#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 3.07 -0.07 4.03 2.01 -0.12 -4.99 118.68 122.60 2rog s LEU 2 Ca 0.00 -0.94 -0.00 0.00 0.01 0.00 0.00 54.13 53.20 2rog s LEU 2 Cb 0.00 -1.46 0.02 0.00 0.01 0.00 0.00 46.19 44.76 2rog s LEU 2 CO 0.00 -0.28 -0.03 -1.59 1.01 0.00 0.00 176.35 175.46 2rog s LYS 3 N -3.77 0.87 -0.39 1.70 -2.85 -1.26 -0.76 119.74 113.28 2rog s LYS 3 Ca 0.36 -0.04 -0.16 0.00 -1.00 0.00 0.00 55.97 55.13 2rog s LYS 3 Cb -0.00 -1.05 0.01 0.00 -2.06 0.00 0.00 37.83 34.73 2rog s LYS 3 CO 0.20 -0.22 0.40 -1.17 0.10 0.00 0.00 175.35 174.67 2rog s LEU 4 N 1.56 4.75 -0.02 2.77 2.96 -0.30 -2.19 118.68 128.22 2rog s LEU 4 Ca -0.01 -0.55 -0.20 0.00 -0.22 0.00 0.00 54.13 53.16 2rog s LEU 4 Cb -0.13 -2.35 -0.05 0.00 0.50 0.00 0.00 46.19 44.15 2rog s LEU 4 CO -0.04 -0.49 0.56 -1.59 -1.32 0.00 0.00 176.35 173.47 2rog s LYS 5 N 2.06 4.28 0.23 1.98 -2.85 0.13 -1.24 119.74 124.34 2rog s LYS 5 Ca 0.11 0.67 0.04 0.00 -1.00 0.00 0.00 55.97 55.80 2rog s LYS 5 Cb -0.17 -3.34 -0.05 0.00 -2.06 0.00 0.00 37.83 32.21 2rog s LYS 5 CO 0.13 0.38 -0.03 0.54 0.10 0.00 0.00 175.35 176.47 2rog s VAL 6 N -0.19 1.19 -0.10 1.79 0.11 0.20 -1.57 120.40 121.83 2rog s VAL 6 Ca 0.30 -2.06 -0.09 0.00 -2.93 0.00 0.00 61.98 57.20 2rog s VAL 6 Cb -0.18 -2.31 0.03 0.00 -1.53 0.00 0.00 36.38 32.39 2rog s VAL 6 CO 0.16 -0.37 0.26 -0.70 -3.33 0.00 0.00 175.10 171.12 2rog s GLU 7 N -3.82 0.30 0.00 1.54 2.56 0.33 -4.42 118.70 115.19 2rog s GLU 7 Ca 0.27 0.37 0.00 0.00 0.00 0.00 0.00 54.97 55.62 2rog s GLU 7 Cb 0.05 0.13 0.00 0.00 2.00 0.00 0.00 34.13 36.31 2rog s GLU 7 CO 0.08 -0.04 0.00 0.41 -0.56 0.00 0.00 175.26 175.15 2rog n GLY 8 N 3.03 -0.60 3.72 -1.50 0.00 -1.26 -1.67 105.19 106.91 2rog n GLY 8 Ca -0.14 -0.64 -0.32 0.00 0.00 0.00 0.00 46.02 44.92 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 -1.20 1.76 0.00 1.61 -1.94 -1.26 -5.01 119.30 113.26 2rog s MET 9 Ca 0.00 1.54 0.00 0.00 -1.71 0.00 0.00 55.69 55.52 2rog s MET 9 Cb 0.00 -1.81 0.00 0.00 2.01 0.00 0.00 34.83 35.03 2rog s MET 9 CO 0.00 -2.08 0.47 2.41 -0.01 0.00 0.00 175.02 175.81 2rog n THR 10 N -3.46 0.00 -3.74 2.05 -1.04 -1.26 -4.92 114.28 101.90 2rog n THR 10 Ca 0.12 0.97 -0.12 0.00 -2.04 0.00 0.00 64.05 62.97 2rog n THR 10 Cb 0.52 -1.91 -0.13 0.00 -1.82 0.00 0.00 70.33 66.99 2rog n THR 10 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2rog