#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 2.62 -0.02 -0.89 1.43 -0.44 -4.96 118.68 116.42 2rog s LEU 2 Ca 0.00 -1.05 0.07 0.00 -1.03 0.00 0.00 54.13 52.12 2rog s LEU 2 Cb 0.00 -1.09 -0.02 0.00 0.03 0.00 0.00 46.19 45.11 2rog s LEU 2 CO 0.00 0.00 -0.23 -0.75 0.23 0.00 0.00 176.35 175.60 2rog s LYS 3 N -3.53 1.87 -0.24 1.70 2.20 -0.52 -1.49 119.74 119.73 2rog s LYS 3 Ca 0.30 -0.82 0.02 0.00 -0.36 0.00 0.00 55.97 55.11 2rog s LYS 3 Cb -0.04 -1.80 0.05 0.00 -1.51 0.00 0.00 37.83 34.53 2rog s LYS 3 CO 0.15 0.49 -0.10 -1.17 -0.36 0.00 0.00 175.35 174.37 2rog s LEU 4 N -0.53 2.91 -0.14 5.43 2.96 -0.08 -1.61 118.68 127.62 2rog s LEU 4 Ca 0.09 -1.20 -0.21 0.00 -0.22 0.00 0.00 54.13 52.59 2rog s LEU 4 Cb -0.09 -1.39 -0.03 0.00 0.50 0.00 0.00 46.19 45.18 2rog s LEU 4 CO -0.01 -0.18 0.62 -0.75 -1.32 0.00 0.00 176.35 174.71 2rog s LYS 5 N 1.25 4.32 -0.01 1.98 2.20 0.18 -0.95 119.74 128.71 2rog s LYS 5 Ca -0.06 0.66 0.06 0.00 -0.36 0.00 0.00 55.97 56.28 2rog s LYS 5 Cb -0.19 -3.50 -0.03 0.00 -1.51 0.00 0.00 37.83 32.61 2rog s LYS 5 CO -0.06 -0.05 -0.20 0.08 -0.36 0.00 0.00 175.35 174.76 2rog s VAL 6 N 1.24 2.56 -0.30 4.02 1.01 -0.42 -0.97 120.40 127.54 2rog s VAL 6 Ca 0.31 -1.03 -0.03 0.00 0.00 0.00 0.00 61.98 61.24 2rog s VAL 6 Cb -0.16 -1.98 0.11 0.00 0.00 0.00 0.00 36.38 34.35 2rog s VAL 6 CO 0.13 0.51 0.17 -0.70 0.00 0.00 0.00 175.10 175.21 2rog s GLU 7 N -0.89 0.27 0.00 2.72 2.12 -0.02 -4.38 118.70 118.52 2rog s GLU 7 Ca 0.12 -0.56 0.00 0.00 0.36 0.00 0.00 54.97 54.88 2rog s GLU 7 Cb -0.10 -1.08 0.00 0.00 0.26 0.00 0.00 34.13 33.21 2rog s GLU 7 CO 0.01 -1.05 0.00 0.41 -0.54 0.00 0.00 175.26 174.09 2rog n GLY 8 N 5.09 2.00 0.00 -1.50 0.00 -1.26 -0.86 105.19 108.66 2rog n GLY 8 Ca -0.03 -2.06 0.00 0.00 0.00 0.00 0.00 46.02 43.93 2rog n GLY 8 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2rog n MET 9 N -0.26 1.73 -4.46 1.61 1.56 -1.26 -4.97 117.12 111.08 2rog n MET 9 Ca 0.00 -1.11 -0.23 0.00 -0.27 0.00 0.00 57.70 56.09 2rog n MET 9 Cb 0.00 -0.89 -0.09 0.00 2.15 0.00 0.00 33.22 34.39 2rog n MET 9 CO 0.00 0.00 0.00 0.95 -0.73 0.00 0.00 175.97 176.19 2rog s THR 10 N -0.63 0.77 0.00 1.12 -4.23 -1.26 -5.10 115.64 106.32 2rog s THR 10 Ca 0.00 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.51 2rog s THR 10 Cb 0.00 -2.54 0.00 0.00 1.34 0.00 0.00 72.50 71.30 2rog s THR 10 CO 0.00 0.00 0.00 0.00 -0.54 0.00 0.00 174.62 174.08 2rog h ASN 12 N 0.00 0.00 0.22 0.00 7.08 -1.99 -0.13 115.58 120.76 2rog h ASN 12 Ca 0.00 0.00 -0.34 0.00 -3.08 0.00 0.00 56.30 52.88 2rog h ASN 12 Cb 0.00 0.00 -0.04 0.00 -2.08 0.00 0.00 38.32 36.20 2rog h ASN 12 CO 0.00 0.00 -2.02 1.57 -2.08 0.00 0.00 177.43 174.90 2rog n HIS 13 N -4.19 0.80 0.09 4.14 -0.00 -1.26 -4.35 115.22 110.45 2rog n HIS 13 Ca 0.07 0.22 -0.12 0.00 0.46 0.00 0.00 57.72 58.35 2rog n HIS 13 Cb 0.53 -1.12 -0.05 0.00 -0.12 0.00 0.00 29.99 29.22 2rog n HIS 13 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2rog h VAL 15 N -0.44 0.73 -0.02 0.00 3.04 -1.48 0.97 116.25 119.05 2rog h VAL 15 Ca 0.04 -0.23 -0.00 0.00 -1.01 0.00 0.00 66.70 65.50 2rog h VAL 15 Cb 0.49 -0.01 -0.00 0.00 -2.01 0.00 0.00 31.29 29.76 2rog h VAL 15 CO -0.18 0.12 0.01 0.24 -1.01 0.00 0.00 177.57 176.75 2rog h MET 16 N 0.68 0.02 -0.45 4.17 2.86 -1.65 -0.84 114.93 119.72 2rog h MET 16 Ca 0.53 -0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 58.05 2rog h MET 16 Cb 0.93 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.57 2rog h MET 16 CO -0.30 0.14 -0.20 0.00 1.06 0.00 0.00 176.91 177.61 2rog h ALA 17 N 0.89 0.80 -0.54 6.32 0.00 -1.21 -1.17 119.26 124.34 2rog h ALA 17 Ca 0.01 -0.38 0.02 0.00 0.00 0.00 0.00 54.91 54.56 2rog h ALA 17 Cb 0.12 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 2rog h ALA 17 CO -0.00 0.65 0.34 0.28 0.00 0.00 0.00 179.25 180.52 2rog h VAL 18 N 0.78 1.09 -0.71 0.00 2.07 -0.63 0.55 116.25 119.39 2rog h VAL 18 Ca 0.11 -0.23 -0.07 0.00 0.82 0.00 0.00 66.70 67.32 2rog h VAL 18 Cb 0.75 0.35 -0.03 0.00 -1.52 0.00 0.00 31.29 30.84 2rog h VAL 18 CO 0.06 0.12 0.16 0.74 0.02 0.00 0.00 177.57 178.67 2rog h THR 19 N 0.68 1.26 -0.24 2.57 2.02 -0.90 0.27 112.91 118.57 2rog h THR 19 Ca 0.21 -0.99 0.04 0.00 0.77 0.00 0.00 66.41 66.44 2rog h THR 19 Cb -0.02 0.54 -0.04 0.00 -1.74 0.00 0.00 68.15 66.89 2rog h THR 19 CO -0.07 0.38 -0.04 0.50 0.37 0.00 0.00 175.52 176.66 2rog h LYS 20 N 1.08 0.02 0.11 6.66 1.63 0.00 0.52 116.57 126.60 2rog h LYS 20 Ca 0.22 -0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 60.01 2rog h LYS 20 Cb 0.39 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.02 2rog h LYS 20 CO 0.00 0.02 -0.05 0.00 -3.45 0.00 0.00 179.45 175.97 2rog h ALA 21 N 1.22 -0.15 -0.10 5.00 0.00 -0.75 -3.08 119.26 121.41 2rog h ALA 21 Ca 0.11 