0.57 1.52 -0.01 0.00 0.00 175.02 177.36 2eec s TYR 79 N -1.14 -0.73 -0.34 -0.03 -0.85 -1.19 -3.52 117.35 109.57 2eec s TYR 79 Ca 0.02 1.63 0.04 0.00 -0.52 0.00 0.00 57.07 58.23 2eec s TYR 79 Cb -0.10 0.33 0.10 0.00 0.38 0.00 0.00 41.96 42.67 2eec s TYR 79 CO 0.03 -0.36 0.04 0.99 -1.52 0.00 0.00 175.55 174.73 2eec s THR 80 N 0.85 2.22 0.04 -3.49 2.01 -1.26 -3.60 115.64 112.41 2eec s THR 80 Ca -0.04 -2.28 -0.30 0.00 0.31 0.00 0.00 61.69 59.37 2eec s THR 80 Cb -0.05 -2.63 -0.06 0.00 0.01 0.00 0.00 72.50 69.76 2eec s THR 80 CO -0.07 -0.58 1.42 -2.16 -0.69 0.00 0.00 174.62 172.54 2eec s PRO 81 N 0.94 4.29 0.10 4.92 0.04 -1.26 -4.78 135.00 139.24 2eec s PRO 81 Ca 0.10 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.17 2eec s PRO 81 Cb -0.19 -3.49 -0.22 0.00 0.04 0.00 0.00 34.50 30.63 2eec s PRO 81 CO -0.08 -0.55 1.22 1.98 0.04 0.00 0.00 177.00 179.60 2eec h MET 82 N 7.62 0.17 -6.03 4.56 4.05 -1.93 -3.27 114.93 120.10 2eec h MET 82 Ca -0.39 -0.28 -0.56 0.00 -0.28 0.00 0.00 59.70 58.19 2eec h MET 82 Cb 1.19 0.10 -0.25 0.00 -0.80 0.00 0.00 31.60 31.84 2eec h MET 82 CO 0.89 1.11 -0.83 0.00 0.23 0.00 0.00 176.91 178.31 2eec s ALA 83 N -2.74 1.71 1.25 0.39 0.00 -1.26 -3.20 121.76 117.91 2eec s ALA 83 Ca -0.02 -1.07 -0.21 0.00 0.00 0.00 0.00 51.96 50.66 2eec s ALA 83 Cb 0.08 -0.31 0.31 0.00 0.00 0.00 0.00 23.12 23.21 2eec s ALA 83 CO 0.86 0.37 1.11 -0.35 0.00 0.00 0.00 175.76 177.75 2eec n PRO 84 N 1.71 -3.18 0.00 0.00 -0.04 -1.26 -4.82 135.00 127.40 2eec n PRO 84 Ca -0.18 -1.78 0.00 0.00 -0.04 0.00 0.00 63.50 61.51 2eec n PRO 84 Cb 0.53 -1.66 0.00 0.00 -0.04 0.00 0.00 33.50 32.33 2eec n PRO 84 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2eec n GLY 85 N -4.88 0.43 2.82 0.55 0.00 -1.19 -4.91 105.19 98.02 2eec n GLY 85 Ca 0.15 -1.41 -0.28 0.00 0.00 0.00 0.00 46.02 44.48 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 2.82 0.32 1.61 2.20 -1.26 -0.79 114.94 115.84 2eec s ASN 86 Ca 0.00 -0.71 0.07 0.00 -0.94 0.00 0.00 52.86 51.28 2eec s ASN 86 Cb 0.00 -0.76 -0.02 0.00 -2.00 0.00 0.00 41.25 38.47 2eec s ASN 86 CO 0.00 -0.24 0.37 -0.31 -2.94 0.00 0.00 177.10 173.99 2eec s TYR 87 N 1.73 3.04 0.01 1.54 1.51 -0.81 -4.57 117.35 119.82 2eec s TYR 87 Ca -0.00 -0.24 0.01 0.00 -1.01 0.00 0.00 57.07 55.83 2eec s TYR 87 Cb -0.16 -1.85 -0.01 0.00 -0.11 0.00 0.00 41.96 39.83 2eec s TYR 87 CO -0.07 0.13 -0.04 -1.17 -1.11 0.00 0.00 175.55 173.28 2eec s LEU 88 N -4.07 2.12 -0.13 -1.29 