#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2edt n SER 2 N 0.00 -4.25 -3.69 1.61 7.64 -1.26 -4.96 113.62 108.71 2edt n SER 2 Ca 0.00 -0.83 -0.10 0.00 1.01 0.00 0.00 58.87 58.95 2edt n SER 2 Cb 0.00 -3.69 -0.11 0.00 -1.01 0.00 0.00 64.21 59.40 2edt n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2edt s SER 3 N -3.40 -0.47 0.99 6.43 0.15 -1.26 -5.15 113.70 110.99 2edt s SER 3 Ca 0.62 0.88 -0.17 0.00 0.70 0.00 0.00 55.95 57.98 2edt s SER 3 Cb -0.32 0.81 -0.08 0.00 -1.71 0.00 0.00 66.02 64.72 2edt s SER 3 CO 0.85 -0.20 -0.45 0.61 1.20 0.00 0.00 173.24 175.25 2edt n GLY 4 N 4.38 -3.48 0.09 9.45 0.00 -1.26 -4.92 105.19 109.46 2edt n GLY 4 Ca -0.22 -0.70 -0.15 0.00 0.00 0.00 0.00 46.02 44.95 2edt n GLY 4 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2edt h SER 5 N -1.26 0.19 -0.90 1.61 4.64 -2.03 -3.47 113.55 112.32 2edt h SER 5 Ca -0.44 -0.75 -0.60 0.00 -0.47 0.00 0.00 61.79 59.53 2edt h SER 5 Cb 1.31 -0.06 -0.08 0.00 -0.31 0.00 0.00 62.40 63.26 2edt h SER 5 CO 0.27 0.91 -0.43 -0.94 -0.87 0.00 0.00 176.83 175.77 2edt s SER 6 N -6.22 4.42 0.17 4.97 1.04 -1.26 -5.13 113.70 111.69 2edt s SER 6 Ca -0.16 -1.29 -0.18 0.00 0.48 0.00 0.00 55.95 54.80 2edt s SER 6 Cb 0.01 0.11 -0.07 0.00 0.10 0.00 0.00 66.02 66.16 2edt s SER 6 CO 0.73 -0.83 0.63 -0.83 0.98 0.00 0.00 173.24 173.92 2edt s GLY 7 N -4.03 2.57 0.72 7.32 0.00 -1.26 -5.06 107.32 107.57 2edt s GLY 7 Ca 0.29 0.03 -0.13 0.00 0.00 0.00 0.00 44.72 44.91 2edt s GLY 7 CO 0.17 0.37 1.10 2.56 0.00 0.00 0.00 173.10 177.30 2edt s PRO 8 N -1.81 2.52 -0.25 2.90 0.04 -1.26 -5.00 135.00 132.14 2edt s PRO 8 Ca 0.38 1.28 -0.20 0.00 0.04 0.00 0.00 61.00 62.50 2edt s PRO 8 Cb -0.17 -1.92 -0.02 0.00 0.04 0.00 0.00 34.50 32.43 2edt s PRO 8 CO 0.20 -1.45 0.62 0.00 0.04 0.00 0.00 177.00 176.41 2edt s ALA 9 N -2.62 3.61 0.40 8.56 0.00 -1.26 -4.93 121.76 125.51 2edt s ALA 9 Ca 0.64 -0.43 0.04 0.00 0.00 0.00 0.00 51.96 52.21 2edt s ALA 9 Cb -0.19 -3.02 -0.00 0.00 0.00 0.00 0.00 23.12 19.91 2edt s ALA 9 CO 0.49 -0.79 0.58 0.15 0.00 0.00 0.00 175.76 176.19 2edt s LYS 10 N 2.46 3.03 -0.30 0.00 -0.14 -1.26 -4.45 119.74 119.07 2edt s LYS 10 Ca 0.26 -0.82 -0.10 0.00 -1.36 0.00 0.00 55.97 53.95 2edt s LYS 10 Cb -0.16 -2.69 -0.02 0.00 -1.68 0.00 0.00 37.83 33.28 2edt s LYS 10 CO 0.09 -0.15 0.17 -0.06 -0.76 0.00 0.00 175.35 174.63 2edt s PHE 11 N -2.38 3.19 -0.11 3.18 0.08 -1.26 -0.55 117.98 120.13 2edt s PHE 11 Ca 0.48 -0.27 -0.11 0.00 0.12 0.00 0.00 56.93 57.15 2edt s PHE 11 Cb -0.10 -2.37 -0.27 0.00 -0.57 0.00 0.00 43.02 39.71 2edt s PHE 11 CO 0.34 -0.34 0.47 1.79 -0.10 0.00 0.00 175.22 177.39 2edt h THR 12 N 5.52 0.81 0.00 0.64 1.35 -1.87 -3.42 112.91 115.95 2edt h THR 12 Ca -0.34 -2.38 -0.34 0.00 -0.55 0.00 0.00 66.41 62.80 2edt h THR 12 Cb 1.17 2.59 -0.06 0.00 -1.73 0.00 0.00 68.15 70.12 2edt h THR 12 CO 0.59 0.80 -2.22 -0.62 -0.25 0.00 0.00 175.52 173.83 2edt n GLU 13 N -3.69 0.50 -0.23 4.72 -0.58 -1.26 -5.04 120.64 115.06 2edt n GLU 13 Ca -0.29 0.16 0.03 0.00 -0.42 0.00 0.00 57.16 56.65 2edt n GLU 13 Cb 0.99 -1.36 -0.01 0.00 -0.57 0.00 0.00 31.44 30.49 2edt n GLU 13 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2edt