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 54.90 2rog h ALA 21 Cb 0.16 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 2rog h ALA 21 CO -0.22 -0.45 0.08 -0.07 0.00 0.00 0.00 179.25 178.59 2rog h LEU 22 N -0.42 0.00 -1.61 0.00 3.38 -0.69 -1.13 115.31 114.84 2rog h LEU 22 Ca -0.02 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 2rog h LEU 22 Cb 0.34 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.09 2rog h LEU 22 CO 0.02 0.00 -0.04 0.50 0.09 0.00 0.00 178.44 179.01 2rog h LYS 23 N 0.00 0.00 0.00 1.13 3.64 -0.80 -3.15 116.57 117.39 2rog h LYS 23 Ca 0.05 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 2rog h LYS 23 Cb 0.21 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 2rog h LYS 23 CO -0.00 0.04 0.00 0.87 -2.27 0.00 0.00 179.45 178.09 2rog h LYS 24 N 0.00 0.00 -6.75 1.90 1.57 -1.29 -3.46 116.57 108.54 2rog h LYS 24 Ca -0.00 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 58.25 2rog h LYS 24 Cb 0.48 0.00 0.22 0.00 0.08 0.00 0.00 32.23 33.01 2rog h LYS 24 CO 0.01 0.00 -0.67 1.33 -0.57 0.00 0.00 179.45 179.55 2rog n VAL 25 N -2.37 0.00 0.00 0.50 0.24 -1.19 -4.99 118.33 110.52 2rog n VAL 25 Ca 0.01 -0.21 0.00 0.00 -2.04 0.00 0.00 64.34 62.09 2rog n VAL 25 Cb 0.16 -0.60 0.00 0.00 -1.47 0.00 0.00 33.84 31.94 2rog n VAL 25 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 2rog n PRO 26 N -1.59 0.00 -2.72 7.34 -0.04 -1.26 -4.75 135.00 131.99 2rog n PRO 26 Ca 0.06 0.45 -0.08 0.00 -0.04 0.00 0.00 63.50 63.89 2rog n PRO 26 Cb 0.54 -1.38 0.10 0.00 -0.04 0.00 0.00 33.50 32.72 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 -0.55 1.31 0.31 0.55 0.00 -1.26 -4.98 105.19 100.57 2rog n GLY 27 Ca 0.00 -0.30 -0.01 0.00 0.00 0.00 0.00 46.02 45.71 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 2.26 1.20 0.00 1.61 3.04 -1.87 -3.42 116.25 119.07 2rog h VAL 28 Ca -0.22 -0.61 0.00 0.00 -1.01 0.00 0.00 66.70 64.86 2rog h VAL 28 Cb 1.24 0.52 0.00 0.00 -2.01 0.00 0.00 31.29 31.04 2rog h VAL 28 CO 0.06 0.24 0.00 -1.84 -1.01 0.00 0.00 177.57 175.02 2rog n GLU 29 N -4.34 0.00 -3.68 4.17 0.28 -1.26 -4.32 120.64 111.48 2rog n GLU 29 Ca 0.05 0.00 -0.29 0.00 -0.16 0.00 0.00 57.16 56.76 2rog n GLU 29 Cb 0.15 -3.61 -0.16 0.00 1.43 0.00 0.00 31.44 29.26 2rog n GLU 29 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 2rog s LYS 30 N 0.00 0.54 -0.06 3.44 1.02 -1.26 -5.08 119.74 118.33 2rog