#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 1.03 -4.57 1.61 3.41 -1.26 -4.95 113.62 108.89 2eec n SER 2 Ca 0.00 0.10 -0.43 0.00 -0.26 0.00 0.00 58.87 58.28 2eec n SER 2 Cb 0.00 -0.27 -0.04 0.00 -0.26 0.00 0.00 64.21 63.63 2eec n SER 2 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2eec s SER 3 N -5.77 6.50 0.00 4.04 0.01 -1.26 -4.54 113.70 112.68 2eec s SER 3 Ca -0.14 0.14 0.00 0.00 1.31 0.00 0.00 55.95 57.26 2eec s SER 3 Cb 0.05 -2.43 0.00 0.00 0.21 0.00 0.00 66.02 63.85 2eec s SER 3 CO 0.18 -0.96 0.00 0.61 0.41 0.00 0.00 173.24 173.48 2eec n GLY 4 N 4.84 -1.34 2.56 3.44 0.00 -1.26 -5.14 105.19 108.29 2eec n GLY 4 Ca 0.05 0.46 -0.33 0.00 0.00 0.00 0.00 46.02 46.20 2eec n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2eec n SER 5 N 0.00 -2.08 -4.66 1.61 7.64 -1.26 -4.89 113.62 109.98 2eec n SER 5 Ca 0.00 0.65 -0.29 0.00 1.01 0.00 0.00 58.87 60.25 2eec n SER 5 Cb 0.00 -0.69 0.18 0.00 -1.01 0.00 0.00 64.21 62.70 2eec n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2eec s SER 6 N -0.77 2.48 0.00 6.43 0.01 -1.26 -3.67 113.70 116.92 2eec s SER 6 Ca 0.46 1.21 0.00 0.00 1.31 0.00 0.00 55.95 58.93 2eec s SER 6 Cb -0.52 -1.88 0.00 0.00 0.21 0.00 0.00 66.02 63.83 2eec s SER 6 CO 0.48 -3.22 0.00 0.61 0.41 0.00 0.00 173.24 171.51 2eec n GLY 7 N -0.95 1.35 3.19 3.44 0.00 -1.26 -4.98 105.19 105.99 2eec n GLY 7 Ca 0.05 -0.07 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 2eec n GLY 7 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2eec n PHE 8 N 0.00 -2.45 -1.22 1.61 3.01 -1.24 -4.84 117.46 112.32 2eec n PHE 8 Ca 0.00 0.22 -0.36 0.00 1.01 0.00 0.00 57.45 58.32 2eec n PHE 8 Cb 0.00 -1.56 0.07 0.00 -0.01 0.00 0.00 39.48 37.98 2eec n PHE 8 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 2eec n LYS 9 N 0.15 0.24 -2.92 -1.08 4.76 -1.26 -4.91 118.16 113.15 2eec n LYS 9 Ca 0.01 0.12 -0.41 0.00 -2.87 0.00 0.00 58.31 55.16 2eec n LYS 9 Cb 0.60 -1.75 -0.04 0.00 -1.84 0.00 0.00 35.03 32.00 2eec n LYS 9 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2eec s VAL 10 N -1.95 4.87 0.37 -0.18 1.01 -1.26 -5.01 120.40 118.25 2eec s VAL 10 Ca 0.64 1.54 -0.27 0.00 0.00 0.00 0.00 61.98 63.89 2eec s VAL 10 Cb -0.34 -4.10 -0.11 0.00 0.00 0.00 0.00 36.38 31.82 2eec s VAL 10 CO 0.60 -0.03 1.27 -2.11 0.00 0.00 0.00 175.10 174.83 2eec n ARG 11 N 5.73 2.03 -3.61 2.72 0.00 -1.26 -5.00 116.66 117.27 2eec n ARG 11 Ca 0.05 0.71 -0.08 0.00 -0.00 0.00 0.00 57.85 58.53 2eec n ARG 11 Cb 0.48 -2.33 -0.05 0.00 -0.00 0.00 0.00 32.46 30.56 2eec n ARG 11 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2eec s VAL 12 N -1.14 0.00 0.00 8.89 0.11 -1.26 -5.18 120.40 121.83 2eec s VAL 12 Ca 0.57 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.62 2eec s VAL 12 Cb -0.55 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.30 2eec s VAL 12 CO 0.61 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 172.99 2eec n GLY 13 N 1.05 -0.84 3.66 6.54 0.00 -1.26 -4.97 105.19 109.37 2eec n GLY 13 Ca -0.09 -1.24 -0.31 0.00 0.00 0.00 0.00 46.02 44.38 2eec n GLY 13 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2eec n GLU 14 N 0.00 -0.39 -2.21 1.61 1.02 -1.26 -4.93 120.64 114.47 2eec n GLU 14 Ca 0.00 -0.05 -0.42 0.00 -0.02 0.00 0.00 57.16 56.68 2eec n GLU 14 Cb 0.00 -2.37 -0.03 0.00 -0.02 0.00 0.00 31.44 29.02 2eec n GLU 14 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2eec s PRO 15 N -4.55 4.36 0.65 3.49 0.04 -1.26 -5.00 135.00 132.74 2eec s PRO 15 Ca 0.67 2.04 -0.16 0.00 0.04 0.00 0.00 61.00 63.59 2eec s PRO 15 Cb -0.24 -3.23 -0.00 0.00 0.04 0.00 0.00 34.50 31.07 2eec s PRO 15 CO 0.57 -0.33 1.16 0.20 0.04 0.00 0.00 177.00 178.65 2eec s GLY 16 N 0.70 2.39 -0.46 0.56 0.00 -1.26 -4.97 107.32 104.28 2eec s GLY 16 Ca 0.60 0.77 -0.23 0.00 0.00 0.00 0.00 44.72 45.87 2eec s GLY 16 CO 0.34 1.15 0.76 1.62 0.00 0.00 0.00 173.10 176.97 2eec s GLN 17 N -3.78 3.36 -1.76 2.90 0.74 -1.26 -4.34 119.66 115.52 2eec s GLN 17 Ca 0.72 -0.21 -0.19 0.00 0.05 0.00 