n ASN 12 N 3.91 -0.53 0.13 0.00 2.85 -1.26 -5.01 115.26 115.35 2rog n ASN 12 Ca -0.22 -1.22 0.07 0.00 -0.11 0.00 0.00 54.58 53.10 2rog n ASN 12 Cb 0.54 0.84 0.40 0.00 1.24 0.00 0.00 39.78 42.81 2rog n ASN 12 CO 0.00 0.00 0.00 1.41 -2.11 0.00 0.00 177.26 176.56 2rog n HIS 13 N -0.28 0.50 -0.04 1.20 8.25 -1.26 -2.71 115.22 120.88 2rog n HIS 13 Ca 0.00 0.26 0.23 0.00 -0.26 0.00 0.00 57.72 57.96 2rog n HIS 13 Cb 0.20 -0.83 0.72 0.00 1.12 0.00 0.00 29.99 31.20 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 0.00 0.86 -0.77 0.00 2.07 -1.95 0.28 116.25 116.74 2rog h VAL 15 Ca 0.30 -0.27 -0.04 0.00 0.82 0.00 0.00 66.70 67.51 2rog h VAL 15 Cb 1.28 0.02 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 2rog h VAL 15 CO -0.00 0.14 0.33 0.24 0.02 0.00 0.00 177.57 178.29 2rog h MET 16 N 0.77 1.15 0.20 1.57 2.86 -1.52 0.06 114.93 120.03 2rog h MET 16 Ca 0.43 -0.20 -0.01 0.00 -2.06 0.00 0.00 59.70 57.86 2rog h MET 16 Cb 0.46 -0.19 0.00 0.00 0.06 0.00 0.00 31.60 31.93 2rog h MET 16 CO -0.28 0.92 -0.10 0.00 1.06 0.00 0.00 176.91 178.51 2rog h ALA 17 N 1.17 -0.27 -0.50 6.32 0.00 -1.18 -1.69 119.26 123.10 2rog h ALA 17 Ca 0.26 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 2rog h ALA 17 Cb 0.19 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2rog h ALA 17 CO -0.02 -0.50 -0.10 -0.39 0.00 0.00 0.00 179.25 178.24 2rog h VAL 18 N -0.58 1.27 -0.66 0.00 -1.51 -0.97 -1.33 116.25 112.47 2rog h VAL 18 Ca -0.03 -1.23 0.02 0.00 -1.23 0.00 0.00 66.70 64.23 2rog h VAL 18 Cb 0.43 1.03 -0.04 0.00 -2.13 0.00 0.00 31.29 30.58 2rog h VAL 18 CO 0.05 0.43 0.43 0.74 -1.23 0.00 0.00 177.57 177.98 2rog h THR 19 N 0.81 1.13 -0.58 7.19 2.02 -1.01 0.24 112.91 122.71 2rog h THR 19 Ca 0.13 -0.29 -0.06 0.00 0.77 0.00 0.00 66.41 66.96 2rog h THR 19 Cb 0.65 0.20 -0.03 0.00 -1.74 0.00 0.00 68.15 67.24 2rog h THR 19 CO 0.04 0.16 0.12 0.50 0.37 0.00 0.00 175.52 176.71 2rog h LYS 20 N 0.85 0.92 -0.19 6.66 3.64 -1.02 -2.70 116.57 124.74 2rog h LYS 20 Ca 0.25 -0.21 -0.08 0.00 -1.27 0.00 0.00 60.65 59.34 2rog h LYS 20 Cb -0.04 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 31.65 2rog h LYS 20 CO -0.08 0.84 -0.21 0.00 -2.27 0.00 0.00 179.45 177.73 2rog h ALA 21 N 1.25 0.28 -0.86 5.00 0.00 -0.36 -3.12 119.26 121.45 2rog h ALA 21 Ca 0.18 -0.36 0.22 0.00 0.00 0.00 0.00 54.91 54.96 2rog h ALA 21 Cb 0.35 