#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2edt s SER 2 N 0.00 6.51 0.29 1.61 0.01 -1.26 -4.90 113.70 115.97 2edt s SER 2 Ca 0.00 -2.07 0.03 0.00 1.31 0.00 0.00 55.95 55.22 2edt s SER 2 Cb 0.00 -2.29 0.64 0.00 0.21 0.00 0.00 66.02 64.58 2edt s SER 2 CO 0.00 -0.89 1.81 0.77 0.41 0.00 0.00 173.24 175.33 2edt h SER 3 N 8.57 0.86 0.00 2.44 4.64 -2.10 -3.48 113.55 124.48 2edt h SER 3 Ca -0.03 0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 2edt h SER 3 Cb 1.05 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.05 2edt h SER 3 CO 0.97 0.39 0.00 0.61 -0.87 0.00 0.00 176.83 177.93 2edt n GLY 4 N -1.34 0.31 2.77 -0.77 0.00 -1.26 -4.90 105.19 100.00 2edt n GLY 4 Ca 0.21 -1.22 -0.38 0.00 0.00 0.00 0.00 46.02 44.62 2edt n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2edt n SER 5 N 0.00 7.43 -3.85 1.61 3.41 -1.26 -4.90 113.62 116.06 2edt n SER 5 Ca 0.00 -3.82 -0.26 0.00 -0.26 0.00 0.00 58.87 54.53 2edt n SER 5 Cb 0.00 -1.02 -0.17 0.00 -0.26 0.00 0.00 64.21 62.76 2edt n SER 5 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2edt s SER 6 N -1.36 2.20 0.00 4.04 0.15 -1.26 -5.06 113.70 112.41 2edt s SER 6 Ca 0.54 -0.35 0.00 0.00 0.70 0.00 0.00 55.95 56.84 2edt s SER 6 Cb 0.45 -0.72 0.00 0.00 -1.71 0.00 0.00 66.02 64.04 2edt s SER 6 CO -0.32 -0.17 0.00 0.61 1.20 0.00 0.00 173.24 174.56 2edt n GLY 7 N 5.00 0.78 3.35 9.45 0.00 -1.26 -5.01 105.19 117.49 2edt n GLY 7 Ca -0.11 0.43 -0.29 0.00 0.00 0.00 0.00 46.02 46.06 2edt n GLY 7 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2edt n PRO 8 N 0.00 -3.06 -3.77 1.61 -0.04 -1.26 -5.04 135.00 123.44 2edt n PRO 8 Ca 0.00 -1.67 -0.36 0.00 -0.04 0.00 0.00 63.50 61.43 2edt n PRO 8 Cb 0.00 -1.57 -0.06 0.00 -0.04 0.00 0.00 33.50 31.84 2edt n PRO 8 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2edt s ALA 9 N -3.02 3.85 0.48 0.55 0.00 -1.25 -4.89 121.76 117.47 2edt s ALA 9 Ca 0.68 -0.56 0.02 0.00 0.00 0.00 0.00 51.96 52.10 2edt s ALA 9 Cb -0.07 -2.07 -0.02 0.00 0.00 0.00 0.00 23.12 20.96 2edt s ALA 9 CO 0.52 0.63 0.03 0.15 0.00 0.00 0.00 175.76 177.09 2edt s LYS 10 N -1.50 2.11 -0.34 0.00 -0.14 -1.26 -4.54 119.74 114.06 2edt s LYS 10 Ca 0.24 -2.32 -0.02 0.00 -1.36 0.00 0.00 55.97 52.51 2edt s LYS 10 Cb -0.13 -1.31 0.08 0.00 -1.68 0.00 0.00 37.83 34.78 2edt s LYS 10 CO 0.13 -0.37 0.08 -0.06 -0.76 0.00 0.00 175.35 174.37 2edt s PHE 11 N -2.95 3.42 -0.05 3.18 0.08 -1.26 -2.74 117.98 117.66 2edt s PHE 11 Ca 0.12 -2.16 -0.19 0.00 0.12 0.00 0.00 56.93 54.82 2edt s PHE 11 Cb 0.02 -2.58 -0.31 0.00 -0.57 0.00 0.00 43.02 39.59 2edt s PHE 11 CO 0.07 -0.88 0.80 1.79 -0.10 0.00 0.00 175.22 176.91 2edt h THR 12 N 6.44 1.33 0.06 0.64 1.35 -1.91 -3.39 112.91 117.43 2edt h THR 12 Ca -0.17 -2.52 -0.37 0.00 -0.55 0.00 0.00 66.41 62.80 2edt h THR 12 Cb 1.05 3.03 -0.04 0.00 -1.73 0.00 0.00 68.15 70.46 2edt h THR 12 CO 0.59 0.73 -2.19 -0.62 -0.25 0.00 0.00 175.52 173.78 2edt n GLU 13 N -4.00 0.71 -0.97 4.72 -0.58 -1.26 -5.05 120.64 114.20 2edt n GLU 13 Ca -0.18 0.21 0.09 0.00 -0.42 0.00 0.00 57.16 56.86 2edt n GLU 13 Cb 0.89 -1.63 -0.05 0.00 -0.57 0.00 0.00 31.44 30.08 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 2.06 -3.24 3.49 0.62 0.00 -1.26 -4.92 105.19 101.93 2edt n GLY 14 Ca -0.36 -1.15 -0.29 0.00 0.00 0.00 0.00 46.02 44.22 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 -5.85 0.34 -0.15 0.99 1.43 -1.26 -4.82 118.68 109.35 2edt s LEU 15 Ca 0.00 1.07 -0.18 0.00 -1.03 0.00 0.00 54.13 53.99 2edt s LEU 15 Cb 0.00 -2.84 0.05 0.00 0.03 0.00 0.00 46.19 43.42 2edt s LEU 15 CO 0.00 -4.36 0.48 0.00 0.23 0.00 0.00 176.35 172.70 2edt s ARG 16 N -4.92 0.61 0.21 1.70 1.70 -1.26 -4.96 118.95 112.03 2edt s ARG 16 Ca 0.68 0.55 -0.31 0.00 -0.47 0.00 0.00 55.73 56.18 2edt s ARG 16 Cb -0.17 0.29 -0.10 0.00 -0.57 0.00 0.00 34.95 34.40 2edt s ARG 16 CO 0.60 -0.10 1.56 -0.80 -1.08 0.00 0.00 175.30 175.48 2edt s ASN 17 N -0.02 6.54 0.28 -2.89 -0.87 -1.26 -4.68 114.94 112.04 2edt s ASN 17 Ca -0.02 2.71 0.04 0.00 -1.57 0.00 0.00 52.86 54.01 2edt s ASN 17 Cb -0.03 -2.61 -0.04 0.00 -0.02 0.00 0.00 41.25 38.56 2edt s ASN 17 CO 0.02 -0.83 0.20 -1.83 -2.57 0.00 0.00 177.10 172.09 2edt s GLU 18 N 0.60 1.55 0.34 -0.60 1.03 -1.04 -4.94 118.70 115.64 2edt s GLU 18 Ca 0.67 -1.88 0.03 0.00 0.03 0.00 0.00 54.97 53.83 2edt s GLU 18 Cb -0.45 0.19 -0.05 0.00 -0.80 0.00 0.00 34.13 33.02 2edt s GLU 18 CO 0.36 -0.52 0.09 -1.83 -1.33 0.00 0.00 175.26 172.03 2edt s GLU 19 N -3.76 1.69 0.19 -4.83 -1.05 -1.26 0.80 118.70 110.48 2edt s GLU 19 Ca 0.39 -1.97 -0.21 0.00 -0.15 0.00 0.00 54.97 53.02 2edt s GLU 19 Cb 0.04 -0.64 0.08 0.00 -0.44 0.00 0.00 34.13 33.16 2edt s GLU 19 CO 0.20 -0.31 1.02 0.00 0.95 0.00 0.00 175.26 177.13 2edt n ALA 20 N -0.71 -2.66 -2.43 -0.84 0.00 0.39 -4.80 120.51 109.47 2edt n ALA 20 Ca -0.03 -1.03 -0.32 0.00 0.00 0.00 0.00 53.44 52.06 2edt n ALA 20 Cb 0.66 0.58 -0.14 0.00 0.00 0.00 0.00 19.45 20.55 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 -2.06 2.75 0.19 0.00 1.01 -1.26 0.22 120.40 121.25 2edt s VAL 21 Ca 0.23 -0.87 -0.30 0.00 0.00 0.00 0.00 61.98 61.04 2edt s VAL 21 Cb -0.03 -2.05 -0.17 0.00 0.00 0.00 0.00 36.38 34.13 2edt s VAL 21 CO 0.06 0.57 0.75 -0.62 0.00 0.00 0.00 175.10 175.85 2edt n GLU 22 N 2.29 0.39 0.00 2.72 1.02 0.33 -0.27 120.64 127.12 2edt n GLU 22 Ca -0.17 0.14 0.00 0.00 -0.02 0.00 0.00 57.16 57.11 2edt n GLU 22 Cb 0.52 -1.32 0.00 0.00 -0.02 0.00 0.00 31.44 30.62 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 1.79 1.76 2.58 0.62 0.00 0.34 -4.77 105.19 107.50 2edt n GLY 23 Ca 0.16 -0.11 -0.20 0.00 0.00 0.00 0.00 46.02 45.86 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 -3.53 -3.82 4.61 0.00 0.63 -3.38 120.51 115.03 2edt n ALA 24 Ca 0.00 -1.03 -0.34 0.00 0.00 0.00 0.00 53.44 52.08 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 -1.86 2.73 0.96 0.00 2.01 -1.26 -2.11 115.64 116.11 2edt s THR 25 Ca 0.45 -1.68 -0.12 0.00 0.31 0.00 0.00 61.69 60.64 2edt s THR 25 Cb -0.08 -2.69 0.16 0.00 0.01 0.00 0.00 72.50 69.90 2edt s THR 25 CO 0.37 -0.25 0.30 0.00 -0.69 0.00 0.00 174.62 174.36 2edt n ALA 26 N 4.52 -0.18 -3.24 7.40 0.00 -1.24 -4.80 120.51 122.97 2edt n ALA 26 Ca -0.09 -0.94 -0.02 