#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 2.41 -0.33 3.17 1.02 -0.41 -4.98 118.68 119.55 2rog s LEU 2 Ca 0.00 -0.96 -0.12 0.00 0.02 0.00 0.00 54.13 53.07 2rog s LEU 2 Cb 0.00 0.25 -0.02 0.00 0.02 0.00 0.00 46.19 46.44 2rog s LEU 2 CO 0.00 -0.60 0.22 -0.54 0.02 0.00 0.00 176.35 175.45 2rog s LYS 3 N -3.82 3.50 -0.04 1.70 3.01 -1.21 -1.71 119.74 121.17 2rog s LYS 3 Ca 0.06 -0.63 -0.02 0.00 -1.01 0.00 0.00 55.97 54.37 2rog s LYS 3 Cb 0.07 -3.75 -0.04 0.00 -1.01 0.00 0.00 37.83 33.11 2rog s LYS 3 CO -0.10 -0.42 0.07 -1.17 0.51 0.00 0.00 175.35 174.24 2rog s LEU 4 N 1.70 3.89 -0.08 3.17 0.20 0.16 -0.82 118.68 126.90 2rog s LEU 4 Ca 0.06 0.19 0.03 0.00 0.69 0.00 0.00 54.13 55.10 2rog s LEU 4 Cb -0.17 -2.13 0.01 0.00 -0.43 0.00 0.00 46.19 43.47 2rog s LEU 4 CO 0.10 0.32 -0.16 -1.59 -0.29 0.00 0.00 176.35 174.73 2rog s LYS 5 N -1.42 2.16 0.21 1.98 -2.85 -0.20 -0.84 119.74 118.78 2rog s LYS 5 Ca 0.19 -0.57 -0.04 0.00 -1.00 0.00 0.00 55.97 54.56 2rog s LYS 5 Cb -0.12 -1.74 -0.05 0.00 -2.06 0.00 0.00 37.83 33.85 2rog s LYS 5 CO 0.10 0.05 0.44 0.08 0.10 0.00 0.00 175.35 176.12 2rog s VAL 6 N 0.65 5.12 0.15 1.79 1.01 0.38 -1.51 120.40 127.98 2rog s VAL 6 Ca -0.14 -0.03 -0.05 0.00 0.00 0.00 0.00 61.98 61.76 2rog s VAL 6 Cb -0.16 -3.68 -0.02 0.00 0.00 0.00 0.00 36.38 32.51 2rog s VAL 6 CO 0.04 -0.13 0.17 -0.70 0.00 0.00 0.00 175.10 174.49 2rog s GLU 7 N -3.09 1.05 0.00 2.72 2.12 0.29 -4.73 118.70 117.05 2rog s GLU 7 Ca 0.42 -1.30 0.00 0.00 0.36 0.00 0.00 54.97 54.45 2rog s GLU 7 Cb -0.11 0.31 0.00 0.00 0.26 0.00 0.00 34.13 34.59 2rog s GLU 7 CO 0.27 -0.34 0.00 0.41 -0.54 0.00 0.00 175.26 175.05 2rog n GLY 8 N -0.16 1.25 2.77 -1.50 0.00 -1.26 -1.57 105.19 104.72 2rog n GLY 8 Ca -0.06 -0.91 -0.19 0.00 0.00 0.00 0.00 46.02 44.85 2rog n GLY 8 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2rog n MET 9 N 0.00 -0.52 -3.30 1.61 2.81 -1.26 -5.08 117.12 111.38 2rog n MET 9 Ca 0.00 -1.66 -0.07 0.00 -1.81 0.00 0.00 57.70 54.16 2rog n MET 9 Cb 0.00 -0.78 -0.06 0.00 -0.71 0.00 0.00 33.22 31.67 2rog n MET 9 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 2rog s THR 10 N -2.71 -0.68 -0.12 2.03 -4.23 -1.26 -5.05 115.64 103.62 2rog s THR 10 Ca 0.51 -0.15 -0.30 0.00 -1.18 0.00 0.00 61.69 60.58 2rog s THR 10 Cb -0.02 -0.92 0.09 0.00 1.34 0.00 0.00 72.50 73.00 2rog s THR 10 CO 0.35 -0.17 0.81 0.00 -0.54 0.00 0.00 174.62 175.08 2rog h ASN 12 N 3.05 0.90 0.07 0.00 7.08 -1.98 -2.71 115.58 122.00 2rog h ASN 12 Ca -0.24 -0.14 0.00 0.00 -3.08 0.00 0.00 56.30 52.84 2rog h ASN 12 Cb 1.15 -0.23 0.00 0.00 -2.08 0.00 0.00 38.32 37.16 2rog h ASN 12 CO 0.32 0.79 0.00 1.41 -2.08 0.00 0.00 177.43 177.88 2rog n HIS 13 N -4.44 0.76 0.20 4.14 8.25 -1.26 -1.96 115.22 120.91 2rog n HIS 13 Ca 0.05 0.39 0.06 0.00 -0.26 0.00 0.00 57.72 57.95 