#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1srm n PHE 10 N 0.00 -2.88 -3.56 -1.42 3.72 -1.26 -1.81 117.46 110.24 1srm n PHE 10 Ca 0.00 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.38 1srm n PHE 10 Cb 0.00 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.49 1srm n PHE 10 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1srm s VAL 11 N -0.72 -0.93 -1.05 -4.37 1.01 -1.06 -4.56 120.40 108.73 1srm s VAL 11 Ca 0.00 0.03 -0.23 0.00 0.00 0.00 0.00 61.98 61.77 1srm s VAL 11 Cb 0.00 -0.94 -0.05 0.00 0.00 0.00 0.00 36.38 35.39 1srm s VAL 11 CO 0.00 0.01 1.89 0.00 0.00 0.00 0.00 175.10 177.00 1srm s ALA 12 N 2.83 1.90 0.43 5.51 0.00 -1.25 -3.12 121.76 128.06 1srm s ALA 12 Ca -0.00 -1.91 0.29 0.00 0.00 0.00 0.00 51.96 50.33 1srm s ALA 12 Cb -0.13 -4.61 1.42 0.00 0.00 0.00 0.00 23.12 19.80 1srm s ALA 12 CO -0.18 -4.79 1.61 -0.07 0.00 0.00 0.00 175.76 172.33 1srm h LEU 13 N 17.09 0.26 0.00 0.00 3.38 0.21 -3.24 115.31 133.00 1srm h LEU 13 Ca 0.17 0.16 -0.11 0.00 0.09 0.00 0.00 57.88 58.19 1srm h LEU 13 Cb 0.97 0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.85 1srm h LEU 13 CO 1.25 -0.24 -0.09 -1.22 0.09 0.00 0.00 178.44 178.23 1srm n TYR 14 N -4.80 -0.51 -2.89 1.13 4.02 -1.03 -4.74 117.16 108.34 1srm n TYR 14 Ca 0.38 -0.77 -0.36 0.00 -0.01 0.00 0.00 57.90 57.14 1srm n TYR 14 Cb 1.43 0.13 -0.01 0.00 -0.02 0.00 0.00 39.34 40.87 1srm n TYR 14 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 176.86 175.45 1srm n ASP 15 N -2.26 5.93 -3.84 7.72 5.75 -1.26 -3.49 116.55 125.10 1srm n ASP 15 Ca 0.01 -3.61 -0.35 0.00 -0.01 0.00 0.00 54.79 50.83 1srm n ASP 15 Cb 0.18 -0.96 0.02 0.00 -1.03 0.00 0.00 41.12 39.33 1srm n ASP 15 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1srm n TYR 16 N 0.27 -3.15 -2.92 2.11 9.36 -1.21 -4.90 117.16 116.72 1srm n TYR 16 Ca 0.36 0.31 -0.01 0.00 3.32 0.00 0.00 57.90 61.88 1srm n TYR 16 Cb 0.33 -1.49 0.01 0.00 -0.63 0.00 0.00 39.34 37.55 1srm n TYR 16 CO 0.00 0.00 0.00 -1.83 0.22 0.00 0.00 176.86 175.25 1srm s GLU 17 N -1.13 0.74 1.18 2.98 -1.05 -1.26 -4.33 118.70 115.82 1srm s GLU 17 Ca 0.49 -0.51 -0.17 0.00 -0.15 0.00 0.00 54.97 54.62 1srm s GLU 17 Cb -0.39 0.02 0.27 0.00 -0.44 0.00 0.00 34.13 33.59 1srm s GLU 17 CO 0.64 -0.98 1.08 0.45 0.95 0.00 0.00 175.26 177.40 1srm s SER 18 N 1.40 1.10 -0.21 0.83 0.15 -1.26 -5.01 113.70 110.70 1srm s SER 18 Ca 0.22 0.86 -0.16 0.00 0.70 0.00 0.00 55.95 57.57 1srm s SER 18 Cb 0.01 -1.27 -0.11 0.00 -1.71 0.00 0.00 66.02 62.94 1srm s SER 18 CO -0.08 -4.04 -0.13 0.54 1.20 0.00 0.00 173.24 170.73 1srm n ARG 19 N -4.73 0.54 -0.07 5.44 1.74 -1.26 -4.40 116.66 113.92 1srm n ARG 19 Ca 0.10 0.42 -0.22 0.00 -0.77 0.00 0.00 57.85 57.37 1srm n ARG 19 Cb 0.59 -1.61 -0.12 0.00 -1.02 0.00 0.00 32.46 30.29 1srm n ARG 19 CO 0.00 0.00 0.00 -2.37 -1.52 0.00 0.00 177.63 173.74 1srm n THR 20 N -4.43 1.63 -1.69 0.55 5.66 -1.26 -4.34 114.28 110.40 1srm n THR 20 Ca -0.29 -0.38 -0.38 0.00 -3.05 0.00 0.00 64.05 59.94 1srm n THR 20 Cb 0.61 -1.83 -0.02 0.00 -1.55 0.00 0.00 70.33 67.54 1srm n THR 20 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1srm n GLU 21 N -3.91 4.12 -0.64 1.09 -0.58 -1.26 -4.69 120.64 114.77 1srm n GLU 21 Ca -0.37 -2.88 0.50 0.00 -0.42 0.00 0.00 57.16 54.00 1srm n GLU 21 Cb 0.89 -2.66 0.80 0.00 -0.57 0.00 0.00 31.44 29.89 1srm n GLU 21 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1srm h THR 22 N 2.72 0.05 0.00 2.62 1.03 -1.77 -3.38 112.91 114.18 1srm h THR 22 Ca 0.75 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 67.15 1srm h THR 22 Cb 0.34 0.05 0.00 0.00 -1.07 0.00 0.00 68.15 67.47 1srm h THR 22 CO 1.55 0.00 0.00 0.47 -0.01 0.00 0.00 175.52 177.53 1srm n ASP 23 N -3.92 0.00 -4.55 0.00 8.00 -1.26 -3.70 116.55 111.11 1srm n ASP 23 Ca 0.41 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.49 1srm n ASP 23 Cb 1.91 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 42.95 1srm n ASP 23 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1srm s LEU 24 N 0.00 4.30 0.05 0.64 2.01 -1.22 -4.63 118.68 119.83 1srm s LEU 24 Ca 0.00 0.01 -0.13 0.00 0.01 0.00 0.00 54.13 54.03 1srm s LEU 24 Cb 0.00 -2.82 -0.31 0.00 0.01 0.00 0.00 46.19 43.07 1srm s LEU 24 CO 0.00 -0.70 1.08 0.28 1.01 0.00 0.00 176.35 178.02 1srm h SER 25 N 8.64 0.77 -0.06 2.29 0.02 -1.75 -3.42 113.55 120.04 1srm h SER 25 Ca -0.26 -0.77 0.00 0.00 -0.84 0.00 0.00 61.79 59.93 1srm h SER 25 Cb 1.10 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 63.40 1srm h SER 25 CO 0.88 1.59 0.00 2.22 -1.14 0.00 0.00 176.83 180.37 1srm n PHE 26 N -3.71 -0.78 -3.48 3.45 -1.74 -1.26 -3.31 117.46 106.63 1srm n PHE 26 Ca -0.14 0.00 -0.12 0.00 -0.56 0.00 0.00 57.45 56.63 1srm n PHE 26 Cb 1.04 0.02 -0.03 0.00 1.52 0.00 0.00 39.48 42.03 1srm n PHE 26 CO 0.00 0.00 0.00 -1.59 -0.56 0.00 0.00 176.76 174.61 1srm s LYS 27 N 0.00 1.04 -0.19 3.97 -2.85 -1.26 -4.57 119.74 115.88 1srm s LYS 27 