#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ec2 n GLU 2 N 0.00 0.64 -4.76 0.03 1.02 -1.26 -4.95 120.64 111.35 2ec2 n GLU 2 Ca 0.00 -0.03 -0.31 0.00 -0.02 0.00 0.00 57.16 56.80 2ec2 n GLU 2 Cb 0.00 -1.67 -0.13 0.00 -0.02 0.00 0.00 31.44 29.62 2ec2 n GLU 2 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 2ec2 s TYR 3 N -3.37 2.57 0.38 -0.32 1.51 -1.26 -4.81 117.35 112.05 2ec2 s TYR 3 Ca -0.05 -0.25 0.08 0.00 -1.01 0.00 0.00 57.07 55.84 2ec2 s TYR 3 Cb 0.11 -1.50 -0.04 0.00 -0.11 0.00 0.00 41.96 40.42 2ec2 s TYR 3 CO 0.85 0.21 0.22 0.15 -1.11 0.00 0.00 175.55 175.88 2ec2 s LYS 4 N -1.22 2.38 0.13 -0.62 1.02 -1.12 -4.98 119.74 115.32 2ec2 s LYS 4 Ca 0.14 -1.63 -0.17 0.00 0.02 0.00 0.00 55.97 54.32 2ec2 s LYS 4 Cb -0.10 -2.18 0.04 0.00 -0.52 0.00 0.00 37.83 35.07 2ec2 s LYS 4 CO 0.04 -0.04 0.44 -1.54 -0.92 0.00 0.00 175.35 173.32 2ec2 s SER 5 N -3.95 -0.30 0.00 2.83 1.04 -1.26 -2.70 113.70 109.37 2ec2 s SER 5 Ca 0.42 -0.25 0.00 0.00 0.48 0.00 0.00 55.95 56.60 2ec2 s SER 5 Cb -0.01 0.49 0.00 0.00 0.10 0.00 0.00 66.02 66.61 2ec2 s SER 5 CO 0.24 -0.87 0.00 0.35 0.98 0.00 0.00 173.24 173.95 2ec2 n THR 6 N -0.22 0.00 0.20 2.02 -2.24 -0.83 -5.01 114.28 108.20 2ec2 n THR 6 Ca -0.16 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.70 2ec2 n THR 6 Cb 0.64 0.00 0.30 0.00 -2.10 0.00 0.00 70.33 69.17 2ec2 n THR 6 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 2ec2 h ARG 7 N 0.00 0.00 -0.09 -0.78 3.08 -2.06 -3.27 114.38 111.26 2ec2 h ARG 7 Ca 0.00 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.01 2ec2 h ARG 7 Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.05 2ec2 h ARG 7 CO 0.00 0.26 -0.09 1.25 -1.07 0.00 0.00 179.97 180.33 2ec2 h HIS 8 N 0.00 0.26 -3.18 3.04 2.76 -2.04 -3.49 115.15 112.49 2ec2 h HIS 8 Ca -0.00 -0.08 -0.03 0.00 -2.20 0.00 0.00 60.37 58.06 2ec2 h HIS 8 Cb 0.96 -0.05 -0.12 0.00 1.55 0.00 0.00 27.41 29.75 2ec2 h HIS 8 CO 0.00 0.64 0.09 0.00 -1.30 0.00 0.00 177.93 177.36 2ec2 s ALA 9 N -4.29 -1.24 -0.09 5.26 0.00 -1.24 -5.15 121.76 115.01 2ec2 s ALA 9 Ca -0.15 0.14 0.02 0.00 0.00 0.00 0.00 51.96 51.98 2ec2 s ALA 9 Cb 0.04 0.82 -0.02 0.00 0.00 0.00 0.00 23.12 23.96 2ec2 s ALA 9 CO 0.72 -0.75 -0.16 0.21 0.00 0.00 0.00 175.76 175.78 2ec2 s LYS 10 N -3.80 2.97 0.03 0.00 2.47 -1.26 -1.97 119.74 118.18 2ec2 s LYS 10 Ca 0.04 -0.73 -0.23 0.00 -1.56 0.00 0.00 55.97 53.48 2ec2 s LYS 10 Cb -0.00 -2.47 0.05 0.00 -1.46 0.00 0.00 37.83 33.96 2ec2 s LYS 10 CO -0.10 0.36 0.54 1.52 0.16 0.00 0.00 175.35 177.83 2ec2 s TYR 11 N -0.06 -0.45 -0.27 4.03 -0.85 -1.10 -5.04 117.35 113.60 2ec2 s TYR 11 Ca -0.03 0.56 -0.03 0.00 -0.52 0.00 0.00 57.07 57.05 2ec2 s TYR 11 Cb -0.14 0.35 0.16 0.00 0.38 0.00 0.00 41.96 42.71 2ec2 s TYR 11 CO 0.04 -0.63 0.51 -1.17 -1.52 0.00 0.00 175.55 172.78 2ec2 s LEU 12 N -1.84 -1.06 -0.38 -3.49 2.96 -1.26 -2.80 118.68 110.80 2ec2 s LEU 12 Ca -0.06 0.70 0.01 0.00 -0.22 0.00 0.00 54.13 54.55 2ec2 s LEU 12 Cb -0.01 1.75 0.12 0.00 0.50 0.00 0.00 46.19 48.55 2ec2 s LEU 12 CO 0.00 -0.27 0.18 0.00 -1.32 0.00 0.00 176.35 174.94 2ec2 s ASN 14 N 0.90 6.45 -0.01 0.00 0.01 -1.26 -2.00 114.94 119.04 2ec2 s ASN 14 Ca 0.14 0.54 0.04 0.00 -0.71 0.00 0.00 52.86 52.88 2ec2 s ASN 14 Cb -0.22 -2.10 -0.01 0.00 0.41 0.00 0.00 41.25 39.34 2ec2 s ASN 14 CO -0.09 0.40 -0.14 -0.31 -1.51 0.00 0.00 177.10 175.44 2ec2 s TYR 15 N -1.03 1.29 -0.24 2.20 1.51 -0.01 -2.31 117.35 118.75 2ec2 s TYR 15 Ca 0.16 -0.25 -0.14 0.00 -1.01 0.00 0.00 57.07 55.83 2ec2 s TYR 15 Cb -0.13 -0.83 -0.04 0.00 -0.11 0.00 0.00 41.96 40.85 2ec2 s TYR 15 CO 0.05 -0.02 0.34 -1.01 -1.11 0.00 0.00 175.55 173.80 2ec2 s HIS 16 N -0.36 3.30 -0.17 2.71 3.76 0.73 -1.48 115.29 123.78 2ec2 s HIS 16 Ca 0.05 0.43 -0.01 0.00 -0.15 0.00 0.00 55.06 55.38 2ec2 s HIS 16 Cb -0.06 -2.50 -0.01 0.00 1.11 0.00 0.00 32.58 31.13 2ec2 s HIS 16 CO -0.00 -0.11 -0.11 -0.06 -0.85 0.00 0.00 174.74 173.60 2ec2 s PHE 17 N 1.66 2.85 -0.07 1.40 0.40 0.93 -1.12 117.98 124.03 2ec2 s PHE 17 Ca 0.15 -0.88 0.01 0.00 -0.60 0.00 0.00 56.93 55.61 2ec2 s PHE 17 Cb -0.15 -1.94 0.02 0.00 0.51 0.00 0.00 43.02 41.46 2ec2 s PHE 17 CO 0.09 -0.41 -0.09 0.08 0.70 0.00 0.00 175.22 175.59 2ec2 s VAL 18 N 0.85 0.91 0.23 -0.44 1.01 0.26 -0.80 120.40 122.43 2ec2 s VAL 18 Ca -0.03 -0.32 -0.04 0.00 0.00 0.00 0.00 61.98 61.58 2ec2 s VAL 18 Cb -0.15 -0.88 -0.03 0.00 0.00 0.00 0.00 36.38 35.32 2ec2 s VAL 18 CO 0.00 0.32 0.26 -1.66 0.00 0.00 0.00 175.10 174.02 2ec2 s TRP 19 N 0.94 0.93 0.19 5.22 -2.14 -1.01 -0.48 118.94 122.60 2ec2 s TRP 19 Ca -0.10 -1.18 0.09 0.00 2.66 0.00 0.00 56.10 57.57 2ec2 s TRP 19 Cb -0.15 -0.31 -0.04 0.00 -3.10 0.00 0.00 33.47 29.87 2ec2 s TRP 19 CO 0.00 -0.78 -0.19 0.96 -2.66 0.00 0.00 176.95 174.28 2ec2 s ILE 20 N -4.04 2.00 0.65 0.66 -4.36 -1.26 -0.50 121.20 114.35 2ec2 s ILE 20 Ca 0.34 -2.03 -0.13 0.00 -0.26 0.00 0.00 60.65 58.57 2ec2 s ILE 20 Cb 0.04 -1.98 -0.01 0.00 1.25 0.00 0.00 42.46 41.76 2ec2 s ILE 20 CO 0.12 -0.32 1.05 -2.84 0.24 0.00 0.00 174.94 173.20 2ec2 s PRO 21 N -2.95 3.15 0.05 0.37 0.02 -1.26 -2.89 135.00 131.48 2ec2 s PRO 21 Ca 0.19 1.01 -0.21 0.00 0.02 0.00 0.00 61.00 62.01 2ec2 s PRO 21 Cb -0.06 -2.02 -0.13 0.00 0.02 0.00 0.00 34.50 32.31 2ec2 s PRO 21 CO 0.08 -0.93 1.42 -0.22 -0.33 0.00 0.00 177.00 177.02 2ec2 h LYS 22 N -0.27 0.28 -6.17 5.54 3.64 -1.65 -3.43 116.57 114.51 2ec2 h LYS 22 Ca -0.45 -0.11 -0.47 0.00 -1.27 0.00 0.00 60.65 58.35 2ec2 h LYS 22 Cb 1.21 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 33.00 2ec2 h LYS 22 CO 0.58 0.59 -0.44 0.71 -2.27 0.00 0.00 179.45 178.62 2ec2 s TYR 23 N -4.68 3.45 0.01 1.91 4.12 -1.26 -4.99 117.35 115.90 2ec2 s TYR 23 Ca -0.14 -0.01 0.00 0.00 0.02 0.00 0.00 57.07 56.94 2ec2 s TYR 23 Cb 0.05 -1.58 0.00 0.00 -1.52 0.00 0.00 41.96 38.91 2ec2 s TYR 23 CO 0.73 0.45 0.00 2.89 0.02 0.00 0.00 175.55 179.64 2ec2 n ARG 24 N -1.31 0.00 0.00 -0.62 -4.01 -1.26 -4.75 116.66 104.70 2ec2 n ARG 24 Ca -0.09 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.72 2ec2 n ARG 24 Cb 0.57 -0.27 0.00 0.00 -3.04 0.00 0.00 32.46 29.72 2ec2 n ARG 24 CO 0.00 0.00 0.00 2.89 -3.04 0.00 0.00 177.63 177.48 2ec2 n ARG 25 N -2.79 0.00 0.00 2.89 0.00 -1.26 -2.21 116.66 113.29 2ec2 n ARG 25 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 2ec2 n ARG 25 Cb 0.26 -1.38 0.00 0.00 -0.00 0.00 0.00 32.46 31.34 2ec2 n ARG 25 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.63 177.99 2ec2 n LYS 26 N -0.54 0.00 -0.07 2.89 2.85 -1.26 -5.07 118.16 116.96 2ec2 n LYS 26 Ca 0.00 0.00 -0.00 0.00 -1.05 0.00 0.00 58.31 57.26 2ec2 n LYS 26 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 2ec2 n LYS 26 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 2ec2 n VAL 27 N 0.00 -0.09 -1.20 0.58 0.31 -0.94 -2.88 118.33 114.10 2ec2 n VAL 27 Ca 0.00 0.40 -0.35 0.00 -0.01 0.00 0.00 64.34 64.37 2ec2 n VAL 27 Cb 0.00 -0.52 -0.03 0.00 -0.91 0.00 0.00 33.84 32.38 2ec2 n VAL 27 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2ec2 n LEU 28 N -4.25 7.59 0.00 7.52 4.77 -1.24 -4.74 117.00 126.65 2ec2 n LEU 28 Ca 0.02 -3.96 0.00 0.00 -0.03 0.00 0.00 56.01 52.03 2ec2 n LEU 28 Cb 0.07 -1.45 0.00 0.00 -2.33 0.00 0.00 43.42 39.71 2ec2 n LEU 28 CO -0.02 1.59 0.00 0.35 -1.33 0.00 0.00 177.39 177.97 2ec2 n THR 29 N 3.92 0.00 0.00 -5.08 -2.24 -1.14 -2.90 114.28 106.84 2ec2 n THR 29 Ca 0.68 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.46 2ec2 n THR 29 Cb 0.22 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.45 2ec2 n THR 29 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ec2 n GLY 30 N 1.01 2.04 0.29 3.38 0.00 -1.26 -1.13 105.19 109.52 2ec2 n GLY 30 Ca 0.00 0.13 -0.07 0.00 0.00 0.00 0.00 46.02 46.09 2ec2 n GLY 30 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2ec2 h GLU 31 N 0.00 0.88 0.43 1.61 5.08 -1.98 -2.81 114.58 117.79 2ec2 h GLU 31 Ca 0.00 -0.28 -0.01 0.00 -1.00 0.00 0.00 59.36 58.07 2ec2 h GLU 31 Cb 0.00 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 2ec2 h GLU 31 CO 0.00 0.91 -0.32 0.28 -1.00 0.00 0.00 179.01 178.88 2ec2 h VAL 32 N 0.80 0.35 -0.86 3.13 2.07 -1.61 0.31 116.25 120.44 2ec2 h VAL 32 Ca 0.14 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.83 2ec2 h VAL 32 Cb 0.55 0.35 -0.10 0.00 -1.52 0.00 0.00 31.29 30.57 2ec2 h VAL 32 CO 0.03 0.00 0.42 0.00 0.02 0.00 0.00 177.57 178.04 2ec2 h ALA 33 N -0.26 1.31 -0.28 1.67 0.00 -1.06 0.10 119.26 120.74 2ec2 h ALA 33 Ca -0.04 0.11 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 2ec2 h ALA 33 Cb 0.62 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 2ec2 