#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dyo n ASP 6 N 0.00 0.00 -0.20 2.55 2.03 -1.23 -4.42 116.55 115.29 1dyo n ASP 6 Ca 0.00 0.00 0.06 0.00 0.52 0.00 0.00 54.79 55.37 1dyo n ASP 6 Cb 0.00 0.00 0.11 0.00 -0.72 0.00 0.00 41.12 40.51 1dyo n ASP 6 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1dyo n ALA 7 N 0.00 2.26 0.00 -1.67 0.00 -1.26 -4.80 120.51 115.03 1dyo n ALA 7 Ca 0.00 -1.91 0.00 0.00 0.00 0.00 0.00 53.44 51.53 1dyo n ALA 7 Cb 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 19.45 19.15 1dyo n ALA 7 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dyo n GLY 8 N -0.84 0.89 3.82 0.00 0.00 -1.26 -5.00 105.19 102.81 1dyo n GLY 8 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 1dyo n GLY 8 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1dyo s TYR 9 N -2.00 3.77 -0.07 1.61 2.02 -1.26 -2.53 117.35 118.89 1dyo s TYR 9 Ca 0.00 1.14 0.08 0.00 -0.37 0.00 0.00 57.07 57.92 1dyo s TYR 9 Cb 0.00 -2.40 -0.24 0.00 -0.40 0.00 0.00 41.96 38.92 1dyo s TYR 9 CO 0.00 0.61 0.55 0.66 -1.57 0.00 0.00 175.55 175.80 1dyo n TYR 10 N 1.79 1.01 -3.86 2.71 4.01 0.33 -3.49 117.16 119.66 1dyo n TYR 10 Ca -0.12 0.32 -0.11 0.00 -0.16 0.00 0.00 57.90 57.82 1dyo n TYR 10 Cb 0.51 -1.17 -0.10 0.00 -0.31 0.00 0.00 39.34 38.28 1dyo n TYR 10 CO 0.00 0.00 0.00 1.52 -0.46 0.00 0.00 176.86 177.92 1dyo s TYR 11 N -2.58 0.03 -0.37 -0.72 -0.85 -0.98 -4.84 117.35 107.03 1dyo s TYR 11 Ca -0.10 -0.10 0.05 0.00 -0.52 0.00 0.00 57.07 56.40 1dyo s TYR 11 Cb 0.08 -0.04 0.17 0.00 0.38 0.00 0.00 41.96 42.54 1dyo s TYR 11 CO 0.81 -0.29 0.48 -1.58 -1.52 0.00 0.00 175.55 173.45 1dyo s HIS 12 N -1.36 -0.96 -0.39 -3.49 2.46 -1.24 -2.73 115.29 107.57 1dyo s HIS 12 Ca -0.14 -0.21 -0.21 0.00 0.47 0.00 0.00 55.06 54.97 1dyo s HIS 12 Cb -0.07 -0.09 0.01 0.00 -0.13 0.00 0.00 32.58 32.30 1dyo s HIS 12 CO 0.02 -1.05 0.67 -0.51 -2.47 0.00 0.00 174.74 171.40 1dyo s ASP 13 N 1.79 6.41 -0.08 9.88 1.01 0.19 -4.90 116.67 130.97 1dyo s ASP 13 Ca 0.15 0.00 0.02 0.00 0.71 0.00 0.00 52.55 53.43 1dyo s ASP 13 Cb -0.11 -2.34 -0.25 0.00 1.01 0.00 0.00 42.92 41.23 1dyo s ASP 13 CO -0.09 -0.70 0.50 0.41 0.21 0.00 0.00 175.17 175.50 1dyo n THR 14 N 5.75 1.71 -1.02 -1.27 -1.04 -1.26 -0.93 114.28 116.22 1dyo n THR 14 Ca -0.00 -0.72 -0.01 0.00 -2.04 0.00 0.00 64.05 61.28 1dyo n THR 14 Cb 0.48 -1.43 -0.00 0.00 -1.82 0.00 0.00 70.33 67.56 1dyo n THR 14 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1dyo n PHE 15 N -3.29 0.00 -2.35 -1.42 3.72 -1.25 -4.50 117.46 108.36 1dyo n PHE 15 Ca -0.25 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.72 1dyo n PHE 15 Cb 1.05 -0.50 0.00 0.00 -0.94 0.00 0.00 39.48 39.09 1dyo n PHE 15 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1dyo n GLU 16 N -2.91 3.11 -0.56 -1.08 -0.58 -1.26 -4.02 120.64 113.35 1dyo n GLU 16 Ca -0.01 -3.11 0.00 0.00 -0.42 0.00 0.00 57.16 53.62 1dyo n GLU 16 Cb 0.04 -3.42 0.00 0.00 -0.57 0.00 0.00 31.44 27.49 1dyo n GLU 16 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1dyo n GLY 17 N 4.96 0.68 3.65 0.62 0.00 -1.26 -5.04 105.19 108.79 1dyo n GLY 17 Ca 0.49 -0.42 -0.02 0.00 0.00 0.00 0.00 46.02 46.07 1dyo n GLY 17 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1dyo s SER 18 N -2.38 -0.25 0.32 1.61 0.15 -1.26 -5.03 113.70 106.87 1dyo s SER 18 Ca 0.00 0.43 0.26 0.00 0.70 0.00 0.00 55.95 57.34 1dyo s SER 18 Cb 0.00 0.81 0.83 0.00 -1.71 0.00 0.00 66.02 65.95 1dyo s SER 18 CO 0.00 -0.07 1.76 -0.37 1.20 0.00 0.00 173.24 175.76 1dyo h VAL 19 N 4.24 0.00 0.00 4.45 -1.51 -1.94 -3.34 116.25 118.16 1dyo h VAL 19 Ca -0.27 -0.53 0.00 0.00 -1.23 0.00 0.00 66.70 64.66 1dyo h VAL 19 Cb 1.18 1.47 0.00 0.00 -2.13 0.00 0.00 31.29 31.81 1dyo h VAL 19 CO 0.19 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 177.14 1dyo n GLY 20 N 0.76 1.97 0.95 5.19 0.00 -1.26 -1.90 105.19 110.90 1dyo n GLY 20 Ca 0.04 -0.57 0.07 0.00 0.00 0.00 0.00 46.02 45.56 1dyo n GLY 20 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1dyo n GLN 21 N 13.19 2.31 -2.24 1.61 1.13 -1.26 -4.95 117.38 127.16 1dyo n GLN 21 Ca 0.00 -1.76 -0.42 0.00 -1.94 0.00 0.00 57.00 52.89 1dyo n GLN 21 Cb 0.00 -1.46 -0.03 0.00 0.11 0.00 0.00 30.24 28.86 1dyo n GLN 21 CO 0.00 0.00 0.00 -1.58 -1.44 0.00 0.00 177.06 174.04 1dyo s TRP 22 N -1.47 3.29 0.26 1.08 0.52 -0.80 -4.53 118.94 117.29 1dyo s TRP 22 Ca 0.32 1.15 0.02 0.00 0.02 0.00 0.00 56.10 57.61 1dyo s TRP 22 Cb 0.18 -3.59 -0.04 0.00 -1.15 0.00 0.00 33.47 28.87 1dyo s TRP 22 CO 0.20 -1.92 0.14 0.95 0.02 0.00 0.00 176.95 176.34 1dyo s THR 23 N 0.58 0.25 0.37 2.01 -4.23 0.93 -4.96 115.64 110.59 1dyo s THR 23 Ca 0.59 -2.00 -0.24 0.00 -1.18 0.00 0.00 61.69 58.86 1dyo s THR 23 Cb -0.35 -2.54 -0.10 0.00 1.34 0.00 0.00 72.50 70.85 1dyo s THR 23 CO 0.34 0.00 0.99 0.00 -0.54 0.00 0.00 174.62 175.41 1dyo s ALA 24 N -3.82 3.13 -0.24 3.99 0.00 -1.26 0.05 121.76 123.60 1dyo s ALA 24 Ca 0.38 0.58 -0.04 0.00 0.00 0.00 0.00 51.96 52.88 1dyo s ALA 24 Cb 0.06 -3.21 0.01 0.00 0.00 0.00 0.00 23.12 19.97 1dyo s ALA 24 CO 0.15 0.00 -0.03 0.50 0.00 0.00 0.00 175.76 176.39 1dyo s ARG 25 N -2.44 3.15 0.98 0.00 3.52 0.28 -4.74 118.95 119.70 1dyo s ARG 25 Ca 0.55 -0.78 0.00 0.00 -0.13 0.00 0.00 55.73 55.38 1dyo s ARG 25 Cb -0.18 -3.06 0.00 0.00 -1.56 0.00 0.00 34.95 30.15 1dyo s ARG 25 CO 0.23 -0.30 0.00 0.41 -0.81 0.00 0.00 175.30 174.83 1dyo n GLY 26 N 4.77 -1.88 0.04 8.12 0.00 -1.26 -1.32 105.19 113.65 1dyo n GLY 26 Ca -0.17 -1.56 0.05 0.00 0.00 0.00 0.00 46.02 44.34 1dyo n GLY 26 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1dyo n PRO 27 N 0.00 1.05 -0.06 1.61 -0.04 -1.26 -4.82 135.00 131.48 1dyo n PRO 27 Ca 0.00 -0.07 -0.04 0.00 -0.04 0.00 0.00 63.50 63.34 1dyo n PRO 27 Cb 0.00 -1.15 0.04 0.00 -0.04 0.00 0.00 33.50 32.35 1dyo n PRO 27 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1dyo n ALA 28 N -0.58 -0.73 -3.11 0.55 0.00 -1.25 -4.86 120.51 110.53 1dyo n ALA 28 Ca 0.07 -0.23 -0.12 0.00 0.00 0.00 0.00 53.44 53.16 1dyo n ALA 28 Cb 0.05 -0.02 -0.11 0.00 0.00 0.00 0.00 19.45 19.37 1dyo n ALA 28 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1dyo s GLU 29 N -3.32 0.35 0.00 0.00 2.12 0.29 -4.82 118.70 113.31 1dyo s GLU 29 Ca 0.10 0.07 0.06 0.00 0.36 0.00 0.00 54.97 55.56 1dyo s GLU 29 Cb -0.02 0.16 -0.02 0.00 0.26 0.00 0.00 34.13 34.51 1dyo s GLU 29 CO 0.08 -0.07 -0.18 0.14 -0.54 0.00 0.00 175.26 174.69 1dyo s VAL 30 N -0.40 1.46 0.11 3.70 -7.23 -1.26 -0.81 120.40 115.96 1dyo s VAL 30 Ca -0.05 -0.87 -0.25 0.00 -1.81 0.00 0.00 61.98 59.00 1dyo s VAL 30 Cb -0.03 -1.23 0.08 0.00 0.56 0.00 0.00 36.38 35.75 1dyo s VAL 30 CO 0.01 0.34 0.68 -1.48 -0.31 0.00 0.00 175.10 174.34 1dyo s LEU 31 N -0.62 -0.52 0.38 1.32 0.05 -0.51 -4.96 118.68 113.82 1dyo s LEU 31 Ca 0.07 0.03 -0.26 0.00 0.05 0.00 0.00 54.13 54.01 1dyo s LEU 31 Cb -0.07 2.44 -0.09 0.00 -2.05 0.00 0.00 46.19 46.42 1dyo s LEU 31 CO -0.00 -0.86 1.18 -0.76 -0.55 0.00 0.00 176.35 175.35 1dyo s LEU 32 N -2.62 4.25 0.01 1.48 1.02 -1.26 0.42 118.68 121.98 1dyo s LEU 32 Ca 0.02 2.37 -0.00 0.00 0.02 0.00 0.00 54.13 56.54 1dyo s LEU 32 Cb -0.01 -3.95 -0.01 0.00 0.02 0.00 0.00 46.19 42.24 1dyo s LEU 32 CO -0.11 -0.61 -0.02 -0.55 0.02 0.00 0.00 176.35 175.08 1dyo s SER 33 N -1.05 0.14 0.00 2.29 0.15 0.58 -4.76 113.70 111.05 1dyo s SER 33 Ca 0.55 -0.30 0.08 0.00 0.70 0.00 0.00 55.95 56.98 1dyo s SER 33 Cb -0.32 0.06 0.22 0.00 -1.71 0.00 0.00 66.02 64.28 1dyo s SER 33 CO 0.40 -0.19 1.15 0.61 1.20 0.00 0.00 173.24 176.42 1dyo n GLY 34 N 2.16 2.50 0.22 9.45 0.00 -1.26 -0.08 105.19 118.18 1dyo n GLY 34 Ca -0.19 -0.28 0.01 0.00 0.00 0.00 0.00 46.02 45.55 1dyo n GLY 34 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1dyo h ARG 35 N 1.56 0.21 -3.35 1.61 2.43 -1.95 -3.46 114.38 111.42 1dyo h ARG 35 Ca 0.00 -0.07 -0.04 0.00 -0.81 0.00 0.00 59.98 59.06 1dyo h ARG 35 Cb 0.65 -0.02 -0.12 0.00 -0.42 0.00 0.00 29.97 30.06 1dyo h ARG 35 CO 0.00 0.47 -0.03 -0.08 -1.51 0.00 0.00 179.97 178.83 1dyo s THR 36 N -4.42 0.05 -0.11 0.20 -1.32 -1.26 -5.14 115.64 103.63 1dyo s THR 36 Ca -0.05 -0.60 -0.30 0.00 -1.21 0.00 0.00 61.69 59.53 1dyo s THR 36 Cb 0.14 -1.28 0.11 0.00 -1.51 0.00 0.00 72.50 69.96 1dyo s THR 36 CO 0.75 -0.23 0.91 0.00 -2.21 0.00 0.00 174.62 173.83 1dyo s ALA 37 N -3.82 -1.88 -0.15 11.08 0.00 -1.26 -3.59 121.76 122.14 1dyo s ALA 37 Ca 0.05 1.44 0.00 0.00 0.00 0.00 0.00 51.96 53.45 1dyo s ALA 37 Cb 0.01 -0.38 -0.23 0.00 0.00 0.00 0.00 23.12 22.51 1dyo s ALA 37 CO -0.09 -0.38 0.25 0.98 0.00 0.00 0.00 175.76 176.52 1dyo n TYR 38 N 0.62 0.83 -4.11 0.00 9.36 -1.26 -4.96 117.16 117.65 1dyo n TYR 38 Ca -0.12 0.20 -0.13 0.00 3.32 0.00 0.00 57.90 61.17 1dyo n TYR 38 Cb 0.58 -1.12 -0.11 0.00 -0.63 0.00 0.00 39.34 38.07 1dyo n TYR 38 CO 0.00 0.00 0.00 0.15 0.22 0.00 0.00 176.86 177.23 1dyo s LYS 39 N -2.55 0.65 3.85 2.98 1.02 -1.26 -5.09 119.74 119.34 1dyo s LYS 39 Ca -0.22 -0.96 0.00 0.00 0.02 0.00 0.00 55.97 54.81 1dyo s LYS 39 Cb 0.07 -0.30 0.00 0.00 -0.52 0.00 0.00 37.83 37.08 1dyo s LYS 39 CO 0.74 0.04 0.00 0.41 -0.92 0.00 0.00 175.35 175.62 1dyo n GLY 40 N 0.96 0.92 0.13 -3.33 0.00 -1.26 -4.26 105.19 98.35 1dyo n GLY 40 Ca -0.19 -0.65 0.01 0.00 0.00 0.00 0.00 46.02 45.19 1dyo n GLY 40 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1dyo n SER 41 N -2.72 1.43 -4.49 1.61 3.41 -1.26 -4.88 113.62 106.72 1dyo n SER 41 Ca 0.00 -1.28 -0.23 0.00 -0.26 0.00 0.00 58.87 57.10 1dyo n SER 41 Cb 0.00 -0.01 -0.11 0.00 -0.26 0.00 0.00 64.21 63.83 1dyo n SER 41 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1dyo s GLU 42 N -0.38 1.70 0.34 4.33 0.41 -1.26 -4.47 118.70 119.36 1dyo s GLU 42 Ca 0.04 -1.93 -0.08 0.00 -0.41 0.00 0.00 54.97 52.59 1dyo s GLU 42 Cb 0.03 -1.14 0.02 0.00 -1.78 0.00 0.00 34.13 31.25 1dyo s GLU 42 CO 0.04 -0.09 0.56 -1.54 -0.49 0.00 0.00 175.26 173.74 1dyo s SER 43 N -3.53 0.48 -0.28 -0.19 1.04 0.88 -4.63 113.70 107.47 1dyo s SER 43 Ca 0.34 -1.28 -0.15 0.00 0.48 0.00 0.00 55.95 55.34 1dyo s SER 43 Cb 0.08 0.70 -0.03 0.00 0.10 0.00 0.00 66.02 66.86 1dyo s SER 43 CO 0.15 -1.37 0.38 -0.22 0.98 0.00 0.00 173.24 173.16 