n GLY 14 N 2.08 -1.68 3.83 0.62 0.00 -1.26 -4.93 105.19 103.84 2edt n GLY 14 Ca -0.40 -1.46 -0.30 0.00 0.00 0.00 0.00 46.02 43.86 2edt n GLY 14 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2edt s LEU 15 N -3.98 2.71 -0.06 0.99 1.43 -1.26 -4.63 118.68 113.88 2edt s LEU 15 Ca 0.00 1.25 -0.09 0.00 -1.03 0.00 0.00 54.13 54.25 2edt s LEU 15 Cb 0.00 -3.93 0.02 0.00 0.03 0.00 0.00 46.19 42.31 2edt s LEU 15 CO 0.00 -1.74 0.23 0.00 0.23 0.00 0.00 176.35 175.07 2edt s ARG 16 N -5.23 0.37 0.58 1.70 1.70 -1.26 -4.91 118.95 111.90 2edt s ARG 16 Ca 0.60 0.13 -0.20 0.00 -0.47 0.00 0.00 55.73 55.79 2edt s ARG 16 Cb -0.13 0.17 -0.04 0.00 -0.57 0.00 0.00 34.95 34.38 2edt s ARG 16 CO 0.53 -0.07 1.20 0.27 -1.08 0.00 0.00 175.30 176.16 2edt n ASN 17 N 2.44 1.88 -3.53 -2.89 0.23 -1.26 -4.70 115.26 107.43 2edt n ASN 17 Ca -0.16 0.89 -0.09 0.00 -0.53 0.00 0.00 54.58 54.70 2edt n ASN 17 Cb 0.57 -1.50 -0.01 0.00 -2.08 0.00 0.00 39.78 36.76 2edt n ASN 17 CO 0.00 0.00 0.00 -1.83 -0.93 0.00 0.00 177.26 174.50 2edt s GLU 18 N -2.91 1.91 0.26 -3.83 1.03 -0.71 -4.97 118.70 109.48 2edt s GLU 18 Ca 0.75 -1.24 0.02 0.00 0.03 0.00 0.00 54.97 54.52 2edt s GLU 18 Cb -0.42 0.58 -0.05 0.00 -0.80 0.00 0.00 34.13 33.44 2edt s GLU 18 CO 0.47 -0.86 0.08 -1.83 -1.33 0.00 0.00 175.26 171.79 2edt s GLU 19 N -3.34 1.42 0.21 -4.83 1.03 -1.26 -0.66 118.70 111.26 2edt s GLU 19 Ca 0.16 -1.76 -0.16 0.00 0.03 0.00 0.00 54.97 53.24 2edt s GLU 19 Cb -0.04 -0.33 0.06 0.00 -0.80 0.00 0.00 34.13 33.01 2edt s GLU 19 CO 0.10 -0.27 0.78 0.00 -1.33 0.00 0.00 175.26 174.54 2edt n ALA 20 N -0.47 -1.97 -2.54 -0.84 0.00 0.28 -4.82 120.51 110.14 2edt n ALA 20 Ca -0.01 -0.90 -0.31 0.00 0.00 0.00 0.00 53.44 52.22 2edt n ALA 20 Cb 0.66 0.58 -0.11 0.00 0.00 0.00 0.00 19.45 20.58 2edt n ALA 20 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2edt s VAL 21 N -2.19 3.23 0.29 0.00 1.01 -1.26 0.93 120.40 122.40 2edt s VAL 21 Ca 0.17 -1.12 -0.29 0.00 0.00 0.00 0.00 61.98 60.74 2edt s VAL 21 Cb -0.03 -2.43 -0.13 0.00 0.00 0.00 0.00 36.38 33.79 2edt s VAL 21 CO 0.06 0.26 1.20 -0.62 0.00 0.00 0.00 175.10 176.01 2edt n GLU 22 N 1.23 1.75 0.00 2.72 1.02 0.18 -1.56 120.64 125.98 2edt n GLU 22 Ca -0.15 0.62 0.00 0.00 -0.02 0.00 0.00 57.16 57.61 2edt n GLU 22 Cb 0.52 -2.13 0.00 0.00 -0.02 0.00 0.00 31.44 29.81 2edt n GLU 22 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2edt n GLY 23 N 1.33 2.16 2.07 0.62 0.00 -0.93 -4.68 105.19 105.77 2edt n GLY 23 Ca 0.09 -0.32 -0.19 0.00 0.00 0.00 0.00 46.02 45.59 2edt n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2edt n ALA 24 N 0.00 -3.15 -3.93 4.61 0.00 -0.60 -3.40 120.51 114.04 2edt n ALA 24 Ca 0.00 -1.00 -0.33 0.00 0.00 0.00 0.00 53.44 52.12 2edt n ALA 24 Cb 0.00 -0.09 -0.14 0.00 0.00 0.00 0.00 19.45 19.22 2edt n ALA 24 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2edt s THR 25 N -1.81 2.49 1.01 0.00 2.01 -1.26 -1.71 115.64 116.36 2edt s THR 25 Ca 0.43 -1.79 -0.18 0.00 0.31 0.00 0.00 61.69 60.47 2edt s THR 25 Cb -0.07 -2.57 0.05 0.00 0.01 0.00 0.00 72.50 69.92 2edt s THR 25 CO 0.36 -0.24 -0.26 0.00 -0.69 0.00 0.00 174.62 173.79 2edt n ALA 26 N 4.45 -2.76 -3.43 7.40 0.00 -1.25 -4.77 120.51 120.14 2edt n ALA 26 Ca -0.08 -1.14 -0.14 0.00 0.00 0.00 0.00 53.44 52.07 2edt n ALA 26 Cb 0.42 -1.02 -0.11 0.00 0.00 0.00 0.00 19.45 18.74 2edt n ALA 26 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 2edt s MET 27 N -3.01 0.26 -0.14 0.00 0.00 -1.26 -4.08 119.30 111.07 2edt s MET 27 Ca 0.41 0.36 0.00 0.00 0.00 0.00 0.00 55.69 56.45 2edt s MET 27 Cb -0.04 -0.88 0.02 0.00 0.00 0.00 0.00 34.83 33.94 2edt s MET 27 CO 0.51 -0.65 -0.12 -0.51 0.00 0.00 0.00 175.02 174.25 2edt s LEU 28 N 2.42 1.54 0.21 4.11 1.43 -0.91 -4.98 118.68 122.50 2edt s LEU 28 Ca 0.09 -0.43 0.07 0.00 -1.03 0.00 0.00 54.13 52.84 2edt s LEU 28 Cb -0.16 -1.07 -0.05 0.00 0.03 0.00 0.00 46.19 44.94 2edt s LEU 28 CO -0.14 -0.07 -0.12 -1.66 0.23 0.00 0.00 176.35 174.59 2edt s TRP 29 N 1.53 1.69 -0.28 0.29 1.48 -1.26 -0.22 118.94 122.17 2edt s TRP 29 Ca 0.04 -0.63 -0.24 0.00 -1.06 0.00 0.00 56.10 54.21 2edt s TRP 29 Cb -0.13 -0.83 0.09 0.00 -1.16 0.00 0.00 33.47 31.45 2edt s TRP 29 CO -0.10 0.30 0.85 0.00 -4.06 0.00 0.00 176.95 173.94 2edt s GLU 31 N 0.39 3.07 0.04 0.00 2.02 -1.26 -1.52 118.70 121.43 2edt s GLU 31 Ca 0.01 -0.46 -0.06 0.00 0.02 0.00 0.00 54.97 54.47 2edt s GLU 31 Cb -0.05 -2.55 -0.01 0.00 0.10 0.00 0.00 34.13 31.63 2edt s GLU 31 CO -0.03 -0.28 0.11 -0.51 0.02 0.00 0.00 175.26 174.56 2edt s LEU 32 N -4.57 1.75 0.50 1.80 1.43 0.08 -3.41 118.68 116.26 2edt s LEU 32 Ca 0.49 -0.49 0.30 0.00 -1.03 0.00 0.00 54.13 53.39 2edt s LEU 32 Cb -0.10 0.64 1.63 0.00 0.03 0.00 0.00 46.19 48.39 2edt s LEU 32 CO 0.38 -0.50 1.91 -1.28 0.23 0.00 0.00 176.35 177.09 2edt h SER 33 N 3.69 0.00 -4.81 2.29 0.87 -1.14 -3.43 113.55 111.01 2edt h SER 33 Ca -0.32 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.23 2edt h SER 33 Cb 1.19 0.00 -0.17 0.00 -0.44 0.00 0.00 62.40 62.98 2edt h SER 33 CO 0.49 0.00 0.29 -1.59 -0.53 0.00 0.00 176.83 175.50 2edt s LYS 34 N -3.82 1.02 -0.45 2.24 -2.85 -1.26 -4.96 119.74 109.65 2edt s LYS 34 Ca -0.03 -0.05 -0.27 0.00 -1.00 0.00 0.00 55.97 54.62 2edt s LYS 34 Cb 0.09 0.47 -0.04 0.00 -2.06 0.00 0.00 37.83 36.29 2edt s LYS 34 CO 0.27 -0.38 2.09 0.08 0.10 0.00 0.00 175.35 177.51 2edt s VAL 35 N -2.20 3.21 0.05 1.79 1.01 -1.26 -4.74 120.40 118.26 2edt s VAL 35 Ca -0.04 0.17 0.01 0.00 0.00 0.00 0.00 61.98 62.12 2edt s VAL 35 Cb -0.01 -3.42 -0.03 0.00 0.00 0.00 0.00 36.38 32.93 2edt s VAL 35 CO -0.01 -0.36 -0.06 0.00 0.00 0.00 0.00 175.10 174.68 2edt s ALA 36 N 9.55 0.59 -0.24 5.51 0.00 -1.26 -4.99 121.76 130.92 2edt s ALA 36 Ca 0.85 -0.96 -0.29 0.00 0.00 0.00 0.00 51.96 51.56 2edt s ALA 36 Cb -0.19 0.13 -0.02 0.00 0.00 0.00 0.00 23.12 23.03 2edt s ALA 36 CO 0.28 -0.16 1.62 -1.25 0.00 0.00 0.00 175.76 176.25 2edt s PRO 37 N -2.53 3.74 0.39 0.00 0.04 -1.26 -5.00 135.00 130.38 2edt s PRO 37 Ca -0.03 1.61 -0.04 0.00 0.04 0.00 0.00 61.00 62.58 2edt s PRO 37 Cb -0.03 -4.05 -0.04 0.00 0.04 0.00 0.00 34.50 30.42 2edt s PRO 37 CO -0.03 -1.36 0.67 0.14 0.04 0.00 0.00 177.00 176.46 2edt s VAL 38 N 5.37 4.98 -0.29 -0.36 -7.23 -1.26 -4.56 120.40 117.04 2edt s VAL 38 Ca 0.72 0.03 0.00 0.00 -1.81 0.00 0.00 61.98 60.92 2edt s VAL 38 Cb -0.24 -3.82 