Ca 0.00 -0.19 -0.29 0.00 -1.00 0.00 0.00 55.97 54.49 1srm s LYS 27 Cb 0.00 0.48 -0.06 0.00 -2.06 0.00 0.00 37.83 36.19 1srm s LYS 27 CO 0.00 -0.41 2.18 1.17 0.10 0.00 0.00 175.35 178.38 1srm n LYS 28 N 0.07 2.00 0.00 1.78 0.00 -1.22 -1.76 118.16 119.03 1srm n LYS 28 Ca -0.15 0.59 0.00 0.00 0.00 0.00 0.00 58.31 58.75 1srm n LYS 28 Cb 0.62 -3.11 0.00 0.00 0.00 0.00 0.00 35.03 32.53 1srm n LYS 28 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1srm n GLY 29 N 5.65 0.96 3.91 3.14 0.00 -1.26 -5.03 105.19 112.56 1srm n GLY 29 Ca 0.30 -0.01 -0.28 0.00 0.00 0.00 0.00 46.02 46.03 1srm n GLY 29 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1srm s GLU 30 N 0.00 3.61 0.76 1.61 -1.05 -0.72 -4.99 118.70 117.91 1srm s GLU 30 Ca 0.00 0.06 -0.03 0.00 -0.15 0.00 0.00 54.97 54.86 1srm s GLU 30 Cb 0.00 -2.55 0.14 0.00 -0.44 0.00 0.00 34.13 31.29 1srm s GLU 30 CO 0.00 0.07 1.05 1.03 0.95 0.00 0.00 175.26 178.35 1srm s ARG 31 N -4.01 1.49 -0.26 -4.83 0.52 -1.26 -3.92 118.95 106.68 1srm s ARG 31 Ca 0.45 -1.06 -0.23 0.00 -0.52 0.00 0.00 55.73 54.37 1srm s ARG 31 Cb -0.10 -2.26 0.07 0.00 0.52 0.00 0.00 34.95 33.17 1srm s ARG 31 CO 0.35 -1.62 0.68 -0.51 0.02 0.00 0.00 175.30 174.22 1srm s LEU 32 N -5.26 -0.62 -0.44 2.53 1.02 -1.26 -4.93 118.68 109.72 1srm s LEU 32 Ca 0.68 1.38 -0.14 0.00 0.02 0.00 0.00 54.13 56.06 1srm s LEU 32 Cb -0.05 2.33 0.05 0.00 0.02 0.00 0.00 46.19 48.55 1srm s LEU 32 CO 0.46 -0.24 0.34 -1.58 0.02 0.00 0.00 176.35 175.35 1srm s GLN 33 N 0.45 2.93 0.54 1.70 0.74 -0.99 -4.48 119.66 120.56 1srm s GLN 33 Ca -0.01 -1.23 -0.21 0.00 0.05 0.00 0.00 55.36 53.95 1srm s GLN 33 Cb -0.05 -4.02 -0.05 0.00 1.10 0.00 0.00 33.01 29.99 1srm s GLN 33 CO -0.01 -0.91 1.25 -0.89 -0.55 0.00 0.00 175.29 174.19 1srm n ILE 34 N 5.15 3.66 -0.01 -2.34 2.08 -1.26 -1.39 119.36 125.25 1srm n ILE 34 Ca -0.12 -0.50 -0.01 0.00 0.56 0.00 0.00 62.75 62.69 1srm n ILE 34 Cb 0.45 -1.52 -0.01 0.00 -0.75 0.00 0.00 39.64 37.81 1srm n ILE 34 CO 0.00 0.00 0.00 0.52 0.56 0.00 0.00 176.55 177.63 1srm n VAL 35 N -1.10 0.09 -3.70 1.39 0.31 0.14 -4.85 118.33 110.61 1srm n VAL 35 Ca 0.11 -0.05 -0.08 0.00 -0.01 0.00 0.00 64.34 64.30 1srm n VAL 35 Cb 0.44 -0.93 0.01 0.00 -0.91 0.00 0.00 33.84 32.46 1srm n VAL 35 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 1srm n ASN 36 N -2.09 -1.65 -2.72 4.52 2.85 -1.25 -4.93 115.26 109.98 1srm n ASN 36 Ca -0.02 -2.32 -0.03 0.00 -0.11 0.00 0.00 54.58 52.10 1srm n