#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 -0.07 -0.25 1.61 0.01 -1.26 -5.18 113.70 108.55 2eec s SER 2 Ca 0.00 -0.91 -0.27 0.00 1.31 0.00 0.00 55.95 56.08 2eec s SER 2 Cb 0.00 0.76 0.15 0.00 0.21 0.00 0.00 66.02 67.15 2eec s SER 2 CO 0.00 -1.47 1.18 -0.55 0.41 0.00 0.00 173.24 172.81 2eec s SER 3 N -3.01 -0.27 0.64 2.44 0.15 -1.26 -5.16 113.70 107.24 2eec s SER 3 Ca 0.15 0.43 -0.16 0.00 0.70 0.00 0.00 55.95 57.06 2eec s SER 3 Cb -0.05 0.40 -0.01 0.00 -1.71 0.00 0.00 66.02 64.65 2eec s SER 3 CO 0.10 -0.15 1.15 -0.83 1.20 0.00 0.00 173.24 174.71 2eec s GLY 4 N -0.37 2.38 -0.30 9.45 0.00 -1.26 -5.04 107.32 112.18 2eec s GLY 4 Ca 0.04 0.74 -0.11 0.00 0.00 0.00 0.00 44.72 45.39 2eec s GLY 4 CO -0.07 1.11 1.00 -1.35 0.00 0.00 0.00 173.10 173.79 2eec s SER 5 N -2.15 -0.57 0.94 1.64 1.04 -1.26 -5.17 113.70 108.17 2eec s SER 5 Ca 0.71 0.28 -0.11 0.00 0.48 0.00 0.00 55.95 57.31 2eec s SER 5 Cb -0.24 1.44 0.16 0.00 0.10 0.00 0.00 66.02 67.48 2eec s SER 5 CO 0.38 -0.11 1.09 -0.44 0.98 0.00 0.00 173.24 175.14 2eec s SER 6 N 2.94 2.98 -0.60 7.02 0.01 -1.26 -4.87 113.70 119.92 2eec s SER 6 Ca 0.07 1.66 -0.07 0.00 1.31 0.00 0.00 55.95 58.92 2eec s SER 6 Cb -0.09 -2.30 -0.17 0.00 0.21 0.00 0.00 66.02 63.67 2eec s SER 6 CO -0.15 -2.97 3.31 0.61 0.41 0.00 0.00 173.24 174.45 2eec n GLY 7 N -0.52 3.58 2.83 3.44 0.00 -1.26 -4.74 105.19 108.53 2eec n GLY 7 Ca 0.07 -1.38 -0.16 0.00 0.00 0.00 0.00 46.02 44.55 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 1.09 -0.34 0.41 1.61 5.36 -1.26 -5.16 117.98 119.69 2eec s PHE 8 Ca 0.67 0.49 0.02 0.00 -0.96 0.00 0.00 56.93 57.14 2eec s PHE 8 Cb 0.27 -0.25 -0.01 0.00 -0.34 0.00 0.00 43.02 42.70 2eec s PHE 8 CO -0.04 -0.51 0.60 -1.59 -1.46 0.00 0.00 175.22 172.22 2eec s LYS 9 N 2.36 3.14 -0.04 10.12 -2.85 -1.26 -5.11 119.74 126.10 2eec s LYS 9 Ca 0.05 -0.59 0.05 0.00 -1.00 0.00 0.00 55.97 54.49 2eec s LYS 9 Cb -0.14 -2.64 -0.01 0.00 -2.06 0.00 0.00 37.83 32.98 2eec s LYS 9 CO -0.11 -0.12 -0.19 0.08 0.10 0.00 0.00 175.35 175.11 2eec s VAL 10 N -2.43 1.56 -0.20 1.79 1.01 -1.26 -5.13 120.40 115.75 2eec s VAL 10 Ca 0.46 -0.80 -0.09 0.00 0.00 0.00 0.00 61.98 61.55 2eec s VAL 10 Cb -0.10 -1.32 -0.05 0.00 0.00 0.00 0.00 36.38 34.91 2eec s VAL 10 CO 0.36 0.44 0.11 -0.13 0.00 0.00 0.00 175.10 175.88 2eec s ARG 11 N -0.09 4.10 0.25 2.72 3.00 -1.26 -5.08 118.95 122.59 2eec s ARG 11 Ca -0.02 -0.27 -0.19 0.00 0.00 0.00 0.00 55.73 55.25 2eec s ARG 11 Cb -0.11 -3.35 0.02 0.00 0.00 0.00 0.00 34.95 31.51 2eec s ARG 11 CO 0.02 0.27 0.63 0.14 0.00 0.00 0.00 175.30 176.36 2eec s VAL 12 N 0.41 0.00 0.00 3.52 -7.23 -1.26 -5.14 120.40 110.70 2eec s VAL 12 Ca 0.06 -0.99 0.00 0.00 -1.81 0.00 0.00 61.98 59.24 2eec s VAL 12 Cb -0.12 -1.91 0.00 0.00 0.56 0.00 0.00 36.38 34.91 2eec s VAL 12 CO -0.01 -0.02 0.00 0.61 -0.31 0.00 0.00 175.10 175.37 2eec n GLY 13 N -0.42 -0.34 3.35 2.32 0.00 -1.26 -4.85 105.19 103.99 2eec n GLY 13 Ca -0.05 -0.49 -0.25 0.00 0.00 0.00 0.00 46.02 45.23 2eec n GLY 13 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2eec s GLU 14 N 0.00 1.30 0.98 1.61 -1.05 -1.26 -5.14 118.70 115.14 2eec s GLU 14 Ca 0.00 -1.34 -0.12 0.00 -0.15 0.00 0.00 54.97 53.36 2eec s GLU 14 Cb 0.00 -1.57 0.18 0.00 -0.44 0.00 0.00 34.13 32.30 2eec s GLU 14 CO 0.00 0.35 1.09 -1.25 0.95 0.00 0.00 175.26 176.40 2eec s PRO 15 N -2.32 0.55 0.00 -4.83 0.04 -1.26 -5.04 135.00 122.14 2eec s PRO 15 Ca 0.13 0.57 0.00 0.00 0.04 0.00 0.00 61.00 61.74 2eec s PRO 15 Cb -0.08 -1.75 0.00 0.00 0.04 0.00 0.00 34.50 32.71 2eec s PRO 15 CO 0.06 -2.66 0.19 0.41 0.04 0.00 0.00 177.00 175.05 2eec n GLY 16 N -1.08 -0.39 3.54 0.56 0.00 -1.26 -4.80 105.19 101.76 2eec n GLY 16 Ca 0.05 0.00 -0.58 0.00 0.00 0.00 0.00 46.02 45.50 2eec n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2eec n GLN 17 N -0.42 0.28 -3.29 1.61 10.64 -1.26 -4.90 117.38 120.04 2eec n GLN 17 Ca 0.00 0.10 -0.38 0.00 -1.83 0.00 0.00 57.00 54.89 2eec n GLN 17 Cb 0.00 -1.64 -0.06 0.00 -0.86 0.00 0.00 30.24 27.68 2eec n GLN 17 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2eec s ALA 18 N 0.33 3.48 0.00 2.61 0.00 -1.26 -4.90 121.76 122.02 2eec s ALA 18 Ca 0.90 -0.14 0.00 0.00 0.00 0.00 0.00 51.96 52.72 2eec s ALA 18 Cb -1.21 -2.66 0.00 0.00 0.00 0.00 0.00 23.12 19.25 2eec s ALA 18 CO 0.56 0.05 0.00 0.41 0.00 0.00 0.00 175.76 176.78 2eec n GLY 19 N 3.04 -0.55 3.63 0.00 0.00 -1.25 -4.60 105.19 105.46 2eec n GLY 19 Ca -0.07 0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 2eec n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2eec s ASN 20 N 0.00 6.79 0.37 1.61 4.22 -1.26 -2.45 114.94 124.21 2eec s ASN 20 Ca 0.00 0.93 0.16 0.00 -2.14 0.00 0.00 52.86 51.81 2eec s ASN 20 Cb 0.00 -2.43 0.72 0.00 1.28 0.00 0.00 41.25 40.82 2eec s ASN 20 CO 0.00 -0.55 1.78 1.55 -2.04 0.00 0.00 177.10 177.84 2eec h PRO 21 N 7.82 0.00 -0.52 3.55 0.13 -1.91 -3.06 132.00 138.01 2eec h PRO 21 Ca -0.23 0.00 0.10 0.00 -0.87 0.00 0.00 66.00 64.99 2eec h PRO 21 Cb 1.09 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.14 2eec h PRO 21 CO 0.88 0.39 0.05 0.00 -0.23 0.00 0.00 178.00 179.09 2eec h ALA 22 N 1.61 0.54 -0.09 -0.56 0.00 -1.91 -2.17 119.26 116.67 2eec h ALA 22 Ca -0.00 0.14 -0.24 0.00 0.00 0.00 0.00 54.91 54.80 2eec h ALA 22 Cb 0.79 0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.81 2eec h ALA 22 CO 0.05 -0.36 -0.89 -0.07 0.00 0.00 0.00 179.25 177.98 2eec h LEU 23 N 0.17 0.93 -9.41 0.00 3.38 -1.95 -3.46 115.31 104.96 2eec h LEU 23 Ca 0.26 -0.67 -0.61 0.00 0.09 0.00 0.00 57.88 56.96 2eec h LEU 23 Cb 0.39 -0.28 0.13 0.00 0.09 0.00 0.00 40.66 40.99 2eec h LEU 23 CO -0.39 1.47 -0.16 0.52 0.09 0.00 0.00 178.44 179.96 2eec n VAL 24 N -3.90 2.01 -3.84 1.22 0.31 -0.82 -4.92 118.33 108.40 2eec n VAL 24 Ca -0.09 -0.50 -0.11 0.00 -0.01 0.00 0.00 64.34 63.63 2eec n VAL 24 Cb 0.81 -0.74 -0.09 0.00 -0.91 0.00 0.00 33.84 32.91 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 -0.82 -0.00 -0.01 4.52 0.01 -1.15 -4.79 113.70 111.46 2eec s SER 25 Ca 0.62 -0.27 0.02 0.00 1.31 0.00 0.00 55.95 57.64 2eec s SER 25 Cb -0.64 0.27 -0.00 0.00 0.21 0.00 0.00 66.02 65.86 2eec s SER 25 CO 0.58 -0.50 -0.07 0.00 0.41 0.00 0.00 173.24 173.66 2eec s ALA 26 N -2.14 0.61 0.18 1.44 0.00 -1.26 -0.88 121.76 119.72 2eec s ALA 26 Ca -0.08 -0.29 -0.24 0.00 0.00 0.00 0.00 51.96 51.35 2eec s ALA 26 Cb -0.03 -0.18 0.05 0.00 0.00 0.00 0.00 23.12 22.96 2eec s ALA 26 CO -0.02 0.13 0.80 1.52 0.00 0.00 0.00 175.76 178.20 2eec s TYR 27 N -0.07 -0.25 -2.62 0.00 1.13 -0.90 -5.03 117.35 109.62 2eec s TYR 27 Ca 0.01 -0.08 0.00 0.00 -1.41 0.00 0.00 57.07 55.60 2eec s TYR 27 Cb -0.04 0.64 0.00 0.00 -1.10 0.00 0.00 41.96 41.46 2eec s TYR 27 CO -0.00 -0.95 0.00 0.41 -2.51 0.00 0.00 175.55 172.49 2eec n GLY 28 N -0.42 0.09 0.05 5.49 0.00 -1.26 -0.85 105.19 108.28 2eec n GLY 28 Ca -0.07 -1.06 0.02 0.00 0.00 0.00 0.00 46.02 44.91 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 4.71 0.00 0.10 2.61 -1.04 -1.19 -4.52 114.28 114.95 2eec n THR 29 Ca 0.00 -0.43 -0.15 0.00 -2.04 0.00 0.00 64.05 61.43 2eec n THR 29 Cb 0.00 1.03 -0.13 0.00 -1.82 0.00 0.00 70.33 69.40 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 0.94 0.30 2.00 3.41 0.00 -1.85 -3.30 103.07 104.57 2eec h GLY 30 Ca 0.00 -0.75 -0.15 0.00 0.00 0.00 0.00 47.33 46.42 2eec h GLY 30 CO 0.00 0.66 -0.72 1.41 0.00 0.00 0.00 176.54 177.89 2eec h LEU 31 N 0.08 0.00 -0.85 3.11 3.38 -1.93 -3.27 115.31 115.83 2eec h LEU 31 Ca -0.12 0.00 0.17 0.00 0.09 0.00 0.00 57.88 58.01 2eec h LEU 31 Cb 1.94 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 42.58 2eec h LEU 31 CO 0.20 0.72 0.41 -0.33 0.09 0.00 0.00 178.44 179.53 2eec h GLU 32 N 0.00 0.53 0.00 1.13 4.39 -1.79 -3.45 114.58 115.38 2eec h GLU 32 Ca -0.01 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.66 2eec h GLU 32 Cb 1.44 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.97 2eec h GLU 32 CO 0.09 0.35 0.00 0.41 -1.16 0.00 0.00 179.01 178.70 2eec n GLY 33 