0.00 0.00 0.00 0.00 53.44 52.39 2edt n ALA 26 Cb 0.43 -0.78 -0.04 0.00 0.00 0.00 0.00 19.45 19.06 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 -3.34 0.47 -0.19 0.00 0.00 -1.26 -4.22 119.30 110.76 2edt s MET 27 Ca 0.33 0.67 0.00 0.00 0.00 0.00 0.00 55.69 56.69 2edt s MET 27 Cb -0.05 0.05 0.05 0.00 0.00 0.00 0.00 34.83 34.87 2edt s MET 27 CO 0.30 -0.73 -0.07 -0.51 0.00 0.00 0.00 175.02 174.00 2edt s LEU 28 N 2.71 2.09 0.26 4.11 1.43 -0.92 -4.99 118.68 123.36 2edt s LEU 28 Ca 0.15 -0.86 0.10 0.00 -1.03 0.00 0.00 54.13 52.49 2edt s LEU 28 Cb -0.14 -1.10 -0.05 0.00 0.03 0.00 0.00 46.19 44.92 2edt s LEU 28 CO -0.21 -0.18 -0.16 -1.66 0.23 0.00 0.00 176.35 174.37 2edt s TRP 29 N 1.48 2.06 -0.08 0.29 1.48 -1.26 -1.24 118.94 121.68 2edt s TRP 29 Ca -0.01 -0.46 -0.30 0.00 -1.06 0.00 0.00 56.10 54.27 2edt s TRP 29 Cb -0.16 -0.95 0.10 0.00 -1.16 0.00 0.00 33.47 31.30 2edt s TRP 29 CO -0.08 0.55 0.85 0.00 -4.06 0.00 0.00 176.95 174.21 2edt s GLU 31 N -1.61 2.63 0.01 0.00 2.02 -1.26 -1.04 118.70 119.45 2edt s GLU 31 Ca -0.04 -1.30 -0.01 0.00 0.02 0.00 0.00 54.97 53.64 2edt s GLU 31 Cb -0.00 -2.38 -0.01 0.00 0.10 0.00 0.00 34.13 31.84 2edt s GLU 31 CO 0.02 0.24 0.00 -0.51 0.02 0.00 0.00 175.26 175.03 2edt s LEU 32 N -3.85 2.09 0.66 1.80 1.43 -0.34 -3.57 118.68 116.90 2edt s LEU 32 Ca 0.36 -0.40 0.24 0.00 -1.03 0.00 0.00 54.13 53.30 2edt s LEU 32 Cb -0.06 0.20 1.27 0.00 0.03 0.00 0.00 46.19 47.63 2edt s LEU 32 CO 0.24 -0.28 1.71 -1.28 0.23 0.00 0.00 176.35 176.97 2edt h SER 33 N 4.73 0.00 -4.94 2.29 0.87 -1.84 -3.42 113.55 111.23 2edt h SER 33 Ca -0.31 0.00 0.02 0.00 -1.23 0.00 0.00 61.79 60.27 2edt h SER 33 Cb 1.21 0.00 -0.12 0.00 -0.44 0.00 0.00 62.40 63.05 2edt h SER 33 CO 0.42 0.00 0.27 -1.59 -0.53 0.00 0.00 176.83 175.40 2edt s LYS 34 N -4.12 1.23 -0.22 2.24 -2.85 -1.26 -5.00 119.74 109.77 2edt s LYS 34 Ca -0.03 -0.48 -0.29 0.00 -1.00 0.00 0.00 55.97 54.17 2edt s LYS 34 Cb 0.07 0.55 -0.02 0.00 -2.06 0.00 0.00 37.83 36.37 2edt s LYS 34 CO 0.24 -0.54 1.53 0.08 0.10 0.00 0.00 175.35 176.76 2edt s VAL 35 N -3.63 3.81 0.05 1.79 1.01 -1.26 -4.70 120.40 117.46 2edt s VAL 35 Ca 0.03 0.93 -0.09 0.00 0.00 0.00 0.00 61.98 62.85 2edt s VAL 35 Cb -0.01 -3.79 0.00 0.00 0.00 0.00 0.00 36.38 32.58 2edt s VAL 35 CO -0.10 -0.30 0.18 0.00 0.00 0.00 0.00 175.10 174.88 2edt s ALA 36 N 4.83 -0.31 -0.45 5.51 0.00 -1.26 -4.98 121.76 125.10 2edt s ALA 36 Ca 0.68 -0.36 -0.28 0.00 0.00 0.00 0.00 51.96 52.00 2edt s ALA 36 Cb -0.24 0.30 -0.01 0.00 0.00 0.00 0.00 23.12 23.17 2edt s ALA 36 CO 0.27 -0.38 1.76 -1.25 0.00 0.00 0.00 175.76 176.16 2edt s PRO 37 N -2.75 3.11 0.68 0.00 0.04 -1.26 -4.99 135.00 129.83 2edt s PRO 37 Ca -0.04 1.04 -0.06 0.00 0.04 0.00 0.00 61.00 61.98 2edt s PRO 37 Cb -0.00 -4.24 0.05 0.00 0.04 0.00 0.00 34.50 30.35 2edt s PRO 37 CO -0.05 -2.14 0.99 0.14 0.04 0.00 0.00 177.00 175.98 2edt s VAL 38 N 7.48 2.45 -0.24 -0.36 -7.23 -1.26 -4.46 120.40 116.77 2edt s VAL 38 Ca 0.72 -0.26 -0.03 0.00 -1.81 0.00 0.00 61.98 60.60 2edt s VAL 38 Cb -0.17 -3.05 0.10 0.00 0.56 0.00 0.00 36.38 33.82 2edt s