#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rog s LEU 2 N 0.00 1.00 -0.37 4.03 0.05 -0.18 -4.94 118.68 118.28 2rog s LEU 2 Ca 0.00 -0.94 -0.04 0.00 0.05 0.00 0.00 54.13 53.20 2rog s LEU 2 Cb 0.00 1.10 0.08 0.00 -2.05 0.00 0.00 46.19 45.32 2rog s LEU 2 CO 0.00 -0.89 0.15 -1.59 -0.55 0.00 0.00 176.35 173.47 2rog s LYS 3 N -3.99 2.28 0.05 1.48 -2.85 -0.44 -1.60 119.74 114.68 2rog s LYS 3 Ca 0.19 -1.54 -0.02 0.00 -1.00 0.00 0.00 55.97 53.60 2rog s LYS 3 Cb 0.04 -3.50 -0.04 0.00 -2.06 0.00 0.00 37.83 32.27 2rog s LYS 3 CO 0.01 -0.89 0.24 -1.17 0.10 0.00 0.00 175.35 173.65 2rog s LEU 4 N 1.25 4.35 -0.01 2.77 0.20 0.13 -1.77 118.68 125.60 2rog s LEU 4 Ca 0.03 0.38 0.04 0.00 0.69 0.00 0.00 54.13 55.27 2rog s LEU 4 Cb -0.22 -2.90 -0.01 0.00 -0.43 0.00 0.00 46.19 42.63 2rog s LEU 4 CO -0.02 0.18 -0.14 -0.75 -0.29 0.00 0.00 176.35 175.34 2rog s LYS 5 N -2.29 1.12 0.01 1.98 2.20 0.01 -0.33 119.74 122.43 2rog s LYS 5 Ca 0.33 -0.51 0.08 0.00 -0.36 0.00 0.00 55.97 55.51 2rog s LYS 5 Cb -0.13 -1.08 -0.02 0.00 -1.51 0.00 0.00 37.83 35.09 2rog s LYS 5 CO 0.24 0.30 -0.24 0.08 -0.36 0.00 0.00 175.35 175.36 2rog s VAL 6 N -0.35 1.94 -0.04 4.02 1.01 -0.41 -1.07 120.40 125.50 2rog s VAL 6 Ca 0.05 -1.18 -0.01 0.00 0.00 0.00 0.00 61.98 60.84 2rog s VAL 6 Cb -0.05 -1.64 0.03 0.00 0.00 0.00 0.00 36.38 34.72 2rog s VAL 6 CO -0.00 0.42 0.03 -0.70 0.00 0.00 0.00 175.10 174.85 2rog s GLU 7 N -0.90 0.14 0.00 2.72 2.56 0.90 -4.71 118.70 119.40 2rog s GLU 7 Ca 0.10 0.25 0.00 0.00 0.00 0.00 0.00 54.97 55.32 2rog s GLU 7 Cb -0.09 -0.57 0.00 0.00 2.00 0.00 0.00 34.13 35.46 2rog s GLU 7 CO 0.01 -0.27 0.00 0.41 -0.56 0.00 0.00 175.26 174.84 2rog n GLY 8 N 4.94 -0.51 2.90 -1.50 0.00 -1.26 -1.61 105.19 108.14 2rog n GLY 8 Ca -0.11 0.29 -0.14 0.00 0.00 0.00 0.00 46.02 46.07 2rog n GLY 8 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2rog s MET 9 N 0.00 0.07 -1.20 1.61 -1.94 -1.26 -5.06 119.30 111.52 2rog s MET 9 Ca 0.00 0.27 -0.21 0.00 -1.71 0.00 0.00 55.69 54.04 2rog s MET 9 Cb 0.00 -0.14 -0.01 0.00 2.01 0.00 0.00 34.83 36.69 2rog s MET 9 CO 0.00 -0.13 1.82 0.99 -0.01 0.00 0.00 175.02 177.69 2rog s THR 10 N 0.87 3.81 0.29 2.05 2.01 -1.26 -4.48 115.64 118.92 2rog s THR 10 Ca -0.07 -1.29 -0.10 0.00 0.31 0.00 0.00 61.69 60.55 2rog s THR 10 Cb -0.09 -4.83 0.00 0.00 0.01 0.00 0.00 72.50 67.59 2rog s THR 10 CO -0.04 -1.49 0.51 0.00 -0.69 0.00 0.00 174.62 172.91 2rog h ASN 12 N 