1dyo s LEU 44 N -3.15 4.09 0.13 2.42 2.96 0.18 -0.31 118.68 125.00 1dyo s LEU 44 Ca 0.25 0.23 -0.19 0.00 -0.22 0.00 0.00 54.13 54.20 1dyo s LEU 44 Cb -0.02 -2.43 -0.07 0.00 0.50 0.00 0.00 46.19 44.17 1dyo s LEU 44 CO 0.16 -0.22 0.62 -0.22 -1.32 0.00 0.00 176.35 175.37 1dyo s LEU 45 N 2.09 4.46 -0.17 -0.68 2.96 0.17 -0.58 118.68 126.93 1dyo s LEU 45 Ca 0.15 1.30 0.01 0.00 -0.22 0.00 0.00 54.13 55.37 1dyo s LEU 45 Cb -0.16 -3.15 0.03 0.00 0.50 0.00 0.00 46.19 43.41 1dyo s LEU 45 CO 0.10 0.19 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.50 1dyo s VAL 46 N -1.27 1.62 0.09 1.68 1.01 0.45 -1.42 120.40 122.56 1dyo s VAL 46 Ca 0.34 -0.79 0.01 0.00 0.00 0.00 0.00 61.98 61.54 1dyo s VAL 46 Cb -0.18 -1.59 -0.00 0.00 0.00 0.00 0.00 36.38 34.60 1dyo s VAL 46 CO 0.20 0.35 0.09 -2.11 0.00 0.00 0.00 175.10 173.64 1dyo n ARG 47 N 4.73 0.14 -1.65 2.72 1.85 0.01 -1.17 116.66 123.28 1dyo n ARG 47 Ca -0.16 -0.86 -0.20 0.00 -1.00 0.00 0.00 57.85 55.63 1dyo n ARG 47 Cb 0.49 0.74 -0.08 0.00 -1.05 0.00 0.00 32.46 32.55 1dyo n ARG 47 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1dyo n ASN 48 N -2.45 -5.47 -4.75 2.89 5.03 -1.26 -0.55 115.26 108.70 1dyo n ASN 48 Ca 0.02 0.46 -0.41 0.00 0.87 0.00 0.00 54.58 55.51 1dyo n ASN 48 Cb 0.16 -4.73 -0.03 0.00 -1.02 0.00 0.00 39.78 34.17 1dyo n ASN 48 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 1dyo s ARG 49 N -3.82 4.43 0.00 3.52 0.52 -1.26 -3.92 118.95 118.42 1dyo s ARG 49 Ca 0.00 2.06 0.00 0.00 -0.52 0.00 0.00 55.73 57.27 1dyo s ARG 49 Cb 0.00 -3.15 0.00 0.00 0.52 0.00 0.00 34.95 32.32 1dyo s ARG 49 CO 0.00 -0.13 0.87 0.25 0.02 0.00 0.00 175.30 176.31 1dyo n THR 50 N 1.71 0.74 -3.60 0.02 -2.24 -1.26 -4.84 114.28 104.82 1dyo n THR 50 Ca 0.03 -0.87 -0.16 0.00 -2.27 0.00 0.00 64.05 60.77 1dyo n THR 50 Cb 0.43 0.63 -0.07 0.00 -2.10 0.00 0.00 70.33 69.22 1dyo n THR 50 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1dyo s ALA 51 N -0.74 -1.50 0.50 6.98 0.00 -1.26 -5.03 121.76 120.70 1dyo s ALA 51 Ca 0.00 1.17 0.19 0.00 0.00 0.00 0.00 51.96 53.32 1dyo s ALA 51 Cb 0.00 -0.16 1.26 0.00 0.00 0.00 0.00 23.12 24.22 1dyo s ALA 51 CO 0.00 -0.33 2.05 0.00 0.00 0.00 0.00 175.76 177.48 1dyo h ALA 52 N 3.57 2.20 0.00 0.00 0.00 -1.86 -1.21 119.26 121.96 1dyo h ALA 52 Ca -0.28 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1dyo h ALA 52 Cb 1.15 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1dyo h ALA 52 CO 0.34 -0.29 0.00 0.11 0.00 0.00 0.00 179.25 179.42 1dyo h TRP 53 N 0.11 0.00 -4.14 0.00 5.08 -1.88 -3.30 115.95 111.82 1dyo h TRP 53 Ca 0.16 0.00 -0.50 0.00 1.08 0.00 0.00 58.89 59.63 1dyo h TRP 53 Cb 0.52 0.00 0.09 0.00 -3.00 0.00 0.00 29.16 26.77 1dyo h TRP 53 CO -0.00 0.00 0.40 -0.80 -1.28 0.00 0.00 178.44 176.76 1dyo s ASN 54 N -4.56 5.43 0.00 0.11 0.02 -0.46 -4.86 114.94 110.62 1dyo s ASN 54 Ca 0.03 2.08 0.00 0.00 -1.02 0.00 0.00 52.86 53.96 1dyo s ASN 54 Cb 0.09 -2.57 0.00 0.00 0.02 0.00 0.00 41.25 38.80 1dyo s ASN 54 CO 0.42 -1.42 0.00 0.61 0.02 0.00 0.00 177.10 176.74 1dyo n GLY 55 N -0.19 -0.84 3.42 0.66 0.00 -0.44 -4.57 105.19 103.23 1dyo n GLY 55 Ca 0.11 -0.21 -0.32 0.00 0.00 0.00 0.00 46.02 45.60 1dyo n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dyo s ALA 56 N -1.00 2.54 0.07 4.61 0.00 -0.80 -0.55 121.76 126.63 1dyo s ALA 56 Ca 0.00 -1.00 0.01 0.00 0.00 0.00 0.00 51.96 50.97 1dyo s ALA 56 Cb 0.00 -0.90 -0.04 0.00 0.00 0.00 0.00 23.12 22.18 1dyo s ALA 56 CO 0.00 0.51 -0.05 1.14 0.00 0.00 0.00 175.76 177.36 1dyo s GLN 57 N -0.56 0.71 -0.03 0.00 -2.07 0.11 -0.12 119.66 117.69 1dyo s GLN 57 Ca 0.08 -1.22 -0.01 0.00 -1.82 0.00 0.00 55.36 52.40 1dyo s GLN 57 Cb -0.11 -0.05 0.03 0.00 -1.09 0.00 0.00 33.01 31.78 1dyo s GLN 57 CO 0.01 -0.05 0.03 0.50 -1.32 0.00 0.00 175.29 174.46 1dyo s ARG 58 N -3.57 0.09 0.38 9.60 3.52 -0.43 -0.05 118.95 128.49 1dyo s ARG 58 Ca 0.07 0.22 -0.28 0.00 -0.13 0.00 0.00 55.73 55.61 1dyo s ARG 58 Cb 0.04 -0.46 -0.10 0.00 -1.56 0.00 0.00 34.95 32.86 1dyo s ARG 58 CO -0.06 -0.23 1.44 0.00 -0.81 0.00 0.00 175.30 175.64 1dyo s ALA 59 N 1.52 3.52 -0.17 6.12 0.00 -1.26 -1.75 121.76 129.73 1dyo s ALA 59 Ca -0.03 1.50 -0.05 0.00 0.00 0.00 0.00 51.96 53.38 1dyo s ALA 59 Cb -0.13 -3.58 -0.03 0.00 0.00 0.00 0.00 23.12 19.38 1dyo s ALA 59 CO -0.03 -0.98 -0.01 -0.51 0.00 0.00 0.00 175.76 174.23 1dyo s LEU 60 N -2.11 3.39 -0.28 0.00 1.43 -1.26 -4.85 118.68 115.01 1dyo s LEU 60 Ca 0.53 -0.09 -0.29 0.00 -1.03 0.00 0.00 54.13 53.25 1dyo s LEU 60 Cb -0.45 -1.83 0.01 0.00 0.03 0.00 0.00 46.19 43.95 1dyo s LEU 60 CO 0.60 0.16 1.13 0.21 0.23 0.00 0.00 176.35 178.68 1dyo s ASN 61 N 0.44 6.92 0.63 2.29 3.84 -1.26 -4.85 114.94 122.96 1dyo s ASN 61 Ca -0.02 1.23 0.42 0.00 0.21 0.00 0.00 52.86 54.71 1dyo s ASN 61 Cb -0.14 -2.54 2.29 0.00 -0.55 0.00 0.00 41.25 40.31 1dyo s ASN 61 CO 0.02 -0.86 2.29 1.55 -2.79 0.00 0.00 177.10 177.32 1dyo h PRO 62 N 8.18 0.00 -0.09 0.43 0.13 -1.99 0.46 132.00 139.11 1dyo h PRO 62 Ca -0.22 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.78 1dyo h PRO 62 