#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1msg s SER 2 N 0.00 6.31 -0.97 0.00 1.04 -1.26 -5.00 113.70 113.82 1msg s SER 2 Ca 0.00 0.70 -0.22 0.00 0.48 0.00 0.00 55.95 56.90 1msg s SER 2 Cb 0.00 -2.14 0.06 0.00 0.10 0.00 0.00 66.02 64.04 1msg s SER 2 CO 0.00 -0.39 1.36 -0.69 0.98 0.00 0.00 173.24 174.50 1msg s VAL 3 N -2.44 4.07 0.46 5.02 1.01 -1.26 -4.98 120.40 122.28 1msg s VAL 3 Ca 0.44 -0.82 0.08 0.00 0.00 0.00 0.00 61.98 61.68 1msg s VAL 3 Cb -0.10 -4.98 0.00 0.00 0.00 0.00 0.00 36.38 31.30 1msg s VAL 3 CO 0.38 -1.84 0.45 0.00 0.00 0.00 0.00 175.10 174.10 1msg s ALA 4 N 4.56 4.25 -0.98 5.51 0.00 -1.26 -5.03 121.76 128.82 1msg s ALA 4 Ca 0.42 -1.79 -0.03 0.00 0.00 0.00 0.00 51.96 50.56 1msg s ALA 4 Cb -0.02 -1.09 0.25 0.00 0.00 0.00 0.00 23.12 22.26 1msg s ALA 4 CO -0.07 -0.34 2.12 0.25 0.00 0.00 0.00 175.76 177.71 1msg n THR 5 N -1.70 5.01 -3.07 0.00 -2.24 -1.26 -4.74 114.28 106.28 1msg n THR 5 Ca 0.05 -4.86 0.02 0.00 -2.27 0.00 0.00 64.05 56.98 1msg n THR 5 Cb 0.62 -1.60 -0.00 0.00 -2.10 0.00 0.00 70.33 67.24 1msg n THR 5 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1msg s GLU 6 N -3.25 0.55 -0.08 -0.78 -1.05 -1.26 -4.28 118.70 108.54 1msg s GLU 6 Ca 0.48 -0.06 -0.07 0.00 -0.15 0.00 0.00 54.97 55.16 1msg s GLU 6 Cb 0.27 0.09 -0.04 0.00 -0.44 0.00 0.00 34.13 34.01 1msg s GLU 6 CO -0.20 -0.83 -0.17 1.28 0.95 0.00 0.00 175.26 176.29 1msg n LEU 7 N 4.40 1.20 -0.23 1.83 7.99 -1.26 -4.67 117.00 126.26 1msg n LEU 7 Ca 0.09 0.19 -0.01 0.00 -0.01 0.00 0.00 56.01 56.27 1msg n LEU 7 Cb 0.58 -0.45 0.06 0.00 -0.11 0.00 0.00 43.42 43.50 1msg n LEU 7 CO -0.05 -0.10 0.71 0.03 -1.51 0.00 0.00 177.39 176.47 1msg h ARG 8 N -0.47 -0.03 -7.05 3.23 2.47 -1.96 -3.41 114.38 107.16 1msg h ARG 8 Ca -0.18 0.00 -0.50 0.00 -1.26 0.00 0.00 59.98 58.05 1msg h ARG 8 Cb 0.91 0.01 0.21 0.00 -1.65 0.00 0.00 29.97 29.44 1msg h ARG 8 CO -0.11 -0.02 -0.17 0.00 0.56 0.00 0.00 179.97 180.23 1msg n GLN 10 N -3.53 1.73 -0.42 0.00 6.02 -1.26 -5.05 117.38 114.87 1msg n GLN 10 Ca 0.07 -0.05 -0.16 0.00 -0.01 0.00 0.00 57.00 56.85 1msg n GLN 10 Cb 0.54 -1.21 -0.02 0.00 1.02 0.00 0.00 30.24 30.57 1msg n GLN 10 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1msg h LEU 12 N 0.81 -0.13 -4.12 0.00 3.38 -1.89 -3.46 115.31 109.92 1msg h LEU 12 Ca -0.14 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.75 1msg h LEU 12 Cb 0.40 0.03 -0.07 0.00 0.09 0.00 0.00 40.66 41.11 1msg h LEU 12 CO 0.18 -0.01 -0.08 0.00 0.09 0.00 0.00 178.44 178.62 1msg n GLN 13 N -2.85 0.56 -1.61 1.13 6.02 -1.26 -5.02 117.38 114.35 1msg n GLN 