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.04 2rog h ALA 21 CO 0.00 0.22 0.59 -0.07 0.00 0.00 0.00 179.25 180.00 2rog h LEU 22 N 0.13 0.19 -1.97 0.00 4.07 -0.39 -1.48 115.31 115.86 2rog h LEU 22 Ca 0.03 0.02 0.07 0.00 0.08 0.00 0.00 57.88 58.07 2rog h LEU 22 Cb 0.76 -0.01 -0.01 0.00 1.08 0.00 0.00 40.66 42.48 2rog h LEU 22 CO 0.05 0.07 0.40 0.50 -1.08 0.00 0.00 178.44 178.38 2rog h LYS 23 N 0.18 0.00 0.00 1.13 1.63 -1.42 -2.75 116.57 115.35 2rog h LYS 23 Ca 0.43 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.23 2rog h LYS 23 Cb 1.39 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.02 2rog h LYS 23 CO -0.09 0.00 0.12 0.36 -3.45 0.00 0.00 179.45 176.39 2rog n LYS 24 N -3.35 0.06 -1.38 1.90 2.85 -0.56 -4.78 118.16 112.91 2rog n LYS 24 Ca 0.03 0.52 -0.36 0.00 -1.05 0.00 0.00 58.31 57.44 2rog n LYS 24 Cb 0.51 -1.83 0.07 0.00 -0.65 0.00 0.00 35.03 33.14 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 -1.82 2.57 0.54 0.58 0.24 -1.04 -4.86 118.33 114.54 2rog n VAL 25 Ca -0.01 -0.41 -0.02 0.00 -2.04 0.00 0.00 64.34 61.86 2rog n VAL 25 Cb 0.13 -0.95 0.01 0.00 -1.47 0.00 0.00 33.84 31.57 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 -1.19 1.08 -0.46 7.34 -0.04 -1.26 -4.74 135.00 135.74 2rog n PRO 26 Ca 0.12 -0.19 0.00 0.00 -0.04 0.00 0.00 63.50 63.39 2rog n PRO 26 Cb 0.49 -1.08 0.00 0.00 -0.04 0.00 0.00 33.50 32.88 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 0.61 -0.98 0.04 0.55 0.00 -1.26 -5.05 105.19 99.11 2rog n GLY 27 Ca 0.04 -0.61 -0.05 0.00 0.00 0.00 0.00 46.02 45.40 2rog n GLY 27 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2rog n VAL 28 N 0.12 0.52 0.00 1.61 3.14 -1.26 -4.68 118.33 117.77 2rog n VAL 28 Ca 0.00 -0.24 0.00 0.00 -2.96 0.00 0.00 64.34 61.14 2rog n VAL 28 Cb 0.00 -0.82 0.00 0.00 -1.06 0.00 0.00 33.84 31.96 2rog n VAL 28 CO 0.00 0.00 0.00 1.21 -6.46 0.00 0.00 176.83 171.58 2rog n GLU 29 N -2.58 0.00 -3.57 1.45 4.07 -1.26 -4.64 120.64 114.12 2rog n GLU 29 Ca -0.15 0.00 -0.41 0.00 -0.06 0.00 0.00 57.16 56.54 2rog n GLU 29 Cb 0.70 -0.62 -0.10 0.00 -0.06 0.00 0.00 31.44 31.36 2rog n GLU 29 CO 0.00 0.00 0.00 0.21 -0.06 0.00 0.00 177.13 177.28 2rog s LYS 30 N 0.00 2.74 -0.07 5.31 2.36 -1.25 -5.04 119.74 123.78 2rog s LYS 30 Ca 0.00 -1.32 -0.11 0.00 -2.55 0.00 0.00 55.97 51.99 2rog s LYS 30 Cb 0.00 -3.82 0.02 0.00 -1.05 0.00 0.00 37.83 32.98 