N -1.33 0.16 3.42 -3.84 0.00 -1.23 -4.89 105.19 97.48 2eec n GLY 33 Ca 0.18 -0.91 -0.44 0.00 0.00 0.00 0.00 46.02 44.85 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 -0.46 -0.02 0.00 -0.79 -4.73 107.32 103.21 2eec s GLY 34 Ca 0.00 -1.93 -0.16 0.00 0.00 0.00 0.00 44.72 42.63 2eec s GLY 34 CO 0.00 1.29 0.41 -0.51 0.00 0.00 0.00 173.10 174.29 2eec s THR 35 N 2.19 5.18 -0.39 0.90 -4.23 -1.26 -1.73 115.64 116.31 2eec s THR 35 Ca 0.10 -0.84 -0.29 0.00 -1.18 0.00 0.00 61.69 59.49 2eec s THR 35 Cb -0.22 -4.10 0.01 0.00 1.34 0.00 0.00 72.50 69.54 2eec s THR 35 CO 0.09 -0.53 1.29 -0.89 -0.54 0.00 0.00 174.62 174.04 2eec s THR 36 N 1.82 4.09 0.00 3.99 2.01 -1.26 -3.02 115.64 123.28 2eec s THR 36 Ca 0.06 1.16 0.00 0.00 0.31 0.00 0.00 61.69 63.23 2eec s THR 36 Cb -0.22 -4.30 0.00 0.00 0.01 0.00 0.00 72.50 67.99 2eec s THR 36 CO 0.09 -0.71 0.00 0.61 -0.69 0.00 0.00 174.62 173.92 2eec n GLY 37 N 4.70 1.79 3.76 4.40 0.00 -1.23 -4.97 105.19 113.64 2eec n GLY 37 Ca 0.15 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.94 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 -1.81 4.09 -0.17 -0.61 1.01 -1.17 -5.10 121.20 117.45 2eec s ILE 38 Ca 0.00 -1.57 -0.05 0.00 0.00 0.00 0.00 60.65 59.03 2eec s ILE 38 Cb 0.00 -3.20 -0.03 0.00 0.01 0.00 0.00 42.46 39.24 2eec s ILE 38 CO 0.00 -0.35 0.01 -1.58 0.00 0.00 0.00 174.94 173.02 2eec s GLN 39 N -3.74 3.77 0.30 2.79 0.74 -1.26 -4.62 119.66 117.64 2eec s GLN 39 Ca 0.32 -0.45 0.09 0.00 0.05 0.00 0.00 55.36 55.37 2eec s GLN 39 Cb -0.07 -3.06 -0.06 0.00 1.10 0.00 0.00 33.01 30.92 2eec s GLN 39 CO 0.23 0.21 -0.11 -1.12 -0.55 0.00 0.00 175.29 173.95 2eec s SER 40 N 0.50 3.30 -0.17 6.67 0.01 -1.25 -5.05 113.70 117.72 2eec s SER 40 Ca -0.00 -1.14 -0.13 0.00 1.31 0.00 0.00 55.95 55.98 2eec s SER 40 Cb -0.14 -0.26 0.05 0.00 0.21 0.00 0.00 66.02 65.88 2eec s SER 40 CO 0.02 -0.19 0.44 -1.83 0.41 0.00 0.00 173.24 172.08 2eec s GLU 41 N -3.63 0.48 -0.06 12.44 -1.05 -1.26 -3.17 118.70 122.45 2eec s GLU 41 Ca 0.30 0.69 0.05 0.00 -0.15 0.00 0.00 54.97 55.86 2eec s GLU 41 Cb 0.01 0.15 -0.00 0.00 -0.44 0.00 0.00 34.13 33.85 2eec s GLU 41 CO 0.14 -0.10 -0.20 -0.59 0.95 0.00 0.00 175.26 175.46 2eec s PHE 42 N 0.68 2.04 0.30 4.83 -0.12 -1.23 -3.20 117.98 121.28 2eec s PHE 42 Ca -0.04 -0.64 -0.02 0.00 -0.05 0.00 0.00 56.93 56.19 2eec s PHE 42 Cb -0.05 -1.36 -0.04 0.00 -0.63 0.00 0.00 43.02 40.94 2eec s PHE 42 CO -0.05 -0.22 0.53 -0.06 -0.05 0.00 0.00 175.22 175.37 2eec s PHE 43 N 0.05 3.49 -0.31 3.49 0.08 -0.03 -3.37 117.98 121.39 2eec s PHE 43 Ca -0.06 0.45 0.02 0.00 0.12 0.00 0.00 56.93 57.46 2eec s PHE 43 Cb -0.13 -1.96 0.09 0.00 -0.57 0.00 0.00 43.02 40.44 2eec s PHE 43 CO 0.04 0.18 0.02 0.42 -0.10 0.00 0.00 175.22 175.77 2eec s ILE 44 N -2.17 1.87 -0.92 0.64 1.01 -1.22 -2.12 121.20 118.29 2eec s ILE 44 Ca 0.41 -1.88 -0.26 0.00 0.00 0.00 0.00 60.65 58.93 2eec s ILE 44 Cb -0.10 -2.29 -0.13 0.00 0.01 0.00 0.00 42.46 39.95 2eec s ILE 44 CO 0.33 -0.45 2.20 0.21 0.00 0.00 0.00 174.94 177.23 2eec s ASN 45 N 1.15 4.14 -0.29 3.58 3.84 -0.06 -4.08 114.94 123.23 2eec s ASN 45 Ca 0.05 -0.50 0.08 0.00 0.21 0.00 0.00 52.86 52.70 2eec s ASN 45 Cb -0.19 -2.57 0.46 0.00 -0.55 0.00 0.00 41.25 38.41 2eec s ASN 45 CO -0.10 -3.78 1.35 1.07 -2.79 0.00 0.00 177.10 172.84 2eec n THR 46 N 8.57 2.50 0.51 -5.21 5.66 -1.26 -2.93 114.28 122.13 2eec n THR 46 Ca 0.44 -3.29 0.12 0.00 -3.05 0.00 0.00 64.05 58.27 2eec n THR 46 Cb 0.45 -0.54 0.25 0.00 -1.55 0.00 0.00 70.33 68.94 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 1.29 0.00 0.00 1.09 1.35 -1.83 -2.88 112.91 111.92 2eec h THR 47 Ca 0.21 -0.59 -0.35 0.00 -0.55 0.00 0.00 66.41 65.14 2eec h THR 47 Cb 1.37 1.38 -0.06 0.00 -1.73 0.00 0.00 68.15 69.11 2eec h THR 47 CO 0.42 0.00 -2.20 0.54 -0.25 0.00 0.00 175.52 174.04 2eec n ARG 48 N -2.34 0.67 -0.04 4.72 5.12 -1.26 -4.51 116.66 119.02 2eec n ARG 48 Ca 0.04 0.08 -0.12 0.00 -1.93 0.00 0.00 57.85 55.92 2eec n ARG 48 Cb 0.46 -1.60 -0.10 0.00 -1.16 0.00 0.00 32.46 30.05 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 0.99 -0.03 0.00 7.54 0.00 -1.85 -3.49 119.26 122.42 2eec h ALA 49 Ca -0.47 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.06 2eec h ALA 49 Cb 2.18 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.98 2eec h ALA 49 CO 0.04 -0.08 0.00 0.41 0.00 0.00 0.00 179.25 179.62 2eec n GLY 50 N 1.26 3.03 3.72 0.00 0.00 -1.09 -3.95 105.19 108.16 2eec n GLY 50 Ca -0.08 -1.70 -0.42 0.00 0.00 0.00 0.00 46.02 43.82 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 -4.23 4.34 0.00 1.61 0.04 -1.26 -4.66 135.00 130.84 2eec s PRO 51 Ca 0.00 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.08 2eec s PRO 51 Cb 0.00 -3.25 0.00 0.00 0.04 0.00 0.00 34.50 31.29 2eec s PRO 51 CO 0.00 -0.40 0.00 0.41 0.04 0.00 0.00 177.00 177.05 2eec n GLY 52 N 3.36 1.54 3.69 0.56 0.00 -1.26 -4.90 105.19 108.17 2eec n GLY 52 Ca 0.11 0.31 -0.42 0.00 0.00 0.00 0.00 46.02 46.01 2eec n GLY 52 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2eec s THR 53 N 2.06 4.26 -0.30 2.61 -4.23 -1.26 -5.01 115.64 113.76 2eec s THR 53 Ca 0.00 1.60 -0.05 0.00 -1.18 0.00 0.00 61.69 62.06 2eec s THR 53 Cb 0.00 -4.03 0.03 0.00 1.34 0.00 0.00 72.50 69.85 2eec s THR 53 CO 0.00 0.03 0.04 -0.22 -0.54 0.00 0.00 174.62 173.94 2eec s LEU 54 N 1.90 3.90 -0.19 4.79 0.20 -1.26 -4.77 118.68 123.25 2eec s LEU 54 Ca 0.56 -1.02 0.01 0.00 0.69 0.00 0.00 54.13 54.37 2eec s LEU 54 Cb -0.25 -1.80 0.03 0.00 -0.43 0.00 0.00 46.19 43.74 2eec s LEU 54 CO 0.24 -0.24 -0.18 -0.44 -0.29 0.00 0.00 176.35 175.43 2eec s SER 55 N 1.38 3.30 -0.03 3.68 0.01 -1.26 -5.11 113.70 115.67 2eec s SER 55 Ca -0.01 -0.75 -0.03 0.00 1.31 0.00 0.00 55.95 56.47 2eec s SER 55 Cb -0.18 -1.47 0.01 0.00 0.21 0.00 0.00 66.02 64.58 2eec s SER 55 CO 0.00 -0.03 0.08 0.54 0.41 0.00 0.00 173.24 174.24 2eec s VAL 56 N 1.28 0.00 -0.01 3.43 0.11 -1.26 -3.52 120.40 120.42 2eec s VAL 56 Ca 0.03 -0.01 -0.16 0.00 -2.93 0.00 0.00 61.98 58.91 2eec s VAL 56 Cb -0.14 -0.12 0.03 0.00 -1.53 0.00 0.00 36.38 34.62 2eec s VAL 56 CO -0.12 -0.01 0.33 -0.89 -3.33 0.00 0.00 175.10 171.09 2eec s THR 57 N 0.02 0.05 0.01 5.04 2.01 -1.21 -5.04 115.64 116.52 2eec s THR 57 Ca -0.00 -0.45 0.01 0.00 0.31 0.00 0.00 61.69 61.55 2eec s THR 57 Cb -0.01 -0.65 -0.01 0.00 0.01 0.00 0.00 72.50 71.85 2eec s THR 57 CO 0.00 -0.25 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.03 2eec s ILE 58 N -1.35 0.17 0.23 1.82 1.01 -1.26 -1.89 121.20 119.93 2eec s ILE 58 Ca -0.13 -0.40 0.05 0.00 0.00 0.00 0.00 60.65 60.17 2eec s ILE 58 Cb -0.05 -0.21 -0.05 0.00 0.01 0.00 0.00 42.46 42.16 2eec s ILE 58 CO 0.04 -0.15 -0.06 -1.61 0.00 0.00 0.00 174.94 173.17 2eec s GLU 59 N -0.57 1.36 0.00 2.79 2.02 -0.22 -4.96 118.70 119.12 2eec s GLU 59 Ca -0.05 -1.67 0.00 0.00 0.02 0.00 0.00 54.97 53.28 2eec s GLU 59 Cb -0.04 -0.86 0.00 0.00 0.10 0.00 0.00 34.13 33.33 2eec s GLU 59 CO -0.00 0.01 0.00 0.41 0.02 0.00 0.00 175.26 175.70 2eec n GLY 60 N -0.43 0.00 0.20 -1.39 0.00 -1.26 -2.05 105.19 100.26 2eec n GLY 60 Ca -0.06 -1.18 -0.04 0.00 0.00 0.00 0.00 46.02 44.73 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 0.33 -4.47 1.61 0.13 -1.92 -3.40 132.00 124.28 2eec h PRO 61 Ca 0.00 -0.17 -0.63 0.00 -0.87 0.00 0.00 66.00 64.33 2eec h PRO 61 Cb 0.00 0.01 -0.38 0.00 0.13 0.00 0.00 31.00 30.75 2eec h PRO 61 CO 0.00 0.72 -0.77 -1.12 -0.23 0.00 0.00 178.00 176.60 2eec s SER 62 N -6.88 4.18 -0.28 1.44 0.01 -1.26 -5.08 113.70 105.83 2eec s SER 62 Ca -0.05 -1.45 -0.42 0.00 1.31 0.00 0.00 55.95 55.33 2eec s SER 62 Cb 0.13 -1.32 -0.18 0.00 0.21 0.00 0.00 66.02 64.85 2eec s SER 62 CO 0.79 -0.27 1.56 0.29 0.41 0.00 0.00 173.24 176.03 2eec n LYS 63 N 4.55 0.59 -3.63 12.44 4.01 -1.26 -4.84 118.16 130.01 2eec n LYS 63 Ca -0.09 0.22 -0.37 0.00 -0.51 0.00 0.00 58.31 57.56 2eec n LYS 63 Cb 0.43 -1.81 -0.10 0.00 -0.51 0.00 0.00 35.03 33.05 2eec n LYS 63 CO 0.00 0.00 0.00 0.14 -1.11 0.00 0.00 177.40 176.43 2eec s VAL 64 N 