VAL 38 CO 0.29 -0.05 0.23 -1.61 -0.31 0.00 0.00 175.10 173.64 2edt s GLU 39 N -5.19 0.22 0.39 4.82 0.41 0.20 -4.97 118.70 114.58 2edt s GLU 39 Ca 0.59 0.03 -0.24 0.00 -0.41 0.00 0.00 54.97 54.95 2edt s GLU 39 Cb -0.11 -1.07 -0.09 0.00 -1.78 0.00 0.00 34.13 31.08 2edt s GLU 39 CO 0.44 -0.79 1.01 -1.58 -0.49 0.00 0.00 175.26 173.85 2edt s TRP 40 N 2.31 3.36 0.12 1.61 0.52 -1.26 -1.27 118.94 124.32 2edt s TRP 40 Ca 0.08 1.67 -0.14 0.00 0.02 0.00 0.00 56.10 57.72 2edt s TRP 40 Cb -0.15 -3.03 0.02 0.00 -1.15 0.00 0.00 33.47 29.16 2edt s TRP 40 CO -0.20 -0.36 0.35 1.03 0.02 0.00 0.00 176.95 177.79 2edt s ARG 41 N -2.55 1.03 -0.42 4.98 0.52 0.83 -2.59 118.95 120.75 2edt s ARG 41 Ca 0.57 -0.80 0.02 0.00 -0.52 0.00 0.00 55.73 55.00 2edt s ARG 41 Cb -0.19 0.44 0.13 0.00 0.52 0.00 0.00 34.95 35.85 2edt s ARG 41 CO 0.24 -0.39 0.21 0.21 0.02 0.00 0.00 175.30 175.60 2edt s LYS 42 N -3.83 1.21 4.05 3.54 2.20 -1.20 -0.40 119.74 125.31 2edt s LYS 42 Ca 0.04 -1.88 0.00 0.00 -0.36 0.00 0.00 55.97 53.78 2edt s LYS 42 Cb 0.03 -2.31 0.00 0.00 -1.51 0.00 0.00 37.83 34.04 2edt s LYS 42 CO -0.11 -1.13 0.00 0.41 -0.36 0.00 0.00 175.35 174.16 2edt n GLY 43 N 3.74 3.26 0.23 5.54 0.00 -1.25 -0.04 105.19 116.67 2edt n GLY 43 Ca 0.07 0.25 0.10 0.00 0.00 0.00 0.00 46.02 46.44 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 -7.62 1.61 0.13 -1.97 -3.44 132.00 120.70 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 0.14 0.00 0.13 0.00 0.00 31.00 31.27 2edt h PRO 44 CO 0.00 0.21 0.33 -1.21 -0.23 0.00 0.00 178.00 177.10 2edt s GLU 45 N -3.79 0.91 -0.03 0.86 8.01 0.95 -5.11 118.70 120.50 2edt s GLU 45 Ca -0.00 -0.64 -0.00 0.00 0.01 0.00 0.00 54.97 54.33 2edt s GLU 45 Cb 0.11 -1.99 0.03 0.00 -4.31 0.00 0.00 34.13 27.97 2edt s GLU 45 CO 0.62 -2.16 0.05 -0.80 0.01 0.00 0.00 175.26 172.98 2edt s ASN 46 N -4.86 0.11 0.35 -0.19 0.01 -1.26 -3.27 114.94 105.84 2edt s ASN 46 Ca 0.72 0.07 0.08 0.00 -0.71 0.00 0.00 52.86 53.02 2edt s ASN 46 Cb -0.04 -0.04 -0.03 0.00 0.41 0.00 0.00 41.25 41.54 2edt s ASN 46 CO 0.51 -0.14 0.23 -0.76 -1.51 0.00 0.00 177.10 175.42 2edt s LEU 47 N 1.16 3.38 0.05 0.60 1.43 -1.07 -4.88 118.68 119.35 2edt s LEU 47 Ca -0.08 -0.70 -0.28 0.00 -1.03 0.00 0.00 54.13 52.03 2edt s LEU 47 Cb -0.13 -1.92 0.10 0.00 0.03 0.00 0.00 46.19 44.28 2edt s LEU 47 CO -0.03 -0.38 1.15 0.00 0.23 0.00 0.00 176.35 177.32 2edt s ARG 48 N -3.94 0.71 -0.22 1.70 1.70 -1.26 -4.40 118.95 113.24 2edt s ARG 48 Ca 0.40 -0.39 -0.29 0.00 -0.47 0.00 0.00 55.73 54.99 2edt s ARG 48 Cb -0.03 0.24 -0.03 0.00 -0.57 0.00 0.00 34.95 34.56 2edt s ARG 48 CO 0.25 -0.32 1.79 0.16 -1.08 0.00 0.00 175.30 176.09 2edt s ASP 49 N -2.94 6.12 0.00 -2.89 1.47 -1.26 -4.66 116.67 112.51 2edt s ASP 49 Ca 0.13 1.70 0.00 0.00 1.18 0.00 0.00 52.55 55.56 2edt s ASP 49 Cb 0.02 -2.53 0.00 0.00 -0.34 0.00 0.00 42.92 40.08 2edt s ASP 49 CO -0.02 -1.45 0.00 0.61 0.68 0.00 0.00 175.17 174.99 2edt n GLY 50 N 5.01 2.92 0.15 2.12 0.00 -0.04 -5.00 105.19 110.34 2edt n GLY 50 Ca 0.22 -1.05 -0.06 0.00 0.00 0.00 0.00 46.02 45.13 2edt n GLY 50 