2rog n HIS 13 Cb 0.14 -1.12 0.52 0.00 1.12 0.00 0.00 29.99 30.65 2rog n HIS 13 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2rog h VAL 15 N 0.08 0.50 0.01 0.00 -1.51 -1.62 0.17 116.25 113.89 2rog h VAL 15 Ca 0.02 0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.49 2rog h VAL 15 Cb 0.20 0.92 0.00 0.00 -2.13 0.00 0.00 31.29 30.28 2rog h VAL 15 CO 0.01 0.00 -0.01 0.24 -1.23 0.00 0.00 177.57 176.59 2rog h MET 16 N 0.00 -0.02 0.18 5.19 2.86 -1.59 -0.92 114.93 120.63 2rog h MET 16 Ca 0.04 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.67 2rog h MET 16 Cb 0.24 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.90 2rog h MET 16 CO -0.00 0.46 -0.09 0.00 1.06 0.00 0.00 176.91 178.34 2rog h ALA 17 N 0.48 -0.24 0.22 6.32 0.00 -1.33 -0.41 119.26 124.30 2rog h ALA 17 Ca -0.00 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.76 2rog h ALA 17 Cb 0.48 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 2rog h ALA 17 CO 0.00 -0.50 -0.31 0.28 0.00 0.00 0.00 179.25 178.73 2rog h VAL 18 N -0.52 0.35 0.00 0.00 2.07 -0.80 -0.55 116.25 116.80 2rog h VAL 18 Ca -0.02 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.42 2rog h VAL 18 Cb 0.39 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 2rog h VAL 18 CO 0.04 0.00 -0.35 0.74 0.02 0.00 0.00 177.57 178.02 2rog h THR 19 N -0.59 0.80 0.40 2.57 2.02 -1.23 0.32 112.91 117.20 2rog h THR 19 Ca 0.01 -1.49 -0.02 0.00 0.77 0.00 0.00 66.41 65.67 2rog h THR 19 Cb 0.57 1.94 0.00 0.00 -1.74 0.00 0.00 68.15 68.93 2rog h THR 19 CO -0.11 0.34 -0.19 0.50 0.37 0.00 0.00 175.52 176.43 2rog h LYS 20 N 0.00 -0.51 0.10 6.66 3.64 -0.47 -2.25 116.57 123.73 2rog h LYS 20 Ca -0.00 0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 2rog h LYS 20 Cb 0.91 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.85 2rog h LYS 20 CO 0.05 -0.20 -0.05 0.00 -2.27 0.00 0.00 179.45 176.97 2rog h ALA 21 N -0.48 -0.14 -0.34 5.00 0.00 -1.06 -2.96 119.26 119.27 2rog h ALA 21 Ca -0.05 -0.09 0.10 0.00 0.00 0.00 0.00 54.91 54.87 2rog h ALA 21 Cb 0.55 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2rog h ALA 21 CO 0.09 -0.51 0.31 -0.07 0.00 0.00 0.00 179.25 179.06 2rog h LEU 22 N -0.27 0.00 -1.74 0.00 3.38 -1.00 -1.98 115.31 113.70 2rog h LEU 22 Ca -0.01 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.00 2rog h LEU 22 Cb 0.22 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 2rog h LEU 22 CO 0.02 0.00 0.47 0.50 0.09 0.00 0.00 178.44 179.53 2rog h LYS 23 N 0.00 0.00 0.00 1.13 3.64 -1.22 -0.50 116.57 119.62 2rog h LYS 23 Ca 0.16 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 2rog h LYS 23 Cb 0.77 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.59 2rog h LYS 23 CO -0.00 0.00 0.00 0.36 -2.27 0.00 0.00 179.45 177.54 2rog n LYS 24 N -3.08 0.40 -1.60 1.90 2.85 -0.75 -4.88 118.16 113.00 2rog n LYS 24 Ca 0.02 0.00 -0.42 0.00 -1.05 0.00 0.00 58.31 56.86 2rog n LYS 24 Cb 0.56 -1.48 0.01 0.00 -0.65 0.00 0.00 35.03 33.47 2rog n LYS 24 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 177.40 178.68 2rog n VAL 25 N -0.98 2.30 0.00 0.58 0.24 -0.20 -4.99 118.33 115.28 2rog n VAL 25 Ca 0.09 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.89 2rog n VAL 25 Cb 0.04 -1.10 0.00 0.00 -1.47 0.00 0.00 33.84 31.31 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 0.29 0.00 -3.05 7.34 -0.04 -1.26 -4.65 135.00 133.62 2rog n PRO 26 Ca 0.09 0.00 -0.26 0.00 -0.04 0.00 0.00 63.50 63.29 2rog n PRO 26 Cb 0.38 -0.69 -0.05 0.00 -0.04 0.00 0.00 33.50 33.10 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 0.86 5.21 0.74 0.55 0.00 -1.26 -4.82 105.19 106.48 2rog n GLY 27 Ca 0.00 -2.65 -0.04 0.00 0.00 0.00 0.00 46.02 43.33 2rog n GLY 27 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2rog n VAL 28 N 0.03 1.16 0.00 1.61 0.31 -1.26 -3.29 118.33 116.89 2rog n VAL 28 Ca 0.30 0.24 0.00 0.00 -0.01 0.00 0.00 64.34 64.87 2rog n VAL 28 Cb 0.42 -1.79 0.00 0.00 -0.91 0.00 0.00 33.84 31.56 2rog n VAL 28 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2rog n GLU 29 N -3.72 0.00 -3.89 5.55 2.13 -1.26 -4.55 120.64 114.90 2rog n GLU 29 Ca -0.07 0.00 -0.30 0.00 0.66 0.00 0.00 57.16 57.45 2rog n GLU 29 Cb 0.25 -3.42 -0.16 0.00 0.27 0.00 0.00 31.44 28.39 2rog n GLU 29 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2rog s LYS 30 N 0.00 1.34 -0.05 5.31 1.02 -1.26 -5.08 119.74 121.02 2rog s LYS 30 Ca 0.00 -0.98 -0.02 0.00 0.02 0.00 0.00 55.97 54.99 2rog s LYS 30 Cb 0.00 -2.48 0.03 0.00 -0.52 0.00 0.00 37.83 34.86 2rog s LYS 30 CO 0.00 -0.68 0.07 0.54 -0.92 0.00 0.00 175.35 174.35 2rog s VAL 31 N 1.46 -0.11 0.03 3.17 0.11 -1.26 -1.61 120.40 122.18 2rog s VAL 31 Ca -0.02 0.39 0.09 0.00 -2.93 0.00 0.00 61.98 59.50 2rog s VAL 31 Cb -0.18 -0.18 -0.03 0.00 -1.53 0.00 0.00 36.38 34.45 2rog s VAL 31 CO -0.09 0.15 -0.25 -0.70 -3.33 0.00 0.00 175.10 170.88 2rog s GLU 32 N 2.17 1.92 0.00 1.54 2.12 -0.54 -4.98 118.70 120.93 2rog s GLU 32 Ca 0.05 -1.04 0.07 0.00 0.36 0.00 0.00 54.97 54.40 2rog s GLU 32 Cb -0.12 -2.04 -0.02 0.00 0.26 0.00 0.00 34.13 32.21 2rog s GLU 32 CO -0.04 0.53 -0.21 0.14 -0.54 0.00 0.00 175.26 175.15 2rog s VAL 33 N -0.79 1.63 -0.28 3.70 -7.23 -1.26 -0.82 120.40 115.35 2rog s VAL 33 Ca 0.12 -0.98 -0.22 0.00 -1.81 0.00 0.00 61.98 59.09 2rog s VAL 33 Cb -0.10 -1.37 -0.01 0.00 0.56 0.00 0.00 36.38 35.46 2rog s VAL 33 CO 0.02 0.38 0.71 -0.55 -0.31 0.00 0.00 175.10 175.35 2rog s SER 34 N -0.70 6.63 0.21 4.85 0.15 -0.67 -4.98 113.70 119.19 2rog s SER 34 Ca 0.08 0.70 -0.07 0.00 0.70 0.00 0.00 55.95 57.35 2rog s SER 34 Cb -0.08 -2.37 0.15 0.00 -1.71 0.00 0.00 66.02 62.00 2rog s SER 34 CO 