2.96 0.41 -2.58 118.68 116.10 2eec s LEU 88 Ca 0.42 -0.28 -0.01 0.00 -0.22 0.00 0.00 54.13 54.04 2eec s LEU 88 Cb -0.08 -0.11 0.04 0.00 0.50 0.00 0.00 46.19 46.53 2eec s LEU 88 CO 0.29 -0.09 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.57 2eec s ILE 89 N -0.70 0.76 -0.21 6.68 1.01 -0.23 -0.47 121.20 128.04 2eec s ILE 89 Ca -0.05 -0.30 -0.06 0.00 0.00 0.00 0.00 60.65 60.24 2eec s ILE 89 Cb -0.05 -0.95 -0.03 0.00 0.01 0.00 0.00 42.46 41.44 2eec s ILE 89 CO -0.00 0.17 0.04 -0.44 0.00 0.00 0.00 174.94 174.71 2eec s SER 90 N 1.80 5.09 -0.18 3.58 0.01 -0.77 -1.79 113.70 121.44 2eec s SER 90 Ca 0.03 -0.14 0.01 0.00 1.31 0.00 0.00 55.95 57.15 2eec s SER 90 Cb -0.14 -1.89 0.02 0.00 0.21 0.00 0.00 66.02 64.22 2eec s SER 90 CO -0.07 0.06 -0.19 -0.69 0.41 0.00 0.00 173.24 172.75 2eec s VAL 91 N 1.06 2.14 -0.06 3.43 1.01 -1.26 -3.07 120.40 123.65 2eec s VAL 91 Ca 0.03 -0.92 0.03 0.00 0.00 0.00 0.00 61.98 61.12 2eec s VAL 91 Cb -0.14 -1.89 -0.03 0.00 0.00 0.00 0.00 36.38 34.32 2eec s VAL 91 CO 0.02 0.54 -0.13 -0.54 0.00 0.00 0.00 175.10 174.99 2eec s LYS 92 N 1.22 2.58 -0.17 2.72 1.02 -1.25 -3.66 119.74 122.20 2eec s LYS 92 Ca 0.03 -0.67 -0.01 0.00 0.02 0.00 0.00 55.97 55.34 2eec s LYS 92 Cb -0.13 -2.43 0.05 0.00 -0.52 0.00 0.00 37.83 34.80 2eec s LYS 92 CO -0.11 0.62 -0.02 0.71 -0.92 0.00 0.00 175.35 175.63 2eec s TYR 93 N -0.71 1.45 -0.78 3.18 1.51 -1.24 -2.86 117.35 117.90 2eec s TYR 93 Ca 0.11 -0.97 -0.01 0.00 -1.01 0.00 0.00 57.07 55.19 2eec s TYR 93 Cb -0.11 -1.19 0.00 0.00 -0.11 0.00 0.00 41.96 40.55 2eec s TYR 93 CO 0.01 -0.59 0.65 0.41 -1.11 0.00 0.00 175.55 174.91 2eec n GLY 94 N 4.94 -1.26 0.00 0.71 0.00 -1.10 -4.77 105.19 103.71 2eec n GLY 94 Ca -0.10 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.48 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 -1.66 1.05 0.24 -0.02 0.00 -1.26 -4.79 105.19 98.75 2eec n GLY 95 Ca -0.17 -2.20 -0.10 0.00 0.00 0.00 0.00 46.02 43.55 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 0.74 -5.89 1.61 0.13 -1.98 -3.44 132.00 123.16 2eec h PRO 96 Ca 0.00 -0.40 -0.69 0.00 -0.87 0.00 0.00 66.00 64.05 2eec h PRO 96 Cb 0.00 0.02 -0.03 0.00 0.13 0.00 0.00 31.00 31.11 2eec h PRO 96 CO 0.00 1.02 1.42 0.09 -0.23 0.00 0.00 178.00 180.29 2eec n ASN 97 N -4.03 1.43 -4.71 1.44 4.13 -1.26 -4.86 115.26 107.40 2eec n ASN 97 Ca -0.02 0.46 -0.29 0.00 1.68 0.00 0.00 54.58 56.41 2eec n ASN 97 Cb 0.54 -1.10 0.16 0.00 -1.54 0.00 0.00 39.78 37.84 