#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 -0.25 -3.71 -1.42 3.01 -1.26 -4.02 117.46 109.81 1srm n PHE 10 Ca 0.00 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.33 1srm n PHE 10 Cb 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 39.48 39.33 1srm n PHE 10 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1srm s VAL 11 N -0.34 -0.16 -0.93 -4.37 1.01 -1.19 -4.55 120.40 109.87 1srm s VAL 11 Ca 0.00 0.21 -0.25 0.00 0.00 0.00 0.00 61.98 61.94 1srm s VAL 11 Cb 0.00 -0.37 -0.08 0.00 0.00 0.00 0.00 36.38 35.93 1srm s VAL 11 CO 0.00 0.09 2.05 0.00 0.00 0.00 0.00 175.10 177.24 1srm s ALA 12 N 1.67 1.42 0.32 5.51 0.00 -1.26 -3.47 121.76 125.95 1srm s ALA 12 Ca -0.05 -1.46 0.25 0.00 0.00 0.00 0.00 51.96 50.70 1srm s ALA 12 Cb -0.11 -4.59 1.36 0.00 0.00 0.00 0.00 23.12 19.78 1srm s ALA 12 CO -0.08 -5.22 1.73 -0.07 0.00 0.00 0.00 175.76 172.13 1srm h LEU 13 N 19.06 0.00 0.00 0.00 3.38 0.14 -3.34 115.31 134.54 1srm h LEU 13 Ca 0.09 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.82 1srm h LEU 13 Cb 0.99 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.68 1srm h LEU 13 CO 1.16 0.00 -0.18 -1.22 0.09 0.00 0.00 178.44 178.29 1srm n TYR 14 N -2.54 -0.97 -2.81 1.13 4.02 -0.89 -4.88 117.16 110.22 1srm n TYR 14 Ca -0.02 -1.77 -0.29 0.00 -0.01 0.00 0.00 57.90 55.81 1srm n TYR 14 Cb 0.27 0.33 -0.02 0.00 -0.02 0.00 0.00 39.34 39.90 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 -1.87 5.02 -4.10 7.72 5.68 -1.26 -2.81 116.55 124.93 1srm n ASP 15 Ca 0.02 -3.70 -0.58 0.00 -0.50 0.00 0.00 54.79 50.04 1srm n ASP 15 Cb 0.42 -0.65 -0.08 0.00 -1.14 0.00 0.00 41.12 39.67 1srm n ASP 15 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1srm n TYR 16 N -0.26 1.33 -3.22 2.11 9.36 -1.26 -4.62 117.16 120.59 1srm n TYR 16 Ca 0.35 0.99 -0.38 0.00 3.32 0.00 0.00 57.90 62.18 1srm n TYR 16 Cb 0.40 -1.92 -0.06 0.00 -0.63 0.00 0.00 39.34 37.13 1srm n TYR 16 CO 0.00 0.00 0.00 -1.21 0.22 0.00 0.00 176.86 175.87 1srm s GLU 17 N 2.05 4.22 -0.61 2.98 0.41 -1.26 -2.69 118.70 123.79 1srm s GLU 17 Ca 0.89 0.77 -0.28 0.00 -0.41 0.00 0.00 54.97 55.94 1srm s GLU 17 Cb -1.27 -3.12 0.02 0.00 -1.78 0.00 0.00 34.13 27.98 1srm s GLU 17 CO 0.67 0.56 1.31 -1.54 -0.49 0.00 0.00 175.26 175.77 1srm s SER 18 N -1.32 6.23 0.21 -0.19 1.04 -1.26 -4.82 113.70 113.58 1srm s SER 18 Ca 0.34 0.04 0.26 0.00 0.48 0.00 0.00 55.95 57.07 1srm