2.56 5.34 -0.68 -0.18 -7.23 -1.26 -4.97 120.40 113.98 2eec s VAL 64 Ca 0.98 0.19 -0.24 0.00 -1.81 0.00 0.00 61.98 61.10 2eec s VAL 64 Cb -1.24 -3.51 0.06 0.00 0.56 0.00 0.00 36.38 32.24 2eec s VAL 64 CO 0.68 0.32 1.07 -0.75 -0.31 0.00 0.00 175.10 176.11 2eec s LYS 65 N 1.25 3.15 0.49 4.82 2.36 -1.26 -5.00 119.74 125.54 2eec s LYS 65 Ca 0.08 -0.61 0.02 0.00 -2.55 0.00 0.00 55.97 52.91 2eec s LYS 65 Cb -0.14 -4.20 -0.02 0.00 -1.05 0.00 0.00 37.83 32.42 2eec s LYS 65 CO 0.06 -1.92 0.02 0.00 1.55 0.00 0.00 175.35 175.07 2eec s MET 66 N 4.62 2.14 0.31 4.03 0.23 -1.26 -4.75 119.30 124.62 2eec s MET 66 Ca 0.27 -2.35 0.07 0.00 -1.03 0.00 0.00 55.69 52.65 2eec s MET 66 Cb -0.14 -1.38 -0.03 0.00 -1.53 0.00 0.00 34.83 31.76 2eec s MET 66 CO 0.12 -0.37 0.27 -0.40 -2.03 0.00 0.00 175.02 172.61 2eec n ASP 67 N -1.26 -0.67 -3.75 -1.18 5.68 -1.22 -5.05 116.55 109.10 2eec n ASP 67 Ca -0.16 -3.06 -0.29 0.00 -0.50 0.00 0.00 54.79 50.78 2eec n ASP 67 Cb 0.67 1.58 -0.13 0.00 -1.14 0.00 0.00 41.12 42.10 2eec n ASP 67 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2eec s GLN 69 N -0.10 3.29 0.02 0.00 2.00 -0.20 -4.89 119.66 119.78 2eec s GLN 69 Ca 0.20 1.63 -0.16 0.00 -2.00 0.00 0.00 55.36 55.03 2eec s GLN 69 Cb -0.18 -1.99 -0.06 0.00 0.80 0.00 0.00 33.01 31.57 2eec s GLN 69 CO -0.05 -0.91 0.45 -2.00 -0.50 0.00 0.00 175.29 172.29 2eec s GLU 70 N -3.32 4.01 0.03 1.67 -6.30 -1.26 -2.34 118.70 111.17 2eec s GLU 70 Ca 0.73 0.50 0.00 0.00 -2.50 0.00 0.00 54.97 53.71 2eec s GLU 70 Cb -0.24 -3.23 -0.02 0.00 0.00 0.00 0.00 34.13 30.63 2eec s GLU 70 CO 0.28 0.66 -0.04 0.95 0.02 0.00 0.00 175.26 177.13 2eec s THR 71 N -1.03 0.20 -1.76 -1.70 -4.23 -1.15 -4.90 115.64 101.07 2eec s THR 71 Ca 0.25 -0.99 0.15 0.00 -1.18 0.00 0.00 61.69 59.93 2eec s THR 71 Cb -0.17 -0.39 0.36 0.00 1.34 0.00 0.00 72.50 73.64 2eec s THR 71 CO 0.15 -0.50 1.37 -0.81 -0.54 0.00 0.00 174.62 174.29 2eec n PRO 72 N 1.50 0.37 -0.07 3.99 -0.04 -1.26 -2.86 135.00 136.63 2eec n PRO 72 Ca -0.23 0.06 -0.10 0.00 -0.04 0.00 0.00 63.50 63.19 2eec n PRO 72 Cb 0.55 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.44 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 -1.12 0.55 0.00 0.54 2.13 -1.26 -5.10 120.64 116.38 2eec n GLU 73 Ca 0.10 0.08 0.00 0.00 0.66 0.00 0.00 57.16 57.99 2eec n GLU 73 Cb 0.08 -1.29 0.00 0.00 0.27 0.00 0.00 31.44 30.50 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 2.75 0.74 2.91 8.31 0.00 -1.13 -4.25 105.19 114.51 2eec n GLY 74 Ca -0.25 0.36 -0.28 0.00 0.00 0.00 0.00 46.02 45.85 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 2.13 1.62 -0.11 1.61 2.02 -1.26 -2.95 117.35 120.42 2eec s TYR 75 Ca 0.00 -0.91 -0.12 0.00 -0.37 0.00 0.00 57.07 55.67 2eec s TYR 75 Cb 0.00 -1.29 -0.05 0.00 -0.40 0.00 0.00 41.96 40.22 2eec s TYR 75 CO 0.00 -0.57 0.27 0.21 -1.57 0.00 0.00 175.55 173.90 2eec s LYS 76 N 1.66 3.93 -0.19 -0.62 2.20 -0.99 -3.43 119.74 122.30 2eec s LYS 76 Ca 0.03 0.10 0.00 0.00 -0.36 0.00 0.00 55.97 55.75 2eec s LYS 76 Cb -0.14 -3.30 0.05 0.00 -1.51 0.00 0.00 37.83 32.93 2eec s LYS 76 CO -0.08 0.51 -0.07 0.08 -0.36 0.00 0.00 175.35 175.43 2eec s VAL 77 N -0.37 1.39 -0.20 4.02 1.01 -1.22 -1.03 120.40 124.00 2eec s VAL 77 Ca 0.18 -0.90 -0.08 0.00 0.00 0.00 0.00 61.98 61.18 2eec s VAL 77 Cb -0.14 -1.56 -0.04 0.00 0.00 0.00 0.00 36.38 34.65 2eec s VAL 77 CO 0.06 0.09 0.08 -0.04 0.00 0.00 0.00 175.10 175.29 2eec s MET 78 N 1.50 3.93 -0.12 2.72 -1.94 -1.24 -3.48 119.30 120.67 2eec s MET 78 Ca -0.01 -0.36 -0.11 0.00 -1.71 0.00 0.00 55.69 53.50 2eec s MET 78 Cb -0.16 -3.29 0.03 0.00 2.01 0.00 0.00 34.83 33.42 2eec s MET 78 CO -0.08 0.16 0.32 1.52 -0.01 0.00 0.00 175.02 176.93 2eec s TYR 79 N 0.70 -0.36 -0.15 -0.03 -0.85 -1.19 -3.41 117.35 112.05 2eec s TYR 79 Ca 0.04 0.88 -0.00 0.00 -0.52 0.00 0.00 57.07 57.47 2eec s TYR 79 Cb -0.13 0.12 0.04 0.00 0.38 0.00 0.00 41.96 42.37 2eec s TYR 79 CO 0.02 -0.18 -0.07 0.99 -1.52 0.00 0.00 175.55 174.79 2eec s THR 80 N 0.28 