0.00 55.36 55.74 2eec s GLN 17 Cb -0.25 -3.96 0.19 0.00 1.10 0.00 0.00 33.01 30.09 2eec s GLN 17 CO 0.39 -1.13 0.47 0.00 -0.55 0.00 0.00 175.29 174.47 2eec n ALA 18 N 6.66 -1.31 -3.82 1.58 0.00 -1.26 -4.88 120.51 117.47 2eec n ALA 18 Ca 0.01 -0.24 -0.30 0.00 0.00 0.00 0.00 53.44 52.92 2eec n ALA 18 Cb 0.48 -2.12 -0.15 0.00 0.00 0.00 0.00 19.45 17.66 2eec n ALA 18 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2eec s GLY 19 N -3.38 1.17 -0.27 0.00 0.00 -1.26 -4.77 107.32 98.81 2eec s GLY 19 Ca 0.66 -1.53 -0.02 0.00 0.00 0.00 0.00 44.72 43.83 2eec s GLY 19 CO 0.98 1.32 0.07 0.21 0.00 0.00 0.00 173.10 175.69 2eec s ASN 20 N 1.51 3.67 0.46 1.64 2.47 -1.26 -4.80 114.94 118.63 2eec s ASN 20 Ca 0.04 -1.35 0.25 0.00 0.42 0.00 0.00 52.86 52.22 2eec s ASN 20 Cb -0.18 -0.77 1.06 0.00 -1.45 0.00 0.00 41.25 39.92 2eec s ASN 20 CO -0.15 -0.38 1.89 1.55 -3.72 0.00 0.00 177.10 176.29 2eec h PRO 21 N 8.15 0.00 -0.47 0.43 0.13 -1.94 -2.99 132.00 135.31 2eec h PRO 21 Ca -0.15 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.94 2eec h PRO 21 Cb 1.05 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.15 2eec h PRO 21 CO 0.43 0.20 0.12 0.00 -0.23 0.00 0.00 178.00 178.52 2eec h ALA 22 N 1.80 1.34 -0.23 -0.56 0.00 -1.94 -2.89 119.26 116.78 2eec h ALA 22 Ca -0.00 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 2eec h ALA 22 Cb 0.64 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2eec h ALA 22 CO 0.03 0.47 -0.07 -0.07 0.00 0.00 0.00 179.25 179.61 2eec h LEU 23 N 0.68 0.46 -9.27 0.00 3.38 -1.93 -3.39 115.31 105.24 2eec h LEU 23 Ca 0.15 -0.38 -0.68 0.00 0.09 0.00 0.00 57.88 57.07 2eec h LEU 23 Cb 0.24 -0.13 0.05 0.00 0.09 0.00 0.00 40.66 40.92 2eec h LEU 23 CO -0.00 0.73 0.45 0.52 0.09 0.00 0.00 178.44 180.23 2eec n VAL 24 N -4.56 0.00 -4.44 1.22 0.31 -1.09 -4.97 118.33 104.81 2eec n VAL 24 Ca -0.04 -0.00 -0.21 0.00 -0.01 0.00 0.00 64.34 64.08 2eec n VAL 24 Cb 0.30 -0.81 -0.11 0.00 -0.91 0.00 0.00 33.84 32.32 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 0.48 2.29 -0.00 4.52 0.15 -1.22 -4.24 113.70 115.66 2eec s SER 25 Ca 0.85 -1.37 0.00 0.00 0.70 0.00 0.00 55.95 56.13 2eec s SER 25 Cb -0.96 -0.07 0.00 0.00 -1.71 0.00 0.00 66.02 63.29 2eec s SER 25 CO 0.47 -0.61 -0.00 0.00 1.20 0.00 0.00 173.24 174.30 2eec s ALA 26 N -3.32 0.09 0.06 5.45 0.00 -1.26 -0.52 121.76 122.26 2eec s ALA 26 Ca 0.36 0.01 -0.22 0.00 0.00 0.00 0.00 51.96 52.11 2eec s ALA 26 Cb 0.09 -0.06 0.05 0.00 0.00 0.00 0.00 23.12 23.19 2eec s ALA 26 CO 0.15 0.00 0.52 1.52 0.00 0.00 0.00 175.76 177.95 2eec s TYR 27 N 0.16 -0.42 -5.00 0.00 -0.85 -0.84 -5.00 117.35 105.41 2eec s TYR 27 Ca -0.01 0.43 0.00 0.00 -0.52 0.00 0.00 57.07 56.96 2eec s TYR 27 Cb -0.03 0.35 0.00 0.00 0.38 0.00 0.00 41.96 42.67 2eec s TYR 27 CO -0.00 -0.66 0.00 0.41 -1.52 0.00 0.00 175.55 173.77 2eec n GLY 28 N 0.31 -0.46 0.01 5.49 0.00 -1.26 -0.72 105.19 108.56 2eec n GLY 28 Ca -0.18 -1.05 0.09 0.00 0.00 0.00 0.00 46.02 44.87 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 -0.09 2.61 -1.04 -1.21 -4.39 114.28 119.16 2eec n THR 29 Ca 0.00 -0.32 -0.14 0.00 -2.04 0.00 0.00 64.05 61.55 2eec n THR 29 Cb 0.00 0.34 -0.04 0.00 -1.82 0.00 0.00 70.33 68.81 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 3.45 0.88 1.98 3.41 0.00 -1.88 -3.10 103.07 107.81 2eec h GLY 30 Ca 0.00 -0.97 -0.07 0.00 0.00 0.00 0.00 47.33 46.29 2eec h GLY 30 CO 0.00 0.87 -0.31 1.41 0.00 0.00 0.00 176.54 178.51 2eec h LEU 31 N 0.58 0.03 -1.46 3.11 3.38 -1.93 -2.94 115.31 116.07 2eec h LEU 31 Ca 0.03 -0.01 0.43 0.00 0.09 0.00 0.00 57.88 58.42 2eec h LEU 31 Cb 1.01 -0.01 -0.12 0.00 0.09 0.00 0.00 40.66 41.64 2eec h LEU 31 CO 0.10 0.34 0.87 -0.33 0.09 0.00 0.00 178.44 179.51 2eec h GLU 32 N 0.02 0.10 0.00 1.13 4.39 -1.74 -3.46 114.58 115.02 2eec h GLU 32 Ca 0.00 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2eec h GLU 32 Cb 0.57 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 2eec h GLU 32 CO 0.04 0.06 0.00 0.41 -1.16 