h ALA 33 CO 0.01 -0.16 -0.26 1.49 0.00 0.00 0.00 179.25 180.33 2ec2 h GLU 34 N 0.56 0.68 -0.16 0.00 4.81 -1.18 -2.87 114.58 116.42 2ec2 h GLU 34 Ca 0.49 -0.35 -0.16 0.00 -0.13 0.00 0.00 59.36 59.21 2ec2 h GLU 34 Cb 0.76 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.14 2ec2 h GLU 34 CO -0.41 0.96 -0.57 -0.92 -0.73 0.00 0.00 179.01 177.35 2ec2 h TYR 35 N 0.42 0.62 -0.61 0.92 3.20 -0.38 -2.95 116.97 118.19 2ec2 h TYR 35 Ca 0.05 -0.22 -0.01 0.00 3.14 0.00 0.00 58.73 61.69 2ec2 h TYR 35 Cb 0.83 -0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.95 2ec2 h TYR 35 CO 0.07 0.94 0.35 1.15 -1.64 0.00 0.00 178.16 179.04 2ec2 h THR 36 N 0.37 1.19 -0.85 1.81 2.02 -0.83 0.32 112.91 116.95 2ec2 h THR 36 Ca 0.00 -0.44 0.05 0.00 0.77 0.00 0.00 66.41 66.79 2ec2 h THR 36 Cb 1.10 0.38 -0.06 0.00 -1.74 0.00 0.00 68.15 67.84 2ec2 h THR 36 CO 0.10 0.20 0.53 0.50 0.37 0.00 0.00 175.52 177.22 2ec2 h LYS 37 N 0.82 0.97 0.42 6.66 3.64 -1.45 -0.61 116.57 127.02 2ec2 h LYS 37 Ca 0.22 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.52 2ec2 h LYS 37 Cb 0.01 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 31.61 2ec2 h LYS 37 CO -0.04 0.64 -0.20 1.49 -2.27 0.00 0.00 179.45 179.08 2ec2 h GLU 38 N 1.00 -0.54 0.32 1.90 4.81 -1.22 -1.72 114.58 119.13 2ec2 h GLU 38 Ca 0.36 0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.61 2ec2 h GLU 38 Cb 0.10 0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.61 2ec2 h GLU 38 CO -0.15 -0.23 -0.15 -0.39 -0.73 0.00 0.00 179.01 177.36 2ec2 h VAL 39 N -0.87 0.70 -0.87 0.32 -1.51 -0.85 -1.59 116.25 111.58 2ec2 h VAL 39 Ca -0.06 -0.10 0.20 0.00 -1.23 0.00 0.00 66.70 65.51 2ec2 h VAL 39 Cb 0.55 0.76 -0.12 0.00 -2.13 0.00 0.00 31.29 30.35 2ec2 h VAL 39 CO 0.09 0.02 0.38 -0.07 -1.23 0.00 0.00 177.57 176.77 2ec2 h LEU 40 N -0.49 0.33 0.06 4.19 3.38 -1.18 1.43 115.31 123.03 2ec2 h LEU 40 Ca -0.04 0.14 0.02 0.00 0.09 0.00 0.00 57.88 58.09 2ec2 h LEU 40 Cb 0.37 0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 2ec2 h LEU 40 CO 0.07 0.03 -0.18 0.03 0.09 0.00 0.00 178.44 178.48 2ec2 h ARG 41 N 0.42 -0.32 0.00 1.13 3.08 -0.73 -0.55 114.38 117.42 2ec2 h ARG 41 Ca 0.53 0.02 -0.07 0.00 0.07 0.00 0.00 59.98 60.53 2ec2 h ARG 41 Cb 0.97 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 31.08 2ec2 h ARG 41 CO -0.50 -0.21 -0.34 0.00 -1.07 0.00 0.00 179.97 177.85 2ec2 h THR 42 N -0.33 0.84 0.21 2.04 1.03 0.12 -1.49 112.91 115.34 2ec2 h THR 42 Ca 0.04 -1.39 -0.01 0.00 -0.01 0.00 0.00 66.41 65.03 2ec2 h THR 42 Cb 0.37 1.86 0.00 0.00 -1.07 0.00 0.00 68.15 69.31 2ec2 h THR 42 CO -0.13 0.33 -0.10 0.40 -0.01 0.00 0.00 175.52 176.01 2ec2 h ILE 43 N 0.00 0.87 0.30 0.00 2.04 0.24 -2.06 117.51 118.90 2ec2 h ILE 43 Ca -0.00 -0.51 -0.00 0.00 1.00 0.00 0.00 64.86 65.35 2ec2 h ILE 43 Cb 0.83 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 38.06 2ec2 h ILE 43 CO 0.04 0.11 -0.27 0.00 0.00 0.00 0.00 178.15 178.04 2ec2 h ALA 44 N 0.18 -0.59 -0.99 1.87 0.00 -1.06 -2.37 119.26 116.31 2ec2 h ALA 44 Ca -0.03 -0.09 0.31 0.00 0.00 0.00 0.00 54.91 55.10 2ec2 h ALA 44 Cb 0.40 0.38 -0.15 0.00 0.00 0.00 0.00 17.79 18.42 2ec2 h ALA 44 CO 0.05 -0.86 0.51 0.93 0.00 0.00 0.00 179.25 179.88 2ec2 h GLU 45 N -0.59 0.28 -0.03 0.00 5.08 -1.24 0.11 114.58 118.18 2ec2 h GLU 45 Ca -0.02 -0.02 -0.14 0.00 -1.00 0.00 0.00 59.36 58.19 2ec2 h GLU 45 Cb 0.53 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.71 2ec2 h GLU 45 CO -0.04 0.18 -0.60 1.49 -1.00 0.00 0.00 179.01 179.04 2ec2 h GLU 46 N 0.29 0.11 0.00 2.33 4.81 -0.84 -2.71 114.58 118.56 2ec2 h GLU 46 Ca 0.71 -0.08 -0.03 0.00 -0.13 0.00 0.00 59.36 59.83 2ec2 h GLU 46 Cb 1.62 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 31.01 2ec2 h GLU 46 CO -0.63 0.68 -0.16 -0.07 -0.73 0.00 0.00 179.01 178.10 2ec2 h LEU 47 N 0.08 0.00 0.00 1.64 3.38 -0.76 -3.47 115.31 116.19 2ec2 h LEU 47 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2ec2 h LEU 47 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 2ec2 h LEU 47 CO 0.09 0.16 0.00 0.61 0.09 0.00 0.00 178.44 179.39 2ec2 n GLY 48 N 0.34 1.83 4.01 0.83 0.00 -0.90 -4.92 105.19 106.38 2ec2 n GLY 48 Ca 0.01 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.83 2ec2 n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ec2 s