2rog s LYS 30 CO 0.00 -0.89 0.28 0.54 1.55 0.00 0.00 175.35 176.83 2rog s VAL 31 N 1.50 0.03 -0.05 4.02 0.11 -1.26 -1.53 120.40 123.22 2rog s VAL 31 Ca 0.03 -0.22 -0.05 0.00 -2.93 0.00 0.00 61.98 58.81 2rog s VAL 31 Cb -0.22 -0.47 0.01 0.00 -1.53 0.00 0.00 36.38 34.17 2rog s VAL 31 CO 0.04 -0.12 0.13 -0.70 -3.33 0.00 0.00 175.10 171.12 2rog s GLU 32 N -0.46 0.18 0.00 1.54 2.12 -0.17 -4.98 118.70 116.93 2rog s GLU 32 Ca -0.06 0.14 0.04 0.00 0.36 0.00 0.00 54.97 55.46 2rog s GLU 32 Cb -0.04 0.08 -0.01 0.00 0.26 0.00 0.00 34.13 34.42 2rog s GLU 32 CO 0.02 -0.02 -0.14 0.08 -0.54 0.00 0.00 175.26 174.65 2rog s VAL 33 N -0.04 1.10 -0.06 3.70 1.01 -1.26 -0.57 120.40 124.28 2rog s VAL 33 Ca -0.01 -0.71 -0.21 0.00 0.00 0.00 0.00 61.98 61.05 2rog s VAL 33 Cb -0.01 -0.94 -0.04 0.00 0.00 0.00 0.00 36.38 35.38 2rog s VAL 33 CO 0.00 0.22 0.59 -0.44 0.00 0.00 0.00 175.10 175.48 2rog s SER 34 N -0.56 6.88 -0.03 3.32 0.01 -0.34 -4.99 113.70 118.01 2rog s SER 34 Ca 0.04 1.06 -0.25 0.00 1.31 0.00 0.00 55.95 58.11 2rog s SER 34 Cb -0.06 -2.35 -0.20 0.00 0.21 0.00 0.00 66.02 63.61 2rog s SER 34 CO 0.00 -0.00 1.17 -0.07 0.41 0.00 0.00 173.24 174.75 2rog h LEU 35 N 6.37 0.15 -0.00 2.44 4.07 -1.95 -3.33 115.31 123.05 2rog h LEU 35 Ca -0.42 -0.61 0.00 0.00 0.08 0.00 0.00 57.88 56.93 2rog h LEU 35 Cb 1.19 -0.04 0.00 0.00 1.08 0.00 0.00 40.66 42.89 2rog h LEU 35 CO 0.73 0.73 -0.12 -0.62 -1.08 0.00 0.00 178.44 178.08 2rog n GLU 36 N -4.67 0.01 -4.18 1.13 4.71 -1.26 -4.45 120.64 111.94 2rog n GLU 36 Ca -0.08 -0.00 -0.11 0.00 -0.01 0.00 0.00 57.16 56.95 2rog n GLU 36 Cb 0.36 -1.50 -0.10 0.00 -1.01 0.00 0.00 31.44 29.19 2rog n GLU 36 CO 0.00 0.00 0.00 0.15 0.09 0.00 0.00 177.13 177.37 2rog s LYS 37 N -2.99 0.86 -1.44 3.49 1.02 -1.25 -4.93 119.74 114.49 2rog s LYS 37 Ca 0.14 -1.33 -0.07 0.00 0.02 0.00 0.00 55.97 54.72 2rog s LYS 37 Cb 0.19 -0.27 0.02 0.00 -0.52 0.00 0.00 37.83 37.25 2rog s LYS 37 CO 0.57 -0.00 2.66 0.41 -0.92 0.00 0.00 175.35 178.07 2rog n GLY 38 N -0.01 4.77 3.17 -3.33 0.00 -1.26 -4.36 105.19 104.17 2rog n GLY 38 Ca -0.12 -1.80 -0.13 0.00 0.00 0.00 0.00 46.02 43.97 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 0.32 0.33 0.05 1.61 2.12 -1.26 -0.63 118.70 121.25 2rog s GLU 39 Ca 0.61 0.43 0.00 0.00 0.36 0.00 0.00 54.97 56.38 2rog s GLU 39 Cb 0.19 0.13 -0.03 0.00 0.26 0.00 0.00 34.13 34.67 2rog s GLU 