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2edt h ASP 51 N 0.00 -0.32 -0.94 1.61 5.19 -2.01 -3.23 116.42 116.72 2edt h ASP 51 Ca 0.00 0.01 0.08 0.00 -0.62 0.00 0.00 57.03 56.50 2edt h ASP 51 Cb 0.00 0.08 -0.07 0.00 0.18 0.00 0.00 39.33 39.53 2edt h ASP 51 CO 0.00 -0.19 0.60 0.08 -3.12 0.00 0.00 179.24 176.61 2edt h ARG 52 N -0.44 0.98 -4.25 3.56 0.11 -1.96 -3.35 114.38 109.03 2edt h ARG 52 Ca -0.04 -0.06 -0.74 0.00 0.10 0.00 0.00 59.98 59.24 2edt h ARG 52 Cb 0.29 -0.22 -0.24 0.00 1.11 0.00 0.00 29.97 30.91 2edt h ARG 52 CO 0.06 0.65 -0.31 0.71 0.10 0.00 0.00 179.97 181.18 2edt s TYR 53 N -5.91 3.26 -0.69 4.08 2.02 -1.22 -2.05 117.35 116.84 2edt s TYR 53 Ca -0.12 -1.13 -0.24 0.00 -0.37 0.00 0.00 57.07 55.22 2edt s TYR 53 Cb 0.21 -3.36 0.06 0.00 -0.40 0.00 0.00 41.96 38.47 2edt s TYR 53 CO 0.80 -0.88 1.05 0.42 -1.57 0.00 0.00 175.55 175.37 2edt s ILE 54 N 1.60 4.18 0.09 2.71 1.01 0.19 -0.87 121.20 130.12 2edt s ILE 54 Ca 0.04 -0.21 0.02 0.00 0.00 0.00 0.00 60.65 60.50 2edt s ILE 54 Cb -0.26 -4.75 -0.04 0.00 0.01 0.00 0.00 42.46 37.43 2edt s ILE 54 CO 0.05 -1.56 0.16 -0.76 0.00 0.00 0.00 174.94 172.83 2edt s LEU 55 N 4.44 4.09 0.12 2.97 1.02 -1.26 -0.55 118.68 129.51 2edt s LEU 55 Ca 0.26 0.11 -0.12 0.00 0.02 0.00 0.00 54.13 54.40 2edt s LEU 55 Cb -0.14 -2.71 0.01 0.00 0.02 0.00 0.00 46.19 43.36 2edt s LEU 55 CO 0.11 0.14 0.30 -0.13 0.02 0.00 0.00 176.35 176.79 2edt s ARG 56 N -2.63 1.02 -0.29 1.70 0.52 -0.13 -4.99 118.95 114.15 2edt s ARG 56 Ca 0.32 -0.93 -0.02 0.00 -0.52 0.00 0.00 55.73 54.59 2edt s ARG 56 Cb -0.12 0.40 0.18 0.00 0.52 0.00 0.00 34.95 35.93 2edt s ARG 56 CO 0.25 -0.37 0.57 -1.14 0.02 0.00 0.00 175.30 174.63 2edt s GLN 57 N -3.87 0.54 -0.30 3.54 0.74 -1.26 -1.00 119.66 118.05 2edt s GLN 57 Ca 0.07 0.96 0.11 0.00 0.05 0.00 0.00 55.36 56.55 2edt s GLN 57 Cb 0.03 0.43 0.73 0.00 1.10 0.00 0.00 33.01 35.30 2edt s GLN 57 CO -0.08 -0.61 1.75 0.39 -0.55 0.00 0.00 175.29 176.19 2edt n GLU 58 N 5.42 3.74 0.00 1.67 -0.58 -1.18 -5.03 120.64 124.68 2edt n GLU 58 Ca -0.02 -3.09 0.00 0.00 -0.42 0.00 0.00 57.16 53.63 2edt n GLU 58 Cb 0.51 -2.18 0.00 0.00 -0.57 0.00 0.00 31.44 29.20 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 -0.13 0.40 0.32 0.62 0.00 -1.26 -4.78 105.19 100.36 2edt n GLY 59 Ca 0.37 -1.30 0.19 0.00 0.00 0.00 0.00 46.02 45.29 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 0.21 -2.90 2.61 1.35 -1.86 -3.42 112.91 108.89 2edt h THR 60 Ca 0.00 -0.07 -0.62 0.00 -0.55 0.00 0.00 66.41 65.16 2edt h THR 60 Cb 0.00 1.06 -0.05 0.00 -1.73 0.00 0.00 68.15 67.43 2edt h THR 60 CO 0.00 0.01 -0.41 -0.60 -0.25 0.00 0.00 175.52 174.27 2edt s ARG 61 N -4.27 3.55 0.05 4.72 3.00 -1.26 -1.19 118.95 123.54 2edt s ARG 61 Ca -0.04 -0.14 0.06 0.00 -1.00 0.00 0.00 55.73 54.61 2edt s ARG 61 Cb 0.13 -3.06 -0.02 0.00 0.00 0.00 0.00 34.95 32.00 2edt s ARG 61 CO 0.47 0.64 -0.17 0.00 0.00 0.00 0.00 175.30 176.24 2edt s GLU 63 N -1.28 1.73 -0.05 0.00 0.41 -0.17 -2.38 118.70 116.95 2edt s GLU 63 Ca 0.04 -0.85 0.01 0.00 -0.41 0.00 0.00 54.97 53.76 2edt s GLU 63 Cb -0.09 -1.72 0.02 0.00 -1.78 0.00 0.00 