GLU 50 N -4.52 0.54 -0.25 0.00 2.12 -0.51 -4.18 118.70 111.90 2ec2 s GLU 50 Ca 0.57 -0.27 -0.29 0.00 0.36 0.00 0.00 54.97 55.34 2ec2 s GLU 50 Cb -0.06 -1.86 -0.02 0.00 0.26 0.00 0.00 34.13 32.45 2ec2 s GLU 50 CO 0.35 -0.59 1.66 0.08 -0.54 0.00 0.00 175.26 176.22 2ec2 s VAL 51 N 1.93 3.64 -0.05 3.70 1.01 -1.26 -2.28 120.40 127.08 2ec2 s VAL 51 Ca 0.01 0.70 0.13 0.00 0.00 0.00 0.00 61.98 62.82 2ec2 s VAL 51 Cb -0.16 -3.70 -0.15 0.00 0.00 0.00 0.00 36.38 32.38 2ec2 s VAL 51 CO -0.08 -0.33 0.98 -0.07 0.00 0.00 0.00 175.10 175.60 2ec2 h LEU 52 N 12.18 0.00 -7.00 3.92 3.38 -0.41 -3.49 115.31 123.89 2ec2 h LEU 52 Ca -0.34 0.00 0.11 0.00 0.09 0.00 0.00 57.88 57.75 2ec2 h LEU 52 Cb 1.16 0.00 -0.26 0.00 0.09 0.00 0.00 40.66 41.64 2ec2 h LEU 52 CO 1.01 0.79 0.62 0.00 0.09 0.00 0.00 178.44 180.95 2ec2 s ALA 53 N -2.78 -2.02 -0.47 1.53 0.00 -1.07 -4.96 121.76 111.99 2ec2 s ALA 53 Ca -0.01 1.74 0.06 0.00 0.00 0.00 0.00 51.96 53.75 2ec2 s ALA 53 Cb 0.09 -1.24 0.20 0.00 0.00 0.00 0.00 23.12 22.17 2ec2 s ALA 53 CO 0.81 -0.24 0.61 -0.11 0.00 0.00 0.00 175.76 176.83 2ec2 n LEU 54 N 1.34 -2.08 -4.67 0.00 7.94 -1.26 -1.86 117.00 116.40 2ec2 n LEU 54 Ca -0.10 -3.62 -0.42 0.00 -1.11 0.00 0.00 56.01 50.77 2ec2 n LEU 54 Cb 0.57 0.70 -0.03 0.00 0.53 0.00 0.00 43.42 45.18 2ec2 n LEU 54 CO 0.08 1.94 0.69 -1.61 -1.11 0.00 0.00 177.39 177.38 2ec2 s GLU 55 N 0.37 4.33 -0.81 1.96 8.01 -1.10 -4.96 118.70 126.50 2ec2 s GLU 55 Ca 0.32 1.15 0.01 0.00 0.01 0.00 0.00 54.97 56.46 2ec2 s GLU 55 Cb 0.07 -3.57 0.22 0.00 -4.31 0.00 0.00 34.13 26.54 2ec2 s GLU 55 CO -0.13 -0.35 0.76 0.28 0.01 0.00 0.00 175.26 175.83 2ec2 n VAL 56 N 4.72 2.71 -3.18 2.63 0.31 -1.26 -0.98 118.33 123.28 2ec2 n VAL 56 Ca 0.06 -5.14 -0.34 0.00 -0.01 0.00 0.00 64.34 58.91 2ec2 n VAL 56 Cb 0.49 -2.25 -0.06 0.00 -0.91 0.00 0.00 33.84 31.11 2ec2 n VAL 56 CO 0.00 0.00 0.00 -0.04 -1.32 0.00 0.00 176.83 175.47 2ec2 s MET 57 N -1.74 4.08 0.49 5.55 -1.94 -0.70 -4.86 119.30 120.18 2ec2 s MET 57 Ca 0.30 0.69 0.37 0.00 -1.71 0.00 0.00 55.69 55.33 2ec2 s MET 57 Cb -0.01 -2.72 1.53 0.00 2.01 0.00 0.00 34.83 35.64 2ec2 s MET 57 CO -0.10 0.32 1.63 -1.35 -0.01 0.00 0.00 175.02 175.52 2ec2 h PRO 58 N 2.98 0.06 0.00 2.03 0.11 -1.83 0.26 132.00 135.61 2ec2 h PRO 58 Ca -0.48 -0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.47 2ec2 h PRO 58 Cb 1.18 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 2ec2 h PRO 58 CO 0.66 0.04 -1.17 0.38 -0.21 0.00 0.00 178.00 177.69 2ec2 h ASP 59 N 0.06 0.00 -5.11 -2.05 2.03 -1.88 -3.30 116.42 106.16 2ec2 h ASP 59 Ca 0.82 0.00 -0.02 0.00 -0.73 0.00 0.00 57.03 57.10 2ec2 h ASP 59 Cb 2.87 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 41.32 2ec2 h ASP 59 CO -0.24 0.60 0.12 -1.38 -1.03 0.00 0.00 179.24 177.31 2ec2 s HIS 60 N -2.91 0.15 -0.02 4.15 -3.43 0.90 -4.30 115.29 109.83 2ec2 s HIS 60 Ca -0.01 -0.63 0.06 0.00 -0.80 0.00 0.00 55.06 53.68 2ec2 s HIS 60 Cb 0.08 0.55 -0.01 0.00 -1.43 0.00 0.00 32.58 31.77 2ec2 s HIS 60 CO 0.80 -1.27 -0.19 0.42 -2.00 0.00 0.00 174.74 172.50 2ec2 s ILE 61 N -3.40 1.54 -0.13 -5.38 1.01 0.34 -1.72 121.20 113.45 2ec2 s ILE 61 Ca 0.17 -0.83 0.02 0.00 0.00 0.00 0.00 60.65 60.01 2ec2 s ILE 61 Cb -0.04 -1.29 0.01 0.00 0.01 0.00 0.00 42.46 41.16 2ec2 s ILE 61 CO 0.10 0.44 -0.18 -2.28 0.00 0.00 0.00 174.94 173.01 2ec2 s HIS 62 N -0.39 2.36 -0.19 3.97 5.65 -0.15 -2.40 115.29 124.13 2ec2 s HIS 62 Ca 0.06 -1.20 -0.02 0.00 0.25 0.00 0.00 55.06 54.15 2ec2 s HIS 62 Cb -0.08 -1.65 0.06 0.00 -1.18 0.00 0.00 32.58 29.72 2ec2 s HIS 62 CO -0.00 -0.58 0.02 -1.17 -0.65 0.00 0.00 174.74 172.35 2ec2 s LEU 63 N 0.98 1.41 -0.19 8.88 2.96 0.02 -2.71 118.68 130.03 2ec2 s LEU 63 Ca -0.05 -0.84 -0.05 0.00 -0.22 0.00 0.00 54.13 52.96 2ec2 s LEU 63 Cb -0.15 -0.70 -0.03 0.00 0.50 0.00 0.00 46.19 45.81 2ec2 s LEU 63 CO -0.03 -0.28 0.01 0.12 -1.32 0.00 0.00 176.35 174.84 2ec2 s PHE 64 N 1.77 3.08 -0.07 5.38 5.36 -0.78 -0.05 117.98 132.68 2ec2 s PHE 64 Ca -0.01 -0.32 -0.13 0.00 -0.96 0.00 0.00 56.93 55.51 2ec2 s PHE 64 Cb -0.17 -2.08 0.03 0.00 -0.34 0.00 0.00 43.02 40.46 2ec2 s PHE 64 CO -0.08 -0.14 0.31 0.14 -1.46 0.00 0.00 175.22 173.99 2ec2 s VAL 65 N 0.83 0.03 -0.01 3.12 -7.23 -0.55 0.41 120.40 117.00 2ec2 s VAL 65 Ca 0.01 -0.26 -0.12 0.00 -1.81 0.00 