0.00 -0.49 1.72 -0.07 1.20 0.00 0.00 173.24 175.60 2rog h LEU 35 N 9.18 1.04 -0.02 3.45 3.38 -2.00 -3.04 115.31 127.30 2rog h LEU 35 Ca -0.25 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.48 2rog h LEU 35 Cb 1.11 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.58 2rog h LEU 35 CO 0.83 1.02 -0.08 1.21 0.09 0.00 0.00 178.44 181.50 2rog n GLU 36 N -4.22 0.10 -1.78 1.13 2.13 -1.26 -4.81 120.64 111.93 2rog n GLU 36 Ca 0.05 -0.02 0.00 0.00 0.66 0.00 0.00 57.16 57.85 2rog n GLU 36 Cb 0.27 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.48 2rog n GLU 36 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2rog n LYS 37 N -1.44 1.83 -3.36 5.31 4.76 -1.15 -5.10 118.16 119.02 2rog n LYS 37 Ca 0.08 0.00 -0.26 0.00 -2.87 0.00 0.00 58.31 55.26 2rog n LYS 37 Cb 0.32 0.00 -0.08 0.00 -1.84 0.00 0.00 35.03 33.43 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 4.13 4.04 3.35 0.72 0.00 -1.26 -4.76 105.19 111.42 2rog n GLY 38 Ca 0.00 -2.31 -0.10 0.00 0.00 0.00 0.00 46.02 43.61 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 -1.93 1.13 0.04 1.61 -1.05 -1.26 -0.47 118.70 116.77 2rog s GLU 39 Ca 0.37 -0.93 -0.11 0.00 -0.15 0.00 0.00 54.97 54.15 2rog s GLU 39 Cb 0.15 0.43 0.01 0.00 -0.44 0.00 0.00 34.13 34.28 2rog s GLU 39 CO -0.06 -0.43 0.23 0.00 0.95 0.00 0.00 175.26 175.95 2rog s ALA 40 N -3.88 -0.48 -0.20 -0.84 0.00 -0.02 -1.67 121.76 114.67 2rog s ALA 40 Ca 0.09 -0.17 -0.01 0.00 0.00 0.00 0.00 51.96 51.87 2rog s ALA 40 Cb 0.02 0.29 0.01 0.00 0.00 0.00 0.00 23.12 23.44 2rog s ALA 40 CO -0.06 -0.38 -0.14 -0.51 0.00 0.00 0.00 175.76 174.67 2rog s LEU 41 N -2.06 2.45 -0.22 0.00 2.01 0.00 -0.66 118.68 120.20 2rog s LEU 41 Ca -0.05 -0.60 0.01 0.00 0.01 0.00 0.00 54.13 53.50 2rog s LEU 41 Cb -0.01 -1.57 0.05 0.00 0.01 0.00 0.00 46.19 44.67 2rog s LEU 41 CO -0.04 -0.02 -0.10 -0.69 1.01 0.00 0.00 176.35 176.52 2rog s VAL 42 N 1.35 1.72 -0.42 -1.59 1.01 -0.69 -1.47 120.40 120.30 2rog s VAL 42 Ca 0.05 -1.17 -0.11 0.00 0.00 0.00 0.00 61.98 60.75 2rog s VAL 42 Cb -0.14 -1.84 0.07 0.00 0.00 0.00 0.00 36.38 34.47 2rog s VAL 42 CO -0.09 0.08 0.28 -1.61 0.00 0.00 0.00 175.10 173.76 2rog s GLU 43 N 1.34 2.73 0.00 2.72 2.02 -0.64 -1.29 118.70 125.58 2rog s GLU 43 Ca -0.03 -1.37 0.00 0.00 0.02 0.00 0.00 54.97 53.58 2rog s GLU 43 Cb -0.17 -3.86 0.00 0.00 0.10 0.00 0.00 34.13 30.20 2rog s GLU 43 CO -0.07 -0.93 0.00 0.41 0.02 0.00 0.00 175.26 174.69 2rog n GLY 44 N 5.00 -0.97 0.04 -1.39 0.00 -1.26 -4.12 105.19 102.49 2rog n GLY 44 Ca -0.11 -1.09 0.13 0.00 0.00 0.00 0.00 46.02 44.95 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 -0.29 0.24 -1.62 2.61 -2.24 -1.21 -3.21 114.28 108.57 2rog n THR 45 Ca 0.00 -0.12 -0.47 0.00 -2.27 0.00 0.00 64.05 61.19 2rog n THR 45 Cb 0.00 -0.43 -0.03 0.00 -2.10 0.00 0.00 70.33 67.77 