39 CO -0.08 -0.06 -0.04 0.00 -0.54 0.00 0.00 175.26 174.54 2rog s ALA 40 N 0.32 0.50 0.01 6.30 0.00 -0.37 -1.19 121.76 127.32 2rog s ALA 40 Ca -0.01 -0.99 0.07 0.00 0.00 0.00 0.00 51.96 51.02 2rog s ALA 40 Cb -0.03 0.18 -0.03 0.00 0.00 0.00 0.00 23.12 23.24 2rog s ALA 40 CO -0.01 -0.23 -0.20 -0.51 0.00 0.00 0.00 175.76 174.81 2rog s LEU 41 N -2.32 2.44 -0.02 0.00 2.01 0.27 -1.15 118.68 119.91 2rog s LEU 41 Ca -0.01 -0.41 0.00 0.00 0.01 0.00 0.00 54.13 53.72 2rog s LEU 41 Cb -0.00 -1.45 0.02 0.00 0.01 0.00 0.00 46.19 44.77 2rog s LEU 41 CO -0.05 0.29 0.00 -0.69 1.01 0.00 0.00 176.35 176.92 2rog s VAL 42 N -0.79 0.12 -0.27 -1.59 1.01 0.06 -1.00 120.40 117.95 2rog s VAL 42 Ca 0.12 0.09 -0.00 0.00 0.00 0.00 0.00 61.98 62.19 2rog s VAL 42 Cb -0.10 -0.21 0.08 0.00 0.00 0.00 0.00 36.38 36.14 2rog s VAL 42 CO 0.02 0.12 0.03 -1.61 0.00 0.00 0.00 175.10 173.66 2rog s GLU 43 N 0.88 1.10 0.00 2.72 2.02 -0.58 -0.95 118.70 123.89 2rog s GLU 43 Ca -0.08 -1.01 0.00 0.00 0.02 0.00 0.00 54.97 53.89 2rog s GLU 43 Cb -0.12 -2.36 0.00 0.00 0.10 0.00 0.00 34.13 31.75 2rog s GLU 43 CO -0.02 -0.78 0.00 0.41 0.02 0.00 0.00 175.26 174.89 2rog n GLY 44 N 4.75 -0.10 0.15 -1.39 0.00 -1.26 -3.91 105.19 103.43 2rog n GLY 44 Ca -0.06 -1.19 0.13 0.00 0.00 0.00 0.00 46.02 44.90 2rog n GLY 44 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2rog n THR 45 N 9.00 0.00 -1.67 2.61 5.66 -1.26 -4.49 114.28 124.13 2rog n THR 45 Ca 0.00 -0.08 -0.51 0.00 -3.05 0.00 0.00 64.05 60.40 2rog n THR 45 Cb 0.00 0.28 -0.06 0.00 -1.55 0.00 0.00 70.33 69.00 2rog n THR 45 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2rog n ALA 46 N -0.95 0.29 -1.55 1.79 0.00 -1.26 -4.95 120.51 113.88 2rog n ALA 46 Ca 0.10 0.39 -0.34 0.00 0.00 0.00 0.00 53.44 53.59 2rog n ALA 46 Cb 0.34 -2.31 0.04 0.00 0.00 0.00 0.00 19.45 17.52 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 2.69 5.11 -0.00 0.00 1.01 -1.26 -4.99 116.67 119.22 2rog s ASP 47 Ca 0.90 2.09 -0.22 0.00 0.71 0.00 0.00 52.55 56.04 2rog s ASP 47 Cb -0.86 -2.56 -0.19 0.00 1.01 0.00 0.00 42.92 40.32 2rog s ASP 47 CO 0.53 -1.63 1.18 1.55 0.21 0.00 0.00 175.17 177.01 2rog h PRO 48 N 0.24 0.29 -0.13 8.23 0.13 -2.01 -3.18 132.00 135.57 2rog h PRO 48 Ca -0.48 -0.23 0.04 0.00 -0.87 0.00 0.00 66.00 64.46 2rog h PRO 48 Cb 1.26 0.04 -0.01 0.00 0.13 0.00 0.00 31.00 32.43 2rog h PRO 48 CO 0.54 