34.13 30.56 2edt s GLU 63 CO 0.02 0.46 -0.07 -1.17 -0.49 0.00 0.00 175.26 174.01 2edt s LEU 64 N -0.71 1.40 -0.07 1.80 2.96 -0.37 -0.96 118.68 122.73 2edt s LEU 64 Ca 0.09 -0.18 0.03 0.00 -0.22 0.00 0.00 54.13 53.84 2edt s LEU 64 Cb -0.09 -0.58 0.01 0.00 0.50 0.00 0.00 46.19 46.04 2edt s LEU 64 CO -0.00 -0.03 -0.15 -1.10 -1.32 0.00 0.00 176.35 173.75 2edt s GLN 65 N 0.90 1.99 -0.51 1.98 -0.21 0.29 -2.16 119.66 121.94 2edt s GLN 65 Ca -0.11 -0.51 -0.06 0.00 0.02 0.00 0.00 55.36 54.69 2edt s GLN 65 Cb -0.15 -1.60 0.13 0.00 1.00 0.00 0.00 33.01 32.40 2edt s GLN 65 CO 0.01 0.05 0.36 0.42 -2.12 0.00 0.00 175.29 174.01 2edt s ILE 66 N 0.61 3.95 -0.14 1.08 1.01 -1.26 -0.63 121.20 125.82 2edt s ILE 66 Ca -0.15 -2.16 -0.29 0.00 0.00 0.00 0.00 60.65 58.04 2edt s ILE 66 Cb -0.16 -3.61 -0.03 0.00 0.01 0.00 0.00 42.46 38.67 2edt s ILE 66 CO 0.05 -0.79 1.51 0.00 0.00 0.00 0.00 174.94 175.70 2edt n GLY 68 N 4.10 0.75 3.79 0.00 0.00 -1.24 -4.90 105.19 107.69 2edt n GLY 68 Ca 0.16 -0.69 -0.31 0.00 0.00 0.00 0.00 46.02 45.19 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 -0.39 3.08 -0.16 0.99 1.43 -0.90 -4.76 118.68 117.96 2edt s LEU 69 Ca 0.00 1.76 -0.31 0.00 -1.03 0.00 0.00 54.13 54.55 2edt s LEU 69 Cb 0.00 -4.51 0.14 0.00 0.03 0.00 0.00 46.19 41.84 2edt s LEU 69 CO 0.00 -1.82 1.08 0.00 0.23 0.00 0.00 176.35 175.84 2edt s ALA 70 N -2.93 -1.97 0.28 4.21 0.00 -1.26 -0.51 121.76 119.57 2edt s ALA 70 Ca 0.60 1.55 0.11 0.00 0.00 0.00 0.00 51.96 54.21 2edt s ALA 70 Cb -0.16 -0.55 0.89 0.00 0.00 0.00 0.00 23.12 23.31 2edt s ALA 70 CO 0.55 -0.42 1.27 -1.33 0.00 0.00 0.00 175.76 175.84 2edt n MET 71 N 0.37 -0.06 -0.13 0.00 2.81 -1.26 0.19 117.12 119.04 2edt n MET 71 Ca -0.06 1.15 -0.06 0.00 -1.81 0.00 0.00 57.70 56.92 2edt n MET 71 Cb 0.59 -1.97 0.02 0.00 -0.71 0.00 0.00 33.22 31.15 2edt n MET 71 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2edt h ALA 72 N 1.62 0.52 -1.05 3.04 0.00 -2.00 -1.98 119.26 119.40 2edt h ALA 72 Ca 0.61 0.01 0.28 0.00 0.00 0.00 0.00 54.91 55.81 2edt h ALA 72 Cb 1.48 -0.07 -0.11 0.00 0.00 0.00 0.00 17.79 19.09 2edt h ALA 72 CO -0.68 -0.14 0.66 -0.44 0.00 0.00 0.00 179.25 178.65 2edt h ASP 73 N 0.43 0.50 -1.97 0.00 5.19 0.17 -3.39 116.42 117.36 2edt h ASP 73 Ca 0.18 0.11 -0.59 0.00 -0.62 0.00 0.00 57.03 56.11 2edt h ASP 73 Cb 0.07 0.04 0.00 0.00 0.18 0.00 0.00 39.33 39.62 2edt h ASP 73 CO -0.12 0.05 1.44 0.00 -3.12 0.00 0.00 179.24 177.50 2edt n ALA 74 N -2.42 1.69 -2.00 3.45 0.00 -0.75 -4.69 120.51 115.79 2edt n ALA 74 Ca 0.27 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.55 2edt n ALA 74 Cb 0.90 -2.85 0.00 0.00 0.00 0.00 0.00 19.45 17.50 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 5.62 1.08 2.68 0.00 0.00 -1.22 -4.99 105.19 108.36 2edt n GLY 75 Ca 0.29 0.36 -0.25 0.00 0.00 0.00 0.00 46.02 46.42 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 3.39 0.31 -0.14 1.61 2.12 -1.26 -2.49 118.70 122.24 2edt s GLU 76 Ca 0.00 -0.09 -0.08 0.00 0.36 0.00 0.00 54.97 55.15 2edt s GLU 76 Cb 0.00 -1.60 -0.04 0.00 0.26 0.00 0.00 34.13 32.74 2edt s GLU 76 CO 0.00 -0.56 0.16 0.71 -0.54 0.00 0.00 175.26 175.03 2edt s TYR 77 N 2.03 3.55 0.03 5.30 1.51 -1.10 -3.84 117.35 124.83 2edt s TYR 77 Ca 0.02 0.51 0.09 0.00 -1.01 0.00 0.00 57.07 56.68 2edt s TYR 77 Cb -0.15 -2.03 -0.03 0.00 -0.11 0.00 0.00 41.96 39.64 2edt s TYR 77 CO -0.07 0.60 -0.26 -0.51 -1.11 0.00 0.00 175.55 174.20 2edt s LEU 78 N -0.63 2.14 -0.20 -1.29 1.02 0.46 -1.23 118.68 118.95 2edt s LEU 78 Ca 0.14 -0.56 0.01 0.00 0.02 0.00 0.00 54.13 53.74 2edt s LEU 78 Cb -0.12 -1.28 0.04 0.00 0.02 0.00 0.00 46.19 44.85 2edt s LEU 78 CO 0.03 0.27 -0.10 0.00 0.02 0.00 0.00 176.35 176.57 2edt s VAL 80 N 1.40 5.30 -0.49 0.00 1.01 -0.40 -2.30 120.40 124.92 2edt s VAL 80 Ca -0.02 0.52 0.07 0.00 0.00 0.00 0.00 61.98 62.56 2edt s VAL 80 Cb -0.16 -3.61 0.37 0.00 0.00 0.00 0.00 36.38 32.98 2edt s VAL 80 CO -0.08 0.44 0.95 0.00 0.00 0.00 0.00 175.10 176.41 2edt n GLY 82 N -0.20 2.05 0.00 0.00 0.00 -1.26 -3.97 105.19 101.81 2edt n GLY 82 Ca 0.30 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.65 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 2.22 -2.36 1.61 -0.06 -1.26 -5.07 117.38 112.46 2edt n GLN 83 Ca 0.00 0.00 -0.25 0.00 -2.00 0.00 0.00 57.00 54.75 2edt n GLN 83 Cb 0.00 -0.99 0.12 0.00 -4.06 0.00 0.00 30.24 25.31 2edt n GLN 83 CO 0.00 0.00 0.00 -1.21 -0.20 0.00 0.00 177.06 175.65 2edt s GLU 84 N -1.99 1.47 -0.29 3.69 0.41 -1.26 -5.12 118.70 115.61 2edt s GLU 84 Ca 0.00 -0.81 -0.20 0.00 -0.41 0.00 0.00 54.97 53.55 2edt s GLU 84 Cb 0.00 -2.18 0.18 0.00 -1.78 0.00 0.00 34.13 30.34 2edt s GLU 84 CO 0.00 -1.68 1.22 -0.98 -0.49 0.00 0.00 175.26 173.33 2edt s ARG 85 N -5.35 0.20 -0.03 1.61 1.70 -1.26 -2.37 118.95 113.44 2edt s ARG 85 Ca 0.67 0.29 0.03 0.00 -0.47 0.00 0.00 55.73 56.26 2edt s ARG 85 Cb -0.06 0.07 -0.03 0.00 -0.57 0.00 0.00 34.95 34.36 2edt s ARG 85 CO 0.47 -0.03 -0.10 -0.08 -1.08 0.00 0.00 175.30 174.47 2edt s THR 86 N 0.67 3.38 0.05 4.99 -1.32 -0.97 -4.90 115.64 117.53 2edt s THR 86 Ca -0.02 -0.73 0.07 0.00 -1.21 0.00 0.00 61.69 59.80 2edt s THR 86 Cb -0.04 -2.40 -0.03 0.00 -1.51 0.00 0.00 72.50 68.52 2edt s THR 86 CO -0.12 0.50 -0.17 -0.94 -2.21 0.00 0.00 174.62 171.68 2edt s SER 87 N -1.05 3.86 0.37 8.08 1.04 -1.26 -1.26 113.70 123.47 2edt s SER 87 Ca 0.14 -0.42 0.05 0.00 0.48 0.00 0.00 55.95 56.20 2edt s SER 87 Cb -0.11 -0.63 -0.02 0.00 0.10 0.00 0.00 66.02 65.36 2edt s SER 87 CO 0.04 0.25 0.19 0.00 0.98 0.00 0.00 173.24 174.70 2edt n ALA 88 N 1.47 0.61 -3.91 5.32 0.00 -0.37 -4.86 120.51 118.78 2edt n ALA 88 Ca -0.16 -1.96 -0.30 0.00 0.00 0.00 0.00 53.44 51.02 2edt n ALA 88 Cb 0.52 1.43 -0.16 0.00 0.00 0.00 0.00 19.45 21.24 2edt n ALA 88 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2edt s THR 89 N -3.15 1.40 0.29 0.00 2.01 -1.26 -2.71 115.64 112.21 2edt s THR 89 Ca 0.28 -1.20 -0.15 0.00 0.31 0.00 0.00 61.69 60.93 2edt s THR 89 Cb 0.01 -1.74 -0.08 0.00 0.01 0.00 0.00 72.50 70.70 2edt s THR 89 CO 0.19 -0.17 0.69 -0.22 -0.69 0.00 0.00 174.62 174.43 2edt s LEU 90 N 1.44 4.13 -0.04 4.42 2.96 -1.04 -2.48 118.68 128.07 2edt s LEU 90 Ca -0.04 1.23 0.06 0.00 -0.22 0.00 