13 Ca -0.02 -0.64 0.00 0.00 -0.01 0.00 0.00 57.00 56.33 1msg n GLN 13 Cb 0.06 0.13 0.00 0.00 1.02 0.00 0.00 30.24 31.45 1msg n GLN 13 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1msg n THR 14 N -0.63 -0.65 -1.57 5.09 -2.24 -1.18 -4.91 114.28 108.19 1msg n THR 14 Ca -0.10 0.08 -0.30 0.00 -2.27 0.00 0.00 64.05 61.45 1msg n THR 14 Cb 0.67 -1.30 0.07 0.00 -2.10 0.00 0.00 70.33 67.67 1msg n THR 14 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1msg s LEU 15 N -0.16 2.85 -1.11 3.22 1.43 0.41 -4.28 118.68 121.04 1msg s LEU 15 Ca 0.00 1.45 -0.05 0.00 -1.03 0.00 0.00 54.13 54.50 1msg s LEU 15 Cb 0.00 -4.19 0.29 0.00 0.03 0.00 0.00 46.19 42.32 1msg s LEU 15 CO 0.00 -1.72 1.51 0.00 0.23 0.00 0.00 176.35 176.37 1msg n GLN 16 N -3.29 4.29 -2.60 1.70 6.02 -1.26 -1.91 117.38 120.33 1msg n GLN 16 Ca 0.07 -4.41 -0.04 0.00 -0.01 0.00 0.00 57.00 52.61 1msg n GLN 16 Cb 0.55 -2.57 0.01 0.00 1.02 0.00 0.00 30.24 29.24 1msg n GLN 16 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1msg n GLY 17 N 1.65 -2.25 0.77 1.08 0.00 -1.26 -4.62 105.19 100.56 1msg n GLY 17 Ca 0.28 0.80 -0.06 0.00 0.00 0.00 0.00 46.02 47.04 1msg n GLY 17 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1msg n ILE 18 N 0.00 0.00 -3.62 -0.61 -0.00 -1.26 -4.94 119.36 108.93 1msg n ILE 18 Ca 0.06 -0.22 -0.35 0.00 -0.00 0.00 0.00 62.75 62.24 1msg n ILE 18 Cb 0.25 -1.75 -0.05 0.00 -0.00 0.00 0.00 39.64 38.08 1msg n ILE 18 CO 0.00 0.00 0.00 -2.28 -0.00 0.00 0.00 176.55 174.27 1msg s HIS 19 N -1.29 3.60 0.00 4.28 5.65 -1.26 -5.04 115.29 121.22 1msg s HIS 19 Ca 0.15 0.75 0.00 0.00 0.25 0.00 0.00 55.06 56.21 1msg s HIS 19 Cb -0.00 -2.13 0.00 0.00 -1.18 0.00 0.00 32.58 29.27 1msg s HIS 19 CO 0.10 0.56 0.00 -0.35 -0.65 0.00 0.00 174.74 174.40 1msg n PRO 20 N 1.10 0.00 0.00 2.88 -0.04 -1.26 -4.63 135.00 133.05 1msg n PRO 20 Ca -0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.36 1msg n PRO 20 Cb 0.52 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.98 1msg n PRO 20 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1msg n LYS 21 N 0.00 0.00 -0.12 0.54 4.81 -1.26 -3.74 118.16 118.39 1msg n LYS 21 Ca 0.00 0.00 -0.22 0.00 -0.87 0.00 0.00 58.31 57.22 1msg n LYS 21 Cb 0.00 0.00 -0.08 0.00 0.02 0.00 0.00 35.03 34.97 1msg n LYS 21 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1msg n ASN 22 N 2.15 1.93 -4.39 3.14 3.02 -1.26 -4.87 115.26 114.97 1msg n ASN 22 Ca 0.00 0.37 -0.51 0.00 -0.03 0.00 0.00 54.58 54.41 1msg n ASN 22 Cb 0.00 -0.83 -0.10 0.00 -0.61 0.00 0.00 39.78 38.24 1msg n ASN 22 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 