ASN 36 Cb 0.54 2.80 -0.03 0.00 1.24 0.00 0.00 39.78 44.33 1srm n ASN 36 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 1srm n ASN 37 N -1.49 -3.40 -0.01 1.20 5.03 -1.26 -4.12 115.26 111.21 1srm n ASN 37 Ca -0.05 1.24 -0.16 0.00 0.87 0.00 0.00 54.58 56.48 1srm n ASN 37 Cb 0.47 -3.85 -0.14 0.00 -1.02 0.00 0.00 39.78 35.24 1srm n ASN 37 CO 0.00 0.00 0.00 1.07 -1.83 0.00 0.00 177.26 176.50 1srm n THR 38 N 2.03 1.71 0.00 3.41 5.66 -1.26 -4.62 114.28 121.21 1srm n THR 38 Ca -0.24 -0.71 0.00 0.00 -3.05 0.00 0.00 64.05 60.05 1srm n THR 38 Cb 0.37 -1.44 0.00 0.00 -1.55 0.00 0.00 70.33 67.71 1srm n THR 38 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1srm n GLU 39 N -3.30 -0.90 -3.35 1.09 1.02 -1.26 -4.90 120.64 109.04 1srm n GLU 39 Ca -0.26 0.00 -0.44 0.00 -0.02 0.00 0.00 57.16 56.44 1srm n GLU 39 Cb 1.05 0.00 -0.08 0.00 -0.02 0.00 0.00 31.44 32.40 1srm n GLU 39 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1srm s GLY 40 N -1.61 2.00 0.00 0.62 0.00 -1.26 -4.88 107.32 102.19 1srm s GLY 40 Ca 0.00 -2.03 0.00 0.00 0.00 0.00 0.00 44.72 42.69 1srm s GLY 40 CO 0.00 1.12 0.00 1.22 0.00 0.00 0.00 173.10 175.44 1srm n ASP 41 N 5.36 0.00 -3.48 1.64 9.92 -1.26 -5.00 116.55 123.74 1srm n ASP 41 Ca -0.11 0.00 -0.28 0.00 -0.53 0.00 0.00 54.79 53.87 1srm n ASP 41 Cb 0.44 0.00 -0.11 0.00 -0.64 0.00 0.00 41.12 40.81 1srm n ASP 41 CO 0.00 0.00 0.00 0.26 0.13 0.00 0.00 177.20 177.59 1srm s TRP 42 N 1.81 1.26 0.49 1.24 0.52 -1.26 -2.06 118.94 120.93 1srm s TRP 42 Ca 0.00 -2.22 -0.18 0.00 0.02 0.00 0.00 56.10 53.72 1srm s TRP 42 Cb 0.00 -1.14 -0.09 0.00 -1.15 0.00 0.00 33.47 31.09 1srm s TRP 42 CO 0.00 -0.80 0.98 -1.58 0.02 0.00 0.00 176.95 175.57 1srm s TRP 43 N 0.25 3.37 -0.41 -1.98 0.51 -1.15 -4.76 118.94 114.76 1srm s TRP 43 Ca 0.27 1.52 -0.21 0.00 -2.12 0.00 0.00 56.10 55.56 1srm s TRP 43 Cb -0.07 -2.83 0.02 0.00 -0.81 0.00 0.00 33.47 29.78 1srm s TRP 43 CO -0.12 -0.32 0.66 -1.17 -0.51 0.00 0.00 176.95 175.48 1srm s LEU 44 N -3.76 4.39 0.13 2.99 2.96 -1.26 -0.09 118.68 124.04 1srm s LEU 44 Ca 0.60 -0.16 0.01 0.00 -0.22 0.00 0.00 54.13 54.37 1srm s LEU 44 Cb -0.10 -2.78 -0.04 0.00 0.50 0.00 0.00 46.19 43.78 1srm s LEU 44 CO 0.25 -0.74 0.27 0.00 -1.32 0.00 0.00 176.35 174.81 1srm s ALA 45 N 2.85 3.97 -0.05 5.97 0.00 -0.65 0.26 121.76 134.10 1srm s ALA 45 Ca 0.24 -0.95 0.02 0.00 0.00 0.00 0.00 51.96 51.27 1srm s ALA 45 Cb -0.14 -1.82 0.01 0.00 0.00 0.00 0.00 23.12 21.17 1srm