0.00 0.00 179.01 178.37 2eec n GLY 33 N -1.55 -0.82 3.20 -3.84 0.00 -1.11 -4.94 105.19 96.13 2eec n GLY 33 Ca 0.36 -0.91 -0.38 0.00 0.00 0.00 0.00 46.02 45.09 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 1.93 -0.41 -0.02 0.00 -0.40 -4.83 107.32 103.59 2eec s GLY 34 Ca 0.00 -2.20 -0.16 0.00 0.00 0.00 0.00 44.72 42.36 2eec s GLY 34 CO 0.00 0.94 0.36 -0.51 0.00 0.00 0.00 173.10 173.88 2eec s THR 35 N 1.30 5.19 -0.60 0.90 -4.23 -1.26 -2.38 115.64 114.56 2eec s THR 35 Ca 0.03 -0.53 -0.27 0.00 -1.18 0.00 0.00 61.69 59.74 2eec s THR 35 Cb -0.22 -3.98 0.03 0.00 1.34 0.00 0.00 72.50 69.67 2eec s THR 35 CO -0.01 -0.36 1.14 -0.89 -0.54 0.00 0.00 174.62 173.97 2eec s THR 36 N 1.87 4.07 0.00 3.99 2.01 -1.26 -3.34 115.64 122.98 2eec s THR 36 Ca 0.08 0.67 0.00 0.00 0.31 0.00 0.00 61.69 62.74 2eec s THR 36 Cb -0.18 -4.71 0.00 0.00 0.01 0.00 0.00 72.50 67.62 2eec s THR 36 CO 0.11 -1.36 0.00 0.61 -0.69 0.00 0.00 174.62 173.30 2eec n GLY 37 N 5.12 1.32 3.79 4.40 0.00 -1.17 -4.87 105.19 113.79 2eec n GLY 37 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 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 -1.51 4.73 -0.29 -0.61 1.01 -1.21 -5.06 121.20 118.25 2eec s ILE 38 Ca 0.00 -0.52 -0.10 0.00 0.00 0.00 0.00 60.65 60.03 2eec s ILE 38 Cb 0.00 -3.21 -0.03 0.00 0.01 0.00 0.00 42.46 39.23 2eec s ILE 38 CO 0.00 0.26 0.16 -1.58 0.00 0.00 0.00 174.94 173.78 2eec s GLN 39 N -2.01 3.65 0.31 2.79 0.74 -1.26 -4.61 119.66 119.28 2eec s GLN 39 Ca 0.26 -0.51 0.07 0.00 0.05 0.00 0.00 55.36 55.23 2eec s GLN 39 Cb -0.12 -3.58 -0.03 0.00 1.10 0.00 0.00 33.01 30.37 2eec s GLN 39 CO 0.18 -0.29 0.25 -1.12 -0.55 0.00 0.00 175.29 173.76 2eec s SER 40 N 1.68 5.29 -0.05 6.67 0.01 -1.25 -5.01 113.70 121.04 2eec s SER 40 Ca 0.06 -0.45 -0.02 0.00 1.31 0.00 0.00 55.95 56.85 2eec s SER 40 Cb -0.16 -1.07 0.03 0.00 0.21 0.00 0.00 66.02 65.03 2eec s SER 40 CO 0.08 -0.25 0.10 -1.83 0.41 0.00 0.00 173.24 171.75 2eec s GLU 41 N -3.93 0.05 -0.06 12.44 4.04 -1.26 -3.52 118.70 126.45 2eec s GLU 41 Ca 0.38 0.30 0.06 0.00 0.04 0.00 0.00 54.97 55.75 2eec s GLU 41 Cb -0.06 -0.20 -0.01 0.00 0.02 0.00 0.00 34.13 33.88 2eec s GLU 41 CO 0.26 -0.16 -0.24 -0.59 -1.84 0.00 0.00 175.26 172.68 2eec s PHE 42 N 1.11 2.37 0.25 4.83 -0.12 -1.18 -3.34 117.98 121.88 2eec s PHE 42 Ca -0.09 -0.73 0.01 0.00 -0.05 0.00 0.00 56.93 56.07 2eec s PHE 42 Cb -0.12 -1.56 -0.04 0.00 -0.63 0.00 0.00 43.02 40.68 2eec s PHE 42 CO -0.05 -0.23 0.42 -0.06 -0.05 0.00 0.00 175.22 175.24 2eec s PHE 43 N -0.09 3.48 -0.10 3.49 0.08 0.10 -3.12 117.98 121.82 2eec s PHE 43 Ca -0.05 0.22 0.01 0.00 0.12 0.00 0.00 56.93 57.23 2eec s PHE 43 Cb -0.14 -1.77 -0.02 0.00 -0.57 0.00 0.00 43.02 40.52 2eec s PHE 43 CO 0.04 0.34 -0.12 0.42 -0.10 0.00 0.00 175.22 175.80 2eec s ILE 44 N -2.01 3.22 -1.37 0.64 1.01 -1.05 -1.98 121.20 119.67 2eec s ILE 44 Ca 0.37 -0.63 -0.11 0.00 0.00 0.00 0.00 60.65 60.28 2eec s ILE 44 Cb -0.10 -2.33 0.11 0.00 0.01 0.00 0.00 42.46 40.15 2eec s ILE 44 CO 0.31 0.55 2.05 -3.20 0.00 0.00 0.00 174.94 174.65 2eec n ASN 45 N 3.01 4.59 -1.91 3.58 2.85 0.32 -4.27 115.26 123.43 2eec n ASN 45 Ca -0.18 -2.98 -0.15 0.00 -0.11 0.00 0.00 54.58 51.15 2eec n ASN 45 Cb 0.53 -1.56 0.21 0.00 1.24 0.00 0.00 39.78 40.19 2eec n ASN 45 CO 0.00 0.00 0.00 1.07 -2.11 0.00 0.00 177.26 176.22 2eec n THR 46 N 4.11 2.99 0.15 -0.44 5.66 -1.26 -3.43 114.28 122.06 2eec n THR 46 Ca 0.46 -2.06 0.05 0.00 -3.05 0.00 0.00 64.05 59.45 2eec n THR 46 Cb 0.37 -0.41 0.06 0.00 -1.55 0.00 0.00 70.33 68.80 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 1.32 0.56 0.00 1.09 1.35 -1.83 -2.85 112.91 112.55 2eec h THR 47 Ca 0.46 -1.81 -0.19 0.00 -0.55 0.00 0.00 66.41 64.32 2eec h THR 47 Cb 2.47 2.24 -0.04 0.00 -1.73 0.00 0.00 68.15 71.09 2eec h THR 47 CO 0.86 0.32 -2.17 0.54 -0.25 0.00 0.00 175.52 174.81 2eec n ARG 48 N -3.15 0.72 -0.00 4.72 1.74 -1.26 -4.47 116.66 114.96 2eec n ARG 48 Ca 0.02 -0.10 -0.17 0.00 -0.77 0.00 0.00 57.85 56.83 2eec n ARG 