1msg n ILE 23 N -4.36 0.07 -0.02 2.41 -0.00 -1.25 0.72 119.36 116.94 1msg n ILE 23 Ca -0.38 -0.16 0.06 0.00 -0.00 0.00 0.00 62.75 62.27 1msg n ILE 23 Cb 0.72 -1.12 -0.13 0.00 -0.00 0.00 0.00 39.64 39.12 1msg n ILE 23 CO 0.00 0.00 0.00 1.67 -0.00 0.00 0.00 176.55 178.22 1msg n GLN 24 N 8.07 0.63 -3.40 0.38 7.27 -0.77 -4.81 117.38 124.74 1msg n GLN 24 Ca 0.50 -0.13 -0.08 0.00 0.07 0.00 0.00 57.00 57.36 1msg n GLN 24 Cb 0.12 -1.39 0.02 0.00 2.41 0.00 0.00 30.24 31.41 1msg n GLN 24 CO 0.00 0.00 0.00 -1.13 0.07 0.00 0.00 177.06 176.00 1msg n SER 25 N -2.13 -1.91 -3.54 1.69 3.41 -1.03 -5.00 113.62 105.11 1msg n SER 25 Ca -0.06 -2.39 -0.13 0.00 -0.26 0.00 0.00 58.87 56.03 1msg n SER 25 Cb 0.50 3.21 -0.04 0.00 -0.26 0.00 0.00 64.21 67.61 1msg n SER 25 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1msg s VAL 26 N -2.27 0.03 0.01 -3.33 0.11 -1.26 0.12 120.40 113.80 1msg s VAL 26 Ca 0.15 -0.22 0.06 0.00 -2.93 0.00 0.00 61.98 59.04 1msg s VAL 26 Cb -0.04 -1.02 -0.02 0.00 -1.53 0.00 0.00 36.38 33.77 1msg s VAL 26 CO 0.11 -0.12 -0.19 0.20 -3.33 0.00 0.00 175.10 171.77 1msg s ASN 27 N -2.31 2.21 -0.11 3.54 0.01 0.46 -4.85 114.94 113.88 1msg s ASN 27 Ca -0.02 -0.40 -0.00 0.00 -0.71 0.00 0.00 52.86 51.73 1msg s ASN 27 Cb -0.00 -0.22 0.02 0.00 0.41 0.00 0.00 41.25 41.46 1msg s ASN 27 CO -0.06 0.19 -0.07 0.54 -1.51 0.00 0.00 177.10 176.19 1msg s VAL 28 N -0.57 0.96 0.11 1.60 0.11 -1.26 0.02 120.40 121.37 1msg s VAL 28 Ca 0.07 -0.25 0.07 0.00 -2.93 0.00 0.00 61.98 58.94 1msg s VAL 28 Cb -0.08 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.74 1msg s VAL 28 CO 0.00 0.36 -0.16 -0.75 -3.33 0.00 0.00 175.10 171.22 1msg s LYS 29 N 1.73 1.05 0.72 1.54 2.47 -0.82 -4.92 119.74 121.50 1msg s LYS 29 Ca 0.05 -1.19 -0.09 0.00 -1.56 0.00 0.00 55.97 53.18 1msg s LYS 29 Cb -0.13 -1.08 0.05 0.00 -1.46 0.00 0.00 37.83 35.22 1msg s LYS 29 CO -0.08 0.23 1.06 0.45 0.16 0.00 0.00 175.35 177.17 1msg s SER 30 N -2.20 4.94 1.07 1.43 0.15 -1.26 0.23 113.70 118.04 1msg s SER 30 Ca 0.07 0.69 -0.08 0.00 0.70 0.00 0.00 55.95 57.33 1msg s SER 30 Cb -0.07 -1.37 0.12 0.00 -1.71 0.00 0.00 66.02 62.99 1msg s SER 30 CO 0.04 -1.57 0.52 -0.81 1.20 0.00 0.00 173.24 172.62 1msg n PRO 31 N -3.00 -1.39 0.00 5.44 -0.04 -1.13 -4.74 135.00 130.14 1msg n PRO 31 Ca 0.07 -0.83 0.00 0.00 -0.04 0.00 0.00 63.50 62.71 1msg n PRO 31 Cb 0.60 -0.67 0.00 0.00 -0.04 0.00 0.00 33.50 33.38 1msg n PRO 31 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1msg n GLY 32 N 0.05 -1.98 0.00 0.55 0.00 -1.26 -4.88 105.19 97.67 1msg n GLY 32 Ca 0.07 