s LYS 30 Ca 0.00 -0.66 -0.03 0.00 0.02 0.00 0.00 55.97 55.30 2rog s LYS 30 Cb 0.00 -1.83 0.04 0.00 -0.52 0.00 0.00 37.83 35.52 2rog s LYS 30 CO 0.00 -0.86 0.12 0.54 -0.92 0.00 0.00 175.35 174.23 2rog s VAL 31 N 1.84 -0.19 0.02 3.17 0.11 -1.26 -1.71 120.40 122.38 2rog s VAL 31 Ca 0.05 0.38 0.07 0.00 -2.93 0.00 0.00 61.98 59.56 2rog s VAL 31 Cb -0.17 -0.23 -0.02 0.00 -1.53 0.00 0.00 36.38 34.43 2rog s VAL 31 CO -0.21 0.16 -0.21 -0.70 -3.33 0.00 0.00 175.10 170.81 2rog s GLU 32 N 2.21 1.51 0.01 1.54 2.12 -0.45 -5.00 118.70 120.64 2rog s GLU 32 Ca 0.04 -0.85 0.01 0.00 0.36 0.00 0.00 54.97 54.53 2rog s GLU 32 Cb -0.12 -1.55 -0.01 0.00 0.26 0.00 0.00 34.13 32.71 2rog s GLU 32 CO -0.05 0.41 -0.05 0.08 -0.54 0.00 0.00 175.26 175.12 2rog s VAL 33 N -0.66 0.35 -0.10 3.70 1.01 -1.26 -0.66 120.40 122.77 2rog s VAL 33 Ca 0.08 -0.45 -0.28 0.00 0.00 0.00 0.00 61.98 61.33 2rog s VAL 33 Cb -0.08 -0.35 -0.02 0.00 0.00 0.00 0.00 36.38 35.93 2rog s VAL 33 CO 0.01 -0.07 0.94 -0.55 0.00 0.00 0.00 175.10 175.42 2rog s SER 34 N -0.56 7.18 -0.02 3.32 0.15 -0.09 -4.96 113.70 118.71 2rog s SER 34 Ca -0.03 1.44 -0.24 0.00 0.70 0.00 0.00 55.95 57.82 2rog s SER 34 Cb -0.04 -2.52 -0.20 0.00 -1.71 0.00 0.00 66.02 61.55 2rog s SER 34 CO -0.00 -0.38 1.21 0.25 1.20 0.00 0.00 173.24 175.53 2rog h LEU 35 N 7.77 0.14 -0.05 3.45 7.12 -1.99 -3.29 115.31 128.47 2rog h LEU 35 Ca -0.33 -0.57 0.00 0.00 0.13 0.00 0.00 57.88 57.11 2rog h LEU 35 Cb 1.16 -0.04 0.00 0.00 -0.53 0.00 0.00 40.66 41.25 2rog h LEU 35 CO 0.83 0.68 0.00 -1.84 -0.13 0.00 0.00 178.44 177.98 2rog n GLU 36 N -4.70 0.19 -0.94 1.25 0.28 -1.26 -4.77 120.64 110.69 2rog n GLU 36 Ca -0.08 0.18 0.00 0.00 -0.16 0.00 0.00 57.16 57.10 2rog n GLU 36 Cb 0.34 -1.73 0.00 0.00 1.43 0.00 0.00 31.44 31.47 2rog n GLU 36 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2rog n LYS 37 N -2.07 2.97 -3.21 3.44 4.76 -1.24 -5.10 118.16 117.70 2rog n LYS 37 Ca 0.06 0.00 -0.23 0.00 -2.87 0.00 0.00 58.31 55.26 2rog n LYS 37 Cb 0.39 0.00 -0.06 0.00 -1.84 0.00 0.00 35.03 33.52 2rog n LYS 37 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2rog n GLY 38 N 5.00 3.73 3.07 0.72 0.00 -1.26 -4.75 105.19 111.69 2rog n GLY 38 Ca 0.00 -1.97 -0.13 0.00 0.00 0.00 0.00 46.02 43.92 2rog n GLY 38 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2rog s GLU 39 N -1.99 0.22 0.05 1.61 2.12 -1.26 -1.30 118.70 118.15 