48 Cb 0.68 -1.51 -0.11 0.00 -1.02 0.00 0.00 32.46 30.50 2eec n ARG 48 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2eec h ALA 49 N 1.42 0.09 0.00 7.54 0.00 -1.82 -3.49 119.26 123.00 2eec h ALA 49 Ca -0.29 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.07 2eec h ALA 49 Cb 1.64 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.45 2eec h ALA 49 CO 0.02 0.33 0.00 0.41 0.00 0.00 0.00 179.25 180.00 2eec n GLY 50 N 1.01 3.09 3.65 0.00 0.00 -1.08 -4.65 105.19 107.21 2eec n GLY 50 Ca -0.10 -1.71 -0.29 0.00 0.00 0.00 0.00 46.02 43.92 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 -4.17 -0.17 0.00 1.61 0.04 -1.26 -4.95 135.00 126.11 2eec s PRO 51 Ca 0.00 0.31 0.00 0.00 0.04 0.00 0.00 61.00 61.35 2eec s PRO 51 Cb 0.00 -1.69 0.00 0.00 0.04 0.00 0.00 34.50 32.85 2eec s PRO 51 CO 0.00 -3.09 0.00 0.41 0.04 0.00 0.00 177.00 174.36 2eec n GLY 52 N -1.03 -0.01 3.29 0.56 0.00 -1.26 -5.08 105.19 101.67 2eec n GLY 52 Ca 0.07 -0.70 -0.35 0.00 0.00 0.00 0.00 46.02 45.04 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 -2.07 3.35 0.12 2.61 -4.23 -1.26 -5.10 115.64 109.05 2eec s THR 53 Ca 0.00 -0.60 0.09 0.00 -1.18 0.00 0.00 61.69 60.00 2eec s THR 53 Cb 0.00 -2.57 -0.04 0.00 1.34 0.00 0.00 72.50 71.23 2eec s THR 53 CO 0.00 0.35 -0.19 -0.22 -0.54 0.00 0.00 174.62 174.02 2eec s LEU 54 N 1.46 2.65 -0.02 4.79 2.96 -1.26 -4.11 118.68 125.14 2eec s LEU 54 Ca 0.05 -0.60 0.05 0.00 -0.22 0.00 0.00 54.13 53.40 2eec s LEU 54 Cb -0.15 -1.49 -0.01 0.00 0.50 0.00 0.00 46.19 45.05 2eec s LEU 54 CO -0.03 0.17 -0.16 -0.55 -1.32 0.00 0.00 176.35 174.46 2eec s SER 55 N -2.18 1.99 -0.05 3.68 0.15 -1.23 -5.07 113.70 110.98 2eec s SER 55 Ca 0.18 -0.31 0.02 0.00 0.70 0.00 0.00 55.95 56.54 2eec s SER 55 Cb -0.10 -0.35 0.01 0.00 -1.71 0.00 0.00 66.02 63.86 2eec s SER 55 CO 0.10 0.18 -0.10 0.54 1.20 0.00 0.00 173.24 175.16 2eec s VAL 56 N -0.21 0.91 -0.00 4.45 0.11 -1.26 -2.53 120.40 121.87 2eec s VAL 56 Ca 0.02 -0.38 0.01 0.00 -2.93 0.00 0.00 61.98 58.70 2eec s VAL 56 Cb -0.08 -0.84 -0.00 0.00 -1.53 0.00 0.00 36.38 33.93 2eec s VAL 56 CO 0.00 0.30 -0.03 -0.89 -3.33 0.00 0.00 175.10 171.15 2eec s THR 57 N 0.52 0.27 0.07 5.04 2.01 -1.02 -5.05 115.64 117.47 2eec s THR 57 Ca -0.10 -0.14 0.05 0.00 0.31 0.00 0.00 61.69 61.82 2eec s THR 57 Cb -0.13 -0.23 -0.03 0.00 0.01 0.00 0.00 72.50 72.12 2eec s THR 57 CO 0.02 0.08 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.25 2eec s ILE 58 N -0.06 1.16 0.25 1.82 1.01 -1.26 -0.77 121.20 123.35 2eec s ILE 58 Ca 0.01 -1.25 0.03 0.00 0.00 0.00 0.00 60.65 59.44 2eec s ILE 58 Cb -0.02 -1.09 -0.05 0.00 0.01 0.00 0.00 42.46 41.31 2eec s ILE 58 CO -0.00 -0.15 0.02 -1.61 0.00 0.00 0.00 174.94 173.19 2eec s GLU 59 N -1.60 1.40 0.00 2.79 2.02 -0.14 -4.96 118.70 118.20 2eec s GLU 59 Ca -0.00 -1.72 0.00 0.00 0.02 0.00 0.00 54.97 53.26 2eec s GLU 59 Cb -0.09 -0.62 0.00 0.00 0.10 0.00 0.00 34.13 33.52 2eec s GLU 59 CO 0.02 -0.13 0.00 0.41 0.02 0.00 0.00 175.26 175.58 2eec n GLY 60 N -0.47 -2.07 0.19 -1.39 0.00 -1.26 -1.46 105.19 98.73 2eec n GLY 60 Ca -0.04 -1.19 -0.13 0.00 0.00 0.00 0.00 46.02 44.66 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 0.62 -4.94 1.61 0.13 -1.89 -3.42 132.00 124.11 2eec h PRO 61 Ca 0.00 -0.32 -0.66 0.00 -0.87 0.00 0.00 66.00 64.15 2eec h PRO 61 Cb 0.00 0.01 -0.36 0.00 0.13 0.00 0.00 31.00 30.78 2eec h PRO 61 CO 0.00 0.92 -0.84 -1.12 -0.23 0.00 0.00 178.00 176.73 2eec s SER 62 N -6.44 3.44 0.59 1.44 0.01 -1.26 -5.10 113.70 106.37 2eec s SER 62 Ca -0.13 -0.84 -0.18 0.00 1.31 0.00 0.00 55.95 56.12 2eec s SER 62 Cb 0.08 -1.45 -0.14 0.00 0.21 0.00 0.00 66.02 64.72 2eec s SER 62 CO 0.81 -0.06 -0.18 0.29 0.41 0.00 0.00 173.24 174.51 2eec n LYS 63 N 4.59 0.03 -4.34 12.44 4.76 -1.26 -4.83 118.16 129.56 2eec n LYS 63 Ca -0.18 0.01 -0.21 0.00 -2.87 0.00 0.00 58.31 55.06 2eec n LYS 63 Cb 0.48 -1.06 -0.16 0.00 -1.84 0.00 0.00 35.03 32.45 2eec n LYS 63 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 2eec s