Cb 1.07 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.19 1dyo h PRO 62 CO 1.01 0.00 -0.51 0.00 -0.23 0.00 0.00 178.00 178.27 1dyo h ARG 63 N 0.00 0.25 0.00 0.86 3.08 -2.00 -3.29 114.38 113.28 1dyo h ARG 63 Ca 0.00 -0.15 -0.38 0.00 0.07 0.00 0.00 59.98 59.52 1dyo h ARG 63 Cb 0.01 0.01 -0.07 0.00 0.08 0.00 0.00 29.97 30.01 1dyo h ARG 63 CO 0.00 0.71 -2.45 2.41 -1.07 0.00 0.00 179.97 179.57 1dyo n THR 64 N -3.94 1.46 -3.50 2.04 -1.04 -0.02 -4.66 114.28 104.61 1dyo n THR 64 Ca -0.02 -0.61 -0.41 0.00 -2.04 0.00 0.00 64.05 60.97 1dyo n THR 64 Cb 0.55 -1.26 -0.04 0.00 -1.82 0.00 0.00 70.33 67.76 1dyo n THR 64 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 1dyo s PHE 65 N -2.51 3.86 0.19 -1.42 0.08 0.14 -5.03 117.98 113.28 1dyo s PHE 65 Ca -0.31 -2.63 -0.31 0.00 0.12 0.00 0.00 56.93 53.81 1dyo s PHE 65 Cb 0.08 -3.53 -0.09 0.00 -0.57 0.00 0.00 43.02 38.92 1dyo s PHE 65 CO 0.63 -0.87 1.43 0.08 -0.10 0.00 0.00 175.22 176.38 1dyo s VAL 66 N -0.70 2.93 0.70 -0.44 1.01 -1.24 -4.32 120.40 118.35 1dyo s VAL 66 Ca 0.24 0.72 -0.16 0.00 0.00 0.00 0.00 61.98 62.78 1dyo s VAL 66 Cb -0.11 -3.46 0.02 0.00 0.00 0.00 0.00 36.38 32.83 1dyo s VAL 66 CO -0.09 0.09 1.23 -2.84 0.00 0.00 0.00 175.10 173.49 1dyo s PRO 67 N 0.38 2.29 0.00 2.72 0.02 -1.26 -1.19 135.00 137.96 1dyo s PRO 67 Ca 0.62 1.84 0.00 0.00 0.02 0.00 0.00 61.00 63.48 1dyo s PRO 67 Cb -0.40 -1.84 0.00 0.00 0.02 0.00 0.00 34.50 32.28 1dyo s PRO 67 CO 0.36 -1.74 0.00 0.41 -0.33 0.00 0.00 177.00 175.70 1dyo n GLY 68 N 0.52 2.85 3.90 0.52 0.00 0.54 -4.74 105.19 108.78 1dyo n GLY 68 Ca 0.14 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.88 1dyo n GLY 68 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1dyo s ASN 69 N -0.56 6.34 -0.12 1.61 0.02 -0.33 -4.66 114.94 117.25 1dyo s ASN 69 Ca 0.00 0.98 -0.05 0.00 -1.02 0.00 0.00 52.86 52.77 1dyo s ASN 69 Cb 0.00 -2.27 -0.04 0.00 0.02 0.00 0.00 41.25 38.97 1dyo s ASN 69 CO 0.00 -0.51 0.08 -0.89 0.02 0.00 0.00 177.10 175.80 1dyo s THR 70 N -2.61 4.97 0.21 1.60 2.01 -1.26 -0.93 115.64 119.62 1dyo s THR 70 Ca 0.48 0.01 -0.02 0.00 0.31 0.00 0.00 61.69 62.47 1dyo s THR 70 Cb -0.10 -3.16 -0.04 0.00 0.01 0.00 0.00 72.50 69.21 1dyo s THR 70 CO 0.40 0.58 0.17 -0.31 -0.69 0.00 0.00 174.62 174.77 1dyo s TYR 71 N -0.68 1.08 -0.10 4.92 2.02 0.28 -3.85 117.35 121.01 1dyo s TYR 71 Ca 0.12 -1.31 -0.02 0.00 -0.37 0.00 0.00 57.07 55.49 1dyo s TYR 71 Cb -0.12 -0.48 -0.03 0.00 -0.40 0.00 0.00 41.96 40.93 1dyo s TYR 71 CO 0.02 -0.68 -0.01 0.00 -1.57 0.00 0.00 175.55 173.31 1dyo s PHE 73 N -0.56 1.03 -0.06 0.00 0.08 0.26 0.01 117.98 118.74 1dyo s PHE 73 Ca 0.09 -0.20 -0.14 0.00 0.12 0.00 0.00 56.93 56.80 1dyo s PHE 73 Cb -0.12 -0.66 0.03 0.00 -0.57 0.00 0.00 43.02 41.70 1dyo s PHE 73 CO 0.02 -0.02 0.34 0.45 -0.10 0.00 0.00 175.22 175.91 1dyo s SER 74 N -0.28 -0.27 -0.05 1.36 0.15 -0.11 -0.75 113.70 113.75 1dyo s SER 74 Ca 0.04 0.35 -0.29 0.00 0.70 0.00 0.00 55.95 56.75 1dyo s SER 74 Cb -0.04 0.48 0.11 0.00 -1.71 0.00 0.00 66.02 64.85 1dyo s SER 74 CO -0.00 -0.32 0.89 0.54 1.20 0.00 0.00 173.24 175.54 1dyo s VAL 75 N -0.73 0.00 -0.03 4.45 0.11 0.08 -0.23 120.40 124.04 1dyo s VAL 75 Ca -0.08 0.00 0.06 0.00 -2.93 0.00 0.00 61.98 59.03 1dyo s VAL 75 Cb -0.04 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 33.79 1dyo s VAL 75 CO 0.03 0.00 -0.22 0.54 -3.33 0.00 0.00 175.10 172.12 1dyo s VAL 76 N -2.28 2.39 0.05 2.04 0.11 -0.91 0.12 120.40 121.92 1dyo s VAL 76 Ca 0.01 -0.98 -0.00 0.00 -2.93 0.00 0.00 61.98 58.08 1dyo s VAL 76 Cb -0.01 -1.87 -0.04 0.00 -1.53 0.00 0.00 36.38 32.94 1dyo s VAL 76 CO -0.04 0.58 -0.04 0.00 -3.33 0.00 0.00 175.10 172.28 1dyo s ALA 77 N -0.61 0.53 0.26 1.54 0.00 -0.21 -1.39 121.76 121.88 1dyo s ALA 77 Ca 0.09 -1.15 -0.21 0.00 0.00 0.00 0.00 51.96 50.70 1dyo s ALA 77 Cb -0.10 0.24 0.03 0.00 0.00 0.00 0.00 23.12 23.28 1dyo s ALA 77 CO -0.00 -0.32 0.68 -1.54 0.00 0.00 0.00 175.76 174.58 1dyo s SER 78 N -2.75 -0.29 0.11 0.00 1.04 -0.46 0.08 113.70 111.44 1dyo s SER 78 Ca 0.05 -0.54 -0.04 0.00 0.48 0.00 0.00 55.95 55.89 1dyo s SER 78 Cb 0.05 0.70 -0.03 0.00 0.10 0.00 0.00 66.02 66.84 1dyo s SER 78 CO -0.08 -1.27 0.11 0.72 0.98 0.00 0.00 173.24 173.70 1dyo s PHE 79 N -3.90 0.52 -0.06 5.02 -0.71 -1.26 -0.05 117.98 117.54 1dyo s PHE 79 Ca 0.10 -0.95 0.02 0.00 -1.04 0.00 0.00 56.93 55.06 1dyo s PHE 79 Cb -0.05 -0.28 -0.05 0.00 -1.21 0.00 0.00 43.02 41.43 1dyo s PHE 79 CO 0.04 -0.53 -0.03 -0.89 -1.34 0.00 0.00 175.22 172.48 1dyo n ILE 80 N -0.06 0.37 -4.11 -4.49 5.41 -1.26 -0.72 119.36 114.50 1dyo n ILE 80 Ca -0.10 -0.18 -0.14 0.00 1.00 0.00 0.00 62.75 63.33 1dyo n ILE 80 Cb 0.63 -0.79 -0.05 0.00 -0.71 0.00 0.00 39.64 38.71 1dyo n ILE 80 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 1dyo s GLU 81 N -2.13 1.76 0.00 0.38 1.03 -1.26 -4.56 118.70 113.92 1dyo s GLU 81 Ca -0.06 -1.70 0.00 0.00 0.03 0.00 0.00 54.97 53.24 1dyo s GLU 81 Cb 0.02 0.41 0.00 0.00 -0.80 0.00 0.00 34.13 33.76 1dyo s GLU 81 CO 0.18 -0.71 0.00 0.41 -1.33 0.00 0.00 175.26 173.81 1dyo