s ALA 45 CO 0.18 0.62 -0.10 -1.58 0.00 0.00 0.00 175.76 174.87 1srm s HIS 46 N -1.68 1.25 -0.21 0.00 2.46 -0.49 -2.43 115.29 114.19 1srm s HIS 46 Ca 0.35 -0.42 -0.19 0.00 0.47 0.00 0.00 55.06 55.28 1srm s HIS 46 Cb -0.12 -0.93 -0.03 0.00 -0.13 0.00 0.00 32.58 31.38 1srm s HIS 46 CO 0.28 -0.22 0.55 -1.12 -2.47 0.00 0.00 174.74 171.76 1srm s SER 47 N 0.59 6.58 0.52 9.88 0.01 -1.17 -2.34 113.70 127.77 1srm s SER 47 Ca -0.11 0.70 0.31 0.00 1.31 0.00 0.00 55.95 58.15 1srm s SER 47 Cb -0.14 -2.31 1.23 0.00 0.21 0.00 0.00 66.02 65.02 1srm s SER 47 CO 0.02 -0.22 1.94 -0.07 0.41 0.00 0.00 173.24 175.32 1srm h LEU 48 N 8.15 0.00 0.00 2.44 3.38 -1.93 0.97 115.31 128.32 1srm h LEU 48 Ca -0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.65 1srm h LEU 48 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1srm h LEU 48 CO 0.75 0.07 0.00 0.41 0.09 0.00 0.00 178.44 179.76 1srm n THR 49 N -3.20 0.00 0.02 0.22 -1.04 -1.26 -4.13 114.28 104.88 1srm n THR 49 Ca 0.00 1.30 -0.22 0.00 -2.04 0.00 0.00 64.05 63.10 1srm n THR 49 Cb 0.34 -2.18 -0.14 0.00 -1.82 0.00 0.00 70.33 66.53 1srm n THR 49 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 1srm h THR 50 N 0.00 0.85 0.00 12.58 1.35 -2.01 -3.48 112.91 122.20 1srm h THR 50 Ca 0.00 -2.39 0.00 0.00 -0.55 0.00 0.00 66.41 63.47 1srm h THR 50 Cb 0.00 2.62 0.00 0.00 -1.73 0.00 0.00 68.15 69.04 1srm h THR 50 CO 0.00 0.79 0.00 0.61 -0.25 0.00 0.00 175.52 176.67 1srm n GLY 51 N 1.85 1.85 3.99 5.82 0.00 0.33 -5.08 105.19 113.96 1srm n GLY 51 Ca -0.28 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.49 1srm n GLY 51 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1srm s GLN 52 N -0.56 1.28 -0.01 1.61 -1.52 -1.24 -4.87 119.66 114.35 1srm s GLN 52 Ca 0.00 -1.11 -0.10 0.00 -1.95 0.00 0.00 55.36 52.20 1srm s GLN 52 Cb 0.00 -2.23 0.01 0.00 -0.22 0.00 0.00 33.01 30.57 1srm s GLN 52 CO 0.00 -1.78 0.20 0.99 -0.25 0.00 0.00 175.29 174.46 1srm s THR 53 N -3.34 0.07 -0.26 -0.19 2.01 -1.26 -3.05 115.64 109.61 1srm s THR 53 Ca 0.70 -0.54 -0.27 0.00 0.31 0.00 0.00 61.69 61.89 1srm s THR 53 Cb -0.04 -0.48 0.16 0.00 0.01 0.00 0.00 72.50 72.16 1srm s THR 53 CO 0.47 -0.30 1.23 -0.83 -0.69 0.00 0.00 174.62 174.50 1srm s GLY 54 N -1.19 0.05 -0.64 4.40 0.00 -1.02 -4.49 107.32 104.43 1srm s GLY 54 Ca -0.13 2.87 -0.26 0.00 0.00 0.00 0.00 44.72 47.20 1srm s GLY 54 CO 0.02 1.56 1.82 -0.19 0.00 0.00 0.00 173.10 176.32 1srm s TYR 55 N -0.36 1.72 -0.21 1.90 