2.18 0.13 -0.11 0.00 2.35 -2.00 -3.03 115.58 115.11 2rog h ASN 12 Ca -0.28 -0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 55.42 2rog h ASN 12 Cb 1.25 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 39.57 2rog h ASN 12 CO 0.37 0.47 0.05 0.45 -1.65 0.00 0.00 177.43 177.12 2rog h HIS 13 N 0.12 0.21 0.05 1.19 3.86 -1.97 -2.20 115.15 116.40 2rog h HIS 13 Ca 0.01 -0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.22 2rog h HIS 13 Cb 0.66 -0.07 0.00 0.00 1.06 0.00 0.00 27.41 29.06 2rog h HIS 13 CO 0.01 0.18 -0.02 0.00 0.86 0.00 0.00 177.93 178.96 2rog h VAL 15 N -0.19 0.61 0.05 0.00 2.07 -1.51 0.34 116.25 117.61 2rog h VAL 15 Ca -0.01 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.51 2rog h VAL 15 Cb 0.17 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 30.55 2rog h VAL 15 CO 0.01 0.00 -0.02 0.24 0.02 0.00 0.00 177.57 177.82 2rog h MET 16 N -0.01 -0.06 0.26 1.57 2.86 -1.19 -1.83 114.93 116.52 2rog h MET 16 Ca 0.18 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.81 2rog h MET 16 Cb 0.28 0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.96 2rog h MET 16 CO -0.39 -0.02 -0.12 0.00 1.06 0.00 0.00 176.91 177.44 2rog h ALA 17 N 0.87 -0.35 -0.11 6.32 0.00 -0.18 -0.29 119.26 125.53 2rog h ALA 17 Ca -0.01 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2rog h ALA 17 Cb 0.07 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 2rog h ALA 17 CO 0.01 -0.69 0.03 -0.39 0.00 0.00 0.00 179.25 178.21 2rog h VAL 18 N -0.35 1.18 -0.67 0.00 -1.51 -0.98 -0.82 116.25 113.10 2rog h VAL 18 Ca -0.03 -0.54 -0.04 0.00 -1.23 0.00 0.00 66.70 64.86 2rog h VAL 18 Cb 0.27 1.34 -0.03 0.00 -2.13 0.00 0.00 31.29 30.74 2rog h VAL 18 CO 0.06 0.16 0.26 0.74 -1.23 0.00 0.00 177.57 177.55 2rog h THR 19 N -0.02 1.24 -0.05 7.19 2.02 -1.32 -1.20 112.91 120.78 2rog h THR 19 Ca 0.03 -0.77 -0.05 0.00 0.77 0.00 0.00 66.41 66.39 2rog h THR 19 Cb 0.22 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 67.12 2rog h THR 19 CO -0.00 0.30 -0.19 0.11 0.37 0.00 0.00 175.52 176.11 2rog h LYS 20 N 0.95 0.08 0.08 6.66 1.79 -0.90 -0.43 116.57 124.79 2rog h LYS 20 Ca 0.22 -0.02 -0.00 0.00 -2.18 0.00 0.00 60.65 58.67 2rog h LYS 20 Cb 0.22 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.86 2rog h LYS 20 CO -0.02 0.27 -0.04 0.00 -1.08 0.00 0.00 179.45 178.58 2rog h ALA 21 N 1.74 -0.11 -0.30 3.86 0.00 -0.19 -3.17 119.26 121.09 2rog h ALA 21 Ca 0.01 