n GLY 82 N -0.51 1.84 3.52 -3.83 0.00 -1.26 -4.59 105.19 100.35 1dyo n GLY 82 Ca 0.01 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.94 1dyo n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dyo s ALA 83 N -2.41 -0.81 -0.53 4.61 0.00 -1.26 -4.92 121.76 116.44 1dyo s ALA 83 Ca 0.00 -0.33 0.23 0.00 0.00 0.00 0.00 51.96 51.86 1dyo s ALA 83 Cb 0.00 0.87 0.03 0.00 0.00 0.00 0.00 23.12 24.02 1dyo s ALA 83 CO 0.00 -0.80 1.01 -1.13 0.00 0.00 0.00 175.76 174.84 1dyo n SER 84 N -0.34 0.60 -3.58 0.00 3.41 -1.26 -4.83 113.62 107.63 1dyo n SER 84 Ca -0.09 -0.12 -0.06 0.00 -0.26 0.00 0.00 58.87 58.34 1dyo n SER 84 Cb 0.62 0.81 -0.02 0.00 -0.26 0.00 0.00 64.21 65.36 1dyo n SER 84 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1dyo s SER 85 N -4.14 -0.28 0.24 4.04 1.04 -1.26 -4.26 113.70 109.09 1dyo s SER 85 Ca 0.03 -0.10 -0.05 0.00 0.48 0.00 0.00 55.95 56.30 1dyo s SER 85 Cb 0.14 0.37 -0.02 0.00 0.10 0.00 0.00 66.02 66.61 1dyo s SER 85 CO 0.80 -0.62 0.32 0.28 0.98 0.00 0.00 173.24 175.00 1dyo s THR 86 N -3.04 0.00 -0.28 2.02 -1.32 0.13 -4.98 115.64 108.17 1dyo s THR 86 Ca 0.08 -1.71 0.03 0.00 -1.21 0.00 0.00 61.69 58.87 1dyo s THR 86 Cb -0.01 -2.40 0.07 0.00 -1.51 0.00 0.00 72.50 68.65 1dyo s THR 86 CO -0.06 0.00 -0.06 -0.89 -2.21 0.00 0.00 174.62 171.41 1dyo s THR 87 N -3.92 2.04 0.18 5.08 2.01 -1.26 -1.17 115.64 118.60 1dyo s THR 87 Ca 0.31 -1.72 -0.30 0.00 0.31 0.00 0.00 61.69 60.30 1dyo s THR 87 Cb 0.03 -2.27 -0.08 0.00 0.01 0.00 0.00 72.50 70.19 1dyo s THR 87 CO 0.13 -0.19 1.11 -0.36 -0.69 0.00 0.00 174.62 174.62 1dyo s PHE 88 N 1.12 3.57 0.00 4.92 0.08 0.72 -0.71 117.98 127.69 1dyo s PHE 88 Ca -0.03 1.58 0.00 0.00 0.12 0.00 0.00 56.93 58.60 1dyo s PHE 88 Cb -0.19 -3.29 0.00 0.00 -0.57 0.00 0.00 43.02 38.96 1dyo s PHE 88 CO -0.07 -0.67 0.00 0.00 -0.10 0.00 0.00 175.22 174.38 1dyo n LYS 91 N 0.00 -0.07 -3.88 0.00 5.02 0.57 -1.45 118.16 118.34 1dyo n LYS 91 Ca 0.00 0.00 -0.35 0.00 -2.02 0.00 0.00 58.31 55.94 1dyo n LYS 91 Cb 0.00 0.00 -0.14 0.00 -0.02 0.00 0.00 35.03 34.87 1dyo n LYS 91 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1dyo s LEU 92 N 0.00 3.02 -0.17 -0.35 2.96 0.34 0.96 118.68 125.44 1dyo s LEU 92 Ca 0.00 -0.35 -0.08 0.00 -0.22 0.00 0.00 54.13 53.48 1dyo s LEU 92 Cb 0.00 -1.78 -0.04 0.00 0.50 0.00 0.00 46.19 44.86 1dyo s LEU 92 CO 0.00 -0.02 0.11 -1.58 -1.32 0.00 0.00 176.35 173.54 1dyo s GLN 93 N 1.49 3.86 0.32 1.98 0.74 0.42 -0.91 119.66 127.56 1dyo s GLN 93 Ca 0.06 -0.24 -0.11 0.00 0.05 0.00 0.00 55.36 55.11 1dyo s GLN 93 Cb -0.14 -3.27 0.02 0.00 1.10 0.00 0.00 33.01 30.72 1dyo s GLN 93 CO -0.02 0.45 0.58 1.52 -0.55 0.00 0.00 175.29 177.28 1dyo s TYR 94 N -0.09 0.45 -0.18 1.67 1.13 -0.75 -0.46 117.35 119.12 1dyo s TYR 94 Ca 0.09 -0.86 -0.04 0.00 -1.41 0.00 0.00 57.07 54.85 1dyo s TYR 94 Cb -0.12 0.33 -0.02 0.00 -1.10 0.00 0.00 41.96 41.05 1dyo s TYR 94 CO 0.00 -1.21 -0.03 0.08 -2.51 0.00 0.00 175.55 171.88 1dyo s VAL 95 N -3.28 3.82 0.47 -3.49 1.01 -0.41 0.49 120.40 119.01 1dyo s VAL 95 Ca 0.22 -0.37 -0.05 0.00 0.00 0.00 0.00 61.98 61.78 1dyo s VAL 95 Cb -0.02 -2.70 0.10 0.00 0.00 0.00 0.00 36.38 33.76 1dyo s VAL 95 CO 0.13 0.46 0.65 -0.90 0.00 0.00 0.00 175.10 175.43 1dyo n ASP 96 N 3.95 0.37 0.04 3.32 5.68 -0.25 -1.39 116.55 128.27 1dyo n ASP 96 Ca -0.17 -1.43 0.09 0.00 -0.50 0.00 0.00 54.79 52.78 1dyo n ASP 96 Cb 0.52 -0.46 0.38 0.00 -1.14 0.00 0.00 41.12 40.41 1dyo n ASP 96 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1dyo n GLY 97 N 0.50 -1.11 0.90 6.12 0.00 -1.24 -1.67 105.19 108.68 1dyo n GLY 97 Ca 0.09 -0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.22 1dyo n GLY 97 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1dyo n SER 98 N -1.75 2.75 0.00 1.61 3.41 -1.26 -4.92 113.62 113.47 1dyo n SER 98 Ca 0.03 -1.89 0.00 0.00 -0.26 0.00 0.00 58.87 56.75 1dyo n SER 98 Cb 0.20 -0.08 0.00 0.00 -0.26 0.00 0.00 64.21 64.07 1dyo n SER 98 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1dyo n GLY 99 N 1.34 0.51 3.62 5.00 0.00 -0.67 -5.02 105.19 109.97 1dyo n GLY 99 Ca 0.16 -0.46 -0.35 0.00 0.00 0.00 0.00 46.02 45.38 1dyo n GLY 99 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1dyo s THR 100 N -2.00 4.79 0.01 2.61 2.01 -1.26 -4.78 115.64 117.02 1dyo s THR 100 Ca 0.00 -0.03 -0.30 0.00 0.31 0.00 0.00 61.69 61.67 1dyo s THR 100 Cb 0.00 -3.18 -0.07 0.00 0.01 0.00 0.00 72.50 69.27 1dyo s THR 100 CO 0.00 0.44 1.58 -1.58 -0.69 0.00 0.00 174.62 174.37 1dyo s GLN 101 N 0.57 4.22 0.30 4.92 0.74 -1.26 -1.08 119.66 128.06 1dyo s GLN 101 Ca 0.04 2.19 0.10 0.00 0.05 0.00 0.00 55.36 57.73 1dyo s GLN 101 Cb -0.13 -3.71 -0.05 0.00 1.10 0.00 0.00 33.01 30.23 1dyo s GLN 101 CO 0.01 -0.72 -0.05 1.03 -0.55 0.00 0.00 175.29 175.00 1dyo s ARG 102 N 2.99 2.03 -0.10 1.67 1.81 0.18 -4.96 118.95 122.56 1dyo s ARG 102 Ca 0.71 -1.66 -0.01 0.00 -1.72 0.00 0.00 55.73 53.04 1dyo s ARG 102 Cb -0.35 -1.95 0.03 0.00 -0.45 0.00 0.00 34.95 32.23 1dyo s ARG 102 CO 0.30 0.26 -0.01 0.71 -0.68 0.00 0.00 175.30 175.87 1dyo s TYR 103 N -2.46 0.91 -0.02 -0.53 2.02 -1.26 -1.81 117.35 114.19 1dyo s TYR 103 Ca 0.32 -0.41 0.07 0.00 -0.37 0.00 0.00 57.07 56.69 1dyo s TYR 103 Cb -0.03 -0.93 -0.02 0.00 -0.40 0.00 0.00 41.96 40.58 1dyo s TYR 103 CO 0.18 -0.41 -0.24 0.34 -1.57 0.00 0.00 175.55 173.85 1dyo s ASP 104 N 1.89 2.86 -0.23 2.29 2.15 -0.09 -4.99 116.67 120.56 1dyo s ASP 104 Ca 0.04 -0.45 -0.23 0.00 0.43 0.00 0.00 52.55 52.35 1dyo s ASP 104 Cb -0.13 -0.39 -0.01 0.00 -0.30 0.00 0.00 42.92 42.08 1dyo s ASP 104 CO -0.06 0.29 0.72 -0.89 -0.17 0.00 0.00 175.17 175.06 1dyo s THR 105 N -0.50 4.93 -0.15 1.71 2.01 -1.26 -0.51 115.64 121.87 1dyo s THR 105 Ca 0.07 1.36 -0.16 0.00 0.31 0.00 0.00 61.69 63.27 1dyo s THR 105 Cb -0.10 -4.03 -0.24 0.00 0.01 0.00 0.00 72.50 68.15 1dyo s THR 105 CO -0.00 0.01 0.37 0.40 -0.69 0.00 0.00 174.62 174.71 1dyo h ILE 106 N 5.34 0.89 -2.33 1.82 2.04 -1.96 -3.48 117.51 119.82 1dyo h ILE 106 Ca -0.27 -2.29 0.00 0.00 1.00 0.00 0.00 64.86 63.30 1dyo h ILE 106 Cb 1.12 2.47 0.00 0.00 -0.74 0.00 0.00 36.82 39.67 1dyo h ILE 106 CO 0.82 0.60 0.15 -0.67 0.00 0.00 0.00 178.15 179.04 1dyo n ASP 107 N -4.02 -0.93 0.00 1.72 2.03 -1.26 -4.67 116.55 109.42 1dyo n ASP 107 Ca -0.29 -1.62 0.00 0.00 0.52 0.00 0.00 54.79 53.40 1dyo n ASP 107 Cb 0.84 1.54 0.00 0.00 -0.72 0.00 0.00 41.12 42.78 1dyo n ASP 107 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1dyo n LYS 109 N -0.24 0.00 -4.10 -0.67 4.76 -0.27 -4.41 118.16 113.23 1dyo n LYS 109 Ca -0.03 0.00 -0.36 0.00 -2.87 0.00 0.00 58.31 55.05 1dyo n LYS 109 Cb 0.25 0.00 -0.08 0.00 -1.84 0.00 0.00 35.03 33.36 1dyo n LYS 109 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 1dyo s THR 110 N -0.95 4.90 0.04 -0.18 -4.23 -1.26 -0.20 115.64 113.76 1dyo s THR 110 Ca 0.00 -0.02 -0.20 0.00 -1.18 0.00 0.00 61.69 60.29 1dyo s THR 110 Cb 0.00 -3.12 0.04 0.00 1.34 0.00 0.00 72.50 70.76 1dyo s THR 110 CO 0.00 0.58 0.45 0.54 -0.54 0.00 0.00 174.62 175.66 1dyo s VAL 111 N -0.70 0.04 0.04 2.29 0.11 -0.32 -4.97 120.40 116.90 1dyo s VAL 111 Ca 0.12 -0.37 -0.00 0.00 -2.93 0.00 0.00 61.98 58.80 1dyo s VAL 111 Cb -0.12 -0.94 0.01 0.00 -1.53 0.00 0.00 36.38 33.80 1dyo s VAL 111 CO 0.03 -0.20 0.06 0.61 -3.33 0.00 0.00 175.10 172.26 1dyo n GLY 112 N 0.53 -0.17 3.82 6.54 0.00 -1.26 -0.70 105.19 113.95 1dyo n GLY 112 Ca -0.19 -1.82 -0.32 0.00 0.00 0.00 0.00 46.02 43.70 1dyo n GLY 112 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1dyo s PRO 113 N -2.82 3.17 -1.50 1.61 0.02 -1.26 -4.15 135.00 130.06 1dyo s PRO 113 Ca 0.04 1.00 -0.12 0.00 0.02 0.00 0.00 61.00 61.94 1dyo s PRO 113 Cb -0.00 -2.02 0.07 0.00 0.02 0.00 0.00 34.50 32.57 1dyo s PRO 113 CO 0.02 -0.92 0.96 0.09 -0.33 0.00 0.00 177.00 176.83 1dyo n ASN 114 N -2.70 -4.44 -3.66 2.53 3.02 0.11 -4.98 115.26 105.13 1dyo n ASN 114 Ca 0.08 -0.77 -0.14 0.00 -0.03 0.00 0.00 54.58 53.72 1dyo n ASN 114 Cb 0.53 -3.96 -0.13 0.00 -0.61 0.00 0.00 39.78 35.61 1dyo n ASN 114 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1dyo s GLN 115 N -6.53 0.14 0.14 3.52 0.74 -1.26 -5.05 119.66 111.35 1dyo s GLN 115 Ca 0.58 0.73 -0.30 0.00 0.05 0.00 0.00 55.36 56.42 1dyo s GLN 115 Cb -0.29 -0.05 -0.07 0.00 1.10 0.00 0.00 33.01 33.70 1dyo s GLN 115 CO 0.82 -0.28 1.26 -1.58 -0.55 0.00 0.00 175.29 174.96 1dyo s TRP 116 N 2.38 3.36 0.05 1.67 0.52 -1.26 -4.48 118.94 121.19 1dyo s TRP 116 Ca 0.01 1.26 0.08 0.00 0.02 0.00 0.00 56.10 57.47 1dyo s TRP 116 Cb -0.12 -3.51 -0.03 0.00 -1.15 0.00 0.00 33.47 28.66 1dyo s TRP 116 CO -0.08 -1.58 -0.23 0.54 0.02 0.00 0.00 176.95 175.61 1dyo s VAL 117 N 0.53 2.39 -0.48 4.03 0.11 0.11 -4.90 120.40 122.20 1dyo s VAL 117 Ca 0.58 -1.33 -0.21 0.00 -2.93 0.00 0.00 61.98 58.09 1dyo s VAL 117 Cb -0.33 -1.96 0.04 0.00 -1.53 0.00 0.00 36.38 32.59 1dyo s VAL 117 CO 0.33 0.35 0.69 -2.28 -3.33 0.00 0.00 175.10 170.86 1dyo s HIS 118 N -0.86 3.02 -0.42 1.54 2.46 -1.26 -1.04 115.29 118.72 1dyo s HIS 118 Ca 0.13 -0.21 -0.25 0.00 0.47 0.00 0.00 55.06 55.20 1dyo s HIS 118 Cb -0.10 -3.53 0.02 0.00 -0.13 0.00 0.00 32.58 28.84 1dyo s HIS 118 CO 0.03 -1.00 0.88 -0.51 -2.47 0.00 0.00 174.74 171.67 1dyo s LEU 119 N 2.94 4.06 -0.20 8.88 1.43 0.33 -4.96 118.68 131.16 1dyo s LEU 119 Ca 0.21 0.21 -0.13 0.00 -1.03 0.00 0.00 54.13 53.40 1dyo s LEU 119 Cb -0.16 -3.14 0.06 0.00 0.03 0.00 0.00 46.19 42.99 1dyo s LEU 119 CO 0.17 -0.94 0.49 -0.47 0.23 0.00 0.00 176.35 175.84 1dyo s TYR 120 N 3.51 -0.70 -0.23 0.29 5.04 -1.26 -0.74 117.35 123.27 1dyo s TYR 120 Ca 0.35 1.49 -0.04 0.00 -2.44 0.00 0.00 57.07 56.44 1dyo s TYR 120 Cb -0.11 0.33 0.09 0.00 0.35 0.00 0.00 41.96 42.62 1dyo s TYR 120 CO 0.23 -0.37 0.18 1.21 -1.34 0.00 0.00 175.55 175.46 1dyo s ASN 121 N 1.19 2.09 0.20 4.32 3.84 0.07 -4.86 114.94 121.79 1dyo s ASN 121 Ca -0.07 -0.62 0.25 0.00 0.21 0.00 0.00 52.86 52.63 1dyo s ASN 121 Cb -0.06 0.11 0.90 0.00 -0.55 0.00 0.00 41.25 41.64 1dyo s ASN 121 CO -0.11 -0.37 1.75 -0.81 -2.79 0.00 0.00 177.10 174.77 1dyo n PRO 122 N 5.29 0.21 -3.25 0.43 -0.04 -1.26 -0.58 135.00 135.80 1dyo n PRO 122 Ca -0.05 0.27 -0.25 0.00 -0.04 