1.16 0.39 -3.49 2.01 -1.26 -3.83 115.64 110.90 2eec s THR 80 Ca -0.01 -0.57 -0.26 0.00 0.31 0.00 0.00 61.69 61.16 2eec s THR 80 Cb -0.03 -1.27 -0.09 0.00 0.01 0.00 0.00 72.50 71.12 2eec s THR 80 CO -0.01 0.21 1.19 -2.16 -0.69 0.00 0.00 174.62 173.17 2eec s PRO 81 N 1.62 4.10 -0.12 4.92 0.04 -1.26 -4.81 135.00 139.50 2eec s PRO 81 Ca 0.02 1.91 0.18 0.00 0.04 0.00 0.00 61.00 63.15 2eec s PRO 81 Cb -0.14 -2.75 -0.27 0.00 0.04 0.00 0.00 34.50 31.37 2eec s PRO 81 CO -0.08 -0.30 0.23 -0.12 0.04 0.00 0.00 177.00 176.77 2eec n MET 82 N 0.21 0.78 -4.17 4.56 1.56 -1.26 -3.50 117.12 115.30 2eec n MET 82 Ca 0.04 -0.09 -0.16 0.00 -0.27 0.00 0.00 57.70 57.22 2eec n MET 82 Cb 0.46 -1.49 -0.13 0.00 2.15 0.00 0.00 33.22 34.21 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 -2.87 0.73 0.89 -5.12 0.00 -1.26 -3.96 121.76 110.16 2eec s ALA 83 Ca -0.09 -0.66 -0.11 0.00 0.00 0.00 0.00 51.96 51.10 2eec s ALA 83 Cb 0.09 -0.06 0.13 0.00 0.00 0.00 0.00 23.12 23.27 2eec s ALA 83 CO 0.81 0.09 1.09 -1.25 0.00 0.00 0.00 175.76 176.50 2eec s PRO 84 N -1.09 1.29 0.00 0.00 0.04 -1.26 -4.85 135.00 129.13 2eec s PRO 84 Ca -0.03 0.83 0.00 0.00 0.04 0.00 0.00 61.00 61.84 2eec s PRO 84 Cb -0.07 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.65 2eec s PRO 84 CO 0.01 -2.22 0.00 0.41 0.04 0.00 0.00 177.00 175.24 2eec n GLY 85 N -1.13 0.25 2.98 0.56 0.00 -1.09 -4.92 105.19 101.84 2eec n GLY 85 Ca 0.07 -1.18 -0.27 0.00 0.00 0.00 0.00 46.02 44.64 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 2.15 0.23 1.61 4.22 -1.26 -0.95 114.94 116.94 2eec s ASN 86 Ca 0.00 -0.34 0.10 0.00 -2.14 0.00 0.00 52.86 50.48 2eec s ASN 86 Cb 0.00 -0.92 -0.04 0.00 1.28 0.00 0.00 41.25 41.57 2eec s ASN 86 CO 0.00 -0.04 -0.10 -0.31 -2.04 0.00 0.00 177.10 174.61 2eec s TYR 87 N 1.24 2.56 -0.06 1.54 1.51 -0.99 -4.33 117.35 118.82 2eec s TYR 87 Ca -0.03 -0.26 0.03 0.00 -1.01 0.00 0.00 57.07 55.80 2eec s TYR 87 Cb -0.14 -1.18 0.01 0.00 -0.11 0.00 0.00 41.96 40.54 2eec s TYR 87 CO -0.04 0.59 -0.13 -1.17 -1.11 0.00 0.00 175.55 173.69 2eec s LEU 88 N -3.24 1.70 -0.23 -1.29 2.96 -0.87 -2.88 118.68 114.84 2eec s LEU 88 Ca 0.28 -0.30 0.00 0.00 -0.22 0.00 0.00 54.13 53.89 2eec s LEU 88 Cb -0.07 -0.82 0.03 0.00 0.50 0.00 0.00 46.19 45.83 2eec s LEU 88 CO 0.16 0.06 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.50 2eec s ILE 89 N 0.52 2.45 0.09 6.68 1.01 -1.07 -1.05 121.20 129.82 2eec s ILE 89 Ca -0.12 -1.15 0.01 0.00 0.00 0.00 0.00 60.65 59.40 2eec s ILE 89 Cb -0.14 -2.23 -0.04 0.00 0.01 0.00 0.00 42.46 40.06 2eec s ILE 89 CO 0.03 0.25 0.20 -0.44 0.00 0.00 0.00 174.94 174.99 2eec s SER 90 N 1.26 6.17 -0.21 3.58 0.01 -0.79 -2.92 113.70 120.79 2eec s SER 90 Ca -0.01 0.17 -0.08 0.00 1.31 0.00 0.00 55.95 57.35 2eec s SER 90 Cb -0.16 -1.84 0.09 0.00 0.21 0.00 0.00 66.02 64.32 2eec s SER 90 CO -0.07 0.13 0.46 -0.69 0.41 0.00 0.00 173.24 173.48 2eec s VAL 91 N -1.57 -0.65 0.27 3.43 1.01 -1.26 -3.32 120.40 118.30 2eec s VAL 91 Ca 0.34 0.14 0.11 0.00 0.00 0.00 0.00 61.98 62.57 2eec s VAL 91 Cb -0.12 -0.72 -0.05 0.00 0.00 0.00 0.00 36.38 35.49 2eec s VAL 91 CO 0.27 0.06 -0.17 -0.54 0.00 0.00 0.00 175.10 174.72 2eec s LYS 92 N 2.56 1.78 -0.23 2.72 1.02 -1.23 -2.91 119.74 123.45 2eec s LYS 92 Ca -0.03 -1.67 -0.08 0.00 0.02 0.00 0.00 55.97 54.21 2eec s LYS 92 Cb -0.12 -1.86 0.10 0.00 -0.52 0.00 0.00 37.83 35.44 2eec s LYS 92 CO -0.14 0.35 0.49 0.71 -0.92 0.00 0.00 175.35 175.84 2eec s TYR 93 N -2.37 -0.97 -0.87 3.18 1.51 -1.23 -4.33 117.35 112.28 2eec s TYR 93 Ca 0.29 1.75 -0.03 0.00 -1.01 0.00 0.00 57.07 58.07 2eec s TYR 93 Cb -0.06 0.45 -0.02 0.00 -0.11 0.00 0.00 41.96 42.22 2eec s TYR 93 CO 0.15 -0.54 0.77 0.41 -1.11 0.00 0.00 175.55 175.23 2eec n GLY 94 N 5.41 -1.21 0.00 0.71 0.00 -1.03 -4.07 105.19 105.00 2eec n GLY 94 Ca -0.09 0.51 0.00 0.00 0.00 0.00 0.00 46.02 46.44 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 -1.59 1.15 0.00 -0.02 0.00 -1.26 -4.61 105.19 98.86 2eec n GLY 95 Ca -0.05 -2.13 