s SER 18 Cb -0.19 -2.55 0.79 0.00 0.10 0.00 0.00 66.02 64.17 1srm s SER 18 CO 0.20 -1.68 1.76 0.54 0.98 0.00 0.00 173.24 175.04 1srm n ARG 19 N 8.78 0.27 -4.26 4.02 1.74 -1.26 -4.88 116.66 121.07 1srm n ARG 19 Ca 0.09 0.22 -0.19 0.00 -0.77 0.00 0.00 57.85 57.19 1srm n ARG 19 Cb 0.49 -1.81 -0.07 0.00 -1.02 0.00 0.00 32.46 30.05 1srm n ARG 19 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1srm s THR 20 N -3.10 0.00 -0.73 0.55 2.01 -1.26 -5.02 115.64 108.09 1srm s THR 20 Ca 0.10 -1.94 0.06 0.00 0.31 0.00 0.00 61.69 60.22 1srm s THR 20 Cb 0.12 -2.53 0.33 0.00 0.01 0.00 0.00 72.50 70.44 1srm s THR 20 CO 0.60 0.00 1.01 -1.84 -0.69 0.00 0.00 174.62 173.70 1srm n GLU 21 N -0.62 2.56 -0.09 4.92 0.00 -1.26 -4.11 120.64 122.04 1srm n GLU 21 Ca 0.07 -1.27 -0.16 0.00 0.00 0.00 0.00 57.16 55.80 1srm n GLU 21 Cb 0.62 -1.80 -0.08 0.00 0.00 0.00 0.00 31.44 30.18 1srm n GLU 21 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.13 179.54 1srm n THR 22 N 0.26 1.49 -4.70 3.84 -1.04 -1.26 -4.91 114.28 107.96 1srm n THR 22 Ca 0.11 0.05 -0.33 0.00 -2.04 0.00 0.00 64.05 61.84 1srm n THR 22 Cb 0.63 -2.16 -0.13 0.00 -1.82 0.00 0.00 70.33 66.85 1srm n THR 22 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 1srm s ASP 23 N -6.47 4.35 0.82 8.00 1.11 -1.26 -4.80 116.67 118.43 1srm s ASP 23 Ca -0.24 -0.16 -0.12 0.00 0.18 0.00 0.00 52.55 52.22 1srm s ASP 23 Cb 0.05 -1.28 0.09 0.00 1.07 0.00 0.00 42.92 42.85 1srm s ASP 23 CO 0.46 0.28 1.10 -0.76 1.18 0.00 0.00 175.17 177.43 1srm s LEU 24 N -0.34 2.49 -0.17 1.23 2.01 -1.26 -4.49 118.68 118.15 1srm s LEU 24 Ca 0.04 1.31 -0.08 0.00 0.01 0.00 0.00 54.13 55.41 1srm s LEU 24 Cb -0.12 -3.86 -0.04 0.00 0.01 0.00 0.00 46.19 42.17 1srm s LEU 24 CO 0.02 -2.14 0.10 -0.44 1.01 0.00 0.00 176.35 174.90 1srm s SER 25 N -3.83 5.95 0.00 2.29 0.01 -1.26 -4.44 113.70 112.42 1srm s SER 25 Ca 0.61 0.22 0.00 0.00 1.31 0.00 0.00 55.95 58.09 1srm s SER 25 Cb -0.15 -1.99 0.00 0.00 0.21 0.00 0.00 66.02 64.09 1srm s SER 25 CO 0.55 0.24 0.00 2.22 0.41 0.00 0.00 173.24 176.66 1srm n PHE 26 N 3.08 -0.13 -4.18 2.43 -1.74 -1.09 -4.91 117.46 110.91 1srm n PHE 26 Ca -0.17 0.00 -0.11 0.00 -0.56 0.00 0.00 57.45 56.61 1srm n PHE 26 Cb 0.53 0.00 -0.10 0.00 1.52 0.00 0.00 39.48 41.43 1srm n PHE 26 CO 0.00 0.00 0.00 0.21 -0.56 0.00 0.00 176.76 176.41 1srm s LYS 27 N -1.84 1.03 -1.17 3.97 2.20 -1.26 -4.00 119.74 