0.09 0.00 0.56 0.00 0.00 36.38 32.96 2edt s VAL 38 CO 0.30 -0.62 0.05 -1.61 -0.31 0.00 0.00 175.10 172.91 2edt s GLU 39 N -4.27 1.03 0.16 4.82 0.41 0.96 -4.97 118.70 116.84 2edt s GLU 39 Ca 0.45 -1.14 -0.30 0.00 -0.41 0.00 0.00 54.97 53.57 2edt s GLU 39 Cb -0.10 -2.35 -0.07 0.00 -1.78 0.00 0.00 34.13 29.83 2edt s GLU 39 CO 0.38 -0.87 1.03 -1.58 -0.49 0.00 0.00 175.26 173.73 2edt s TRP 40 N 1.47 3.72 0.04 1.61 0.52 -1.26 -1.54 118.94 123.50 2edt s TRP 40 Ca 0.06 1.71 -0.06 0.00 0.02 0.00 0.00 56.10 57.83 2edt s TRP 40 Cb -0.18 -3.16 -0.01 0.00 -1.15 0.00 0.00 33.47 28.97 2edt s TRP 40 CO -0.16 -0.17 0.10 1.03 0.02 0.00 0.00 176.95 177.76 2edt s ARG 41 N -0.33 0.61 -0.49 4.98 0.52 0.12 -1.72 118.95 122.64 2edt s ARG 41 Ca 0.47 -0.78 0.03 0.00 -0.52 0.00 0.00 55.73 54.94 2edt s ARG 41 Cb -0.27 0.24 0.15 0.00 0.52 0.00 0.00 34.95 35.60 2edt s ARG 41 CO 0.33 -0.16 0.33 0.21 0.02 0.00 0.00 175.30 176.03 2edt s LYS 42 N -2.73 1.44 5.08 3.54 2.20 -1.17 0.02 119.74 128.12 2edt s LYS 42 Ca -0.04 -2.35 0.00 0.00 -0.36 0.00 0.00 55.97 53.22 2edt s LYS 42 Cb -0.00 -2.30 0.00 0.00 -1.51 0.00 0.00 37.83 34.02 2edt s LYS 42 CO -0.05 -1.26 0.00 0.41 -0.36 0.00 0.00 175.35 174.09 2edt n GLY 43 N 2.96 3.14 0.19 5.54 0.00 -1.26 -0.17 105.19 115.59 2edt n GLY 43 Ca 0.18 0.28 0.14 0.00 0.00 0.00 0.00 46.02 46.61 2edt n GLY 43 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2edt h PRO 44 N 0.00 0.00 -7.00 1.61 0.13 -1.97 -3.44 132.00 121.32 2edt h PRO 44 Ca 0.00 0.00 -0.45 0.00 -0.87 0.00 0.00 66.00 64.68 2edt h PRO 44 Cb 0.00 0.00 0.06 0.00 0.13 0.00 0.00 31.00 31.19 2edt h PRO 44 CO 0.00 0.00 0.05 -1.21 -0.23 0.00 0.00 178.00 176.61 2edt s GLU 45 N -3.46 2.17 -0.13 0.86 2.02 0.76 -5.11 118.70 115.81 2edt s GLU 45 Ca 0.03 -0.84 -0.04 0.00 0.02 0.00 0.00 54.97 54.14 2edt s GLU 45 Cb 0.09 -2.39 0.06 0.00 0.10 0.00 0.00 34.13 31.99 2edt s GLU 45 CO 0.44 -1.06 0.11 -0.80 0.02 0.00 0.00 175.26 173.97 2edt s ASN 46 N -4.55 1.69 0.34 -0.19 0.01 -1.26 -3.04 114.94 107.94 2edt s ASN 46 Ca 0.61 -0.26 -0.01 0.00 -0.71 0.00 0.00 52.86 52.49 2edt s ASN 46 Cb -0.08 -0.05 -0.04 0.00 0.41 0.00 0.00 41.25 41.48 2edt s ASN 46 CO 0.41 -0.31 0.56 -0.76 -1.51 0.00 0.00 177.10 175.49 2edt s LEU 47 N 2.20 4.01 -0.14 0.60 1.43 -0.70 -4.94 118.68 121.13 2edt s LEU 47 Ca 0.04 0.54 -0.34 0.00 -1.03 0.00 0.00 54.13 53.34 2edt s LEU 47 Cb -0.14 -3.39 0.13 0.00 0.03 0.00 0.00 46.19 42.81 2edt s LEU 47 CO -0.08 -0.28 1.22 0.00 0.23 0.00 0.00 176.35 177.44 2edt s ARG 48 N -4.12 0.35 -0.48 1.70 1.70 -1.26 -4.22 118.95 112.62 2edt s ARG 48 Ca 0.41 -0.15 -0.27 0.00 -0.47 0.00 0.00 55.73 55.25 2edt s ARG 48 Cb -0.10 0.15 -0.08 0.00 -0.57 0.00 0.00 34.95 34.35 2edt s ARG 48 CO 0.35 -0.16 2.40 -0.40 -1.08 0.00 0.00 175.30 176.41 2edt n ASP 49 N -0.20 2.31 0.00 -2.89 5.68 -1.26 -4.61 116.55 115.58 2edt n ASP 49 Ca -0.02 -0.30 0.00 0.00 -0.50 0.00 0.00 54.79 53.97 2edt n ASP 49 Cb 0.59 -1.52 0.00 0.00 -1.14 0.00 0.00 41.12 39.06 2edt n ASP 49 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2edt n GLY 50 N 6.04 5.11 0.06 6.12 0.00 -0.16 -4.98 105.19 117.38 2edt n GLY 50 Ca 0.38 -1.16 -0.02 0.00 0.00 0.00 0.00 