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 2rog h ALA 21 Cb 0.38 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 2rog h ALA 21 CO 0.03 -0.35 0.00 -0.07 0.00 0.00 0.00 179.25 178.86 2rog h LEU 22 N -0.54 0.42 0.00 0.00 4.07 -1.07 -2.04 115.31 116.15 2rog h LEU 22 Ca -0.01 -0.07 0.00 0.00 0.08 0.00 0.00 57.88 57.88 2rog h LEU 22 Cb 0.46 -0.11 0.00 0.00 1.08 0.00 0.00 40.66 42.09 2rog h LEU 22 CO 0.02 0.49 0.00 1.17 -1.08 0.00 0.00 178.44 179.04 2rog n LYS 23 N -4.30 0.02 -0.02 1.13 4.81 -0.19 -2.65 118.16 116.97 2rog n LYS 23 Ca 0.01 0.33 0.09 0.00 -0.87 0.00 0.00 58.31 57.87 2rog n LYS 23 Cb 0.23 -1.50 0.50 0.00 0.02 0.00 0.00 35.03 34.28 2rog n LYS 23 CO 0.00 0.00 0.00 1.57 1.17 0.00 0.00 177.40 180.14 2rog h LYS 24 N 0.00 0.38 -6.67 1.64 2.10 -1.43 -3.41 116.57 109.19 2rog h LYS 24 Ca 0.00 -0.02 -0.49 0.00 -2.00 0.00 0.00 60.65 58.14 2rog h LYS 24 Cb 0.03 -0.09 0.01 0.00 -0.90 0.00 0.00 32.23 31.29 2rog h LYS 24 CO 0.00 0.25 -0.06 0.14 -2.00 0.00 0.00 179.45 177.78 2rog s VAL 25 N -5.37 5.00 0.00 0.07 -7.23 -1.08 -5.08 120.40 106.70 2rog s VAL 25 Ca -0.07 -0.05 0.00 0.00 -1.81 0.00 0.00 61.98 60.05 2rog s VAL 25 Cb 0.19 -3.82 0.00 0.00 0.56 0.00 0.00 36.38 33.30 2rog s VAL 25 CO 0.73 -0.59 0.03 -0.81 -0.31 0.00 0.00 175.10 174.15 2rog n PRO 26 N -1.70 0.00 -2.95 4.82 -0.04 -1.26 -4.88 135.00 128.98 2rog n PRO 26 Ca -0.02 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.31 2rog n PRO 26 Cb 0.55 -0.34 -0.01 0.00 -0.04 0.00 0.00 33.50 33.66 2rog n PRO 26 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2rog n GLY 27 N 1.24 0.78 0.39 0.55 0.00 -1.26 -5.00 105.19 101.89 2rog n GLY 27 Ca 0.00 -0.36 0.17 0.00 0.00 0.00 0.00 46.02 45.83 2rog n GLY 27 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2rog h VAL 28 N 3.68 0.74 0.00 1.61 3.04 -1.89 -3.45 116.25 119.97 2rog h VAL 28 Ca 0.03 -0.15 0.00 0.00 -1.01 0.00 0.00 66.70 65.57 2rog h VAL 28 Cb 1.00 0.26 0.00 0.00 -2.01 0.00 0.00 31.29 30.55 2rog h VAL 28 CO 0.27 0.08 0.00 1.21 -1.01 0.00 0.00 177.57 178.12 2rog n GLU 29 N -4.50 0.00 -3.61 4.17 2.13 -1.24 -4.50 120.64 113.09 2rog n GLU 29 Ca 0.17 0.00 -0.15 0.00 0.66 0.00 0.00 57.16 57.84 2rog n GLU 29 Cb 0.61 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 32.25 2rog n GLU 29 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 2rog s LYS 30 N -0.14 0.93 -0.11 5.31 2.47 -0.90 -4.99 119.74 122.31 2rog s LYS 30 Ca 0.00 -0.03 -0.08 