118.67 1srm s LYS 27 Ca 0.00 -1.51 -0.20 0.00 -0.36 0.00 0.00 55.97 53.90 1srm s LYS 27 Cb 0.00 0.18 0.05 0.00 -1.51 0.00 0.00 37.83 36.55 1srm s LYS 27 CO 0.00 -0.28 1.63 0.21 -0.36 0.00 0.00 175.35 176.55 1srm s LYS 28 N -4.06 3.75 0.00 4.03 2.20 -1.13 -3.22 119.74 121.31 1srm s LYS 28 Ca 0.28 -1.58 0.00 0.00 -0.36 0.00 0.00 55.97 54.31 1srm s LYS 28 Cb 0.07 -5.45 0.00 0.00 -1.51 0.00 0.00 37.83 30.94 1srm s LYS 28 CO 0.05 -2.31 0.00 0.41 -0.36 0.00 0.00 175.35 173.14 1srm n GLY 29 N 6.05 0.22 3.46 5.54 0.00 -1.26 -4.99 105.19 114.20 1srm n GLY 29 Ca 0.42 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 46.00 1srm n GLY 29 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1srm s GLU 30 N 0.00 4.05 -0.62 1.61 2.12 -1.20 -4.96 118.70 119.71 1srm s GLU 30 Ca 0.00 -2.54 -0.37 0.00 0.36 0.00 0.00 54.97 52.42 1srm s GLU 30 Cb 0.00 -5.03 -0.18 0.00 0.26 0.00 0.00 34.13 29.18 1srm s GLU 30 CO 0.00 -1.75 2.33 0.54 -0.54 0.00 0.00 175.26 175.84 1srm n ARG 31 N 5.61 0.27 -2.24 4.30 3.00 -1.26 -4.67 116.66 121.66 1srm n ARG 31 Ca 0.35 0.06 -0.28 0.00 -0.01 0.00 0.00 57.85 57.97 1srm n ARG 31 Cb 0.43 -1.80 0.04 0.00 0.00 0.00 0.00 32.46 31.13 1srm n ARG 31 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1srm s LEU 32 N 7.50 3.12 -0.32 0.55 1.02 -1.26 -4.79 118.68 124.49 1srm s LEU 32 Ca 1.21 0.82 -0.07 0.00 0.02 0.00 0.00 54.13 56.11 1srm s LEU 32 Cb -1.23 -3.63 0.02 0.00 0.02 0.00 0.00 46.19 41.37 1srm s LEU 32 CO 0.55 -1.16 0.11 -1.58 0.02 0.00 0.00 176.35 174.29 1srm s GLN 33 N -5.11 2.87 0.82 1.70 0.74 -0.97 -4.10 119.66 115.62 1srm s GLN 33 Ca 0.55 -1.01 -0.15 0.00 0.05 0.00 0.00 55.36 54.80 1srm s GLN 33 Cb -0.11 -3.47 -0.02 0.00 1.10 0.00 0.00 33.01 30.52 1srm s GLN 33 CO 0.47 -0.57 0.40 -0.89 -0.55 0.00 0.00 175.29 174.15 1srm n ILE 34 N 4.87 1.01 0.00 -2.34 2.08 -1.26 -1.57 119.36 122.15 1srm n ILE 34 Ca -0.13 -0.33 0.00 0.00 0.56 0.00 0.00 62.75 62.85 1srm n ILE 34 Cb 0.46 -0.64 0.00 0.00 -0.75 0.00 0.00 39.64 38.71 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 -2.82 0.00 -3.99 1.39 0.31 0.13 -4.74 118.33 108.61 1srm n VAL 35 Ca 0.08 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.28 1srm n VAL 35 Cb 0.51 -0.17 -0.01 0.00 -0.91 0.00 0.00 33.84 33.26 1srm n VAL 35 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 1srm s ASN 36 N -3.28 0.69 -0.13 4.52 0.01 -1.25 -4.95 114.94 110.55 