46.02 45.23 2edt n GLY 50 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2edt h ASP 51 N 0.00 -0.10 0.19 1.61 3.58 -2.01 -3.35 116.42 116.34 2edt h ASP 51 Ca 0.00 0.00 -0.05 0.00 0.42 0.00 0.00 57.03 57.41 2edt h ASP 51 Cb 0.00 0.03 -0.01 0.00 1.72 0.00 0.00 39.33 41.07 2edt h ASP 51 CO 0.00 0.04 -0.21 0.08 -2.88 0.00 0.00 179.24 176.27 2edt h ARG 52 N -0.35 0.04 -4.24 0.28 0.11 -1.95 -3.38 114.38 104.89 2edt h ARG 52 Ca -0.01 -0.01 -0.75 0.00 0.10 0.00 0.00 59.98 59.31 2edt h ARG 52 Cb 0.09 -0.00 -0.23 0.00 1.11 0.00 0.00 29.97 30.94 2edt h ARG 52 CO 0.02 0.25 -0.19 0.71 0.10 0.00 0.00 179.97 180.86 2edt s TYR 53 N -4.56 3.21 -0.82 4.08 2.02 -1.26 -0.93 117.35 119.09 2edt s TYR 53 Ca -0.04 -1.14 -0.21 0.00 -0.37 0.00 0.00 57.07 55.31 2edt s TYR 53 Cb 0.15 -3.68 0.09 0.00 -0.40 0.00 0.00 41.96 38.12 2edt s TYR 53 CO 0.71 -1.01 1.12 0.42 -1.57 0.00 0.00 175.55 175.22 2edt s ILE 54 N 1.78 4.38 -0.08 2.71 1.01 0.76 -0.99 121.20 130.77 2edt s ILE 54 Ca 0.05 -0.82 -0.10 0.00 0.00 0.00 0.00 60.65 59.78 2edt s ILE 54 Cb -0.28 -4.79 -0.05 0.00 0.01 0.00 0.00 42.46 37.36 2edt s ILE 54 CO 0.05 -1.57 0.23 -0.76 0.00 0.00 0.00 174.94 172.88 2edt s LEU 55 N 3.79 4.42 0.31 2.97 2.01 -1.26 -1.25 118.68 129.67 2edt s LEU 55 Ca 0.30 0.64 0.04 0.00 0.01 0.00 0.00 54.13 55.13 2edt s LEU 55 Cb -0.09 -2.25 -0.03 0.00 0.01 0.00 0.00 46.19 43.82 2edt s LEU 55 CO 0.00 0.38 0.19 -0.13 1.01 0.00 0.00 176.35 177.80 2edt s ARG 56 N -1.05 1.62 -0.30 1.70 0.52 -0.16 -4.97 118.95 116.30 2edt s ARG 56 Ca 0.18 -1.93 -0.14 0.00 -0.52 0.00 0.00 55.73 53.33 2edt s ARG 56 Cb -0.14 0.05 0.17 0.00 0.52 0.00 0.00 34.95 35.55 2edt s ARG 56 CO 0.07 -0.51 0.98 -1.14 0.02 0.00 0.00 175.30 174.73 2edt s GLN 57 N -3.74 0.28 -0.17 3.54 0.74 -1.26 -2.74 119.66 116.31 2edt s GLN 57 Ca 0.37 0.64 0.17 0.00 0.05 0.00 0.00 55.36 56.59 2edt s GLN 57 Cb 0.04 0.38 0.43 0.00 1.10 0.00 0.00 33.01 34.97 2edt s GLN 57 CO 0.20 -0.16 1.31 0.39 -0.55 0.00 0.00 175.29 176.48 2edt n GLU 58 N 5.11 2.17 -0.37 1.67 -0.58 -1.22 -5.07 120.64 122.37 2edt n GLU 58 Ca -0.08 -2.78 0.00 0.00 -0.42 0.00 0.00 57.16 53.88 2edt n GLU 58 Cb 0.53 -1.70 0.00 0.00 -0.57 0.00 0.00 31.44 29.69 2edt n GLU 58 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2edt n GLY 59 N -0.93 0.61 0.35 0.62 0.00 -1.26 -4.84 105.19 99.73 2edt n GLY 59 Ca 0.20 -1.59 0.13 0.00 0.00 0.00 0.00 46.02 44.76 2edt n GLY 59 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2edt h THR 60 N 0.00 0.03 -2.88 2.61 1.35 -1.86 -3.39 112.91 108.77 2edt h THR 60 Ca 0.00 0.00 -0.65 0.00 -0.55 0.00 0.00 66.41 65.21 2edt h THR 60 Cb 0.00 0.50 -0.08 0.00 -1.73 0.00 0.00 68.15 66.84 2edt h THR 60 CO 0.00 0.00 -0.52 -0.60 -0.25 0.00 0.00 175.52 174.15 2edt s ARG 61 N -4.13 3.31 0.45 4.72 3.00 -1.26 -0.74 118.95 124.29 2edt s ARG 61 Ca -0.03 -0.32 0.06 0.00 -1.00 0.00 0.00 55.73 54.44 2edt s ARG 61 Cb 0.07 -3.04 -0.05 0.00 0.00 0.00 0.00 34.95 31.94 2edt s ARG 61 CO 0.24 0.70 0.09 0.00 0.00 0.00 0.00 175.30 176.33 2edt s GLU 63 N -3.86 0.23 -0.13 0.00 2.02 -1.11 -3.35 118.70 112.51 2edt s GLU 63 Ca 0.30 0.89 -0.02 0.00 0.02 0.00 0.00 54.97 56.15 2edt s GLU 63 Cb 0.05 