2rog n THR 45 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2rog n ALA 46 N -1.63 0.04 -1.77 6.98 0.00 -1.26 -4.93 120.51 117.94 2rog n ALA 46 Ca 0.06 0.43 -0.39 0.00 0.00 0.00 0.00 53.44 53.54 2rog n ALA 46 Cb 0.38 -2.13 -0.00 0.00 0.00 0.00 0.00 19.45 17.70 2rog n ALA 46 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2rog s ASP 47 N 0.05 6.24 0.34 0.00 1.01 -1.26 -4.95 116.67 118.10 2rog s ASP 47 Ca 0.69 2.63 0.08 0.00 0.71 0.00 0.00 52.55 56.66 2rog s ASP 47 Cb -0.75 -2.63 0.60 0.00 1.01 0.00 0.00 42.92 41.14 2rog s ASP 47 CO 0.52 -0.89 1.80 1.55 0.21 0.00 0.00 175.17 178.35 2rog h PRO 48 N 2.56 0.24 -0.08 8.23 0.13 -2.00 -2.62 132.00 138.45 2rog h PRO 48 Ca -0.50 -0.08 -0.01 0.00 -0.87 0.00 0.00 66.00 64.54 2rog h PRO 48 Cb 1.25 -0.02 -0.00 0.00 0.13 0.00 0.00 31.00 32.36 2rog h PRO 48 CO 0.62 0.51 0.03 0.87 -0.23 0.00 0.00 178.00 179.80 2rog h LYS 49 N 0.21 0.13 -0.26 0.86 1.79 -1.99 -1.81 116.57 115.50 2rog h LYS 49 Ca 0.03 -0.03 0.06 0.00 -2.18 0.00 0.00 60.65 58.53 2rog h LYS 49 Cb 0.62 -0.02 -0.05 0.00 -1.58 0.00 0.00 32.23 31.20 2rog h LYS 49 CO 0.04 0.28 -0.09 0.00 -1.08 0.00 0.00 179.45 178.60 2rog h ALA 50 N 0.85 0.14 0.12 3.86 0.00 -1.88 0.47 119.26 122.82 2rog h ALA 50 Ca 0.03 0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.05 2rog h ALA 50 Cb 0.20 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 2rog h ALA 50 CO -0.00 -0.49 -0.16 -0.07 0.00 0.00 0.00 179.25 178.53 2rog h LEU 51 N -0.03 -0.44 -0.29 0.00 3.38 -1.40 -0.24 115.31 116.28 2rog h LEU 51 Ca 0.13 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.15 2rog h LEU 51 Cb 0.23 0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 2rog h LEU 51 CO -0.29 -0.24 0.17 0.58 0.09 0.00 0.00 178.44 178.75 2rog h VAL 52 N -0.33 1.11 -0.16 1.22 2.07 -1.07 -1.84 116.25 117.25 2rog h VAL 52 Ca 0.01 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 2rog h VAL 52 Cb 0.33 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 2rog h VAL 52 CO -0.07 0.11 0.06 -0.61 0.02 0.00 0.00 177.57 177.09 2rog h GLN 53 N 0.37 0.22 0.05 1.57 5.75 -0.69 -1.51 115.11 120.87 2rog h GLN 53 Ca 0.10 -0.02 -0.00 0.00 -0.15 0.00 0.00 58.65 58.58 2rog h GLN 53 Cb 0.03 -0.05 0.00 0.00 1.07 0.00 0.00 27.48 28.54 2rog h GLN 53 CO -0.02 0.19 -0.02 0.00 -2.65 0.00 0.00 178.83 176.33 2rog h ALA 54 N 1.85 -0.07 -0.26 3.38 0.00 -0.55 -3.26 119.26 120.35 2rog h ALA 54 Ca 0.06 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 2rog h ALA 54 Cb 0.06 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2rog h ALA 54 CO -0.01 -0.26 0.06 -0.39 0.00 0.00 0.00 179.25 178.66 2rog h VAL 55 N -0.61 1.13 -0.00 0.00 -1.51 -0.97 -1.87 116.25 112.40 2rog h VAL 55 Ca -0.01 -0.43 0.00 0.00 -1.23 0.00 0.00 66.70 65.03 2rog h VAL 55 Cb 0.54 0.86 -0.00 0.00 -2.13 0.00 