2eec n ASN 97 CO 0.00 0.00 0.00 -1.38 0.28 0.00 0.00 177.26 176.16 2eec s HIS 98 N 7.13 2.26 0.95 3.10 -3.43 -1.26 -4.19 115.29 119.85 2eec s HIS 98 Ca 1.16 0.99 -0.14 0.00 -0.80 0.00 0.00 55.06 56.26 2eec s HIS 98 Cb -1.12 -3.28 0.21 0.00 -1.43 0.00 0.00 32.58 26.96 2eec s HIS 98 CO 0.55 -2.66 1.30 0.96 -2.00 0.00 0.00 174.74 172.89 2eec s ILE 99 N -3.05 2.01 0.27 -5.38 -4.36 -1.24 -4.78 121.20 104.66 2eec s ILE 99 Ca 0.64 -0.08 -0.29 0.00 -0.26 0.00 0.00 60.65 60.66 2eec s ILE 99 Cb -0.17 -2.93 -0.09 0.00 1.25 0.00 0.00 42.46 40.52 2eec s ILE 99 CO 0.56 0.00 1.21 -0.69 0.24 0.00 0.00 174.94 176.26 2eec s VAL 100 N -3.83 3.22 0.00 8.37 1.01 -1.26 -3.56 120.40 124.35 2eec s VAL 100 Ca 0.75 1.16 0.00 0.00 0.00 0.00 0.00 61.98 63.89 2eec s VAL 100 Cb -0.03 -3.74 0.00 0.00 0.00 0.00 0.00 36.38 32.61 2eec s VAL 100 CO 0.52 0.25 0.00 0.61 0.00 0.00 0.00 175.10 176.48 2eec n GLY 101 N 1.41 2.41 3.50 4.51 0.00 -1.26 -4.96 105.19 110.79 2eec n GLY 101 Ca 0.01 -0.48 -0.33 0.00 0.00 0.00 0.00 46.02 45.22 2eec n GLY 101 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2eec n SER 102 N 2.61 -1.21 -4.77 1.61 7.64 -1.23 -4.57 113.62 113.71 2eec n SER 102 Ca 0.00 0.41 -0.36 0.00 1.01 0.00 0.00 58.87 59.93 2eec n SER 102 Cb 0.00 -1.29 -0.00 0.00 -1.01 0.00 0.00 64.21 61.91 2eec n SER 102 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2eec s PRO 103 N -3.75 3.47 -0.22 1.43 0.04 -1.26 -4.89 135.00 129.83 2eec s PRO 103 Ca 0.62 1.65 -0.22 0.00 0.04 0.00 0.00 61.00 63.09 2eec s PRO 103 Cb -0.24 -2.12 -0.02 0.00 0.04 0.00 0.00 34.50 32.16 2eec s PRO 103 CO 0.63 -0.76 0.69 -0.06 0.04 0.00 0.00 177.00 177.53 2eec s PHE 104 N -1.71 3.35 -0.38 0.56 0.08 -0.74 -4.95 117.98 114.19 2eec s PHE 104 Ca 0.70 0.97 -0.05 0.00 0.12 0.00 0.00 56.93 58.68 2eec s PHE 104 Cb -0.25 -2.88 0.08 0.00 -0.57 0.00 0.00 43.02 39.40 2eec s PHE 104 CO 0.29 -0.26 0.16 -1.59 -0.10 0.00 0.00 175.22 173.72 2eec s LYS 105 N 2.25 2.31 -0.12 0.44 -2.85 -1.26 -1.06 119.74 119.44 2eec s LYS 105 Ca 0.30 -1.54 -0.09 0.00 -1.00 0.00 0.00 55.97 53.64 2eec s LYS 105 Cb -0.16 -3.53 -0.04 0.00 -2.06 0.00 0.00 37.83 32.04 2eec s LYS 105 CO 0.10 -0.90 0.18 0.00 0.10 0.00 0.00 175.35 174.83 2eec s ALA 106 N 1.26 3.81 -0.28 0.59 0.00 -1.06 -5.00 121.76 121.07 2eec s ALA 106 Ca 0.03 -0.58 -0.10 0.00 0.00 0.00 0.00 51.96 51.31 2eec s ALA 106 Cb -0.22 -2.09 -0.03 0.00 0.00 0.00 0.00 23.12 20.79 2eec s ALA 106 CO -0.01 0.49 0.15 0.21 