0.00 -1.56 0.00 0.00 55.97 54.30 2rog s LYS 30 Cb 0.00 0.43 0.04 0.00 -1.46 0.00 0.00 37.83 36.84 2rog s LYS 30 CO 0.00 -0.30 0.28 0.14 0.16 0.00 0.00 175.35 175.64 2rog s VAL 31 N -1.61 -0.01 -0.04 4.02 -7.23 -1.26 -0.71 120.40 113.56 2rog s VAL 31 Ca -0.10 0.05 -0.04 0.00 -1.81 0.00 0.00 61.98 60.08 2rog s VAL 31 Cb -0.02 -0.41 0.01 0.00 0.56 0.00 0.00 36.38 36.52 2rog s VAL 31 CO 0.05 0.02 0.12 -0.70 -0.31 0.00 0.00 175.10 174.28 2rog s GLU 32 N 0.62 0.16 -0.02 4.82 2.56 -0.66 -5.02 118.70 121.15 2rog s GLU 32 Ca -0.04 0.12 0.01 0.00 0.00 0.00 0.00 54.97 55.06 2rog s GLU 32 Cb -0.05 0.07 0.02 0.00 2.00 0.00 0.00 34.13 36.18 2rog s GLU 32 CO -0.04 -0.02 -0.00 0.54 -0.56 0.00 0.00 175.26 175.18 2rog s VAL 33 N -0.04 0.18 -0.27 3.70 0.11 -1.26 -0.33 120.40 122.48 2rog s VAL 33 Ca -0.01 0.05 -0.08 0.00 -2.93 0.00 0.00 61.98 59.01 2rog s VAL 33 Cb -0.01 -0.26 -0.02 0.00 -1.53 0.00 0.00 36.38 34.56 2rog s VAL 33 CO 0.00 0.13 0.09 -0.94 -3.33 0.00 0.00 175.10 171.05 2rog s SER 34 N 0.84 5.23 0.54 3.54 1.04 -0.55 -4.98 113.70 119.36 2rog s SER 34 Ca -0.08 -0.38 0.36 0.00 0.48 0.00 0.00 55.95 56.32 2rog s SER 34 Cb -0.12 -1.93 1.86 0.00 0.10 0.00 0.00 66.02 65.93 2rog s SER 34 CO -0.01 -0.11 2.09 0.17 0.98 0.00 0.00 173.24 176.37 2rog h LEU 35 N 8.26 0.00 -0.13 2.42 -0.00 -1.97 0.13 115.31 124.02 2rog h LEU 35 Ca -0.35 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.53 2rog h LEU 35 Cb 1.16 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.82 2rog h LEU 35 CO 0.59 0.00 0.00 -0.33 -0.00 0.00 0.00 178.44 178.70 2rog h GLU 36 N 0.00 0.00 0.00 0.17 5.08 -1.97 -3.38 114.58 114.49 2rog h GLU 36 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2rog h GLU 36 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 2rog h GLU 36 CO 0.00 0.00 -0.08 1.63 -1.00 0.00 0.00 179.01 179.56 2rog n LYS 37 N -2.38 3.41 -1.03 2.33 4.01 -0.81 -5.04 118.16 118.65 2rog n LYS 37 Ca 0.05 0.00 -0.01 0.00 -0.51 0.00 0.00 58.31 57.84 2rog n LYS 37 Cb 0.41 -0.36 -0.00 0.00 -0.51 0.00 0.00 35.03 34.57 2rog n LYS 37 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2rog n GLY 38 N 0.26 0.49 3.87 0.72 0.00 0.38 -4.94 105.19 105.96 2rog n GLY 38 Ca 0.00 -0.25 -0.34 0.00 0.00 0.00 0.00 46.02 45.43 2rog n GLY 38 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2rog s GLU 39 N -0.94 3.77 -0.17 1.61 -1.05 -1.25 -1.28 118.70 119.39 2rog s GLU 39 Ca 0.00 0.19 -0.00 0.00 -0.15 0.00 0.00 54.97 55.01 2rog s GLU 39 Cb 0.00 -2.90 0.04 0.00 -0.44 0.00 0.00 34.13 30.83 2rog s GLU 39 CO 0.00 0.49 -0.05 0.00 0.95 0.00 0.00 175.26 176.65 2rog s ALA 40 N -1.52 1.52 -0.03 -0.84 0.00 0.55 -1.49 121.76 119.94 2rog s ALA 40 Ca 0.37 -0.87 -0.19 0.00 0.00 0.00 0.00 51.96 51.27 2rog s ALA 40 Cb -0.13 -1.15 -0.05 0.00 0.00 0.00 0.00 23.12 21.79 2rog s ALA 40 CO 0.20 -0.82 0.55 -0.51 0.00 0.00 0.00 175.76 175.19 2rog s LEU 41 N 1.62 4.39 -0.02 0.00 1.43 0.55 -0.70 118.68 125.94 2rog s LEU 41 Ca 0.00 1.06 0.00 0.00 -1.03 0.00 0.00 54.13 54.17 2rog s LEU 41 Cb -0.16 -2.84 0.02 0.00 0.03 0.00 0.00 46.19 43.25 2rog s LEU 41 CO -0.08 0.09 0.00 0.54 0.23 0.00 0.00 176.35 177.14 2rog s VAL 42 N -0.06 0.13 0.05 -1.59 0.11 -0.63 -1.66 120.40 116.76 2rog s VAL 42 Ca 0.29 0.08 0.08 0.00 -2.93 0.00 0.00 61.98 59.50 2rog s VAL 42 Cb -0.17 -0.22 -0.03 0.00 -1.53 0.00 0.00 36.38 34.43 2rog s VAL 42 CO 0.15 0.12 -0.22 -0.70 -3.33 0.00 0.00 175.10 171.13 2rog s GLU 43 N 0.86 1.42 0.00 1.54 2.12 0.12 -1.01 118.70 123.75 2rog s GLU 43 Ca -0.08 -1.00 0.00 0.00 0.36 0.00 0.00 54.97 54.25 2rog s GLU 43 Cb -0.12 -1.57 0.00 0.00 0.26 0.00 0.00 34.13 32.71 2rog s GLU 43 CO -0.02 0.40 0.00 0.41 -0.54 0.00 0.00 175.26 175.51 2rog n GLY 44 N 1.73 1.38 0.00 -1.50 0.00 -1.26 -2.13 105.19 103.41 2rog n GLY 44 Ca -0.17 -2.25 0.02 0.00 0.00 0.00 0.00 46.02 43.62 2rog n GLY 44 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2rog n THR 45 N -1.08 0.00 -2.15 2.61 -2.24 -1.26 -4.54 114.28 105.62 2rog n THR 45 Ca 0.00 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.38 2rog n THR 45 Cb 0.00 -0.59 -0.02 0.00 -2.10 0.00 0.00 70.33 67.62 2rog n THR 45 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2rog s ALA 46 N -2.00 3.45 -0.14 6.98 0.00 -1.26 -5.02 121.76 123.78 2rog s ALA 46 Ca 0.07 1.22 -0.17 0.00 0.00 0.00 0.00 51.96 53.08 2rog s ALA 46 Cb 0.03 -3.46 -0.04 0.00 0.00 0.00 0.00 23.12 19.65 2rog s ALA 46 CO 0.06 -0.62 0.43 0.34 0.00 0.00 0.00 175.76 175.97 2rog s ASP 47 N -0.57 6.61 0.49 0.00 -1.08 -1.26 -4.98 116.67 115.88 2rog s ASP 47 Ca 0.50 0.72 0.16 0.00 -0.52 0.00 0.00 52.55 53.41 2rog s ASP 47 Cb -0.39 -2.26 1.19 0.00 -1.46 0.00 0.00 42.92 40.01 2rog s ASP 47 CO 0.51 0.01 2.08 1.55 0.52 0.00 0.00 175.17 179.84 2rog h PRO 48 N 6.78 0.15 -0.45 4.34 0.13 -1.97 -2.32 132.00 138.65 2rog h PRO 48 Ca -0.40 -0.01 0.04 0.00 -0.87 0.00 0.00 66.00 64.76 2rog