0.00 31.29 30.56 2rog h VAL 55 CO 0.01 0.16 0.04 -0.08 -1.23 0.00 0.00 177.57 176.47 2rog h GLU 56 N 0.36 0.00 0.00 5.19 4.22 -1.33 -2.07 114.58 120.95 2rog h GLU 56 Ca 0.09 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.53 2rog h GLU 56 Cb 0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.39 2rog h GLU 56 CO -0.00 0.00 0.00 0.93 -2.18 0.00 0.00 179.01 177.76 2rog h GLU 57 N 0.00 0.00 0.00 1.92 5.08 -1.42 -3.36 114.58 116.80 2rog h GLU 57 Ca 0.00 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.17 2rog h GLU 57 Cb 0.08 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.30 2rog h GLU 57 CO -0.00 0.00 -1.13 0.39 -1.00 0.00 0.00 179.01 177.27 2rog n GLU 58 N -2.56 0.54 0.00 2.33 4.71 -0.78 -5.02 120.64 119.87 2rog n GLU 58 Ca 0.03 0.56 0.00 0.00 -0.01 0.00 0.00 57.16 57.74 2rog n GLU 58 Cb 0.34 -1.73 0.00 0.00 -1.01 0.00 0.00 31.44 29.03 2rog n GLU 58 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2rog n GLY 59 N 1.47 0.00 3.36 0.62 0.00 -1.25 -5.18 105.19 104.20 2rog n GLY 59 Ca -0.27 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.55 2rog n GLY 59 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2rog s TYR 60 N 0.00 1.63 0.32 1.61 -0.85 -1.26 -4.78 117.35 114.02 2rog s TYR 60 Ca 0.00 -1.32 0.10 0.00 -0.52 0.00 0.00 57.07 55.33 2rog s TYR 60 Cb 0.00 -0.91 -0.06 0.00 0.38 0.00 0.00 41.96 41.37 2rog s TYR 60 CO 0.00 -0.45 -0.12 0.21 -1.52 0.00 0.00 175.55 173.67 2rog s LYS 61 N -3.84 1.76 0.20 -3.49 2.20 -0.61 -4.09 119.74 111.87 2rog s LYS 61 Ca 0.35 -1.88 -0.15 0.00 -0.36 0.00 0.00 55.97 53.92 2rog s LYS 61 Cb 0.05 -1.68 0.02 0.00 -1.51 0.00 0.00 37.83 34.71 2rog s LYS 61 CO 0.17 0.18 0.48 0.00 -0.36 0.00 0.00 175.35 175.82 2rog s ALA 62 N -2.61 -0.67 0.05 3.13 0.00 -1.26 -0.55 121.76 119.84 2rog s ALA 62 Ca 0.32 -0.45 -0.11 0.00 0.00 0.00 0.00 51.96 51.72 2rog s ALA 62 Cb 0.01 0.88 0.01 0.00 0.00 0.00 0.00 23.12 24.02 2rog s ALA 62 CO 0.16 -0.79 0.22 -1.21 0.00 0.00 0.00 175.76 174.14 2rog s GLU 63 N -3.91 0.74 -0.02 0.00 2.02 -0.57 -4.95 118.70 111.99 2rog s GLU 63 Ca 0.13 -0.62 0.04 0.00 0.02 0.00 0.00 54.97 54.54 2rog s GLU 63 Cb -0.00 0.31 -0.01 0.00 0.10 0.00 0.00 34.13 34.53 2rog s GLU 63 CO -0.00 -0.22 -0.15 0.08 0.02 0.00 0.00 175.26 174.99 2rog s VAL 64 N -2.67 1.22 -0.41 2.63 1.01 -1.26 -1.03 120.40 119.89 2rog s VAL 64 Ca -0.04 -0.63 -0.20 0.00 0.00 0.00 0.00 61.98 61.10 2rog s VAL 64 Cb -0.01 -1.04 0.02 0.00 0.00 0.00 0.00 36.38 35.35 2rog s VAL 64 CO -0.04 0.35 0.61 -0.22 0.00 0.00 0.00 175.10 175.80 2rog s LEU 65 N -0.14 4.45 0.00 3.92 0.20 -0.00 -5.01 118.68 122.09 2rog s LEU 65 Ca 0.01 -0.22 0.03 0.00 0.69 0.00 0.00 54.13 54.65 2rog s LEU 65 Cb -0.08 -2.70 0.21 0.00 -0.43 0.00 0.00 46.19 43.19 2rog s LEU 65 CO 0.00 -0.69 0.69 0.00 -0.29 0.00 0.00 176.35 176.06