0.00 61.98 59.81 2ec2 s VAL 65 Cb -0.14 -0.52 -0.05 0.00 0.56 0.00 0.00 36.38 36.22 2ec2 s VAL 65 CO 0.02 -0.14 0.35 0.21 -0.31 0.00 0.00 175.10 175.23 2ec2 s ASN 66 N -0.60 6.68 -0.18 4.85 3.04 -0.96 -0.83 114.94 126.93 2ec2 s ASN 66 Ca -0.07 0.81 -0.12 0.00 0.04 0.00 0.00 52.86 53.52 2ec2 s ASN 66 Cb -0.04 -2.19 0.06 0.00 -1.54 0.00 0.00 41.25 37.53 2ec2 s ASN 66 CO 0.02 0.31 0.45 0.00 -3.04 0.00 0.00 177.10 174.84 2ec2 n PRO 68 N 3.75 0.00 0.05 0.00 -0.02 -1.26 -4.47 135.00 133.04 2ec2 n PRO 68 Ca -0.19 0.00 0.08 0.00 -2.02 0.00 0.00 63.50 61.36 2ec2 n PRO 68 Cb 0.56 -0.90 0.34 0.00 -0.02 0.00 0.00 33.50 33.48 2ec2 n PRO 68 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2ec2 n PRO 69 N 1.14 0.06 0.00 0.52 -0.04 -1.26 -3.12 135.00 132.31 2ec2 n PRO 69 Ca 0.11 0.35 0.15 0.00 -0.04 0.00 0.00 63.50 64.07 2ec2 n PRO 69 Cb 0.33 -1.63 0.73 0.00 -0.04 0.00 0.00 33.50 32.89 2ec2 n PRO 69 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 2ec2 n ARG 70 N -1.75 0.83 -3.67 0.54 1.85 -1.26 -4.76 116.66 108.43 2ec2 n ARG 70 Ca 0.02 -0.20 -0.37 0.00 -1.00 0.00 0.00 57.85 56.31 2ec2 n ARG 70 Cb 0.16 -1.50 -0.11 0.00 -1.05 0.00 0.00 32.46 29.97 2ec2 n ARG 70 CO 0.00 0.00 0.00 0.71 -0.01 0.00 0.00 177.63 178.33 2ec2 s TYR 71 N -2.31 3.24 0.44 2.89 2.02 -1.18 -5.09 117.35 117.36 2ec2 s TYR 71 Ca 0.35 0.08 -0.23 0.00 -0.37 0.00 0.00 57.07 56.90 2ec2 s TYR 71 Cb 0.21 -2.29 -0.08 0.00 -0.40 0.00 0.00 41.96 39.39 2ec2 s TYR 71 CO 0.43 -0.08 1.14 0.00 -1.57 0.00 0.00 175.55 175.47 2ec2 s ALA 72 N 1.36 3.01 0.18 3.71 0.00 -1.26 -4.93 121.76 123.83 2ec2 s ALA 72 Ca 0.07 0.88 -0.13 0.00 0.00 0.00 0.00 51.96 52.78 2ec2 s ALA 72 Cb -0.15 -3.36 0.15 0.00 0.00 0.00 0.00 23.12 19.77 2ec2 s ALA 72 CO 0.07 -0.54 1.77 -1.35 0.00 0.00 0.00 175.76 175.70 2ec2 h PRO 73 N 2.19 0.40 -0.71 0.00 0.11 -1.98 -1.44 132.00 130.56 2ec2 h PRO 73 Ca -0.49 -0.02 0.14 0.00 0.11 0.00 0.00 66.00 65.73 2ec2 h PRO 73 Cb 1.24 -0.09 -0.13 0.00 0.11 0.00 0.00 31.00 32.12 2ec2 h PRO 73 CO 0.61 0.27 -0.25 0.77 -0.21 0.00 0.00 178.00 179.18 2ec2 h SER 74 N 0.41 -0.90 0.03 -2.05 0.02 -1.98 0.44 113.55 109.51 2ec2 h SER 74 Ca 0.23 0.23 0.01 0.00 -0.84 0.00 0.00 61.79 61.42 2ec2 h SER 74 Cb 0.19 0.52 -0.01 0.00 0.14 0.00 0.00 62.40 63.24 2ec2 h SER 74 CO -0.20 -0.27 -0.07 0.22 -1.14 0.00 0.00 176.83 175.37 2ec2 h TYR 75 N -0.06 -0.18 0.92 3.45 3.20 -1.88 0.14 116.97 122.57 2ec2 h TYR 75 Ca 0.32 0.00 -0.05 0.00 3.14 0.00 0.00 58.73 62.15 2ec2 h TYR 75 Cb 0.55 0.08 0.01 0.00 1.54 0.00 0.00 36.73 38.91 2ec2 h TYR 75 CO -0.63 -0.11 -0.44 -0.07 -1.64 0.00 0.00 178.16 175.26 2ec2 h LEU 76 N -0.14 -1.05 -0.77 2.82 3.38 0.30 0.55 115.31 120.40 2ec2 h LEU 76 Ca 0.02 0.04 0.17 0.00 0.09 0.00 0.00 57.88 58.19 2ec2 h LEU 76 Cb 0.16 0.27 -0.14 0.00 0.09 0.00 0.00 40.66 41.04 2ec2 h LEU 76 CO -0.06 -0.74 -0.09 0.00 0.09 0.00 0.00 178.44 177.65 2ec2 h ALA 77 N -1.40 0.66 0.00 1.53 0.00 -0.28 0.19 119.26 119.96 2ec2 h ALA 77 Ca -0.13 0.27 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 2ec2 h ALA 77 Cb 0.95 0.51 -0.01 0.00 0.00 0.00 0.00 17.79 19.23 2ec2 h ALA 77 CO 0.21 -0.43 -0.50 -0.91 0.00 0.00 0.00 179.25 177.63 2ec2 h ASN 78 N 0.04 0.00 -0.23 0.00 2.35 -0.41 0.93 115.58 118.27 2ec2 h ASN 78 Ca 0.40 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 56.06 2ec2 h ASN 78 Cb 0.66 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.03 2ec2 h ASN 78 CO -0.74 0.50 -0.19 0.22 -1.65 0.00 0.00 177.43 175.57 2ec2 h TYR 79 N 0.00 0.63 0.59 1.19 3.20 0.21 0.41 116.97 123.20 2ec2 h TYR 79 Ca -0.00 -0.18 -0.03 0.00 3.14 0.00 0.00 58.73 61.66 2ec2 h TYR 79 Cb 0.93 -0.14 0.01 0.00 1.54 0.00 0.00 36.73 39.07 2ec2 h TYR 79 CO 0.00 0.85 -0.28 0.74 -1.64 0.00 0.00 178.16 177.82 2ec2 h PHE 80 N 0.23 -0.73 -0.68 -3.82 0.04 -0.51 -1.10 116.94 110.37 2ec2 h PHE 80 Ca 0.04 -0.02 0.03 0.00 2.80 0.00 0.00 57.97 60.82 2ec2 h PHE 80 Cb 0.72 0.24 -0.04 0.00 2.20 0.00 0.00 35.95 39.07 2ec2 h PHE 80 CO 0.07 -0.40 0.42 0.87 -0.60 0.00 0.00 178.31 178.67 2ec2 h LYS 81 N -0.98 0.80 0.51 1.51 1.57 -0.85 -2.08 116.57 117.04 2ec2 h LYS 81 Ca -0.08 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.63 2ec2 h LYS 81 Cb 0.66 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.78 2ec2 h LYS 81 CO 