2rog s GLU 39 Ca 0.39 0.34 0.07 0.00 0.36 0.00 0.00 54.97 56.13 2rog s GLU 39 Cb 0.22 0.04 -0.03 0.00 0.26 0.00 0.00 34.13 34.63 2rog s GLU 39 CO -0.09 -0.07 -0.20 0.00 -0.54 0.00 0.00 175.26 174.37 2rog s ALA 40 N 0.44 1.68 -0.03 6.30 0.00 -0.12 -0.92 121.76 129.12 2rog s ALA 40 Ca -0.03 -1.04 0.07 0.00 0.00 0.00 0.00 51.96 50.96 2rog s ALA 40 Cb -0.04 -0.32 -0.02 0.00 0.00 0.00 0.00 23.12 22.75 2rog s ALA 40 CO -0.02 0.37 -0.23 -0.51 0.00 0.00 0.00 175.76 175.37 2rog s LEU 41 N -1.20 2.04 -0.00 0.00 2.01 0.16 -0.91 118.68 120.78 2rog s LEU 41 Ca 0.07 -0.43 0.01 0.00 0.01 0.00 0.00 54.13 53.79 2rog s LEU 41 Cb -0.09 -1.20 -0.00 0.00 0.01 0.00 0.00 46.19 44.91 2rog s LEU 41 CO 0.02 0.27 -0.03 0.68 1.01 0.00 0.00 176.35 178.30 2rog s VAL 42 N -0.45 0.24 -0.28 -1.59 -7.23 -0.56 -1.34 120.40 109.20 2rog s VAL 42 Ca 0.06 -0.13 0.00 0.00 -1.81 0.00 0.00 61.98 60.11 2rog s VAL 42 Cb -0.10 -0.21 0.08 0.00 0.56 0.00 0.00 36.38 36.72 2rog s VAL 42 CO -0.00 0.07 0.04 -0.70 -0.31 0.00 0.00 175.10 174.20 2rog s GLU 43 N -0.04 1.08 0.00 4.82 2.56 -0.69 -0.38 118.70 126.05 2rog s GLU 43 Ca 0.01 -1.10 0.00 0.00 0.00 0.00 0.00 54.97 53.88 2rog s GLU 43 Cb -0.01 -2.37 0.00 0.00 2.00 0.00 0.00 34.13 33.74 2rog s GLU 43 CO -0.00 -0.83 0.00 0.41 -0.56 0.00 0.00 175.26 174.28 2rog n GLY 44 N 4.73 0.24 0.00 -1.50 0.00 -1.26 -4.13 105.19 103.27 2rog n GLY 44 Ca -0.05 -1.68 0.00 0.00 0.00 0.00 0.00 46.02 44.29 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 9.00 0.00 -2.35 2.61 -2.24 -1.26 -4.79 114.28 115.26 2rog n THR 45 Ca 0.00 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.37 2rog n THR 45 Cb 0.00 -0.69 -0.03 0.00 -2.10 0.00 0.00 70.33 67.51 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 -1.96 2.76 0.20 6.98 0.00 -1.26 -4.82 121.76 123.65 2rog s ALA 46 Ca 0.00 -0.64 -0.31 0.00 0.00 0.00 0.00 51.96 51.02 2rog s ALA 46 Cb 0.00 -4.12 -0.10 0.00 0.00 0.00 0.00 23.12 18.91 2rog s ALA 46 CO 0.00 -3.00 1.45 0.34 0.00 0.00 0.00 175.76 174.55 2rog s ASP 47 N 4.79 6.69 0.32 0.00 -1.08 -1.26 -4.89 116.67 121.23 2rog s ASP 47 Ca 0.55 2.57 0.05 0.00 -0.52 0.00 0.00 52.55 55.20 2rog s ASP 47 Cb -0.11 -2.61 0.67 0.00 -1.46 0.00 0.00 42.92 39.41 2rog s ASP 47 CO 0.25 -0.71 1.86 1.55 0.52 0.00 0.00 175.17 178.64 2rog h PRO 48 N 5.79 0.84 -0.47 4.34 0.13 -1.99 -1.50 132.00 139.15 2rog h PRO 48 Ca -0.44 -0.05 -0.11 