1srm s ASN 36 Ca 0.00 -1.42 -0.09 0.00 -0.71 0.00 0.00 52.86 50.64 1srm s ASN 36 Cb 0.00 0.75 0.03 0.00 0.41 0.00 0.00 41.25 42.44 1srm s ASN 36 CO 0.00 -1.47 0.17 0.59 -1.51 0.00 0.00 177.10 174.88 1srm n ASN 37 N -1.53 -1.47 -0.01 -1.22 5.03 -1.26 -3.97 115.26 110.83 1srm n ASN 37 Ca -0.02 1.08 -0.21 0.00 0.87 0.00 0.00 54.58 56.30 1srm n ASN 37 Cb 0.61 -4.28 -0.14 0.00 -1.02 0.00 0.00 39.78 34.95 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 1.33 1.75 -0.00 3.41 5.66 -1.26 -4.71 114.28 120.46 1srm n THR 38 Ca -0.29 -0.62 0.00 0.00 -3.05 0.00 0.00 64.05 60.08 1srm n THR 38 Cb 0.46 -1.72 0.00 0.00 -1.55 0.00 0.00 70.33 67.51 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 -3.51 -0.97 -3.41 1.09 1.02 -1.26 -4.91 120.64 108.69 1srm n GLU 39 Ca -0.33 0.00 -0.44 0.00 -0.02 0.00 0.00 57.16 56.37 1srm n GLU 39 Cb 1.03 0.00 -0.09 0.00 -0.02 0.00 0.00 31.44 32.36 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 -1.66 2.03 0.00 0.62 0.00 -1.26 -4.88 107.32 102.17 1srm s GLY 40 Ca 0.00 -1.96 0.00 0.00 0.00 0.00 0.00 44.72 42.76 1srm s GLY 40 CO 0.00 1.01 0.00 1.22 0.00 0.00 0.00 173.10 175.33 1srm n ASP 41 N 5.19 0.00 -3.49 1.64 8.00 -1.26 -4.99 116.55 121.65 1srm n ASP 41 Ca -0.12 0.00 -0.28 0.00 0.71 0.00 0.00 54.79 55.10 1srm n ASP 41 Cb 0.45 0.00 -0.11 0.00 -0.02 0.00 0.00 41.12 41.44 1srm n ASP 41 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 1srm s TRP 42 N 1.77 1.18 0.47 1.24 0.52 -1.26 -2.71 118.94 120.15 1srm s TRP 42 Ca 0.00 -2.10 -0.19 0.00 0.02 0.00 0.00 56.10 53.84 1srm s TRP 42 Cb 0.00 -1.13 -0.09 0.00 -1.15 0.00 0.00 33.47 31.09 1srm s TRP 42 CO 0.00 -0.81 0.97 -1.58 0.02 0.00 0.00 176.95 175.55 1srm s TRP 43 N 0.44 3.35 -0.23 -1.98 0.51 -1.25 -4.90 118.94 114.90 1srm s TRP 43 Ca 0.24 1.54 -0.18 0.00 -2.12 0.00 0.00 56.10 55.59 1srm s TRP 43 Cb -0.12 -2.84 -0.03 0.00 -0.81 0.00 0.00 33.47 29.68 1srm s TRP 43 CO -0.08 -0.28 0.50 -1.17 -0.51 0.00 0.00 176.95 175.41 1srm s LEU 44 N -3.63 4.11 -0.14 2.99 0.20 -1.25 -1.77 118.68 119.19 1srm s LEU 44 Ca 0.61 0.59 0.01 0.00 0.69 0.00 0.00 54.13 56.02 1srm s LEU 44 Cb -0.10 -2.66 -0.01 0.00 -0.43 0.00 0.00 46.19 42.99 1srm s LEU 44 CO 0.22 -0.22 -0.16 0.00 -0.29 0.00 0.00 176.35 175.91 1srm s ALA 45 N 1.90 2.50 -0.20 5.97 0.00 -0.87 0.17 121.76 131.21 1srm s ALA 45 Ca 0.22 -0.98 -0.11 0.00 0.00 0.00 0.00 51.96 51.09 1srm s ALA 