1.51 -1.26 -1.64 117.35 119.01 1srm s TYR 55 Ca 0.05 0.71 -0.23 0.00 -1.01 0.00 0.00 57.07 56.58 1srm s TYR 55 Cb -0.03 -4.13 -0.02 0.00 -0.11 0.00 0.00 41.96 37.67 1srm s TYR 55 CO -0.08 -2.26 0.75 0.96 -1.11 0.00 0.00 175.55 173.81 1srm s ILE 56 N 8.89 4.92 0.14 2.71 -5.25 0.87 -4.25 121.20 129.23 1srm s ILE 56 Ca 0.65 1.42 -0.31 0.00 -0.99 0.00 0.00 60.65 61.42 1srm s ILE 56 Cb -0.12 -4.05 -0.11 0.00 2.95 0.00 0.00 42.46 41.14 1srm s ILE 56 CO 0.19 0.03 1.79 -2.84 -1.79 0.00 0.00 174.94 172.31 1srm s PRO 57 N 2.30 4.14 0.06 0.37 0.02 -1.26 -2.95 135.00 137.69 1srm s PRO 57 Ca 0.33 2.58 0.09 0.00 0.02 0.00 0.00 61.00 64.02 1srm s PRO 57 Cb -0.16 -3.45 0.42 0.00 0.02 0.00 0.00 34.50 31.33 1srm s PRO 57 CO 0.10 -0.81 1.28 -1.13 -0.33 0.00 0.00 177.00 176.11 1srm n SER 58 N 5.21 0.13 0.00 2.53 3.41 -0.87 -1.68 113.62 122.35 1srm n SER 58 Ca 0.17 0.55 0.06 0.00 -0.26 0.00 0.00 58.87 59.39 1srm n SER 58 Cb 0.37 -0.57 0.29 0.00 -0.26 0.00 0.00 64.21 64.05 1srm n SER 58 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1srm n ASN 59 N -1.66 0.00 -0.34 4.04 4.05 -1.26 -2.21 115.26 117.88 1srm n ASN 59 Ca 0.01 0.35 0.07 0.00 0.45 0.00 0.00 54.58 55.46 1srm n ASN 59 Cb 0.07 -0.42 0.12 0.00 1.23 0.00 0.00 39.78 40.79 1srm n ASN 59 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 177.26 172.99 1srm n TYR 60 N -1.42 0.00 -3.71 1.20 4.01 -0.68 -4.89 117.16 111.67 1srm n TYR 60 Ca 0.04 -0.89 0.00 0.00 -0.16 0.00 0.00 57.90 56.89 1srm n TYR 60 Cb 0.13 -0.15 0.00 0.00 -0.31 0.00 0.00 39.34 39.01 1srm n TYR 60 CO 0.00 0.00 0.00 1.55 -0.46 0.00 0.00 176.86 177.95 1srm n VAL 61 N -1.01 0.00 0.00 -0.72 3.14 -0.94 0.20 118.33 119.01 1srm n VAL 61 Ca 0.13 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.51 1srm n VAL 61 Cb 0.69 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.47 1srm n VAL 61 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1srm n ALA 62 N -3.00 0.00 -1.73 1.55 0.00 -1.18 -4.64 120.51 111.50 1srm n ALA 62 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.01 1srm n ALA 62 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1srm n ALA 62 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1srm s PRO 63 N -1.66 3.60 0.00 0.00 0.04 -1.26 -2.55 135.00 133.16 1srm s PRO 63 Ca 0.00 2.14 0.00 0.00 0.04 0.00 0.00 61.00 63.18 1srm s PRO 63 Cb 0.00 -4.24 0.00 0.00 0.04 0.00 0.00 34.50 30.30 1srm s PRO 63 CO 0.00 -1.57 0.00 0.43 0.04 0.00 0.00 177.00 175.90