0.00 0.00 63.50 63.43 1dyo n PRO 122 Cb 0.47 -1.79 -0.07 0.00 -0.04 0.00 0.00 33.50 32.07 1dyo n PRO 122 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1dyo n GLN 123 N -2.17 1.80 -3.70 0.54 1.13 -1.24 0.11 117.38 113.86 1dyo n GLN 123 Ca 0.04 -4.04 -0.36 0.00 -1.94 0.00 0.00 57.00 50.70 1dyo n GLN 123 Cb 0.34 -1.82 -0.10 0.00 0.11 0.00 0.00 30.24 28.77 1dyo n GLN 123 CO 0.00 0.00 0.00 -0.47 -1.44 0.00 0.00 177.06 175.15 1dyo s TYR 124 N -2.13 3.27 -0.20 1.08 5.04 0.10 -4.85 117.35 119.66 1dyo s TYR 124 Ca 0.39 0.13 -0.17 0.00 -2.44 0.00 0.00 57.07 54.99 1dyo s TYR 124 Cb 0.19 -2.26 -0.04 0.00 0.35 0.00 0.00 41.96 40.21 1dyo s TYR 124 CO -0.07 0.01 0.44 0.50 -1.34 0.00 0.00 175.55 175.08 1dyo s ARG 125 N 1.13 4.18 -0.03 4.97 3.52 -1.26 -0.55 118.95 130.90 1dyo s ARG 125 Ca 0.07 0.27 -0.30 0.00 -0.13 0.00 0.00 55.73 55.64 1dyo s ARG 125 Cb -0.14 -3.54 -0.03 0.00 -1.56 0.00 0.00 34.95 29.68 1dyo s ARG 125 CO 0.05 -0.07 1.11 0.42 -0.81 0.00 0.00 175.30 176.00 1dyo s ILE 126 N 1.39 4.47 0.23 4.11 1.01 -0.11 -4.91 121.20 127.39 1dyo s ILE 126 Ca 0.21 1.77 -0.30 0.00 0.00 0.00 0.00 60.65 62.32 1dyo s ILE 126 Cb -0.15 -4.14 -0.15 0.00 0.01 0.00 0.00 42.46 38.04 1dyo s ILE 126 CO 0.09 0.05 1.10 -2.65 0.00 0.00 0.00 174.94 173.53 1dyo n PRO 127 N 4.64 1.31 0.23 2.79 -0.02 -1.26 0.20 135.00 142.89 1dyo n PRO 127 Ca 0.09 0.46 0.16 0.00 -2.02 0.00 0.00 63.50 62.19 1dyo n PRO 127 Cb 0.48 -1.91 0.66 0.00 -0.02 0.00 0.00 33.50 32.71 1dyo n PRO 127 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1dyo h SER 128 N 2.75 0.00 -0.68 2.55 4.64 -1.91 -2.76 113.55 118.14 1dyo h SER 128 Ca -0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 1dyo h SER 128 Cb 1.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.43 1dyo h SER 128 CO 0.66 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.72 1dyo n ASP 129 N -2.78 4.00 -4.76 4.97 5.75 -1.26 -4.61 116.55 117.85 1dyo n ASP 129 Ca 0.01 -2.12 -0.39 0.00 -0.01 0.00 0.00 54.79 52.27 1dyo n ASP 129 Cb 0.26 -0.50 -0.05 0.00 -1.03 0.00 0.00 41.12 39.80 1dyo n ASP 129 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1dyo s ALA 130 N -1.28 3.33 0.23 2.12 0.00 -1.05 -3.68 121.76 121.43 1dyo s ALA 130 Ca 0.48 0.77 0.00 0.00 0.00 0.00 0.00 51.96 53.21 1dyo s ALA 130 Cb 0.27 -3.28 -0.05 0.00 0.00 0.00 0.00 23.12 20.06 1dyo s ALA 130 CO 0.30 -0.04 0.11 0.95 0.00 0.00 0.00 175.76 177.07 1dyo s THR 131 N -1.27 0.32 -0.09 0.00 -4.23 -0.49 -4.82 115.64 105.06 1dyo s THR 131 Ca 0.46 -2.00 -0.04 0.00 -1.18 0.00 0.00 61.69 58.93 1dyo s THR 131 Cb -0.28 -2.54 0.02 0.00 1.34 0.00 0.00 72.50 71.04 1dyo s THR 131 CO 0.35 -0.03 0.09 -0.67 -0.54 0.00 0.00 174.62 173.82 1dyo n ASP 132 N -0.36 -5.01 0.00 3.99 2.03 -1.26 -1.28 116.55 114.65 1dyo n ASP 132 Ca 0.00 1.08 0.00 0.00 0.52 0.00 0.00 54.79 56.39 1dyo n ASP 132 Cb 0.66 -3.15 0.00 0.00 -0.72 0.00 0.00 41.12 37.91 1dyo n ASP 132 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 1dyo n TYR 134 N 1.98 0.00 -3.43 -0.67 4.02 0.39 -4.18 117.16 115.27 1dyo n TYR 134 Ca -0.15 0.00 -0.37 0.00 -0.01 0.00 0.00 57.90 57.37 1dyo n TYR 134 Cb 0.29 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.54 1dyo n TYR 134 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1dyo s VAL 135 N -0.38 5.20 0.12 -0.72 0.11 -0.72 0.16 120.40 124.17 1dyo s VAL 135 Ca 0.00 0.79 0.02 0.00 -2.93 0.00 0.00 61.98 59.86 1dyo s VAL 135 Cb 0.00 -3.73 -0.04 0.00 -1.53 0.00 0.00 36.38 31.07 1dyo s VAL 135 CO 0.00 0.40 -0.04 -0.72 -3.33 0.00 0.00 175.10 171.41 1dyo s TYR 136 N 0.22 0.99 -0.08 1.54 1.13 0.27 -1.31 117.35 120.12 1dyo s TYR 136 Ca 0.22 -0.97 0.04 0.00 -1.41 0.00 0.00 57.07 54.96 1dyo s TYR 136 Cb -0.15 -0.57 -0.00 0.00 -1.10 0.00 0.00 41.96 40.14 1dyo s TYR 136 CO 0.09 -0.19 -0.22 0.08 -2.51 0.00 0.00 175.55 172.79 1dyo s VAL 137 N -3.66 1.90 0.21 -3.49 1.01 0.83 0.21 120.40 117.42 1dyo s VAL 137 Ca 0.16 -0.95 0.04 0.00 0.00 0.00 0.00 61.98 61.23 1dyo s VAL 137 Cb 0.06 -1.64 -0.01 0.00 0.00 0.00 0.00 36.38 34.78 1dyo s VAL 137 CO -0.02 0.53 0.21 -1.84 0.00 0.00 0.00 175.10 173.98 1dyo n GLU 138 N 3.37 0.30 -4.38 2.72 0.28 -0.53 -1.90 120.64 120.50 1dyo n GLU 138 Ca -0.19 -2.06 -0.27 0.00 -0.16 0.00 0.00 57.16 54.48 1dyo n GLU 138 Cb 0.53 1.74 -0.11 0.00 1.43 0.00 0.00 31.44 35.03 1dyo n GLU 138 CO 0.00 0.00 0.00 0.95 -0.16 0.00 0.00 177.13 177.92 1dyo s THR 139 N -2.83 2.67 0.14 3.84 -4.23 -1.24 -1.08 115.64 112.91 1dyo s THR 139 Ca 0.24 -1.92 -0.09 0.00 -1.18 0.00 0.00 61.69 58.74 1dyo s THR 139 Cb 0.01 -2.31 -0.10 0.00 1.34 0.00 0.00 72.50 71.44 1dyo s THR 139 CO 0.17 -0.13 1.41 0.00 -0.54 0.00 0.00 174.62 175.52 1dyo h ALA 140 N 3.03 0.49 -0.57 3.99 0.00 -1.21 -3.41 119.26 121.58 1dyo h ALA 140 Ca -0.46 -0.55 -0.31 0.00 0.00 0.00 0.00 54.91 53.60 1dyo h ALA 140 Cb 1.21 -0.06 -0.23 0.00 0.00 0.00 0.00 17.79 18.71 1dyo h ALA 140 CO 0.51 0.69 -0.66 -3.47 0.00 0.00 0.00 179.25 176.32 1dyo n ASP 141 N -3.96 -1.30 -3.59 0.00 2.03 -1.26 -4.87 116.55 103.61 1dyo n ASP 141 Ca -0.05 -3.34 -0.08 0.00 