45 Cb -0.15 -1.17 -0.05 0.00 0.00 0.00 0.00 23.12 21.75 1srm s ALA 45 CO 0.09 0.11 0.17 -1.58 0.00 0.00 0.00 175.76 174.55 1srm s HIS 46 N 0.60 3.39 -0.27 0.00 2.46 -0.61 -2.16 115.29 118.71 1srm s HIS 46 Ca -0.09 0.36 -0.23 0.00 0.47 0.00 0.00 55.06 55.57 1srm s HIS 46 Cb -0.16 -2.23 -0.01 0.00 -0.13 0.00 0.00 32.58 30.06 1srm s HIS 46 CO 0.03 0.22 0.76 -1.12 -2.47 0.00 0.00 174.74 172.16 1srm s SER 47 N 0.56 6.71 0.42 9.88 0.01 -1.05 -2.29 113.70 127.94 1srm s SER 47 Ca 0.10 0.82 0.23 0.00 1.31 0.00 0.00 55.95 58.41 1srm s SER 47 Cb -0.12 -2.40 0.68 0.00 0.21 0.00 0.00 66.02 64.39 1srm s SER 47 CO 0.01 -0.51 1.72 -0.07 0.41 0.00 0.00 173.24 174.80 1srm h LEU 48 N 9.20 0.00 0.00 2.44 3.38 -1.90 -1.11 115.31 127.32 1srm h LEU 48 Ca -0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1srm h LEU 48 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1srm h LEU 48 CO 0.85 0.23 0.00 0.41 0.09 0.00 0.00 178.44 180.01 1srm n THR 49 N -3.27 0.00 -0.03 0.22 -1.04 -1.26 -4.25 114.28 104.65 1srm n THR 49 Ca 0.01 1.34 -0.07 0.00 -2.04 0.00 0.00 64.05 63.29 1srm n THR 49 Cb 0.50 -2.31 -0.06 0.00 -1.82 0.00 0.00 70.33 66.64 1srm n THR 49 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 1srm h THR 50 N 0.00 0.79 0.00 12.58 2.02 -2.00 -3.48 112.91 122.81 1srm h THR 50 Ca 0.00 -1.47 0.00 0.00 0.77 0.00 0.00 66.41 65.71 1srm h THR 50 Cb 0.00 1.45 0.00 0.00 -1.74 0.00 0.00 68.15 67.86 1srm h THR 50 CO 0.00 0.25 0.00 0.61 0.37 0.00 0.00 175.52 176.75 1srm n GLY 51 N 1.42 1.71 3.90 2.16 0.00 -0.42 -5.09 105.19 108.87 1srm n GLY 51 Ca -0.05 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.69 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 0.00 3.64 -0.41 1.61 -1.52 -1.25 -4.87 119.66 116.86 1srm s GLN 52 Ca 0.00 0.12 -0.14 0.00 -1.95 0.00 0.00 55.36 53.39 1srm s GLN 52 Cb 0.00 -2.53 0.03 0.00 -0.22 0.00 0.00 33.01 30.29 1srm s GLN 52 CO 0.00 0.07 0.28 0.99 -0.25 0.00 0.00 175.29 176.38 1srm s THR 53 N -2.30 5.02 -0.10 -0.19 2.01 -1.26 -2.53 115.64 116.29 1srm s THR 53 Ca 0.46 -0.78 0.01 0.00 0.31 0.00 0.00 61.69 61.69 1srm s THR 53 Cb -0.10 -3.83 0.02 0.00 0.01 0.00 0.00 72.50 68.60 1srm s THR 53 CO 0.34 -0.32 -0.14 -0.83 -0.69 0.00 0.00 174.62 172.98 1srm s GLY 54 N 1.74 0.96 0.00 4.40 0.00 -0.92 -4.03 107.32 109.48 1srm s GLY 54 Ca 0.04 -0.64 -0.30 0.00 0.00 0.00 0.00 44.72 43.81 1srm s GLY 54 CO 0.08 0.29 