0.65 0.00 0.00 0.00 0.00 0.00 46.02 46.74 1msg n GLY 32 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1msg n PRO 33 N 0.00 1.06 0.28 1.61 -0.04 -1.26 -4.56 135.00 132.09 1msg n PRO 33 Ca 0.00 0.00 0.18 0.00 -0.04 0.00 0.00 63.50 63.64 1msg n PRO 33 Cb 0.00 0.00 0.96 0.00 -0.04 0.00 0.00 33.50 34.42 1msg n PRO 33 CO 0.00 0.00 0.00 1.12 -0.04 0.00 0.00 175.50 176.58 1msg h HIS 34 N -0.34 0.00 -0.85 0.54 2.07 -2.01 0.22 115.15 114.78 1msg h HIS 34 Ca 0.00 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.50 1msg h HIS 34 Cb 0.00 0.00 -0.04 0.00 2.57 0.00 0.00 27.41 29.94 1msg h HIS 34 CO 0.00 0.00 0.43 0.00 -3.07 0.00 0.00 177.93 175.29 1msg n ALA 36 N -2.40 -1.10 -2.16 0.00 0.00 0.77 -4.45 120.51 111.16 1msg n ALA 36 Ca 0.08 -0.19 -0.10 0.00 0.00 0.00 0.00 53.44 53.23 1msg n ALA 36 Cb 0.12 -2.00 -0.10 0.00 0.00 0.00 0.00 19.45 17.47 1msg n ALA 36 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1msg s GLN 37 N -6.34 0.88 0.00 0.00 0.74 -1.26 -4.76 119.66 108.92 1msg s GLN 37 Ca 0.64 -1.39 0.00 0.00 0.05 0.00 0.00 55.36 54.67 1msg s GLN 37 Cb -0.38 -0.01 0.00 0.00 1.10 0.00 0.00 33.01 33.73 1msg s GLN 37 CO 0.87 -0.13 0.00 2.41 -0.55 0.00 0.00 175.29 177.89 1msg n THR 38 N -0.07 0.00 -3.69 -0.34 -1.04 -1.26 -2.84 114.28 105.03 1msg n THR 38 Ca -0.09 0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 61.80 1msg n THR 38 Cb 0.62 -0.53 -0.10 0.00 -1.82 0.00 0.00 70.33 68.50 1msg n THR 38 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1msg s GLU 39 N -1.02 0.52 -0.47 -2.82 2.02 0.13 -4.76 118.70 112.31 1msg s GLU 39 Ca 0.00 0.80 0.06 0.00 0.02 0.00 0.00 54.97 55.86 1msg s GLU 39 Cb 0.00 0.15 0.23 0.00 0.10 0.00 0.00 34.13 34.61 1msg s GLU 39 CO 0.00 -0.11 0.76 1.33 0.02 0.00 0.00 175.26 177.25 1msg n VAL 40 N 3.57 -0.22 -3.55 2.63 0.24 -1.21 -1.95 118.33 117.84 1msg n VAL 40 Ca -0.18 -2.09 -0.39 0.00 -2.04 0.00 0.00 64.34 59.64 1msg n VAL 40 Cb 0.56 0.50 -0.11 0.00 -1.47 0.00 0.00 33.84 33.33 1msg n VAL 40 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1msg s ILE 41 N 0.27 5.29 -0.39 1.34 1.01 0.10 -2.14 121.20 126.68 1msg s ILE 41 Ca 0.32 0.05 -0.22 0.00 0.00 0.00 0.00 60.65 60.80 1msg s ILE 41 Cb 0.18 -3.62 0.01 0.00 0.01 0.00 0.00 42.46 39.03 1msg s ILE 41 CO -0.19 0.13 0.72 0.00 0.00 0.00 0.00 174.94 175.60 1msg s ALA 42 N 1.78 3.40 -0.02 9.38 0.00 0.40 0.17 121.76 136.88 1msg s ALA 42 Ca 0.07 -0.84 -0.30 0.00 0.00 0.00 0.00 51.96 50.89 1msg s ALA 42 Cb -0.17 -3.32 -0.05 0.00 0.00 0.00 0.00 23.12 19.59 1msg s ALA 42 CO 0.11 -1.56 1.33 0.99 0.00 0.00 0.00 175.76 176.64 