0.87 0.10 0.87 -0.23 0.00 0.00 178.00 180.15 2rog h LYS 49 N -0.22 0.00 0.09 0.86 1.79 -1.98 0.31 116.57 117.42 2rog h LYS 49 Ca -0.01 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.45 2rog h LYS 49 Cb 0.91 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.56 2rog h LYS 49 CO 0.05 0.00 -0.05 0.00 -1.08 0.00 0.00 179.45 178.38 2rog h ALA 50 N 1.91 -0.13 -0.52 3.86 0.00 -1.95 -1.71 119.26 120.73 2rog h ALA 50 Ca 0.06 -0.13 -0.11 0.00 0.00 0.00 0.00 54.91 54.73 2rog h ALA 50 Cb 0.27 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2rog h ALA 50 CO -0.00 -0.46 -0.10 -0.07 0.00 0.00 0.00 179.25 178.62 2rog h LEU 51 N -0.35 0.98 -0.03 0.00 4.07 -1.37 -0.26 115.31 118.35 2rog h LEU 51 Ca -0.01 -0.35 0.03 0.00 0.08 0.00 0.00 57.88 57.62 2rog h LEU 51 Cb 0.30 -0.27 -0.03 0.00 1.08 0.00 0.00 40.66 41.74 2rog h LEU 51 CO 0.02 1.11 -0.13 0.58 -1.08 0.00 0.00 178.44 178.94 2rog h VAL 52 N 0.85 0.67 -0.03 1.22 2.07 -0.94 -0.29 116.25 119.80 2rog h VAL 52 Ca 0.13 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.59 2rog h VAL 52 Cb 0.66 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 2rog h VAL 52 CO 0.05 0.00 -0.29 1.56 0.02 0.00 0.00 177.57 178.91 2rog h GLN 53 N -0.20 0.05 -0.25 1.57 7.50 -1.19 0.95 115.11 123.54 2rog h GLN 53 Ca 0.06 -0.02 -0.08 0.00 0.50 0.00 0.00 58.65 59.11 2rog h GLN 53 Cb 0.28 -0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.79 2rog h GLN 53 CO -0.15 0.34 -0.18 0.00 -1.50 0.00 0.00 178.83 177.33 2rog h ALA 54 N 1.67 1.23 0.04 3.87 0.00 0.13 -1.28 119.26 124.91 2rog h ALA 54 Ca 0.01 -0.29 -0.30 0.00 0.00 0.00 0.00 54.91 54.32 2rog h ALA 54 Cb 0.54 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 2rog h ALA 54 CO 0.04 0.50 -1.67 -0.39 0.00 0.00 0.00 179.25 177.73 2rog h VAL 55 N 0.40 0.93 -0.04 0.00 -1.51 -0.62 -3.36 116.25 112.05 2rog h VAL 55 Ca 0.07 -2.72 -0.05 0.00 -1.23 0.00 0.00 66.70 62.76 2rog h VAL 55 Cb 0.55 2.52 -0.01 0.00 -2.13 0.00 0.00 31.29 32.23 2rog h VAL 55 CO 0.04 0.65 -0.22 -0.08 -1.23 0.00 0.00 177.57 176.73 2rog h GLU 56 N 0.02 0.06 0.00 5.19 4.81 -0.66 -0.82 114.58 123.19 2rog h GLU 56 Ca -0.28 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.94 2rog h GLU 56 Cb 1.99 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 31.37 2rog h GLU 56 CO 0.10 0.29 0.00 1.05 -0.73 0.00 0.00 179.01 179.71 2rog h GLU 57 N 0.06 0.00 -0.25 1.92 4.11 -1.38 -0.97 114.58 118.07 2rog h GLU 57 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.44 2rog h GLU 57 Cb 0.43 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.68 2rog h GLU 57 CO 0.03 0.00 0.00 0.39 0.07 0.00 0.00 179.01 179.50 2rog n GLU 58 N -3.02 2.30 -0.46 1.06 -0.58 -0.41 -4.96 120.64 114.57 2rog n GLU 58 Ca 0.00 -1.94 0.00 0.00 -0.42 0.00 0.00 57.16 54.81 2rog n GLU 58 Cb 0.26 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 29.65 2rog n GLU 58 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2rog n GLY 59 N 1.39 1.39 3.78 0.62 0.00 -0.37 -5.06 105.19 106.95 2rog n GLY 59 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 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 -3.20 2.65 -0.12 1.61 1.51 -0.61 -4.91 117.35 114.28 2rog s TYR 60 Ca 0.00 1.08 0.02 0.00 -1.01 0.00 0.00 57.07 57.16 2rog s TYR 60 Cb 0.00 -3.20 -0.00 0.00 -0.11 0.00 0.00 41.96 38.64 2rog s TYR 60 CO 0.00 -2.06 -0.19 0.15 -1.11 0.00 0.00 175.55 172.34 2rog s LYS 61 N -5.15 3.17 0.10 -0.62 1.02 -0.67 -3.66 119.74 113.93 2rog s LYS 61 Ca 0.62 -0.80 -0.09 0.00 0.02 0.00 0.00 55.97 55.72 2rog s LYS 61 Cb -0.15 -2.45 0.00 0.00 -0.52 0.00 0.00 37.83 34.71 2rog s LYS 61 CO 0.54 0.16 0.21 0.00 -0.92 0.00 0.00 175.35 175.35 2rog s ALA 62 N 0.42 -0.27 0.17 5.17 0.00 -1.26 -0.52 121.76 125.47 2rog s ALA 62 Ca -0.14 -0.59 -0.15 0.00 0.00 0.00 0.00 51.96 51.08 2rog s ALA 62 Cb -0.17 0.53 0.02 0.00 0.00 0.00 0.00 23.12 23.50 2rog s ALA 62 CO 0.06 -0.53 0.44 -2.00 0.00 0.00 0.00 175.76 173.73 2rog s GLU 63 N -3.86 1.25 0.19 0.00 2.12 -0.60 -4.86 118.70 112.93 2rog s GLU 63 Ca 0.06 -0.90 0.09 0.00 0.36 0.00 0.00 54.97 54.58 2rog s GLU 63 Cb 0.04 0.47 -0.04 0.00 0.26 0.00 0.00 34.13 34.87 2rog s GLU 63 CO -0.10 -0.51 -0.12 0.14 -0.54 0.00 0.00 175.26 174.13 2rog s VAL 64 N -3.88 3.03 -0.28 3.70 -7.23 -1.26 -0.69 120.40 113.79 2rog s VAL 64 Ca 0.09 -1.76 0.03 0.00 -1.81 0.00 0.00 61.98 58.53 2rog s VAL 64 Cb 0.01 -2.50 0.07 0.00 0.56 0.00 0.00 36.38 34.51 2rog s VAL 64 CO -0.04 -0.13 -0.07 -0.22 -0.31 0.00 0.00 175.10 174.33 2rog s LEU 65 N -2.85 3.74 0.00 1.32 1.98 -0.93 -4.96 118.68 116.98 2rog s LEU 65 Ca 0.25 -1.53 0.31 0.00 -2.89 0.00 0.00 54.13 50.27 2rog s LEU 65 Cb -0.08 -1.58 1.77 0.00 0.66 0.00 0.00 46.19 46.95 2rog s LEU 65 CO 0.14 -0.23 2.15 0.00 -1.89 0.00 0.00 176.35 176.52