0.52 0.00 0.00 54.79 51.84 1dyo n ASP 141 Cb 0.66 1.06 -0.01 0.00 -0.72 0.00 0.00 41.12 42.11 1dyo n ASP 141 CO 0.00 0.00 0.00 1.51 -1.92 0.00 0.00 177.20 176.79 1dyo s ASP 142 N -1.65 -0.16 -0.27 1.67 1.47 -1.26 -4.98 116.67 111.48 1dyo s ASP 142 Ca 0.27 -0.79 0.09 0.00 1.18 0.00 0.00 52.55 53.29 1dyo s ASP 142 Cb 0.33 0.76 0.45 0.00 -0.34 0.00 0.00 42.92 44.11 1dyo s ASP 142 CO -0.06 -1.44 1.26 0.35 0.68 0.00 0.00 175.17 175.97 1dyo n THR 143 N -0.48 2.43 -1.74 2.11 -2.24 -1.26 -3.75 114.28 109.35 1dyo n THR 143 Ca -0.05 -3.58 -0.34 0.00 -2.27 0.00 0.00 64.05 57.81 1dyo n THR 143 Cb 0.59 -0.65 0.06 0.00 -2.10 0.00 0.00 70.33 68.23 1dyo n THR 143 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 1dyo s ILE 144 N -3.85 2.77 0.33 2.28 -4.36 -1.26 -4.49 121.20 112.62 1dyo s ILE 144 Ca 0.45 0.40 -0.28 0.00 -0.26 0.00 0.00 60.65 60.95 1dyo s ILE 144 Cb 0.40 -2.99 -0.10 0.00 1.25 0.00 0.00 42.46 41.02 1dyo s ILE 144 CO -0.02 -0.18 1.27 0.20 0.24 0.00 0.00 174.94 176.46 1dyo s ASN 145 N -2.10 6.79 0.21 4.36 0.02 -1.26 -4.87 114.94 118.09 1dyo s ASN 145 Ca 0.72 2.62 -0.06 0.00 -1.02 0.00 0.00 52.86 55.12 1dyo s ASN 145 Cb -0.26 -2.64 -0.02 0.00 0.02 0.00 0.00 41.25 38.34 1dyo s ASN 145 CO 0.40 -0.51 0.27 0.72 0.02 0.00 0.00 177.10 177.99 1dyo s PHE 146 N -1.17 0.75 0.02 2.20 -0.12 -0.32 -4.58 117.98 114.77 1dyo s PHE 146 Ca 0.49 -1.05 0.06 0.00 -0.05 0.00 0.00 56.93 56.38 1dyo s PHE 146 Cb -0.38 -0.22 -0.02 0.00 -0.63 0.00 0.00 43.02 41.77 1dyo s PHE 146 CO 0.50 -0.77 -0.19 0.71 -0.05 0.00 0.00 175.22 175.43 1dyo s TYR 147 N -4.08 1.65 0.16 3.49 1.51 0.93 -0.42 117.35 120.59 1dyo s TYR 147 Ca 0.29 -0.34 0.08 0.00 -1.01 0.00 0.00 57.07 56.09 1dyo s TYR 147 Cb 0.04 -1.02 -0.04 0.00 -0.11 0.00 0.00 41.96 40.83 1dyo s TYR 147 CO 0.09 0.03 -0.17 0.96 -1.11 0.00 0.00 175.55 175.34 1dyo s ILE 148 N -0.64 1.72 0.12 2.71 -4.36 0.25 -1.35 121.20 119.66 1dyo s ILE 148 Ca 0.06 -1.88 -0.13 0.00 -0.26 0.00 0.00 60.65 58.45 1dyo s ILE 148 Cb -0.08 -1.78 0.02 0.00 1.25 0.00 0.00 42.46 41.86 1dyo s ILE 148 CO 0.01 -0.33 0.32 -0.62 0.24 0.00 0.00 174.94 174.55 1dyo s ASP 149 N -2.62 -0.08 -1.25 4.36 -1.08 -0.49 -0.65 116.67 114.87 1dyo s ASP 149 Ca 0.14 -0.52 -0.07 0.00 -0.52 0.00 0.00 52.55 51.59 1dyo s ASP 149 Cb -0.06 0.43 -0.01 0.00 -1.46 0.00 0.00 42.92 41.83 1dyo s ASP 149 CO 0.06 -0.83 0.71 -0.62 0.52 0.00 0.00 175.17 175.00 1dyo n GLU 150 N -0.18 -3.34 -2.78 4.34 -0.58 -0.54 -2.14 120.64 115.42 1dyo n GLU 150 Ca -0.14 0.57 -0.42 0.00 -0.42 0.00 0.00 57.16 56.74 1dyo n GLU 150 Cb 0.63 -4.85 -0.03 0.00 -0.57 0.00 0.00 31.44 26.62 1dyo n GLU 150 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1dyo s ALA 151 N -3.63 3.62 -0.01 0.62 0.00 -0.10 -4.06 121.76 118.20 1dyo s ALA 151 Ca 0.18 0.06 0.02 0.00 0.00 0.00 0.00 51.96 52.23 1dyo s ALA 151 Cb -0.05 -3.39 -0.00 0.00 0.00 0.00 0.00 23.12 19.67 1dyo s ALA 151 CO 0.83 -0.89 -0.08 0.42 0.00 0.00 0.00 175.76 176.04 1dyo s ILE 152 N 2.78 0.61 -0.13 0.00 1.01 0.67 0.56 121.20 126.71 1dyo s ILE 152 Ca 0.40 -0.31 0.02 0.00 0.00 0.00 0.00 60.65 60.76 1dyo s ILE 152 Cb -0.16 -0.53 0.01 0.00 0.01 0.00 0.00 42.46 41.80 1dyo s ILE 152 CO 0.09 0.18 -0.20 -0.83 0.00 0.00 0.00 174.94 174.18 1dyo s GLY 153 N -0.06 1.26 0.07 6.18 0.00 -1.11 -0.93 107.32 112.74 1dyo s GLY 153 Ca 0.01 -0.98 0.01 0.00 0.00 0.00 0.00 44.72 43.76 1dyo s GLY 153 CO -0.00 0.07 0.07 0.00 0.00 0.00 0.00 173.10 173.24 1dyo n ALA 154 N 4.13 0.08 -1.78 3.20 0.00 0.10 0.12 120.51 126.37 1dyo n ALA 154 Ca -0.20 -0.39 -0.36 0.00 0.00 0.00 0.00 53.44 52.49 1dyo n ALA 154 Cb 0.51 0.32 -0.01 0.00 0.00 0.00 0.00 19.45 20.27 1dyo n ALA 154 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1dyo s VAL 155 N -2.36 3.28 0.35 0.00 1.01 -1.05 0.41 120.40 122.04 1dyo s VAL 155 Ca 0.08 0.91 -0.26 0.00 0.00 0.00 0.00 61.98 62.71 1dyo s VAL 155 Cb 0.00 -3.44 -0.13 0.00 0.00 0.00 0.00 36.38 32.82 1dyo s VAL 155 CO 0.05 -0.06 0.97 0.00 0.00 0.00 0.00 175.10 176.07 1dyo n ALA 156 N -0.63 -0.16 0.00 5.51 0.00 -1.25 -2.15 120.51 121.82 1dyo n ALA 156 Ca 0.08 0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.83 1dyo n ALA 156 Cb 0.49 -2.02 0.00 0.00 0.00 0.00 0.00 19.45 17.92 1dyo n ALA 156 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dyo n GLY 157 N 1.25 2.97 3.64 0.00 0.00 0.12 -4.88 105.19 108.28 1dyo n GLY 157 Ca 0.09 0.00 -0.59 0.00 0.00 0.00 0.00 46.02 45.53 1dyo n GLY 157 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1dyo n THR 158 N -2.00 0.08 -2.92 2.61 -2.24 -0.92 -4.87 114.28 104.03 1dyo n THR 158 Ca 0.00 -0.02 -0.42 0.00 -2.27 0.00 0.00 64.05 61.35 1dyo n THR 158 Cb 0.00 -0.66 -0.04 0.00 -2.10 0.00 0.00 70.33 67.52 1dyo n THR 158 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1dyo s VAL 159 N 1.81 4.87 0.00 2.28 1.01 -1.26 -4.83 120.40 124.27 1dyo s VAL 159 Ca 0.95 1.54 0.00 0.00 0.00 0.00 0.00 61.98 64.47 1dyo s VAL 159 Cb -1.19 -4.10 0.00 0.00 0.00 0.00 0.00 36.38 31.09 1dyo s VAL 159 CO 0.63 -0.03 0.38 -0.38 0.00 0.00 0.00 175.10 175.70