0.13 0.53 -0.38 0.78 -0.57 0.00 0.00 179.45 179.94 2ec2 h GLY 82 N 0.82 -1.11 1.26 3.86 0.00 -0.13 -2.92 103.07 104.85 2ec2 h GLY 82 Ca 0.27 0.48 -0.20 0.00 0.00 0.00 0.00 47.33 47.88 2ec2 h GLY 82 CO -0.11 -0.36 -0.68 0.50 0.00 0.00 0.00 176.54 175.89 2ec2 h LYS 83 N -0.85 0.75 -0.32 4.80 6.56 -1.16 -2.97 116.57 123.38 2ec2 h LYS 83 Ca -0.07 -0.55 0.06 0.00 -1.06 0.00 0.00 60.65 59.04 2ec2 h LYS 83 Cb 0.71 0.10 -0.06 0.00 -0.57 0.00 0.00 32.23 32.40 2ec2 h LYS 83 CO 0.02 1.17 -0.08 0.66 -2.06 0.00 0.00 179.45 179.16 2ec2 h SER 84 N 0.54 -0.30 -0.73 0.86 4.64 -1.46 -1.98 113.55 115.12 2ec2 h SER 84 Ca -0.02 0.10 0.07 0.00 -0.47 0.00 0.00 61.79 61.46 2ec2 h SER 84 Cb 1.28 0.20 -0.05 0.00 -0.31 0.00 0.00 62.40 63.53 2ec2 h SER 84 CO 0.14 -0.11 0.48 0.00 -0.87 0.00 0.00 176.83 176.47 2ec2 h ALA 85 N 1.31 1.71 -0.27 5.18 0.00 -1.37 0.91 119.26 126.72 2ec2 h ALA 85 Ca 0.15 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.90 2ec2 h ALA 85 Cb 0.23 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2ec2 h ALA 85 CO -0.33 0.18 -0.42 -0.09 0.00 0.00 0.00 179.25 178.59 2ec2 h ARG 86 N 0.75 0.67 0.14 0.00 2.43 -1.23 -1.94 114.38 115.21 2ec2 h ARG 86 Ca 0.31 -0.36 -0.29 0.00 -0.81 0.00 0.00 59.98 58.83 2ec2 h ARG 86 Cb 0.27 0.01 0.03 0.00 -0.42 0.00 0.00 29.97 29.86 2ec2 h ARG 86 CO -0.10 0.97 -1.23 -0.07 -1.51 0.00 0.00 179.97 178.02 2ec2 h LEU 87 N 0.55 0.83 -0.53 3.80 3.38 -0.57 -2.92 115.31 119.85 2ec2 h LEU 87 Ca 0.04 -0.85 -0.11 0.00 0.09 0.00 0.00 57.88 57.05 2ec2 h LEU 87 Cb 0.96 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.42 2ec2 h LEU 87 CO 0.09 1.60 -0.11 0.40 0.09 0.00 0.00 178.44 180.51 2ec2 h ILE 88 N 0.18 1.27 -0.12 1.22 2.04 -0.92 -3.09 117.51 118.09 2ec2 h ILE 88 Ca -0.19 -1.26 -0.15 0.00 1.00 0.00 0.00 64.86 64.25 2ec2 h ILE 88 Cb 1.92 0.99 0.01 0.00 -0.74 0.00 0.00 36.82 39.00 2ec2 h ILE 88 CO 0.23 0.44 -0.53 -0.07 0.00 0.00 0.00 178.15 178.23 2ec2 h LEU 89 N 0.88 0.68 -1.86 1.44 3.38 -1.41 0.01 115.31 118.43 2ec2 h LEU 89 Ca 0.14 -0.63 0.00 0.00 0.09 0.00 0.00 57.88 57.48 2ec2 h LEU 89 Cb 0.67 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.22 2ec2 h LEU 89 CO 0.05 1.19 0.00 0.11 0.09 0.00 0.00 178.44 179.88 2ec2 h LYS 90 N 0.20 0.00 0.00 1.13 1.57 -1.57 -2.95 116.57 114.96 2ec2 h LYS 90 Ca -0.03 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.55 2ec2 h LYS 90 Cb 1.16 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.44 2ec2 h LYS 90 CO 0.11 0.00 -1.56 1.17 -0.57 0.00 0.00 179.45 178.60 2ec2 n LYS 91 N -2.57 0.55 -2.48 3.15 3.00 -0.96 -4.49 118.16 114.36 2ec2 n LYS 91 Ca -0.01 0.29 -0.41 0.00 -0.00 0.00 0.00 58.31 58.18 2ec2 n LYS 91 Cb 0.08 -1.50 0.01 0.00 0.00 0.00 0.00 35.03 33.62 2ec2 n LYS 91 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 2ec2 n PHE 92 N -4.39 2.73 -0.01 5.64 3.01 -0.05 -4.79 117.46 119.60 2ec2 n PHE 92 Ca -0.30 -2.61 0.23 0.00 1.01 0.00 0.00 57.45 55.77 2ec2 n PHE 92 Cb 0.65 -1.34 0.72 0.00 -0.01 0.00 0.00 39.48 39.50 2ec2 n PHE 92 CO 0.00 0.00 0.00 1.96 1.01 0.00 0.00 176.76 179.73 2ec2 h GLN 93 N 4.27 0.00 -0.57 -1.08 4.20 -1.74 0.86 115.11 121.05 2ec2 h GLN 93 Ca 0.58 0.00 0.11 0.00 0.06 0.00 0.00 58.65 59.40 2ec2 h GLN 93 Cb 0.31 0.00 -0.11 0.00 0.30 0.00 0.00 27.48 27.99 2ec2 h GLN 93 CO 1.25 0.00 -0.13 1.49 -0.67 0.00 0.00 178.83 180.76 2ec2 h GLU 94 N 0.00 0.00 0.00 1.46 4.81 -1.87 -0.49 114.58 118.49 2ec2 h GLU 94 Ca 0.28 -0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.48 2ec2 h GLU 94 Cb 1.27 -0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.65 2ec2 h GLU 94 CO -0.00 0.00 -0.14 1.25 -0.73 0.00 0.00 179.01 179.39 2ec2 h LEU 95 N 0.01 0.00 -0.86 1.64 5.85 0.38 -1.85 115.31 120.47 2ec2 h LEU 95 Ca 0.27 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.92 2ec2 h LEU 95 Cb 0.42 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.42 2ec2 h LEU 95 CO -0.58 0.14 0.08 0.50 -0.34 0.00 0.00 178.44 178.24 2ec2 h LYS 96 N 0.00 0.93 0.07 1.25 3.64 -0.62 0.18 116.57 122.02 2ec2 h LYS 96 Ca -0.00 -0.23 -0.00 0.00 -1.27 0.00 0.00 60.65 59.14 2ec2 h LYS 96 Cb 0.75 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.45 2ec2 h LYS 96 CO 0.02 0.87 -0.04 0.87 -2.27 0.00 0.00 179.45 178.90 2ec2 h LYS 97 N 0.88 -0.10 0.00 1.90 1.57 -0.81 