1msg s THR 43 N 2.99 3.89 0.68 0.00 2.01 0.32 -1.13 115.64 124.40 1msg s THR 43 Ca 0.28 1.25 -0.12 0.00 0.31 0.00 0.00 61.69 63.41 1msg s THR 43 Cb -0.13 -3.81 0.00 0.00 0.01 0.00 0.00 72.50 68.58 1msg s THR 43 CO 0.18 -0.00 1.06 -0.76 -0.69 0.00 0.00 174.62 174.41 1msg s LEU 44 N 2.33 3.19 0.26 4.42 2.01 0.20 -1.84 118.68 129.26 1msg s LEU 44 Ca 0.61 1.69 -0.02 0.00 0.01 0.00 0.00 54.13 56.42 1msg s LEU 44 Cb -0.29 -4.51 0.44 0.00 0.01 0.00 0.00 46.19 41.85 1msg s LEU 44 CO 0.25 -1.46 1.85 0.50 1.01 0.00 0.00 176.35 178.50 1msg h LYS 45 N -0.53 1.00 0.00 1.70 3.11 -0.02 0.27 116.57 122.10 1msg h LYS 45 Ca -0.44 -0.06 0.00 0.00 -2.81 0.00 0.00 60.65 57.34 1msg h LYS 45 Cb 1.21 -0.23 0.00 0.00 -1.00 0.00 0.00 32.23 32.22 1msg h LYS 45 CO 0.56 0.66 0.00 0.27 -2.81 0.00 0.00 179.45 178.14 1msg n ASN 46 N -4.59 0.00 -0.22 4.20 0.23 -1.26 -4.77 115.26 108.84 1msg n ASN 46 Ca 0.16 -0.73 0.00 0.00 -0.53 0.00 0.00 54.58 53.48 1msg n ASN 46 Cb 0.25 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.95 1msg n ASN 46 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1msg n GLY 47 N 0.13 0.94 0.00 4.83 0.00 0.95 -5.08 105.19 106.96 1msg n GLY 47 Ca 0.10 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.61 1msg n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1msg n ARG 48 N -0.57 1.78 -3.69 1.61 1.74 -1.13 -4.82 116.66 111.59 1msg n ARG 48 Ca 0.00 0.00 -0.14 0.00 -0.77 0.00 0.00 57.85 56.94 1msg n ARG 48 Cb 0.34 0.00 -0.08 0.00 -1.02 0.00 0.00 32.46 31.70 1msg n ARG 48 CO 0.00 0.00 0.00 -1.59 -1.52 0.00 0.00 177.63 174.52 1msg s LYS 49 N -1.33 0.79 0.05 5.56 0.00 -1.26 0.61 119.74 124.16 1msg s LYS 49 Ca 0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 55.97 55.86 1msg s LYS 49 Cb 0.00 0.36 -0.03 0.00 0.00 0.00 0.00 37.83 38.15 1msg s LYS 49 CO 0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 175.35 175.11 1msg s ALA 50 N -1.38 0.40 0.12 0.59 0.00 -0.28 -4.85 121.76 116.36 1msg s ALA 50 Ca -0.12 -1.08 0.08 0.00 0.00 0.00 0.00 51.96 50.84 1msg s ALA 50 Cb -0.04 0.27 -0.04 0.00 0.00 0.00 0.00 23.12 23.31 1msg s ALA 50 CO 0.05 -0.35 -0.14 0.00 0.00 0.00 0.00 175.76 175.32 1msg s LEU 52 N -2.28 1.77 -0.71 0.00 -0.00 -0.91 0.15 118.68 116.71 1msg s LEU 52 Ca 0.20 -1.32 -0.19 0.00 -0.00 0.00 0.00 54.13 52.82 1msg s LEU 52 Cb -0.10 0.00 0.12 0.00 -0.00 0.00 0.00 46.19 46.20 1msg s LEU 52 CO 0.12 -0.68 0.86 0.20 -0.00 0.00 0.00 176.35 176.85 1msg s ASN 53 N -3.27 6.36 0.51 1.48 -0.87 -0.80 -4.68 114.94 113.66 1msg s ASN 53 Ca 0.34 -1.65 0.21 0.00 -1.57 0.00 0.00 52.86 50.18 1msg s ASN 