h PRO 48 Cb 1.17 -0.03 -0.04 0.00 0.13 0.00 0.00 31.00 32.23 2rog h PRO 48 CO 0.75 0.10 0.20 0.87 -0.23 0.00 0.00 178.00 179.70 2rog h LYS 49 N 0.15 0.40 -0.02 0.86 1.57 -1.98 0.11 116.57 117.66 2rog h LYS 49 Ca 0.12 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 2rog h LYS 49 Cb 0.28 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.50 2rog h LYS 49 CO -0.02 0.26 0.01 0.00 -0.57 0.00 0.00 179.45 179.13 2rog h ALA 50 N 1.26 0.02 -0.47 3.86 0.00 -1.84 -0.08 119.26 122.02 2rog h ALA 50 Ca 0.20 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 2rog h ALA 50 Cb 0.14 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 2rog h ALA 50 CO -0.16 -0.48 0.05 -0.07 0.00 0.00 0.00 179.25 178.58 2rog h LEU 51 N 0.02 0.76 0.18 0.00 3.38 -1.41 0.70 115.31 118.94 2rog h LEU 51 Ca 0.01 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2rog h LEU 51 Cb 0.00 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 2rog h LEU 51 CO -0.01 0.85 -0.16 0.58 0.09 0.00 0.00 178.44 179.79 2rog h VAL 52 N 0.65 0.64 -0.35 1.22 2.07 -0.65 -1.72 116.25 118.10 2rog h VAL 52 Ca 0.14 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.65 2rog h VAL 52 Cb 0.43 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 30.82 2rog h VAL 52 CO 0.01 0.00 0.20 1.56 0.02 0.00 0.00 177.57 179.36 2rog h GLN 53 N -0.37 0.47 0.09 1.57 1.08 -0.82 0.12 115.11 117.25 2rog h GLN 53 Ca -0.00 -0.04 -0.00 0.00 -1.45 0.00 0.00 58.65 57.15 2rog h GLN 53 Cb 0.34 -0.10 0.00 0.00 -0.05 0.00 0.00 27.48 27.67 2rog h GLN 53 CO -0.03 0.35 -0.04 0.00 -0.95 0.00 0.00 178.83 178.15 2rog h ALA 54 N 1.73 -0.12 -0.03 3.87 0.00 -0.03 0.18 119.26 124.87 2rog h ALA 54 Ca 0.13 -0.04 -0.17 0.00 0.00 0.00 0.00 54.91 54.83 2rog h ALA 54 Cb 0.01 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2rog h ALA 54 CO -0.02 -0.55 -0.72 -0.39 0.00 0.00 0.00 179.25 177.56 2rog h VAL 55 N -0.14 1.44 -0.22 0.00 -1.51 -0.95 -2.94 116.25 111.92 2rog h VAL 55 Ca -0.01 -2.29 -0.08 0.00 -1.23 0.00 0.00 66.70 63.09 2rog h VAL 55 Cb 0.11 2.22 -0.00 0.00 -2.13 0.00 0.00 31.29 31.49 2rog h VAL 55 CO 0.02 0.67 -0.18 -0.08 -1.23 0.00 0.00 177.57 176.77 2rog h GLU 56 N 0.13 0.52 0.00 5.19 4.81 -0.60 -2.96 114.58 121.67 2rog h GLU 56 Ca -0.02 -0.26 -0.02 0.00 -0.13 0.00 0.00 59.36 58.93 2rog h GLU 56 Cb 1.28 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.66 2rog h GLU 56 CO 0.11 0.83 -0.11 0.93 -0.73 0.00 0.00 179.01 