0.08 0.00 0.00 0.00 0.00 46.02 43.93 2eec n GLY 95 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2eec n PRO 96 N 0.27 0.48 -2.48 1.61 -0.04 -1.26 -4.70 135.00 128.88 2eec n PRO 96 Ca 0.00 0.01 -0.43 0.00 -0.04 0.00 0.00 63.50 63.04 2eec n PRO 96 Cb 0.00 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 31.94 2eec n PRO 96 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2eec s ASN 97 N -2.02 6.70 0.86 3.54 0.01 -1.26 -4.98 114.94 117.77 2eec s ASN 97 Ca 0.23 1.08 -0.11 0.00 -0.71 0.00 0.00 52.86 53.35 2eec s ASN 97 Cb 0.11 -2.54 0.10 0.00 0.41 0.00 0.00 41.25 39.33 2eec s ASN 97 CO 0.18 -1.08 1.09 -1.38 -1.51 0.00 0.00 177.10 174.40 2eec s HIS 98 N 4.32 2.47 0.73 2.20 -3.43 -1.26 -3.51 115.29 116.80 2eec s HIS 98 Ca 0.54 1.27 -0.10 0.00 -0.80 0.00 0.00 55.06 55.97 2eec s HIS 98 Cb -0.15 -3.13 0.05 0.00 -1.43 0.00 0.00 32.58 27.92 2eec s HIS 98 CO 0.23 -2.17 1.08 0.96 -2.00 0.00 0.00 174.74 172.84 2eec s ILE 99 N -2.98 2.67 0.41 -5.38 -4.36 -1.15 -4.90 121.20 105.51 2eec s ILE 99 Ca 0.62 0.05 -0.26 0.00 -0.26 0.00 0.00 60.65 60.80 2eec s ILE 99 Cb -0.17 -3.18 -0.09 0.00 1.25 0.00 0.00 42.46 40.27 2eec s ILE 99 CO 0.56 -0.22 1.36 -0.69 0.24 0.00 0.00 174.94 176.19 2eec s VAL 100 N -3.36 2.39 0.00 8.37 1.01 -1.26 -2.96 120.40 124.60 2eec s VAL 100 Ca 0.59 0.36 0.00 0.00 0.00 0.00 0.00 61.98 62.93 2eec s VAL 100 Cb -0.11 -3.22 0.00 0.00 0.00 0.00 0.00 36.38 33.06 2eec s VAL 100 CO 0.48 0.06 0.00 0.61 0.00 0.00 0.00 175.10 176.25 2eec n GLY 101 N 0.63 2.48 3.76 4.51 0.00 -1.26 -4.97 105.19 110.34 2eec n GLY 101 Ca 0.03 -0.57 -0.31 0.00 0.00 0.00 0.00 46.02 45.17 2eec n GLY 101 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eec s SER 102 N 0.00 4.35 0.61 1.61 0.01 -1.15 -4.47 113.70 114.65 2eec s SER 102 Ca 0.00 1.85 -0.17 0.00 1.31 0.00 0.00 55.95 58.94 2eec s SER 102 Cb 0.00 -2.52 -0.03 0.00 0.21 0.00 0.00 66.02 63.68 2eec s SER 102 CO 0.00 -2.14 1.12 -2.16 0.41 0.00 0.00 173.24 170.47 2eec s PRO 103 N -4.88 3.06 -0.19 12.44 0.04 -1.26 -4.89 135.00 139.32 2eec s PRO 103 Ca 0.62 1.49 -0.14 0.00 0.04 0.00 0.00 61.00 63.01 2eec s PRO 103 Cb -0.18 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.34 2eec s PRO 103 CO 0.56 -1.06 0.30 -0.06 0.04 0.00 0.00 177.00 176.77 2eec s PHE 104 N -2.08 3.41 -0.39 0.56 0.08 -1.15 -5.02 117.98 113.39 2eec s PHE 104 Ca 0.70 0.53 -0.06 0.00 0.12 0.00 0.00 56.93 58.21 2eec s PHE 104 Cb -0.22 -2.38 0.07 0.00 -0.57 0.00 0.00 43.02 39.92 2eec s PHE 104 CO 0.35 0.13 0.19 0.15 -0.10 0.00 0.00 175.22 175.94 2eec s LYS 105 N 0.84 2.46 -0.11 0.44 1.02 -1.26 -2.61 119.74 120.52 2eec s LYS 105 Ca 0.15 -1.46 -0.04 0.00 0.02 0.00 0.00 55.97 54.64 2eec s LYS 105 Cb -0.14 -3.61 -0.04 0.00 -0.52 0.00 0.00 37.83 33.53 2eec s LYS 105 CO 0.05 -0.88 0.06 0.00 -0.92 0.00 0.00 175.35 173.66 2eec s ALA 106 N 1.34 3.53 -0.23 5.17 0.00 -1.14 -5.04 121.76 125.39 2eec s ALA 106 Ca 0.02 -0.73 -0.05 0.00 0.00 0.00 0.00 51.96 51.19 2eec s ALA 106 Cb -0.22 -1.72 -0.02 0.00 0.00 0.00 0.00 23.12 21.16 2eec s ALA 106 CO 0.01 0.55 0.01 0.21 0.00 0.00 0.00 175.76 176.54 2eec s LYS 107 N -0.79 3.54 -0.07 0.00 2.20 -1.26 -2.34 119.74 121.02 2eec s LYS 107 Ca 0.13 -0.54 -0.20 0.00 -0.36 0.00 0.00 55.97 54.99 2eec s LYS 107 Cb -0.12 -3.15 -0.04 0.00 -1.51 0.00 0.00 37.83 33.01 2eec s LYS 107 CO 0.03 -0.15 0.56 0.08 -0.36 0.00 0.00 175.35 175.51 2eec s VAL 108 N 1.43 5.08 -0.00 4.02 1.01 -0.13 -1.89 120.40 129.92 2eec s VAL 108 Ca 0.05 1.14 0.03 0.00 0.00 0.00 0.00 61.98 63.20 2eec s VAL 108 Cb -0.15 -3.90 -0.01 0.00 0.00 0.00 0.00 36.38 32.33 2eec s VAL 108 CO 0.01 0.34 -0.10 0.42 0.00 0.00 0.00 175.10 175.77 2eec s THR 109 N 0.39 0.81 0.00 3.92 -4.23 -0.70 -2.66 115.64 113.16 2eec s THR 109 Ca 0.30 -0.49 0.00 0.00 -1.18 0.00 0.00 61.69 60.32 2eec s THR 109 Cb -0.17 -0.68 0.00 0.00 1.34 0.00 0.00 72.50 72.99 2eec s THR 109 CO 0.14 0.19 0.00 0.61 -0.54 0.00 0.00 174.62 175.02 2eec n GLY 110 N 2.73 3.44 2.64 3.99 0.00 -1.26 -4.05 105.19 112.69 2eec n GLY 110 Ca -0.14 -0.52 -0.33 0.00 0.00 0.00 0.00 46.02 45.03 2eec n GLY 110 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2eec n GLN 111 N 0.00 0.00 -1.70 1.61 10.64 -1.26 -4.39 117.38 122.28 2eec n GLN 111 Ca 0.00 0.00 -0.43 0.00 -1.83 0.00 0.00 57.00 54.74 2eec n GLN 111 Cb 0.00 -0.81 -0.03 0.00 -0.86 0.00 0.00 30.24 28.54 2eec n GLN 111 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.06 175.77 2eec n ARG 112 N 1.13 2.68 -2.11 2.61 1.74 -1.26 -4.88 116.66 116.56 2eec n ARG 112 Ca 0.08 0.97 -0.41 0.00 -0.77 0.00 0.00 57.85 57.72 2eec n ARG 112 Cb 0.34 -2.82 -0.03 0.00 -1.02 0.00 0.00 32.46 28.93 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 1.81 3.41 -0.01 0.55 1.43 -1.25 -4.89 118.68 119.74 2eec s LEU 113 Ca 0.79 0.72 -0.16 0.00 -1.03 0.00 0.00 54.13 54.45 2eec s LEU 113 Cb -0.53 -3.06 -0.09 0.00 0.03 0.00 0.00 46.19 42.55 2eec s LEU 113 CO 0.36 -1.94 0.81 0.58 0.23 0.00 0.00 176.35 176.38 2eec h VAL 114 N 6.74 0.00 -3.26 -1.59 2.07 -1.94 -3.44 116.25 114.82 2eec h VAL 114 Ca -0.29 -0.31 -0.57 0.00 0.82 0.00 0.00 66.70 66.35 2eec h VAL 114 Cb 1.15 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.88 2eec h VAL 114 CO 1.13 0.00 -0.05 -0.94 0.02 0.00 0.00 177.57 177.73 2eec s SER 115 N -4.05 6.98 0.35 0.57 1.04 -1.26 -4.97 113.70 112.37 2eec s SER 115 Ca -0.08 1.20 0.27 0.00 0.48 0.00 0.00 55.95 57.82 2eec s SER 115 Cb 0.01 -2.34 1.12 0.00 0.10 0.00 0.00 66.02 64.91 2eec s SER 115 CO 0.25 0.22 1.80 1.55 0.98 0.00 0.00 173.24 178.04 2eec h PRO 116 N 4.24 0.00 0.00 4.02 0.13 -2.03 -3.49 132.00 134.86 2eec h PRO 116 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2eec h PRO 116 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2eec h PRO 116 CO 0.64 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.82 2eec n GLY 117 N -0.02 -0.37 3.66 1.56 0.00 -1.26 -4.91 105.19 103.85 2eec n GLY 117 Ca 0.02 -1.78 -0.63 0.00 0.00 0.00 0.00 46.02 43.62 2eec n GLY 117 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2eec n SER 118 N -0.96 0.98 -4.28 1.61 2.88 -1.26 -4.94 113.62 107.65 2eec n SER 118 Ca 0.00 1.17 -0.27 0.00 -1.33 0.00 0.00 58.87 58.44 2eec n SER 118 Cb 0.00 -0.94 -0.14 0.00 -0.75 0.00 0.00 64.21 62.38 2eec n SER 118 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2eec s ALA 119 N 2.00 1.91 0.20 -1.46 0.00 -1.26 -5.14 121.76 118.01 2eec s ALA 119 Ca 0.99 -1.12 -0.11 0.00 0.00 0.00 0.00 51.96 51.71 2eec s ALA 119 Cb -1.36 -0.38 -0.00 0.00 0.00 0.00 0.00 23.12 21.38 2eec s ALA 119 CO 0.71 0.44 0.39 1.21 0.00 0.00 0.00 175.76 178.50 2eec s ASN 120 N -1.20 -0.05 -0.18 0.00 3.04 -1.26 -5.15 114.94 110.13 2eec s ASN 120 Ca 0.09 -0.86 0.00 0.00 0.04 0.00 0.00 52.86 52.13 2eec s ASN 120 Cb -0.09 0.51 0.04 0.00 -1.54 0.00 0.00 41.25 40.17 2eec s ASN 120 CO 0.02 -1.01 -0.08 -0.70 -3.04 0.00 0.00 177.10 172.29 2eec s GLU 121 N -3.98 1.78 -0.82 0.43 2.56 -1.26 -5.08 118.70 112.33 2eec s GLU 121 Ca 0.19 -0.69 -0.19 0.00 0.00 0.00 0.00 54.97 54.28 2eec s GLU 121 Cb 0.01 -2.22 0.12 0.00 2.00 0.00 0.00 34.13 34.04 2eec s GLU 121 CO 0.04 -0.42 1.01 0.95 -0.56 0.00 0.00 175.26 176.28 2eec s THR 122 N 1.50 4.71 0.00 -1.70 -4.23 -1.26 -5.02 115.64 109.65 2eec s THR 122 Ca -0.00 -1.30 -0.22 0.00 -1.18 0.00 0.00 61.69 58.99 2eec s THR 122 Cb -0.16 -4.70 -0.05 0.00 1.34 0.00 0.00 72.50 68.93 2eec s THR 122 CO -0.08 -1.42 0.66 -0.44 -0.54 0.00 0.00 174.62 172.81 2eec s SER 123 N 3.55 7.05 -0.15 3.99 0.01 -1.26 -5.06 113.70 121.82 2eec s SER 123 Ca 0.27 1.25 -0.03 0.00 1.31 0.00 0.00 55.95 58.74 2eec s SER 123 Cb -0.10 -2.40 -0.03 0.00 0.21 0.00 0.00 66.02 63.70 2eec s SER 123 CO -0.03 0.04 -0.04 -0.94 0.41 0.00 0.00 173.24 172.67 2eec s SER 124 N 0.01 4.74 0.00 2.44 1.04 -1.26 -5.36 113.70 115.32 2eec s SER 124 Ca 0.34 -0.14 0.00 0.00 0.48 0.00 0.00 55.95 56.63 2eec s SER 124 Cb -0.19 -1.77 0.00 0.00 0.10 0.00 0.00 66.02 64.16 2eec s SER 124 CO 0.19 0.17 0.06 -0.38 0.98 0.00 0.00 173.24 174.26