0.00 0.00 0.00 175.76 176.59 2eec s LYS 107 N -0.71 3.66 0.24 0.00 2.20 -1.26 -1.92 119.74 121.95 2eec s LYS 107 Ca 0.15 -0.50 -0.10 0.00 -0.36 0.00 0.00 55.97 55.16 2eec s LYS 107 Cb -0.13 -3.54 -0.07 0.00 -1.51 0.00 0.00 37.83 32.58 2eec s LYS 107 CO 0.04 -0.27 0.57 0.08 -0.36 0.00 0.00 175.35 175.42 2eec s VAL 108 N 1.67 4.90 0.04 4.02 1.01 0.03 -1.73 120.40 130.34 2eec s VAL 108 Ca 0.06 0.54 -0.04 0.00 0.00 0.00 0.00 61.98 62.54 2eec s VAL 108 Cb -0.16 -3.62 -0.02 0.00 0.00 0.00 0.00 36.38 32.58 2eec s VAL 108 CO 0.07 -0.08 0.06 0.42 0.00 0.00 0.00 175.10 175.58 2eec s THR 109 N -1.83 0.15 -3.66 3.92 -4.23 -0.86 -3.20 115.64 105.93 2eec s THR 109 Ca 0.48 -1.25 0.00 0.00 -1.18 0.00 0.00 61.69 59.74 2eec s THR 109 Cb -0.11 -1.02 0.00 0.00 1.34 0.00 0.00 72.50 72.71 2eec s THR 109 CO 0.21 -0.69 0.00 0.61 -0.54 0.00 0.00 174.62 174.21 2eec n GLY 110 N 0.62 0.80 3.48 3.99 0.00 -1.26 -3.95 105.19 108.87 2eec n GLY 110 Ca -0.18 -2.02 -0.35 0.00 0.00 0.00 0.00 46.02 43.47 2eec n GLY 110 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2eec s GLN 111 N -1.44 3.70 -0.41 1.61 0.74 -1.26 -4.82 119.66 117.79 2eec s GLN 111 Ca 0.00 -0.47 -0.37 0.00 0.05 0.00 0.00 55.36 54.57 2eec s GLN 111 Cb 0.00 -3.20 -0.16 0.00 1.10 0.00 0.00 33.01 30.75 2eec s GLN 111 CO 0.00 -0.02 1.56 0.54 -0.55 0.00 0.00 175.29 176.82 2eec n ARG 112 N 4.38 0.00 -2.80 1.67 1.74 -1.26 -4.84 116.66 115.55 2eec n ARG 112 Ca -0.17 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.50 2eec n ARG 112 Cb 0.52 -1.22 -0.03 0.00 -1.02 0.00 0.00 32.46 30.70 2eec n ARG 112 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2eec s LEU 113 N 3.84 4.29 -0.36 0.55 1.43 -1.20 -5.02 118.68 122.21 2eec s LEU 113 Ca 0.93 1.44 -0.18 0.00 -1.03 0.00 0.00 54.13 55.29 2eec s LEU 113 Cb -1.22 -3.41 0.00 0.00 0.03 0.00 0.00 46.19 41.59 2eec s LEU 113 CO 0.60 -0.30 0.52 0.68 0.23 0.00 0.00 176.35 178.07 2eec s VAL 114 N 1.43 5.01 0.42 -1.59 -7.23 -1.26 -4.87 120.40 112.31 2eec s VAL 114 Ca 0.46 0.25 -0.24 0.00 -1.81 0.00 0.00 61.98 60.64 2eec s VAL 114 Cb -0.19 -3.99 -0.11 0.00 0.56 0.00 0.00 36.38 32.65 2eec s VAL 114 CO 0.21 -0.27 0.93 -1.54 -0.31 0.00 0.00 175.10 174.11 2eec n SER 115 N 5.77 0.86 -0.01 4.85 3.41 -1.26 -4.93 113.62 122.32 2eec n SER 115 Ca -0.05 1.01 -0.13 0.00 -0.26 0.00 0.00 58.87 59.44 2eec n SER 115 Cb 0.49 -1.31 -0.10 0.00 -0.26 0.00 0.00 64.21 63.03 2eec n SER 115 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 