0.14 -0.02 0.00 0.10 0.00 0.00 34.13 34.40 2edt s GLU 63 CO 0.16 -0.27 -0.07 -1.17 0.02 0.00 0.00 175.26 173.93 2edt s LEU 64 N 2.51 3.10 -0.11 1.80 2.96 0.69 -0.99 118.68 128.65 2edt s LEU 64 Ca -0.00 -0.16 0.01 0.00 -0.22 0.00 0.00 54.13 53.76 2edt s LEU 64 Cb -0.12 -1.72 0.02 0.00 0.50 0.00 0.00 46.19 44.87 2edt s LEU 64 CO -0.10 0.21 -0.11 -1.10 -1.32 0.00 0.00 176.35 173.92 2edt s GLN 65 N 0.12 1.83 -0.76 1.98 -0.21 -0.38 -2.14 119.66 120.09 2edt s GLN 65 Ca -0.03 -0.40 -0.12 0.00 0.02 0.00 0.00 55.36 54.83 2edt s GLN 65 Cb -0.14 -1.68 0.20 0.00 1.00 0.00 0.00 33.01 32.39 2edt s GLN 65 CO 0.03 -0.15 0.68 0.42 -2.12 0.00 0.00 175.29 174.15 2edt s ILE 66 N 1.28 5.23 -0.03 1.08 1.01 -1.26 -0.17 121.20 128.35 2edt s ILE 66 Ca -0.02 -2.46 -0.30 0.00 0.00 0.00 0.00 60.65 57.87 2edt s ILE 66 Cb -0.14 -4.27 -0.08 0.00 0.01 0.00 0.00 42.46 37.99 2edt s ILE 66 CO -0.04 -0.98 2.00 0.00 0.00 0.00 0.00 174.94 175.91 2edt n GLY 68 N 4.78 -0.15 3.92 0.00 0.00 -1.24 -4.87 105.19 107.63 2edt n GLY 68 Ca 0.22 -0.43 -0.27 0.00 0.00 0.00 0.00 46.02 45.54 2edt n GLY 68 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2edt s LEU 69 N -0.37 2.79 -0.17 0.99 1.43 -0.70 -4.86 118.68 117.79 2edt s LEU 69 Ca 0.00 0.60 -0.33 0.00 -1.03 0.00 0.00 54.13 53.37 2edt s LEU 69 Cb 0.00 -3.24 0.14 0.00 0.03 0.00 0.00 46.19 43.12 2edt s LEU 69 CO 0.00 -1.60 1.16 0.00 0.23 0.00 0.00 176.35 176.13 2edt s ALA 70 N -3.31 -2.03 0.45 4.21 0.00 -1.26 -2.18 121.76 117.64 2edt s ALA 70 Ca 0.60 1.55 0.31 0.00 0.00 0.00 0.00 51.96 54.42 2edt s ALA 70 Cb -0.11 -0.25 1.44 0.00 0.00 0.00 0.00 23.12 24.20 2edt s ALA 70 CO 0.46 -0.54 1.63 0.52 0.00 0.00 0.00 175.76 177.83 2edt h MET 71 N 2.06 0.08 -0.09 0.00 2.86 -1.97 0.54 114.93 118.43 2edt h MET 71 Ca -0.12 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.51 2edt h MET 71 Cb 1.18 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 32.82 2edt h MET 71 CO 0.25 0.06 0.01 0.00 1.06 0.00 0.00 176.91 178.29 2edt h ALA 72 N 1.55 0.12 -1.03 6.32 0.00 -2.00 -2.96 119.26 121.26 2edt h ALA 72 Ca 0.81 -0.15 0.42 0.00 0.00 0.00 0.00 54.91 55.99 2edt h ALA 72 Cb 2.62 -0.03 -0.17 0.00 0.00 0.00 0.00 17.79 20.20 2edt h ALA 72 CO -0.37 -0.23 0.57 -0.44 0.00 0.00 0.00 179.25 178.78 2edt h ASP 73 N -0.09 0.33 -1.51 0.00 3.32 -0.28 -3.37 116.42 114.82 2edt h ASP 73 Ca 0.03 0.25 -0.62 0.00 0.02 0.00 0.00 57.03 56.71 2edt h ASP 73 Cb 0.28 0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.07 2edt h ASP 73 CO 0.00 -0.40 1.48 0.00 -1.72 0.00 0.00 179.24 178.60 2edt n ALA 74 N -2.28 1.38 -2.00 3.45 0.00 -1.12 -4.67 120.51 115.26 2edt n ALA 74 Ca 0.38 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.60 2edt n ALA 74 Cb 1.28 -2.76 0.00 0.00 0.00 0.00 0.00 19.45 17.97 2edt n ALA 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2edt n GLY 75 N 6.16 1.71 2.73 0.00 0.00 -1.25 -5.00 105.19 109.54 2edt n GLY 75 Ca 0.36 0.29 -0.19 0.00 0.00 0.00 0.00 46.02 46.48 2edt n GLY 75 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2edt s GLU 76 N 3.25 0.17 0.16 1.61 2.12 -1.26 -3.25 118.70 121.50 2edt s GLU 76 Ca 0.00 0.16 -0.06 0.00 0.36 0.00 0.00 54.97 55.43 