1.02 -0.19 0.00 0.00 0.00 173.10 174.31 1srm s TYR 55 N 1.03 3.61 -0.24 1.90 2.02 -1.26 -2.06 117.35 122.35 1srm s TYR 55 Ca -0.06 1.62 -0.03 0.00 -0.37 0.00 0.00 57.07 58.22 1srm s TYR 55 Cb -0.15 -3.18 0.01 0.00 -0.40 0.00 0.00 41.96 38.24 1srm s TYR 55 CO -0.02 -0.26 -0.04 0.96 -1.57 0.00 0.00 175.55 174.62 1srm s ILE 56 N 1.09 3.22 0.71 2.71 -5.25 -0.73 -4.66 121.20 118.29 1srm s ILE 56 Ca 0.53 -0.74 -0.16 0.00 -0.99 0.00 0.00 60.65 59.29 1srm s ILE 56 Cb -0.22 -2.55 0.01 0.00 2.95 0.00 0.00 42.46 42.65 1srm s ILE 56 CO 0.28 0.29 1.09 -2.65 -1.79 0.00 0.00 174.94 172.16 1srm n PRO 57 N 4.75 0.61 0.07 0.37 -0.02 -1.26 -3.77 135.00 135.76 1srm n PRO 57 Ca -0.17 0.27 0.08 0.00 -2.02 0.00 0.00 63.50 61.66 1srm n PRO 57 Cb 0.49 -2.34 0.37 0.00 -0.02 0.00 0.00 33.50 32.00 1srm n PRO 57 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1srm n SER 58 N -1.99 0.33 -0.17 2.55 3.41 -1.10 -1.59 113.62 115.06 1srm n SER 58 Ca 0.14 0.60 0.11 0.00 -0.26 0.00 0.00 58.87 59.46 1srm n SER 58 Cb 0.49 -0.66 0.58 0.00 -0.26 0.00 0.00 64.21 64.36 1srm n SER 58 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1srm n ASN 59 N -1.89 0.51 -0.29 4.04 4.13 -1.26 -3.36 115.26 117.14 1srm n ASN 59 Ca 0.02 -1.42 0.03 0.00 1.68 0.00 0.00 54.58 54.89 1srm n ASN 59 Cb 0.14 -0.02 0.04 0.00 -1.54 0.00 0.00 39.78 38.40 1srm n ASN 59 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1srm n TYR 60 N -0.49 0.00 -3.55 3.10 4.02 -0.62 -4.78 117.16 114.85 1srm n TYR 60 Ca 0.17 -0.33 0.00 0.00 -0.01 0.00 0.00 57.90 57.73 1srm n TYR 60 Cb 0.16 -0.08 0.00 0.00 -0.02 0.00 0.00 39.34 39.40 1srm n TYR 60 CO 0.00 0.00 0.00 1.55 -1.01 0.00 0.00 176.86 177.40 1srm n VAL 61 N -0.46 0.00 0.00 -0.72 3.14 -1.21 0.17 118.33 119.24 1srm n VAL 61 Ca 0.05 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.43 1srm n VAL 61 Cb 0.64 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.42 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 -1.77 1.55 0.00 -1.23 -4.65 120.51 111.42 1srm n ALA 62 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.02 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 -1.85 4.15 0.00 0.00 0.05 -1.26 -3.15 135.00 132.94 1srm s PRO 63 Ca 0.00 2.52 0.00 0.00 0.05 0.00 0.00 61.00 63.57 1srm s PRO 63 Cb 0.00 -3.66 0.00 0.00 0.05 0.00 0.00 34.50 30.89 1srm s PRO 63 CO 0.00 -0.83 0.00 -1.13 0.05 0.00 0.00 177.00 175.09