2eec h PRO 116 N 1.38 -0.00 0.00 4.33 0.13 -2.06 -3.48 132.00 132.30 2eec h PRO 116 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2eec h PRO 116 Cb 1.35 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.48 2eec h PRO 116 CO 0.56 0.48 0.00 0.41 -0.23 0.00 0.00 178.00 179.22 2eec n GLY 117 N 0.23 1.85 3.40 1.56 0.00 -1.26 -4.67 105.19 106.29 2eec n GLY 117 Ca -0.08 -0.21 -0.45 0.00 0.00 0.00 0.00 46.02 45.27 2eec n GLY 117 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eec s SER 118 N -4.00 6.83 -0.18 1.61 0.01 -1.26 -5.02 113.70 111.70 2eec s SER 118 Ca 0.00 -2.62 -0.22 0.00 1.31 0.00 0.00 55.95 54.43 2eec s SER 118 Cb 0.00 -2.31 -0.02 0.00 0.21 0.00 0.00 66.02 63.90 2eec s SER 118 CO 0.00 -0.74 0.67 0.00 0.41 0.00 0.00 173.24 173.58 2eec s ALA 119 N 1.11 3.52 0.39 1.44 0.00 -1.26 -5.06 121.76 121.90 2eec s ALA 119 Ca 0.29 -0.18 0.08 0.00 0.00 0.00 0.00 51.96 52.15 2eec s ALA 119 Cb -0.07 -3.02 -0.04 0.00 0.00 0.00 0.00 23.12 19.99 2eec s ALA 119 CO -0.08 -0.54 0.19 1.21 0.00 0.00 0.00 175.76 176.55 2eec s ASN 120 N 1.15 4.60 0.12 0.00 2.47 -1.26 -5.15 114.94 116.87 2eec s ASN 120 Ca 0.31 -0.92 0.04 0.00 0.42 0.00 0.00 52.86 52.72 2eec s ASN 120 Cb -0.16 -0.58 -0.04 0.00 -1.45 0.00 0.00 41.25 39.02 2eec s ASN 120 CO 0.11 -0.47 -0.11 -0.70 -3.72 0.00 0.00 177.10 172.22 2eec s GLU 121 N -3.91 0.97 0.47 0.43 2.12 -1.26 -5.16 118.70 112.36 2eec s GLU 121 Ca 0.41 -1.31 -0.03 0.00 0.36 0.00 0.00 54.97 54.40 2eec s GLU 121 Cb 0.00 -0.63 -0.02 0.00 0.26 0.00 0.00 34.13 33.75 2eec s GLU 121 CO 0.23 0.09 0.74 -0.08 -0.54 0.00 0.00 175.26 175.71 2eec s THR 122 N -2.81 4.47 -0.22 -1.70 -1.32 -1.26 -5.10 115.64 107.71 2eec s THR 122 Ca 0.11 -0.12 -0.03 0.00 -1.21 0.00 0.00 61.69 60.44 2eec s THR 122 Cb -0.01 -3.69 0.10 0.00 -1.51 0.00 0.00 72.50 67.40 2eec s THR 122 CO 0.01 -0.60 0.25 -0.55 -2.21 0.00 0.00 174.62 171.52 2eec s SER 123 N -4.16 1.33 0.07 8.08 0.15 -1.26 -5.06 113.70 112.85 2eec s SER 123 Ca 0.48 -0.27 -0.18 0.00 0.70 0.00 0.00 55.95 56.68 2eec s SER 123 Cb -0.10 0.47 -0.06 0.00 -1.71 0.00 0.00 66.02 64.62 2eec s SER 123 CO 0.42 -0.33 1.30 -1.28 1.20 0.00 0.00 173.24 174.54 2eec h SER 124 N 8.29 -0.99 0.00 5.45 0.87 -2.10 -3.58 113.55 121.49 2eec h SER 124 Ca -0.17 0.13 0.00 0.00 -1.23 0.00 0.00 61.79 60.52 2eec h SER 124 Cb 1.14 0.40 0.00 0.00 -0.44 0.00 0.00 62.40 63.50 2eec h SER 124 CO 0.29 -0.23 0.00 -0.38 -0.53 0.00 0.00 176.83 175.98