0.00 -0.87 0.00 0.00 66.00 64.53 2rog h PRO 48 Cb 1.21 -0.19 -0.02 0.00 0.13 0.00 0.00 31.00 32.14 2rog h PRO 48 CO 0.83 0.55 -0.14 1.57 -0.23 0.00 0.00 178.00 180.58 2rog h LYS 49 N 0.86 0.87 -0.43 0.86 2.10 -1.99 -0.83 116.57 118.02 2rog h LYS 49 Ca 0.46 -0.32 -0.07 0.00 -2.00 0.00 0.00 60.65 58.72 2rog h LYS 49 Cb 0.56 -0.06 -0.02 0.00 -0.90 0.00 0.00 32.23 31.81 2rog h LYS 49 CO -0.23 0.96 -0.04 0.00 -2.00 0.00 0.00 179.45 178.14 2rog h ALA 50 N 1.06 1.13 0.04 0.07 0.00 -1.72 -1.31 119.26 118.53 2rog h ALA 50 Ca 0.12 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 2rog h ALA 50 Cb 0.66 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2rog h ALA 50 CO 0.05 0.55 -0.02 -0.07 0.00 0.00 0.00 179.25 179.76 2rog h LEU 51 N 0.67 -0.04 -0.09 0.00 3.38 -0.99 -1.60 115.31 116.63 2rog h LEU 51 Ca 0.13 -0.35 0.04 0.00 0.09 0.00 0.00 57.88 57.79 2rog h LEU 51 Cb 0.47 0.01 -0.06 0.00 0.09 0.00 0.00 40.66 41.18 2rog h LEU 51 CO 0.02 0.33 -0.27 0.58 0.09 0.00 0.00 178.44 179.20 2rog h VAL 52 N -0.42 0.38 -0.17 1.22 2.07 -1.03 -1.69 116.25 116.62 2rog h VAL 52 Ca -0.00 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.55 2rog h VAL 52 Cb 0.39 0.38 -0.04 0.00 -1.52 0.00 0.00 31.29 30.50 2rog h VAL 52 CO 0.01 0.00 -0.08 1.56 0.02 0.00 0.00 177.57 179.08 2rog h GLN 53 N -0.36 -0.06 -0.28 1.57 7.50 -1.25 -0.65 115.11 121.58 2rog h GLN 53 Ca 0.09 0.00 0.06 0.00 0.50 0.00 0.00 58.65 59.30 2rog h GLN 53 Cb 0.49 0.01 -0.06 0.00 0.05 0.00 0.00 27.48 27.97 2rog h GLN 53 CO -0.30 -0.04 -0.09 0.00 -1.50 0.00 0.00 178.83 176.90 2rog h ALA 54 N 1.09 0.16 -0.10 3.87 0.00 -0.73 -1.64 119.26 121.91 2rog h ALA 54 Ca 0.09 0.11 -0.13 0.00 0.00 0.00 0.00 54.91 54.99 2rog h ALA 54 Cb 0.20 0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2rog h ALA 54 CO -0.21 -0.49 -0.49 -0.39 0.00 0.00 0.00 179.25 177.67 2rog h VAL 55 N -0.03 1.34 0.00 0.00 -1.51 -1.09 -2.89 116.25 112.07 2rog h VAL 55 Ca 0.14 -1.72 -0.00 0.00 -1.23 0.00 0.00 66.70 63.89 2rog h VAL 55 Cb 0.24 1.80 -0.00 0.00 -2.13 0.00 0.00 31.29 31.21 2rog h VAL 55 CO -0.31 0.51 -0.01 -0.33 -1.23 0.00 0.00 177.57 176.21 2rog h GLU 56 N 0.21 0.00 0.00 5.19 5.08 -0.22 -2.48 114.58 122.37 2rog h GLU 56 Ca 0.01 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 2rog h GLU 56 Cb 0.95 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.19 2rog h GLU 56 CO 0.08 0.01 -0.06 0.93 -1.00 0.00 0.00 179.01 178.96 2rog h GLU 57 N 0.00 0.00 -0.00 2.33 5.08 -1.15 0.54 114.58 121.39 2rog h GLU 57 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2rog h GLU 57 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 2rog h GLU 57 CO 0.00 0.06 -0.41 -1.91 -1.00 0.00 0.00 179.01 175.75 2rog n GLU 58 N -4.20 0.36 -0.62 2.33 4.07 -0.93 -4.97 120.64 116.68 2rog n GLU 58 Ca -0.03 -0.22 0.00 0.00 -0.06 0.00 0.00 57.16 56.86 2rog n GLU 58 Cb 0.15 -1.50 0.00 0.00 -0.06 0.00 0.00 31.44 30.03 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 1.43 0.68 3.80 8.31 0.00 0.18 -5.07 105.19 114.53 2rog n GLY 59 Ca 0.08 -0.03 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 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 2.97 -0.24 1.61 2.02 -1.24 -4.98 117.35 115.49 2rog s TYR 60 Ca 0.00 1.49 -0.28 0.00 -0.37 0.00 0.00 57.07 57.91 2rog s TYR 60 Cb 0.00 -2.99 0.01 0.00 -0.40 0.00 0.00 41.96 38.58 2rog s TYR 60 CO 0.00 -1.22 1.02 0.15 -1.57 0.00 0.00 175.55 173.93 2rog s LYS 61 N -4.37 4.22 -0.05 -0.62 -0.14 -0.04 -4.40 119.74 114.35 2rog s LYS 61 Ca 0.62 1.27 -0.03 0.00 -1.36 0.00 0.00 55.97 56.47 2rog s LYS 61 Cb -0.16 -3.65 -0.04 0.00 -1.68 0.00 0.00 37.83 32.30 2rog s LYS 61 CO 0.43 -0.66 0.12 0.00 -0.76 0.00 0.00 175.35 174.49 2rog s ALA 62 N 3.22 3.77 -0.01 5.17 0.00 -1.26 -0.84 121.76 131.81 2rog s ALA 62 Ca 0.43 -0.76 -0.11 0.00 0.00 0.00 0.00 51.96 51.53 2rog s ALA 62 Cb -0.15 -1.79 0.01 0.00 0.00 0.00 0.00 23.12 21.19 2rog s ALA 62 CO 0.07 0.68 0.22 -2.00 0.00 0.00 0.00 175.76 174.73 2rog s GLU 63 N -1.48 0.57 0.06 0.00 2.56 -0.15 -5.01 118.70 115.24 2rog s GLU 63 Ca 0.21 -0.29 0.02 0.00 0.00 0.00 0.00 54.97 54.91 2rog s GLU 63 Cb -0.12 0.25 -0.04 0.00 2.00 0.00 0.00 34.13 36.21 2rog s GLU 63 CO 0.11 -0.15 0.06 0.14 -0.56 0.00 0.00 175.26 174.86 2rog s VAL 64 N -1.34 4.43 -0.00 3.70 -7.23 -1.26 -0.65 120.40 118.05 2rog s VAL 64 Ca -0.14 -0.72 -0.13 0.00 -1.81 0.00 0.00 61.98 59.19 2rog s VAL 64 Cb -0.06 -3.09 0.02 0.00 0.56 0.00 0.00 36.38 33.80 2rog s VAL 64 CO 0.03 0.20 0.26 -0.76 -0.31 0.00 0.00 175.10 174.52 2rog s LEU 65 N -2.15 1.06 0.00 1.32 1.43 -0.63 -4.90 118.68 114.81 2rog s LEU 65 Ca 0.26 -0.03 0.31 0.00 -1.03 0.00 0.00 54.13 53.65 2rog s LEU 65 Cb -0.12 1.10 1.72 0.00 0.03 0.00 0.00 46.19 48.93 2rog s LEU 65 CO 0.18 -0.44 2.12 0.00 0.23 0.00 0.00 176.35 178.45