VAL 64 N -1.98 0.76 -1.12 -0.18 -7.23 -1.26 -4.80 120.40 104.58 2eec s VAL 64 Ca 0.55 -0.28 -0.16 0.00 -1.81 0.00 0.00 61.98 60.28 2eec s VAL 64 Cb -0.44 -0.72 0.14 0.00 0.56 0.00 0.00 36.38 35.91 2eec s VAL 64 CO 0.68 0.26 1.37 -0.54 -0.31 0.00 0.00 175.10 176.56 2eec s LYS 65 N 0.66 3.91 0.09 4.82 1.02 -1.26 -5.00 119.74 123.97 2eec s LYS 65 Ca -0.11 -2.21 -0.11 0.00 0.02 0.00 0.00 55.97 53.56 2eec s LYS 65 Cb -0.13 -5.08 -0.06 0.00 -0.52 0.00 0.00 37.83 32.04 2eec s LYS 65 CO 0.01 -1.84 0.43 0.00 -0.92 0.00 0.00 175.35 173.04 2eec s MET 66 N 2.33 3.82 0.41 1.68 0.23 -1.26 -4.69 119.30 121.83 2eec s MET 66 Ca 0.41 0.26 0.08 0.00 -1.03 0.00 0.00 55.69 55.41 2eec s MET 66 Cb -0.03 -3.01 -0.00 0.00 -1.53 0.00 0.00 34.83 30.27 2eec s MET 66 CO -0.03 0.56 0.50 -0.51 -2.03 0.00 0.00 175.02 173.51 2eec s ASP 67 N -1.68 5.51 -0.18 -1.18 1.01 0.02 -4.94 116.67 115.23 2eec s ASP 67 Ca 0.33 -0.49 -0.05 0.00 0.71 0.00 0.00 52.55 53.05 2eec s ASP 67 Cb -0.14 -0.69 0.06 0.00 1.01 0.00 0.00 42.92 43.16 2eec s ASP 67 CO 0.18 -0.69 0.09 0.00 0.21 0.00 0.00 175.17 174.95 2eec s GLN 69 N 2.11 2.52 -0.14 0.00 -1.52 -1.11 -5.07 119.66 116.46 2eec s GLN 69 Ca 0.02 -1.51 -0.06 0.00 -1.95 0.00 0.00 55.36 51.86 2eec s GLN 69 Cb -0.16 -2.33 -0.04 0.00 -0.22 0.00 0.00 33.01 30.26 2eec s GLN 69 CO -0.10 -0.08 0.07 -1.21 -0.25 0.00 0.00 175.29 173.73 2eec s GLU 70 N -4.04 3.57 0.07 2.91 2.02 -1.26 -3.69 118.70 118.28 2eec s GLU 70 Ca 0.44 -0.30 0.04 0.00 0.02 0.00 0.00 54.97 55.18 2eec s GLU 70 Cb -0.03 -3.10 -0.03 0.00 0.10 0.00 0.00 34.13 31.07 2eec s GLU 70 CO 0.26 0.53 -0.12 0.95 0.02 0.00 0.00 175.26 176.90 2eec s THR 71 N -0.36 0.98 -0.96 3.63 -4.23 -1.24 -4.97 115.64 108.49 2eec s THR 71 Ca 0.09 -1.32 0.15 0.00 -1.18 0.00 0.00 61.69 59.43 2eec s THR 71 Cb -0.12 -1.03 0.13 0.00 1.34 0.00 0.00 72.50 72.81 2eec s THR 71 CO 0.02 -0.31 1.47 -0.81 -0.54 0.00 0.00 174.62 174.45 2eec n PRO 72 N 1.19 0.02 -0.05 3.99 -0.04 -1.26 -2.50 135.00 136.35 2eec n PRO 72 Ca -0.21 0.27 -0.10 0.00 -0.04 0.00 0.00 63.50 63.43 2eec n PRO 72 Cb 0.55 -1.53 -0.15 0.00 -0.04 0.00 0.00 33.50 32.33 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 -1.56 0.66 0.00 0.54 4.07 -1.26 -5.07 120.64 118.02 2eec n GLU 73 Ca 0.03 0.20 0.00 0.00 -0.06 0.00 0.00 57.16 57.33 2eec n GLU 73 Cb 0.17 -1.70 0.00 0.00 -0.06 0.00 0.00 31.44 29.85 2eec n GLU 73 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2eec n GLY 74 N 1.66 -1.10 2.74 8.31 0.00 -1.04 -4.43 105.19 111.32 2eec n GLY 74 Ca -0.23 0.51 -0.17 0.00 0.00 0.00 0.00 46.02 46.13 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 0.05 -0.13 1.61 2.02 -1.26 -3.71 117.35 115.93 2eec s TYR 75 Ca 0.00 0.17 -0.00 0.00 -0.37 0.00 0.00 57.07 56.87 2eec s TYR 75 Cb 0.00 -0.33 -0.02 0.00 -0.40 0.00 0.00 41.96 41.22 2eec s TYR 75 CO 0.00 -0.13 -0.12 0.21 -1.57 0.00 0.00 175.55 173.95 2eec s LYS 76 N 1.44 3.35 -0.03 -0.62 2.20 -1.24 -2.53 119.74 122.31 2eec s LYS 76 Ca -0.04 -0.66 0.07 0.00 -0.36 0.00 0.00 55.97 54.97 2eec s LYS 76 Cb -0.13 -2.65 -0.01 0.00 -1.51 0.00 0.00 37.83 33.53 2eec s LYS 76 CO -0.03 0.26 -0.23 0.08 -0.36 0.00 0.00 175.35 175.07 2eec s VAL 77 N 0.24 1.87 -0.11 4.02 1.01 -1.18 -2.75 120.40 123.51 2eec s VAL 77 Ca -0.08 -0.99 0.04 0.00 0.00 0.00 0.00 61.98 60.94 2eec s VAL 77 Cb -0.15 -1.57 0.00 0.00 0.00 0.00 0.00 36.38 34.66 2eec s VAL 77 CO 0.05 0.53 -0.22 -0.04 0.00 0.00 0.00 175.10 175.41 2eec s MET 78 N -0.37 2.92 -0.11 2.72 -1.94 -1.06 -3.13 119.30 118.33 2eec s MET 78 Ca 0.04 -0.83 -0.08 0.00 -1.71 0.00 0.00 55.69 53.11 2eec s MET 78 Cb -0.11 -2.25 0.04 0.00 2.01 0.00 0.00 34.83 34.52 2eec s MET 78 CO 0.01 0.12 0.28 1.52 -0.01 0.00 0.00 175.02 176.94 2eec s TYR 79 N 0.48 -0.35 -0.21 -0.03 -0.85 -1.23 -0.80 117.35 114.36 2eec s TYR 79 Ca -0.16 0.82 0.01 0.00 -0.52 0.00 0.00 57.07 57.22 2eec s TYR 79 Cb -0.17 0.10 0.05 0.00 0.38 0.00 0.00 41.96 42.32 2eec s TYR 79 CO 0.06 -0.20 -0.08 0.99 -1.52 0.00 0.00 175.55 174.80 2eec