0.00 54.13 55.16 2edt s LEU 90 Cb -0.19 -3.91 -0.01 0.00 0.50 0.00 0.00 46.19 42.59 2edt s LEU 90 CO -0.08 -0.14 -0.21 -0.89 -1.32 0.00 0.00 176.35 173.71 2edt s THR 91 N -1.87 1.74 -0.06 3.68 2.01 0.24 -3.43 115.64 117.96 2edt s THR 91 Ca 0.51 -0.90 0.03 0.00 0.31 0.00 0.00 61.69 61.63 2edt s THR 91 Cb -0.11 -1.48 -0.03 0.00 0.01 0.00 0.00 72.50 70.89 2edt s THR 91 CO 0.19 0.49 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.85 2edt s ILE 92 N -0.15 3.23 -0.29 1.82 -1.09 -1.26 0.15 121.20 123.60 2edt s ILE 92 Ca -0.01 -0.66 -0.04 0.00 -2.23 0.00 0.00 60.65 57.70 2edt s ILE 92 Cb -0.12 -2.28 0.03 0.00 -1.58 0.00 0.00 42.46 38.51 2edt s ILE 92 CO 0.02 0.59 0.03 -0.13 -1.23 0.00 0.00 174.94 174.23 2edt s ARG 93 N -0.74 2.80 0.07 2.79 1.81 0.61 -4.87 118.95 121.42 2edt s ARG 93 Ca 0.11 -1.03 -0.35 0.00 -1.72 0.00 0.00 55.73 52.74 2edt s ARG 93 Cb -0.11 -3.26 -0.14 0.00 -0.45 0.00 0.00 34.95 31.00 2edt s ARG 93 CO 0.01 -0.51 1.63 0.00 -0.68 0.00 0.00 175.30 175.74 2edt n ALA 94 N 4.76 0.85 -1.36 2.13 0.00 -1.26 -0.51 120.51 125.11 2edt n ALA 94 Ca -0.14 0.41 -0.34 0.00 0.00 0.00 0.00 53.44 53.37 2edt n ALA 94 Cb 0.46 -2.34 0.09 0.00 0.00 0.00 0.00 19.45 17.66 2edt n ALA 94 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2edt s LEU 95 N 1.76 3.32 0.00 0.00 1.43 -1.26 -4.85 118.68 119.07 2edt s LEU 95 Ca 0.84 2.38 0.16 0.00 -1.03 0.00 0.00 54.13 56.47 2edt s LEU 95 Cb -0.74 -4.59 0.92 0.00 0.03 0.00 0.00 46.19 41.81 2edt s LEU 95 CO 0.44 -2.28 1.35 -0.81 0.23 0.00 0.00 176.35 175.27 2edt n PRO 96 N -2.72 0.47 -1.53 1.29 -0.04 -1.26 -4.83 135.00 126.38 2edt n PRO 96 Ca 0.14 0.01 -0.58 0.00 -0.04 0.00 0.00 63.50 63.02 2edt n PRO 96 Cb 0.50 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.37 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 -1.02 1.73 0.00 3.54 7.64 -1.26 -4.66 113.62 119.58 2edt n SER 97 Ca 0.11 0.82 0.00 0.00 1.01 0.00 0.00 58.87 60.81 2edt n SER 97 Cb 0.06 -1.07 0.00 0.00 -1.01 0.00 0.00 64.21 62.19 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 5.64 -0.81 0.00 0.23 0.00 -1.26 -4.90 105.19 104.09 2edt n GLY 98 Ca 0.38 0.18 0.06 0.00 0.00 0.00 0.00 46.02 46.63 2edt n GLY 98 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2edt n PRO 99 N -2.21 0.49 -4.57 1.61 -0.04 -1.26 -4.69 135.00 124.32 2edt n PRO 99 Ca 0.00 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.14 2edt n PRO 99 Cb 0.00 -1.36 -0.11 0.00 -0.04 0.00 0.00 33.50 31.99 2edt n PRO 99 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2edt s SER 100 N -1.86 4.28 -0.81 3.54 0.01 -1.26 -5.06 113.70 112.54 2edt s SER 100 Ca 0.17 -0.25 -0.26 0.00 1.31 0.00 0.00 55.95 56.92 2edt s SER 100 Cb 0.08 -0.89 0.02 0.00 0.21 0.00 0.00 66.02 65.44 2edt s SER 100 CO 0.13 0.28 1.44 -0.55 0.41 0.00 0.00 173.24 174.95 2edt s SER 101 N -1.36 6.07 0.00 2.44 0.15 -1.26 -5.04 113.70 114.70 2edt s SER 101 Ca 0.16 -0.62 0.00 0.00 0.70 0.00 0.00 55.95 56.18 2edt s SER 101 Cb -0.11 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.64 2edt s SER 101 CO 0.06 -1.88 0.00 0.61 1.20 0.00 0.00 173.24 173.23