53 Cb 0.07 -2.33 1.35 0.00 -0.02 0.00 0.00 41.25 40.32 1msg s ASN 53 CO 0.11 -1.10 2.11 1.55 -2.57 0.00 0.00 177.10 177.20 1msg h PRO 54 N 9.00 0.00 -0.07 -0.60 0.13 -1.92 0.43 132.00 138.99 1msg h PRO 54 Ca -0.14 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.96 1msg h PRO 54 Cb 1.06 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.19 1msg h PRO 54 CO 1.08 0.08 -0.10 0.00 -0.23 0.00 0.00 178.00 178.83 1msg h ALA 55 N 1.92 1.71 -2.85 -0.56 0.00 -1.96 -3.35 119.26 114.16 1msg h ALA 55 Ca -0.00 -0.13 -0.53 0.00 0.00 0.00 0.00 54.91 54.24 1msg h ALA 55 Cb 0.17 -0.05 0.11 0.00 0.00 0.00 0.00 17.79 18.03 1msg h ALA 55 CO 0.01 0.22 0.49 0.45 0.00 0.00 0.00 179.25 180.42 1msg s SER 56 N -6.96 5.24 -0.06 0.00 0.15 0.15 -4.90 113.70 107.32 1msg s SER 56 Ca -0.05 2.43 -0.17 0.00 0.70 0.00 0.00 55.95 58.86 1msg s SER 56 Cb 0.16 -2.60 -0.12 0.00 -1.71 0.00 0.00 66.02 61.75 1msg s SER 56 CO 0.70 -1.56 0.69 1.55 1.20 0.00 0.00 173.24 175.82 1msg h PRO 57 N 1.01 -0.26 -0.72 5.44 0.13 -1.82 -0.50 132.00 135.29 1msg h PRO 57 Ca -0.50 0.02 0.12 0.00 -0.87 0.00 0.00 66.00 64.77 1msg h PRO 57 Cb 1.30 0.06 -0.09 0.00 0.13 0.00 0.00 31.00 32.40 1msg h PRO 57 CO 0.56 0.07 0.29 0.82 -0.23 0.00 0.00 178.00 179.51 1msg h ILE 58 N -0.96 0.72 -0.52 -3.56 5.03 -1.92 -0.42 117.51 115.88 1msg h ILE 58 Ca -0.03 -0.16 -0.12 0.00 -0.12 0.00 0.00 64.86 64.43 1msg h ILE 58 Cb 0.45 0.21 -0.02 0.00 -3.03 0.00 0.00 36.82 34.44 1msg h ILE 58 CO 0.05 0.09 -0.15 0.58 -0.68 0.00 0.00 178.15 178.03 1msg h VAL 59 N 0.47 1.27 -0.02 1.67 2.07 -1.77 -0.59 116.25 119.35 1msg h VAL 59 Ca 0.38 -1.31 0.01 0.00 0.82 0.00 0.00 66.70 66.59 1msg h VAL 59 Cb 0.52 1.03 -0.00 0.00 -1.52 0.00 0.00 31.29 31.32 1msg h VAL 59 CO -0.36 0.46 0.20 0.50 0.02 0.00 0.00 177.57 178.39 1msg h LYS 60 N 0.89 0.00 0.05 1.57 3.64 0.59 0.50 116.57 123.81 1msg h LYS 60 Ca 0.13 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.51 1msg h LYS 60 Cb 0.72 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.54 1msg h LYS 60 CO 0.06 0.00 -0.02 -0.22 -2.27 0.00 0.00 179.45 176.99 1msg h LYS 61 N 0.00 -0.06 -1.03 1.90 3.64 -0.43 -2.81 116.57 117.77 1msg h LYS 61 Ca 0.01 0.00 0.40 0.00 -1.27 0.00 0.00 60.65 59.79 1msg h LYS 61 Cb 0.40 0.01 -0.17 0.00 -0.41 0.00 0.00 32.23 32.07 1msg h LYS 61 CO -0.00 0.54 0.58 0.82 -2.27 0.00 0.00 179.45 179.12 1msg h ILE 62 N -0.74 0.08 0.18 2.00 5.03 0.57 1.20 117.51 125.83 1msg h ILE 62 Ca -0.01 -0.03 -0.01 0.00 -0.12 0.00 0.00 64.86 64.70 1msg h ILE 62 Cb 0.63 -0.01 0.00 0.00 -3.03 0.00 0.00 36.82 34.41 1msg h ILE 62 CO 0.01 