s THR 80 N 0.75 1.58 0.20 -3.49 2.01 -1.26 -3.91 115.64 111.51 2eec s THR 80 Ca -0.05 -1.08 -0.30 0.00 0.31 0.00 0.00 61.69 60.57 2eec s THR 80 Cb -0.06 -1.73 -0.09 0.00 0.01 0.00 0.00 72.50 70.63 2eec s THR 80 CO -0.05 0.06 1.30 -2.16 -0.69 0.00 0.00 174.62 173.09 2eec s PRO 81 N 1.40 4.39 -0.05 4.92 0.04 -1.26 -4.73 135.00 139.72 2eec s PRO 81 Ca -0.03 2.05 0.09 0.00 0.04 0.00 0.00 61.00 63.14 2eec s PRO 81 Cb -0.17 -3.19 -0.24 0.00 0.04 0.00 0.00 34.50 30.94 2eec s PRO 81 CO -0.07 -0.24 0.63 1.98 0.04 0.00 0.00 177.00 179.33 2eec h MET 82 N 5.33 0.05 -4.97 4.56 4.05 -1.88 -3.09 114.93 118.99 2eec h MET 82 Ca -0.45 -0.09 -0.32 0.00 -0.28 0.00 0.00 59.70 58.56 2eec h MET 82 Cb 1.21 0.03 -0.19 0.00 -0.80 0.00 0.00 31.60 31.86 2eec h MET 82 CO 0.77 0.64 -0.74 0.00 0.23 0.00 0.00 176.91 177.81 2eec s ALA 83 N -2.59 1.06 1.16 0.39 0.00 -1.26 -4.09 121.76 116.43 2eec s ALA 83 Ca -0.08 -1.12 -0.18 0.00 0.00 0.00 0.00 51.96 50.58 2eec s ALA 83 Cb 0.08 0.02 0.26 0.00 0.00 0.00 0.00 23.12 23.48 2eec s ALA 83 CO 0.82 -0.01 1.11 -1.25 0.00 0.00 0.00 175.76 176.42 2eec s PRO 84 N -2.55 -0.84 0.00 0.00 0.04 -1.26 -4.87 135.00 125.52 2eec s PRO 84 Ca 0.03 0.07 0.00 0.00 0.04 0.00 0.00 61.00 61.14 2eec s PRO 84 Cb -0.04 -1.63 0.00 0.00 0.04 0.00 0.00 34.50 32.87 2eec s PRO 84 CO 0.00 -3.49 0.00 0.41 0.04 0.00 0.00 177.00 173.97 2eec n GLY 85 N -0.99 0.51 2.76 0.56 0.00 -1.26 -4.86 105.19 101.91 2eec n GLY 85 Ca 0.11 -1.38 -0.26 0.00 0.00 0.00 0.00 46.02 44.49 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 2.42 0.05 1.61 2.20 -1.26 -2.56 114.94 113.40 2eec s ASN 86 Ca 0.00 -0.54 0.03 0.00 -0.94 0.00 0.00 52.86 51.41 2eec s ASN 86 Cb 0.00 -0.56 -0.04 0.00 -2.00 0.00 0.00 41.25 38.65 2eec s ASN 86 CO 0.00 -0.26 0.01 -0.31 -2.94 0.00 0.00 177.10 173.61 2eec s TYR 87 N 1.88 3.05 -0.18 1.54 1.51 -1.04 -4.27 117.35 119.85 2eec s TYR 87 Ca 0.01 0.03 0.01 0.00 -1.01 0.00 0.00 57.07 56.11 2eec s TYR 87 Cb -0.15 -1.60 0.02 0.00 -0.11 0.00 0.00 41.96 40.12 2eec s TYR 87 CO -0.07 0.48 -0.18 -1.17 -1.11 0.00 0.00 175.55 173.50 2eec s LEU 88 N -2.04 2.08 -0.27 -1.29 2.96 -0.54 -2.14 118.68 117.45 2eec s LEU 88 Ca 0.24 -0.65 -0.10 0.00 -0.22 0.00 0.00 54.13 53.40 2eec s LEU 88 Cb -0.12 -1.40 -0.04 0.00 0.50 0.00 0.00 46.19 45.13 2eec s LEU 88 CO 0.16 -0.03 0.14 -0.63 -1.32 0.00 0.00 176.35 174.67 2eec s ILE 89 N 1.34 4.93 0.07 6.68 1.01 -0.72 -0.97 121.20 133.54 2eec s ILE 89 Ca 0.04 0.04 0.06 0.00 0.00 0.00 0.00 60.65 60.80 2eec s ILE 89 Cb -0.13 -3.33 -0.04 0.00 0.01 0.00 0.00 42.46 38.97 2eec s ILE 89 CO -0.12 0.29 -0.12 -0.44 0.00 0.00 0.00 174.94 174.55 2eec s SER 90 N 1.66 4.25 -0.04 3.58 0.01 0.05 -1.73 113.70 121.48 2eec s SER 90 Ca 0.07 -0.36 -0.02 0.00 1.31 0.00 0.00 55.95 56.95 2eec s SER 90 Cb -0.16 -0.81 0.03 0.00 0.21 0.00 0.00 66.02 65.30 2eec s SER 90 CO 0.08 0.22 0.05 -0.69 0.41 0.00 0.00 173.24 173.31 2eec s VAL 91 N -1.08 -0.06 0.14 3.43 1.01 -1.26 -2.44 120.40 120.14 2eec s VAL 91 Ca 0.18 0.39 0.05 0.00 0.00 0.00 0.00 61.98 62.61 2eec s VAL 91 Cb -0.11 -0.18 -0.04 0.00 0.00 0.00 0.00 36.38 36.05 2eec s VAL 91 CO 0.10 0.18 0.06 -0.54 0.00 0.00 0.00 175.10 174.90 2eec s LYS 92 N 2.09 2.67 -0.13 2.72 1.02 -1.05 -3.44 119.74 123.62 2eec s LYS 92 Ca 0.04 -0.92 -0.03 0.00 0.02 0.00 0.00 55.97 55.08 2eec s LYS 92 Cb -0.12 -2.54 0.05 0.00 -0.52 0.00 0.00 37.83 34.69 2eec s LYS 92 CO -0.03 0.50 0.06 -0.47 -0.92 0.00 0.00 175.35 174.48 2eec s TYR 93 N -1.61 0.43 0.00 3.18 6.14 -1.24 -3.51 117.35 120.73 2eec s TYR 93 Ca 0.29 -0.28 0.00 0.00 0.64 0.00 0.00 57.07 57.71 2eec s TYR 93 Cb -0.10 -0.74 0.00 0.00 0.42 0.00 0.00 41.96 41.54 2eec s TYR 93 CO 0.21 -0.43 0.00 0.41 0.64 0.00 0.00 175.55 176.38 2eec n GLY 94 N 5.21 1.26 0.00 8.97 0.00 -1.26 -4.76 105.19 114.62 2eec n GLY 94 Ca -0.07 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.94 2eec n GLY 94 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2eec n GLY 95 N 0.00 5.88 0.27 -0.02 0.00 -1.26 -5.03 105.19 105.03 2eec n GLY 95 Ca 0.00 -1.57 0.16 0.00 0.00 0.00 0.00 46.02 44.61 2eec n GLY 95 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eec h PRO 96 N 0.00 0.00 -6.53 1.61 0.13 -1.99 -3.45 132.00 121.76 2eec h PRO 96 Ca 0.00 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.53 2eec h PRO 96 Cb 0.00 0.00 0.08 0.00 0.13 0.00 0.00 31.00 31.21 2eec h PRO 96 CO 0.00 0.05 0.50 0.09 -0.23 0.00 0.00 178.00 178.42 2eec n ASN 97 N -3.18 2.35 -4.88 1.44 4.13 -1.26 -4.92 115.26 108.94 2eec n ASN 97 Ca 0.00 1.15 -0.34 0.00 1.68 0.00 0.00 54.58 57.07 2eec n ASN 97 Cb 0.32 -1.37 -0.05 0.00 -1.54 0.00 0.00 39.78 37.13 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 -0.19 3.57 1.02 3.10 -3.43 -1.26 -3.68 115.29 114.42 2eec s HIS 98 Ca 0.68 0.67 -0.15 0.00 -0.80 0.00 0.00 55.06 55.46 2eec s HIS 98 Cb -0.70 -2.07 0.21 0.00 -1.43 0.00 0.00 32.58 28.59 2eec s HIS 98 CO 0.51 0.55 1.17 0.96 -2.00 0.00 0.00 174.74 175.93 2eec s ILE 99 N -1.39 1.87 0.28 -5.38 -4.36 -1.22 -4.81 121.20 106.19 2eec s ILE 99 Ca 0.32 0.00 -0.29 0.00 -0.26 0.00 0.00 60.65 60.42 2eec s ILE 99 Cb -0.13 -2.71 -0.10 0.00 1.25 0.00 0.00 42.46 40.77 2eec s ILE 99 CO 0.18 0.00 1.30 -0.69 0.24 0.00 0.00 174.94 175.98 2eec s VAL 100 N -3.32 2.90 0.00 8.37 1.01 -1.26 -3.32 120.40 124.79 2eec s VAL 100 Ca 0.69 0.85 0.00 0.00 0.00 0.00 0.00 61.98 63.51 2eec s VAL 100 Cb -0.11 -3.54 0.00 0.00 0.00 0.00 0.00 36.38 32.74 2eec s VAL 100 CO 0.54 0.18 0.00 0.61 0.00 0.00 0.00 175.10 176.43 2eec n GLY 101 N 1.38 2.87 3.78 4.51 0.00 -1.26 -4.83 105.19 111.64 2eec n GLY 101 Ca 0.02 -0.74 -0.33 0.00 0.00 0.00 0.00 46.02 44.98 2eec n GLY 101 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2eec s SER 102 N 0.00 5.19 0.25 1.61 1.04 -1.21 -4.15 113.70 116.43 2eec s SER 102 Ca 0.00 1.93 -0.30 0.00 0.48 0.00 0.00 55.95 58.06 2eec s SER 102 Cb 0.00 -2.54 -0.09 0.00 0.10 0.00 0.00 66.02 63.49 2eec s SER 102 CO 0.00 -1.57 1.27 -2.16 0.98 0.00 0.00 173.24 171.76 2eec s PRO 103 N -4.21 4.42 -0.24 4.02 0.04 -1.26 -4.83 135.00 132.94 2eec s PRO 103 Ca 0.65 2.05 -0.23 0.00 0.04 0.00 0.00 61.00 63.51 2eec s PRO 103 Cb -0.19 -3.16 -0.01 0.00 0.04 0.00 0.00 34.50 31.18 2eec s PRO 103 CO 0.43 -0.16 0.77 -0.06 0.04 0.00 0.00 177.00 178.02 2eec s PHE 104 N -0.43 3.31 -0.42 0.56 0.08 -0.71 -4.95 117.98 115.43 2eec s PHE 104 Ca 0.53 1.05 -0.18 0.00 0.12 0.00 0.00 56.93 58.45 2eec s PHE 104 Cb -0.37 -2.99 0.02 0.00 -0.57 0.00 0.00 43.02 39.12 2eec s PHE 104 CO 0.43 -0.37 0.49 0.15 -0.10 0.00 0.00 175.22 175.82 2eec s LYS 105 N 2.69 3.17 -0.14 0.44 1.02 -1.26 -1.76 119.74 123.90 2eec s LYS 105 Ca 0.33 -0.63 -0.05 0.00 0.02 0.00 0.00 55.97 55.63 2eec s LYS 105 Cb -0.15 -3.96 -0.04 0.00 -0.52 0.00 0.00 37.83 33.16 2eec s LYS 105 CO 0.08 -0.89 0.03 0.00 -0.92 0.00 0.00 175.35 173.65 2eec s ALA 106 N 2.33 3.33 -0.22 5.17 0.00 -0.91 -5.04 121.76 126.41 2eec s ALA 106 Ca 0.15 -0.77 -0.07 0.00 0.00 0.00 0.00 51.96 51.27 2eec s ALA 106 Cb -0.16 -1.73 -0.03 0.00 0.00 0.00 0.00 23.12 21.20 2eec s ALA 106 CO 0.15 0.34 0.05 0.21 0.00 0.00 0.00 175.76 176.51 2eec s LYS 107 N -0.09 3.73 0.12 0.00 2.20 -1.26 -2.49 119.74 121.94 2eec s LYS 107 Ca 0.05 -0.45 -0.12 0.00 -0.36 0.00 0.00 55.97 55.09 2eec s LYS 107 Cb -0.12 -3.25 -0.06 0.00 -1.51 0.00 0.00 37.83 32.88 2eec s LYS 107 CO 0.02 -0.03 0.48 0.08 -0.36 0.00 0.00 175.35 175.54 2eec s VAL 108 N 1.19 4.96 0.45 4.02 1.01 -1.06 -1.28 120.40 129.69 2eec s VAL 108 Ca 0.04 0.66 -0.02 0.00 0.00 0.00 0.00 61.98 62.66 2eec s VAL 108 Cb -0.14 -3.70 -0.02 0.00 0.00 0.00 0.00 36.38 32.52 2eec s VAL 108 CO 0.03 0.26 0.70 0.42 0.00 0.00 0.00 175.10 176.51 2eec s THR 109 N -1.44 4.60 -1.03 3.92 -4.23 -1.00 -4.05 115.64 112.40 2eec s THR 109 Ca 0.36 -0.19 -0.23 0.00 -1.18 0.00 0.00 61.69 60.45 2eec s THR 109 Cb -0.15 -3.72 -0.02 0.00 1.34 0.00 0.00 72.50 69.95 2eec s THR 109 CO 0.19 -0.59 1.80 -0.83 -0.54 0.00 0.00 174.62 174.64 2eec s GLY 110 N -4.14 0.60 -0.24 3.99 0.00 -1.26 -4.45 107.32 101.82 2eec s GLY 110 Ca 0.46 -1.98 0.14 0.00 0.00 0.00 0.00 44.72 43.34 2eec s GLY 110 CO 0.41 3.22 1.18 -1.06 0.00 0.00 0.00 173.10 176.85 2eec n GLN 111 N 8.70 2.37 -1.42 2.90 1.13 -1.26 -5.08 117.38 124.72 2eec n GLN 111 Ca 0.40 -3.61 -0.55 0.00 -1.94 0.00 0.00 57.00 51.30 2eec n GLN 111 Cb 0.48 -1.74 -0.08 0.00 0.11 0.00 0.00 30.24 29.00 2eec n GLN 111 CO 0.00 0.00 0.00 -2.13 -1.44 0.00 0.00 177.06 173.49 2eec n ARG 112 N -0.64 0.00 0.02 -1.09 3.00 -1.26 -4.81 116.66 111.88 2eec n ARG 112 Ca 0.26 0.00 0.11 0.00 -0.00 0.00 0.00 57.85 58.22 2eec n ARG 112 Cb 0.89 -1.23 0.04 0.00 0.00 0.00 0.00 32.46 32.17 2eec n ARG 112 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 2eec n LEU 113 N 3.19 0.63 -3.61 6.15 4.77 -1.26 -4.94 117.00 121.94 2eec n LEU 113 Ca 0.25 -0.04 -0.14 0.00 -0.03 0.00 0.00 56.01 56.05 2eec n LEU 113 Cb -0.04 -0.11 -0.07 0.00 -2.33 0.00 0.00 43.42 40.87 2eec n LEU 113 CO 0.73 0.06 0.51 0.54 -1.33 0.00 0.00 177.39 177.90 2eec s VAL 114 N -3.16 0.00 0.32 4.08 0.11 -1.26 -5.16 120.40 115.33 2eec s VAL 114 Ca 0.05 0.00 -0.26 0.00 -2.93 0.00 0.00 61.98 58.84 2eec s VAL 114 Cb 0.15 -1.00 -0.10 0.00 -1.53 0.00 0.00 36.38 33.90 2eec s VAL 114 CO 0.79 0.00 0.94 -0.94 -3.33 0.00 0.00 175.10 172.57 2eec s SER 115 N -0.06 7.34 0.87 3.54 1.04 -1.26 -5.05 113.70 120.11 2eec s SER 115 Ca -0.02 1.83 -0.11 0.00 0.48 0.00 0.00 55.95 58.13 2eec s SER 115 Cb -0.04 -2.58 0.11 0.00 0.10 0.00 0.00 66.02 63.62 2eec s SER 115 CO 0.01 -0.07 1.09 -2.16 0.98 0.00 0.00 173.24 173.10 2eec s PRO 116 N -2.06 1.47 0.00 4.02 0.04 -1.26 -5.01 135.00 132.20 2eec s PRO 116 Ca 0.50 0.89 0.00 0.00 0.04 0.00 0.00 61.00 62.43 2eec s PRO 116 Cb -0.19 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.53 2eec s PRO 116 CO 0.24 -2.12 0.00 0.41 0.04 0.00 0.00 177.00 175.57 2eec n GLY 117 N -1.15 -0.95 3.45 0.56 0.00 -1.26 -5.17 105.19 100.67 2eec n GLY 117 Ca 0.07 0.08 -0.16 0.00 0.00 0.00 0.00 46.02 46.02 2eec n GLY 117 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2eec s SER 118 N -4.00 -0.56 0.88 1.61 0.15 -1.26 -5.18 113.70 105.35 2eec s SER 118 Ca 0.00 0.47 -0.13 0.00 0.70 0.00 0.00 55.95 56.99 2eec s SER 118 Cb 0.00 0.51 0.16 0.00 -1.71 0.00 0.00 66.02 64.98 2eec s SER 118 CO 0.00 -0.65 1.23 0.00 1.20 0.00 0.00 173.24 175.02 2eec s ALA 119 N -1.73 2.55 0.49 5.45 0.00 -1.26 -5.10 121.76 122.17 2eec s ALA 119 Ca -0.09 -1.13 0.07 0.00 0.00 0.00 0.00 51.96 50.82 2eec s ALA 119 Cb -0.01 -2.72 0.03 0.00 0.00 0.00 0.00 23.12 20.42 2eec s ALA 119 CO 0.05 -2.09 0.50 1.21 0.00 0.00 0.00 175.76 175.42 2eec s ASN 120 N -4.78 4.97 -0.63 0.00 3.84 -1.26 -5.00 114.94 112.08 2eec s ASN 120 Ca 0.70 -0.91 -0.27 0.00 0.21 0.00 0.00 52.86 52.58 2eec s ASN 120 Cb -0.06 -0.06 -0.11 0.00 -0.55 0.00 0.00 41.25 40.47 2eec s ASN 120 CO 0.51 -0.97 2.49 -0.62 -2.79 0.00 0.00 177.10 175.72 2eec n GLU 121 N -1.80 0.76 -3.68 0.43 4.71 -1.26 -4.87 120.64 114.94 2eec n GLU 121 Ca 0.05 -0.01 -0.12 0.00 -0.01 0.00 0.00 57.16 57.07 2eec n GLU 121 Cb 0.62 -2.94 -0.09 0.00 -1.01 0.00 0.00 31.44 28.03 2eec n GLU 121 CO 0.00 0.00 0.00 0.95 0.09 0.00 0.00 177.13 178.17 2eec s THR 122 N 11.42 -0.00 0.44 2.62 -4.23 -1.26 -5.18 115.64 119.45 2eec s THR 122 Ca 1.08 0.01 0.06 0.00 -1.18 0.00 0.00 61.69 61.66 2eec s THR 122 Cb -0.46 -0.80 -0.06 0.00 1.34 0.00 0.00 72.50 72.53 2eec s THR 122 CO 0.32 0.00 0.03 -0.94 -0.54 0.00 0.00 174.62 173.50 2eec s SER 123 N 0.62 4.01 0.45 3.99 1.04 -1.26 -5.16 113.70 117.39 2eec s SER 123 Ca -0.03 -1.40 0.07 0.00 0.48 0.00 0.00 55.95 55.08 2eec s SER 123 Cb -0.05 -0.19 0.02 0.00 0.10 0.00 0.00 66.02 65.91 2eec s SER 123 CO -0.04 -0.56 0.61 -0.55 0.98 0.00 0.00 173.24 173.68 2eec s SER 124 N -3.78 5.56 0.00 7.02 0.15 -1.26 -5.27 113.70 116.12 2eec s SER 124 Ca 0.29 -0.42 0.00 0.00 0.70 0.00 0.00 55.95 56.52 2eec s SER 124 Cb 0.07 -0.58 0.00 0.00 -1.71 0.00 0.00 66.02 63.80 2eec s SER 124 CO 0.15 -0.86 0.48 0.00 1.20 0.00 0.00 173.24 174.21