2edt s GLU 76 Cb 0.00 -1.30 -0.06 0.00 0.26 0.00 0.00 34.13 33.03 2edt s GLU 76 CO 0.00 -0.66 0.41 0.71 -0.54 0.00 0.00 175.26 175.18 2edt s TYR 77 N 2.30 3.47 0.06 5.30 1.51 -0.68 -4.10 117.35 125.21 2edt s TYR 77 Ca 0.06 0.62 0.05 0.00 -1.01 0.00 0.00 57.07 56.79 2edt s TYR 77 Cb -0.16 -2.06 -0.03 0.00 -0.11 0.00 0.00 41.96 39.61 2edt s TYR 77 CO -0.12 0.41 -0.14 -0.51 -1.11 0.00 0.00 175.55 174.09 2edt s LEU 78 N -2.66 2.23 -0.27 -1.29 1.02 0.10 -0.37 118.68 117.45 2edt s LEU 78 Ca 0.42 -0.54 0.01 0.00 0.02 0.00 0.00 54.13 54.04 2edt s LEU 78 Cb -0.12 -0.53 0.07 0.00 0.02 0.00 0.00 46.19 45.64 2edt s LEU 78 CO 0.24 -0.04 -0.02 0.00 0.02 0.00 0.00 176.35 176.55 2edt s VAL 80 N 1.30 5.21 -0.18 0.00 1.01 -0.59 -2.07 120.40 125.08 2edt s VAL 80 Ca -0.00 0.73 -0.05 0.00 0.00 0.00 0.00 61.98 62.66 2edt s VAL 80 Cb -0.19 -3.70 0.06 0.00 0.00 0.00 0.00 36.38 32.55 2edt s VAL 80 CO -0.09 0.42 0.09 0.00 0.00 0.00 0.00 175.10 175.52 2edt n GLY 82 N 5.26 1.27 0.00 0.00 0.00 -1.26 -2.47 105.19 108.00 2edt n GLY 82 Ca -0.07 0.29 0.00 0.00 0.00 0.00 0.00 46.02 46.24 2edt n GLY 82 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2edt n GLN 83 N 0.00 2.89 -1.81 1.61 7.27 -1.26 -4.99 117.38 121.09 2edt n GLN 83 Ca 0.00 0.00 -0.24 0.00 0.07 0.00 0.00 57.00 56.83 2edt n GLN 83 Cb 0.00 -0.95 0.16 0.00 2.41 0.00 0.00 30.24 31.86 2edt n GLN 83 CO 0.00 0.00 0.00 0.39 0.07 0.00 0.00 177.06 177.52 2edt n GLU 84 N -1.74 -0.87 -3.60 3.69 -0.58 -1.03 -5.12 120.64 111.40 2edt n GLU 84 Ca 0.00 -1.92 -0.05 0.00 -0.42 0.00 0.00 57.16 54.77 2edt n GLU 84 Cb 0.34 -1.05 -0.02 0.00 -0.57 0.00 0.00 31.44 30.14 2edt n GLU 84 CO 0.00 0.00 0.00 -0.98 -0.48 0.00 0.00 177.13 175.67 2edt s ARG 85 N -5.35 0.31 0.26 3.49 1.70 -1.26 -2.38 118.95 115.72 2edt s ARG 85 Ca 0.64 -0.09 0.01 0.00 -0.47 0.00 0.00 55.73 55.81 2edt s ARG 85 Cb -0.02 0.14 -0.03 0.00 -0.57 0.00 0.00 34.95 34.47 2edt s ARG 85 CO 0.44 -0.13 0.24 -0.08 -1.08 0.00 0.00 175.30 174.68 2edt s THR 86 N -2.24 0.00 0.03 4.99 -1.32 -0.88 -4.97 115.64 111.25 2edt s THR 86 Ca 0.09 -1.92 -0.11 0.00 -1.21 0.00 0.00 61.69 58.54 2edt s THR 86 Cb -0.01 -2.49 0.01 0.00 -1.51 0.00 0.00 72.50 68.50 2edt s THR 86 CO -0.05 0.00 0.23 -0.94 -2.21 0.00 0.00 174.62 171.65 2edt s SER 87 N -3.22 -0.03 0.22 8.08 1.04 -1.26 -1.40 113.70 117.13 2edt s SER 87 Ca 0.37 -0.25 -0.10 0.00 0.48 0.00 0.00 55.95 56.46 2edt s SER 87 Cb 0.04 0.30 -0.01 0.00 0.10 0.00 0.00 66.02 66.45 2edt s SER 87 CO 0.17 -0.54 0.37 0.00 0.98 0.00 0.00 173.24 174.23 2edt s ALA 88 N -2.28 0.11 -0.09 5.32 0.00 0.51 -4.75 121.76 120.57 2edt s ALA 88 Ca -0.07 -1.06 0.03 0.00 0.00 0.00 0.00 51.96 50.86 2edt s ALA 88 Cb -0.02 1.11 -0.01 0.00 0.00 0.00 0.00 23.12 24.20 2edt s ALA 88 CO -0.02 -0.76 -0.19 0.99 0.00 0.00 0.00 175.76 175.77 2edt s THR 89 N -4.04 2.54 0.08 0.00 2.01 -1.26 -1.68 115.64 113.29 2edt s THR 89 Ca 0.25 -0.87 0.05 0.00 0.31 0.00 0.00 61.69 61.44 2edt s THR 89 Cb 0.02 -2.00 -0.04 0.00 0.01 0.00 0.00 72.50 70.49 2edt s THR 89 CO 0.08 0.56 -0.03 -0.22 -0.69 0.00 0.00 174.62 174.32 2edt s LEU 90 N 0.05 3.34 -0.06 4.42 2.96 -1.20 -1.73 118.68 126.45 2edt s LEU 90 Ca -0.08 -0.21 0.05 0.00 -0.22 0.00 0.00 54.13 53.67 2edt s LEU 90 Cb -0.15 -2.06 -0.01 0.00 0.50 0.00 0.00 46.19 44.47 2edt s LEU 90 CO 0.05 0.19 -0.23 -0.89 -1.32 0.00 0.00 176.35 174.16 2edt s THR 91 N -1.24 1.89 -0.14 3.68 2.01 0.16 -3.81 115.64 118.18 2edt s THR 91 Ca 0.23 -0.96 -0.01 0.00 0.31 0.00 0.00 61.69 61.26 2edt s THR 91 Cb -0.11 -1.61 -0.02 0.00 0.01 0.00 0.00 72.50 70.77 2edt s THR 91 CO 0.16 0.53 -0.10 -0.63 -0.69 0.00 0.00 174.62 173.89 2edt s ILE 92 N 0.03 3.32 -0.30 1.82 -1.09 -1.26 0.99 121.20 124.71 2edt s ILE 92 Ca -0.08 -0.56 -0.09 0.00 -2.23 0.00 0.00 60.65 57.69 2edt s ILE 92 Cb -0.14 -2.42 -0.01 0.00 -1.58 0.00 0.00 42.46 38.30 2edt s ILE 92 CO 0.05 0.51 0.14 -0.13 -1.23 0.00 0.00 174.94 174.28 2edt s ARG 93 N 0.42 3.36 -0.10 2.79 1.81 0.26 -4.88 118.95 122.61 2edt s ARG 93 Ca -0.08 -0.70 -0.36 0.00 -1.72 0.00 0.00 55.73 52.88 2edt s ARG 93 Cb -0.15 -3.53 -0.13 0.00 -0.45 0.00 0.00 34.95 30.69 2edt s ARG 93 CO 0.04 -0.39 1.80 0.00 -0.68 0.00 0.00 175.30 176.07 2edt n ALA 94 N 4.97 0.61 -1.24 2.13 0.00 -1.26 -0.65 120.51 125.07 2edt n ALA 94 Ca -0.14 0.33 -0.36 0.00 0.00 0.00 0.00 53.44 53.27 2edt n ALA 94 Cb 0.49 -2.40 0.06 0.00 0.00 0.00 0.00 19.45 17.60 2edt n ALA 94 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2edt n LEU 95 N 5.86 -0.21 0.00 0.00 4.77 -1.26 -4.80 117.00 121.36 2edt n LEU 95 Ca 0.23 0.57 0.06 0.00 -0.03 0.00 0.00 56.01 56.84 2edt n LEU 95 Cb 0.25 -1.14 0.38 0.00 -2.33 0.00 0.00 43.42 40.58 2edt n LEU 95 CO 0.74 -3.53 0.59 -0.81 -1.33 0.00 0.00 177.39 173.05 2edt n PRO 96 N -0.24 0.49 -2.81 3.23 -0.04 -1.26 -4.83 135.00 129.55 2edt n PRO 96 Ca 0.09 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.46 2edt n PRO 96 Cb 0.50 -1.41 0.04 0.00 -0.04 0.00 0.00 33.50 32.60 2edt n PRO 96 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2edt n SER 97 N -0.91 -2.79 0.00 3.54 7.64 -1.26 -4.45 113.62 115.39 2edt n SER 97 Ca 0.10 -0.28 0.00 0.00 1.01 0.00 0.00 58.87 59.69 2edt n SER 97 Cb 0.04 -2.68 0.00 0.00 -1.01 0.00 0.00 64.21 60.56 2edt n SER 97 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2edt n GLY 98 N -1.12 1.32 3.68 0.23 0.00 -1.26 -5.01 105.19 103.02 2edt n GLY 98 Ca -0.08 -0.78 -0.42 0.00 0.00 0.00 0.00 46.02 44.73 2edt n GLY 98 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2edt s PRO 99 N 0.00 4.25 0.31 1.61 0.04 -1.26 -4.90 135.00 135.05 2edt s PRO 99 Ca 0.00 2.02 0.09 0.00 0.04 0.00 0.00 61.00 63.14 2edt s PRO 99 Cb 0.00 -3.68 0.88 0.00 0.04 0.00 0.00 34.50 31.73 2edt s PRO 99 CO 0.00 -0.66 1.70 1.03 0.04 0.00 0.00 177.00 179.11 2edt h SER 100 N 8.28 0.53 0.00 6.66 0.87 -1.95 -3.33 113.55 124.61 2edt h SER 100 Ca -0.37 0.15 0.00 0.00 -1.23 0.00 0.00 61.79 60.34 2edt h SER 100 Cb 1.17 0.09 0.00 0.00 -0.44 0.00 0.00 62.40 63.22 2edt h SER 100 CO 0.92 0.02 -0.71 -0.24 -0.53 0.00 0.00 176.83 176.30 2edt n SER 101 N -4.97 2.04 0.00 6.23 2.88 -1.26 -4.86 113.62 113.68 2edt n SER 101 Ca 0.26 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.80 2edt n SER 101 Cb 0.77 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.23 2edt n SER 101 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42