0.13 116.57 120.14 2ec2 h LYS 97 Ca 0.18 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 2ec2 h LYS 97 Cb 0.40 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.74 2ec2 h LYS 97 CO 0.01 0.33 0.00 0.66 -0.57 0.00 0.00 179.45 179.88 2ec2 h SER 98 N -0.56 0.00 0.47 0.86 4.64 -1.33 -2.71 113.55 114.93 2ec2 h SER 98 Ca -0.01 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.16 2ec2 h SER 98 Cb 0.47 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.53 2ec2 h SER 98 CO 0.02 0.00 -1.66 1.07 -0.87 0.00 0.00 176.83 175.39 2ec2 n THR 99 N -3.07 0.94 -3.45 2.95 5.66 0.62 -5.01 114.28 112.93 2ec2 n THR 99 Ca 0.01 -0.67 -0.20 0.00 -3.05 0.00 0.00 64.05 60.14 2ec2 n THR 99 Cb 0.30 -0.51 0.06 0.00 -1.55 0.00 0.00 70.33 68.63 2ec2 n THR 99 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 2ec2 n ASN 100 N -2.72 -4.54 0.00 1.09 3.02 0.40 -3.46 115.26 109.04 2ec2 n ASN 100 Ca -0.12 -0.77 0.00 0.00 -0.03 0.00 0.00 54.58 53.66 2ec2 n ASN 100 Cb 0.82 -4.64 0.00 0.00 -0.61 0.00 0.00 39.78 35.35 2ec2 n ASN 100 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ec2 n GLY 101 N -1.36 1.15 3.38 7.41 0.00 -0.94 -4.91 105.19 109.93 2ec2 n GLY 101 Ca -0.16 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.42 2ec2 n GLY 101 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ec2 s LYS 102 N 0.00 3.11 -0.02 1.61 1.02 -1.22 -4.89 119.74 119.34 2ec2 s LYS 102 Ca 0.00 -1.35 0.01 0.00 0.02 0.00 0.00 55.97 54.65 2ec2 s LYS 102 Cb 0.00 -4.31 -0.26 0.00 -0.52 0.00 0.00 37.83 32.74 2ec2 s LYS 102 CO 0.00 -1.57 0.76 1.25 -0.92 0.00 0.00 175.35 174.86 2ec2 h LEU 103 N 10.04 0.26 -9.83 3.17 5.85 -1.91 -3.43 115.31 119.46 2ec2 h LEU 103 Ca -0.25 -0.42 -0.58 0.00 0.84 0.00 0.00 57.88 57.48 2ec2 h LEU 103 Cb 1.08 -0.08 -0.09 0.00 0.37 0.00 0.00 40.66 41.93 2ec2 h LEU 103 CO 1.10 1.36 -0.53 0.26 -0.34 0.00 0.00 178.44 180.29 2ec2 s TRP 104 N -2.61 2.59 0.87 1.25 0.52 -1.26 -2.27 118.94 118.03 2ec2 s TRP 104 Ca -0.09 -0.57 -0.12 0.00 0.02 0.00 0.00 56.10 55.34 2ec2 s TRP 104 Cb 0.07 -1.87 0.11 0.00 -1.15 0.00 0.00 33.47 30.64 2ec2 s TRP 104 CO 0.83 0.26 1.14 0.95 0.02 0.00 0.00 176.95 180.15 2ec2 s THR 105 N -2.60 2.24 -1.84 2.01 -4.23 -1.14 -4.35 115.64 105.72 2ec2 s THR 105 Ca 0.39 0.08 0.13 0.00 -1.18 0.00 0.00 61.69 61.11 2ec2 s THR 105 Cb 0.04 -2.87 0.41 0.00 1.34 0.00 0.00 72.50 71.41 2ec2 s THR 105 CO 0.22 -0.10 1.32 0.54 -0.54 0.00 0.00 174.62 176.06 2ec2 n ARG 106 N -3.61 2.19 -4.43 3.99 3.00 -1.26 -4.90 116.66 111.63 2ec2 n ARG 106 Ca 0.07 -1.65 -0.21 0.00 -0.01 0.00 0.00 57.85 56.04 2ec2 n ARG 106 Cb 0.59 -1.42 -0.10 0.00 0.00 0.00 0.00 32.46 31.53 2ec2 n ARG 106 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 2ec2 s SER 107 N -0.94 2.74 -0.03 0.55 1.04 -1.26 -5.16 113.70 110.64 2ec2 s SER 107 Ca 0.30 -1.21 -0.29 0.00 0.48 0.00 0.00 55.95 55.23 2ec2 s SER 107 Cb 0.17 -0.16 0.11 0.00 0.10 0.00 0.00 66.02 66.23 2ec2 s SER 107 CO 0.19 -0.37 0.90 -0.72 0.98 0.00 0.00 173.24 174.22 2ec2 s TYR 108 N -3.04 -0.36 -0.06 5.02 -0.85 -1.26 -4.69 117.35 112.11 2ec2 s TYR 108 Ca 0.30 0.31 0.04 0.00 -0.52 0.00 0.00 57.07 57.21 2ec2 s TYR 108 Cb 0.04 0.52 -0.02 0.00 0.38 0.00 0.00 41.96 42.88 2ec2 s TYR 108 CO 0.12 -0.51 -0.17 0.12 -1.52 0.00 0.00 175.55 173.59 2ec2 s PHE 109 N -2.72 2.64 -0.05 -3.49 2.19 0.37 -4.98 117.98 111.94 2ec2 s PHE 109 Ca 0.03 -0.36 0.01 0.00 0.33 0.00 0.00 56.93 56.94 2ec2 s PHE 109 Cb -0.01 -1.65 0.02 0.00 -1.31 0.00 0.00 43.02 40.08 2ec2 s PHE 109 CO -0.07 0.03 -0.04 0.54 1.83 0.00 0.00 175.22 177.52 2ec2 s VAL 110 N -0.45 0.52 -0.06 3.12 0.11 -1.25 -0.58 120.40 121.82 2ec2 s VAL 110 Ca 0.05 -0.09 0.05 0.00 -2.93 0.00 0.00 61.98 59.06 2ec2 s VAL 110 Cb -0.12 -0.57 -0.00 0.00 -1.53 0.00 0.00 36.38 34.16 2ec2 s VAL 110 CO 0.02 0.23 -0.20 -0.55 -3.33 0.00 0.00 175.10 171.28 2ec2 s SER 111 N 1.10 2.47 0.35 3.54 0.15 -0.28 -4.93 113.70 116.10 2ec2 s SER 111 Ca -0.08 -0.41 -0.25 0.00 0.70 0.00 0.00 55.95 55.90 2ec2 s SER 111 Cb -0.14 -0.77 -0.10 0.00 -1.71 0.00 0.00 66.02 63.30 2ec2 s SER 111 CO -0.01 0.17 0.99 0.42 1.20 0.00 0.00 173.24 176.00 2ec2 s THR 112 N 0.08 4.03 0.01 6.45 -4.23 -1.26 -0.20 115.64 120.52 2ec2 s THR 112 Ca -0.06 1.64 0.05 0.00 -1.18 0.00 0.00 61.69 62.13 2ec2 s THR 112 Cb -0.13 -3.88 -0.02 0.00 1.34 0.00 0.00 72.50 69.81 2ec2 s THR 112 CO 0.03 0.09 -0.15 -0.55 -0.54 0.00 0.00 174.62 173.50 2ec2 s SER 113 N -1.59 1.79 0.00 3.99 0.15 -0.98 -4.93 113.70 112.13 2ec2 s SER 113 Ca 0.53 -0.36 0.00 0.00 0.70 0.00 0.00 55.95 56.81 2ec2 s SER 113 Cb -0.20 -0.16 0.00 0.00 -1.71 0.00 0.00 66.02 63.95 2ec2 s SER 113 CO 0.25 0.13 0.00 0.61 1.20 0.00 0.00 173.24 175.43 2ec2 n GLY 114 N 2.32 -0.18 3.20 9.45 0.00 -1.26 -4.22 105.19 114.49 2ec2 n GLY 114 Ca -0.16 -1.65 0.04 0.00 0.00 0.00 0.00 46.02 44.25 2ec2 n GLY 114 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2ec2 s ASN 115 N -2.70 -0.88 -0.24 1.61 3.84 -1.26 -5.15 114.94 110.17 2ec2 s ASN 115 Ca 0.00 0.63 -0.08 0.00 0.21 0.00 0.00 52.86 53.62 2ec2 s ASN 115 Cb 0.00 1.77 -0.03 0.00 -0.55 0.00 0.00 41.25 42.43 2ec2 s ASN 115 CO 0.00 -0.16 0.09 -0.69 -2.79 0.00 0.00 177.10 173.55 2ec2 s VAL 116 N 2.86 4.59 0.31 -5.21 1.01 -1.26 -5.06 120.40 117.64 2ec2 s VAL 116 Ca 0.08 -0.08 -0.27 0.00 0.00 0.00 0.00 61.98 61.70 2ec2 s VAL 116 Cb -0.12 -3.14 -0.09 0.00 0.00 0.00 0.00 36.38 33.03 2ec2 s VAL 116 CO -0.16 0.35 1.00 -0.44 0.00 0.00 0.00 175.10 175.85 2ec2 s SER 117 N 1.40 7.27 0.49 3.32 0.01 -1.26 -4.92 113.70 120.01 2ec2 s SER 117 Ca 0.06 2.00 0.29 0.00 1.31 0.00 0.00 55.95 59.61 2ec2 s SER 117 Cb -0.15 -2.60 1.38 0.00 0.21 0.00 0.00 66.02 64.87 2ec2 s SER 117 CO 0.05 -0.12 1.82 0.28 0.41 0.00 0.00 173.24 175.67 2ec2 h SER 118 N 3.40 0.15 0.57 2.44 0.02 -2.00 -1.86 113.55 116.26 2ec2 h SER 118 Ca -0.47 0.03 -0.22 0.00 -0.84 0.00 0.00 61.79 60.29 2ec2 h SER 118 Cb 1.20 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.71 2ec2 h SER 118 CO 0.65 0.03 -1.59 -1.84 -1.14 0.00 0.00 176.83 172.95 2ec2 n GLU 119 N -4.35 0.63 0.01 3.45 0.28 -1.26 -2.90 120.64 116.50 2ec2 n GLU 119 Ca 0.23 0.23 -0.13 0.00 -0.16 0.00 0.00 57.16 57.33 2ec2 n GLU 119 Cb 1.04 -1.78 -0.02 0.00 1.43 0.00 0.00 31.44 32.12 2ec2 n GLU 119 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2ec2 h THR 120 N 0.00 1.32 -0.55 3.84 1.03 -1.78 0.50 112.91 117.27 2ec2 h THR 120 Ca -0.23 -2.01 0.11 0.00 -0.01 0.00 0.00 66.41 64.27 2ec2 h THR 120 Cb 1.76 1.99 -0.08 0.00 -1.07 0.00 0.00 68.15 70.75 2ec2 h THR 120 CO 0.06 0.62 0.06 0.40 -0.01 0.00 0.00 175.52 176.65 2ec2 h ILE 121 N 0.43 0.62 -0.17 0.00 2.04 -1.49 -1.74 117.51 117.20 2ec2 h ILE 121 Ca -0.03 -0.06 -0.02 0.00 1.00 0.00 0.00 64.86 65.75 2ec2 h ILE 121 Cb 1.32 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 37.81 2ec2 h ILE 121 CO 0.14 0.03 0.04 0.11 0.00 0.00 0.00 178.15 178.47 2ec2 h LYS 122 N 0.19 0.27 -1.12 2.37 1.57 -1.35 -2.68 116.57 115.81 2ec2 h LYS 122 Ca 0.29 -0.07 0.31 0.00 -1.87 0.00 0.00 60.65 59.31 2ec2 h LYS 122 Cb 0.43 -0.04 -0.09 0.00 0.08 0.00 0.00 32.23 32.61 2ec2 h LYS 122 CO -0.41 0.41 0.74 0.87 -0.57 0.00 0.00 179.45 180.49 2ec2 h LYS 123 N 0.08 0.25 0.01 3.15 1.79 0.47 -2.74 116.57 119.58 2ec2 h LYS 123 Ca 0.05 -0.02 -0.00 0.00 -2.18 0.00 0.00 60.65 58.51 2ec2 h LYS 123 Cb 0.26 -0.06 0.00 0.00 -1.58 0.00 0.00 32.23 30.86 2ec2 h LYS 123 CO 0.00 0.17 -0.00 -0.92 -1.08 0.00 0.00 179.45 177.61 2ec2 h TYR 124 N 0.26 -0.01 -0.68 -1.35 3.20 -0.98 -3.30 116.97 114.11 2ec2 h TYR 124 Ca 0.63 -0.00 0.07 0.00 3.14 0.00 0.00 58.73 62.57 2ec2 h TYR 124 Cb 1.85 0.00 -0.10 0.00 1.54 0.00 0.00 36.73 40.03 2ec2 h TYR 124 CO -0.00 0.52 -0.56 0.82 -1.64 0.00 0.00 178.16 177.29 2ec2 h ILE 125 N -0.55 0.00 0.00 1.81 1.08 -1.48 -2.14 117.51 116.24 2ec2 h ILE 125 Ca -0.00 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.47 2ec2 h ILE 125 Cb 0.53 0.00 -0.00 0.00 -3.07 0.00 0.00 36.82 34.29 2ec2 h ILE 125 CO 0.00 0.00 -0.01 1.05 -0.69 0.00 0.00 178.15 178.50 2ec2 h GLU 126 N -0.21 0.00 0.00 2.37 4.11 -1.68 -1.08 114.58 118.09 2ec2 h GLU 126 Ca 0.12 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.52 2ec2 h GLU 126 Cb 0.51 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.76 2ec2 h GLU 126 CO -0.76 0.01 -0.16 0.93 0.07 0.00 0.00 179.01 179.10 2ec2 h GLU 127 N 0.00 0.00 -0.01 1.06 5.08 -1.46 -3.53 114.58 115.72 2ec2 h GLU 127 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2ec2 h GLU 127 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 2ec2 h GLU 127 CO 0.00 0.16 0.00 1.04 -1.00 0.00 0.00 179.01 179.21