0.02 -0.08 0.40 -0.68 0.00 0.00 178.15 177.81 1msg h ILE 63 N 0.09 0.89 -0.50 -0.67 5.03 -1.38 -1.24 117.51 119.73 1msg h ILE 63 Ca 0.82 -1.00 -0.01 0.00 -0.12 0.00 0.00 64.86 64.55 1msg h ILE 63 Cb 2.15 1.43 -0.02 0.00 -3.03 0.00 0.00 36.82 37.35 1msg h ILE 63 CO -0.70 0.21 0.28 -0.33 -0.68 0.00 0.00 178.15 176.93 1msg h GLU 64 N -0.78 0.70 -0.23 2.37 5.08 -0.05 0.74 114.58 122.42 1msg h GLU 64 Ca -0.02 -0.08 -0.04 0.00 -1.00 0.00 0.00 59.36 58.21 1msg h GLU 64 Cb 0.52 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 1msg h GLU 64 CO 0.04 0.55 -0.03 -0.22 -1.00 0.00 0.00 179.01 178.35 1msg h LYS 65 N 0.67 0.42 -0.64 2.33 3.64 0.11 0.20 116.57 123.31 1msg h LYS 65 Ca 0.18 -0.15 0.06 0.00 -1.27 0.00 0.00 60.65 59.47 1msg h LYS 65 Cb 0.05 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 31.80 1msg h LYS 65 CO -0.03 0.64 0.42 0.52 -2.27 0.00 0.00 179.45 178.73 1msg h MET 66 N 0.17 0.61 -0.17 1.90 2.86 -1.06 0.11 114.93 119.36 1msg h MET 66 Ca 0.06 -0.04 -0.12 0.00 -2.06 0.00 0.00 59.70 57.54 1msg h MET 66 Cb 0.47 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 31.98 1msg h MET 66 CO 0.02 0.41 -0.42 -0.07 1.06 0.00 0.00 176.91 177.90 1msg h LEU 67 N 0.63 0.41 0.00 1.22 3.38 -0.08 -3.40 115.31 117.48 1msg h LEU 67 Ca 0.28 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1msg h LEU 67 Cb 0.28 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1msg h LEU 67 CO -0.09 0.79 0.00 -3.20 0.09 0.00 0.00 178.44 176.03 1msg n ASN 68 N -4.02 0.00 -3.10 -0.43 5.15 0.63 -4.97 115.26 108.52 1msg n ASN 68 Ca -0.02 0.00 -0.06 0.00 -0.60 0.00 0.00 54.58 53.90 1msg n ASN 68 Cb 0.51 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.76 1msg n ASN 68 CO 0.00 0.00 0.00 -0.24 1.40 0.00 0.00 177.26 178.42 1msg n SER 69 N 0.00 -7.46 -2.44 1.20 2.88 -1.17 -5.03 113.62 101.60 1msg n SER 69 Ca 0.00 -0.01 -0.03 0.00 -1.33 0.00 0.00 58.87 57.50 1msg n SER 69 Cb 0.00 -4.82 0.01 0.00 -0.75 0.00 0.00 64.21 58.65 1msg n SER 69 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1msg n ASP 70 N -1.42 0.30 -0.09 -3.46 8.00 -1.26 -5.02 116.55 113.60 1msg n ASP 70 Ca -0.01 -1.22 -0.11 0.00 0.71 0.00 0.00 54.79 54.16 1msg n ASP 70 Cb 0.52 -0.07 -0.04 0.00 -0.02 0.00 0.00 41.12 41.50 1msg n ASP 70 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1msg h LYS 71 N 0.00 0.47 0.00 -1.24 6.56 -2.06 -3.56 116.57 116.74 1msg h LYS 71 Ca -0.04 -0.16 0.00 0.00 -1.06 0.00 0.00 60.65 59.38 1msg h LYS 71 Cb 0.19 -0.04 0.00 0.00 -0.57 0.00 0.00 32.23 31.82 1msg h LYS 71 CO 0.06 0.66 0.00 0.45 -2.06 0.00 0.00 179.45 178.56