180.04 2rog h GLU 57 N 0.22 0.00 0.00 1.92 4.39 -0.69 -0.90 114.58 119.51 2rog h GLU 57 Ca 0.04 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.74 2rog h GLU 57 Cb 0.72 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.37 2rog h GLU 57 CO 0.05 0.11 0.00 -1.91 -1.16 0.00 0.00 179.01 176.10 2rog n GLU 58 N -3.46 0.18 0.00 2.33 4.07 -1.11 -4.86 120.64 117.79 2rog n GLU 58 Ca -0.01 0.49 0.00 0.00 -0.06 0.00 0.00 57.16 57.58 2rog n GLU 58 Cb 0.27 -1.90 0.00 0.00 -0.06 0.00 0.00 31.44 29.75 2rog n GLU 58 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2rog n GLY 59 N -0.43 2.00 3.42 8.31 0.00 -0.35 -5.10 105.19 113.04 2rog n GLY 59 Ca 0.01 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.81 2rog n GLY 59 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2rog s TYR 60 N -2.00 1.73 -0.16 1.61 1.51 -1.17 -5.06 117.35 113.81 2rog s TYR 60 Ca 0.00 -1.28 -0.08 0.00 -1.01 0.00 0.00 57.07 54.69 2rog s TYR 60 Cb 0.00 -1.03 -0.05 0.00 -0.11 0.00 0.00 41.96 40.77 2rog s TYR 60 CO 0.00 -0.37 0.13 0.15 -1.11 0.00 0.00 175.55 174.36 2rog s LYS 61 N -3.77 3.82 0.16 -0.62 3.01 -0.63 -4.27 119.74 117.43 2rog s LYS 61 Ca 0.31 -0.18 0.04 0.00 -1.01 0.00 0.00 55.97 55.14 2rog s LYS 61 Cb 0.04 -3.30 -0.05 0.00 -1.01 0.00 0.00 37.83 33.51 2rog s LYS 61 CO 0.16 0.53 -0.09 0.00 0.51 0.00 0.00 175.35 176.47 2rog s ALA 62 N -0.32 1.53 0.16 5.17 0.00 -1.26 -0.07 121.76 126.97 2rog s ALA 62 Ca 0.11 -1.54 -0.11 0.00 0.00 0.00 0.00 51.96 50.42 2rog s ALA 62 Cb -0.11 0.11 0.00 0.00 0.00 0.00 0.00 23.12 23.12 2rog s ALA 62 CO 0.01 -0.11 0.33 -2.00 0.00 0.00 0.00 175.76 173.99 2rog s GLU 63 N -3.76 1.18 0.08 0.00 2.12 -0.23 -5.00 118.70 113.09 2rog s GLU 63 Ca 0.19 -1.08 -0.11 0.00 0.36 0.00 0.00 54.97 54.33 2rog s GLU 63 Cb 0.03 0.41 0.01 0.00 0.26 0.00 0.00 34.13 34.84 2rog s GLU 63 CO 0.02 -0.45 0.24 0.54 -0.54 0.00 0.00 175.26 175.08 2rog s VAL 64 N -3.94 0.12 0.19 3.70 0.11 -1.26 -0.81 120.40 118.51 2rog s VAL 64 Ca 0.14 -0.96 -0.23 0.00 -2.93 0.00 0.00 61.98 58.00 2rog s VAL 64 Cb 0.02 -1.19 0.05 0.00 -1.53 0.00 0.00 36.38 33.73 2rog s VAL 64 CO -0.02 -0.53 0.77 -0.22 -3.33 0.00 0.00 175.10 171.78 2rog s LEU 65 N -2.63 -0.31 0.00 2.54 2.96 -0.73 -5.00 118.68 115.52 2rog s LEU 65 Ca 0.02 -0.37 0.00 0.00 -0.22 0.00 0.00 54.13 53.56 2rog s LEU 65 Cb 0.03 2.49 0.00 0.00 0.50 0.00 0.00 46.19 49.20 2rog s LEU 65 CO -0.09 -1.08 0.00 0.00 -1.32 0.00 0.00 176.35 173.85