#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c7c s ARG 4 N 0.00 3.21 0.27 6.28 6.06 -1.26 -4.83 118.95 128.68 2c7c s ARG 4 Ca 0.00 -0.56 -0.29 0.00 -2.50 0.00 0.00 55.73 52.38 2c7c s ARG 4 Cb 0.00 -4.00 -0.09 0.00 0.06 0.00 0.00 34.95 30.92 2c7c s ARG 4 CO 0.00 -1.07 1.16 -1.25 -2.50 0.00 0.00 175.30 171.64 2c7c s PRO 5 N 2.74 4.56 -1.31 5.12 0.04 -1.26 -4.93 135.00 139.95 2c7c s PRO 5 Ca 0.20 1.89 -0.08 0.00 0.04 0.00 0.00 61.00 63.05 2c7c s PRO 5 Cb -0.16 -3.18 0.14 0.00 0.04 0.00 0.00 34.50 31.34 2c7c s PRO 5 CO 0.16 0.08 2.11 -0.11 0.04 0.00 0.00 177.00 179.29 2c7c n LEU 6 N 1.39 7.29 -1.54 -3.56 -0.00 -1.26 -4.18 117.00 115.12 2c7c n LEU 6 Ca 0.00 -4.74 0.00 0.00 -0.00 0.00 0.00 56.01 51.28 2c7c n LEU 6 Cb 0.44 -1.43 0.00 0.00 -0.00 0.00 0.00 43.42 42.43 2c7c n LEU 6 CO 0.55 1.68 -0.45 0.00 -0.00 0.00 0.00 177.39 179.17 2c7c n HIS 7 N 3.00 -4.25 0.00 1.96 1.44 -1.26 -4.71 115.22 111.39 2c7c n HIS 7 Ca 0.50 2.27 0.00 0.00 -2.01 0.00 0.00 57.72 58.48 2c7c n HIS 7 Cb 0.31 -3.46 0.00 0.00 0.12 0.00 0.00 29.99 26.96 2c7c n HIS 7 CO 0.00 0.00 0.00 -3.47 -2.81 0.00 0.00 176.34 170.06 2c7c n ASP 8 N -1.28 0.00 -4.80 4.39 2.03 -0.13 -4.93 116.55 111.83 2c7c n ASP 8 Ca 0.00 0.00 -0.33 0.00 0.52 0.00 0.00 54.79 54.98 2c7c n ASP 8 Cb 0.11 0.00 -0.00 0.00 -0.72 0.00 0.00 41.12 40.50 2c7c n ASP 8 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2c7c s ARG 9 N 0.00 3.48 0.03 -0.67 3.03 -1.26 -1.66 118.95 121.91 2c7c s ARG 9 Ca 0.00 1.22 0.01 0.00 2.03 0.00 0.00 55.73 58.99 2c7c s ARG 9 Cb 0.00 -2.06 -0.02 0.00 -1.03 0.00 0.00 34.95 31.84 2c7c s ARG 9 CO 0.00 -0.68 -0.05 0.08 -1.13 0.00 0.00 175.30 173.52 2c7c s VAL 10 N -2.35 0.32 -0.08 4.99 1.01 0.83 -2.30 120.40 122.82 2c7c s VAL 10 Ca 0.64 -1.04 0.02 0.00 0.00 0.00 0.00 61.98 61.61 2c7c s VAL 10 Cb -0.16 -0.49 0.01 0.00 0.00 0.00 0.00 36.38 35.74 2c7c s VAL 10 CO 0.32 -0.47 -0.15 -0.63 0.00 0.00 0.00 175.10 174.18 2c7c s ILE 11 N -1.55 1.34 0.10 2.22 1.01 0.38 -1.40 121.20 123.30 2c7c s ILE 11 Ca -0.12 -0.59 0.00 0.00 0.00 0.00 0.00 60.65 59.94 2c7c s ILE 11 Cb -0.09 -1.21 -0.04 0.00 0.01 0.00 0.00 42.46 41.13 2c7c s ILE 11 CO -0.01 0.40 -0.01 0.68 0.00 0.00 0.00 174.94 176.00 2c7c s VAL 12 N 0.66 0.42 -0.05 2.92 -7.23 -0.21 -0.60 120.40 116.30 2c7c s VAL 12 Ca -0.14 -1.90 -0.19 0.00 -1.81 0.00 0.00 61.98 57.94 2c7c s VAL 12 Cb -0.16 -1.80 -0.05 0.00 0.56 0.00 0.00 36.38 34.93 2c7c s VAL 12 CO 0.04 -0.75 0.53 -1.59 -0.31 0.00 0.00 175.10 173.02 2c7c s LYS 13 N -3.92 4.28 0.40 4.82 -2.85 -0.35 -0.79 119.74 121.33 2c7c s LYS 13 Ca 0.15 0.58 -0.25 0.00 -1.00 0.00 0.00 55.97 55.45 2c7c s LYS 13 Cb 0.07 -3.37 -0.08 0.00 -2.06 0.00 0.00 37.83 32.38 2c7c s LYS 13 CO -0.03 0.31 1.18 0.50 0.10 0.00 0.00 175.35 177.40 2c7c s ARG 14 N 0.09 4.06 0.30 1.78 3.52 -1.26 -1.54 118.95 125.90 2c7c s ARG 14 Ca 0.28 1.86 0.03 0.00 -0.13 0.00 0.00 55.73 57.77 2c7c s ARG 14 Cb -0.17 -2.68 0.05 0.00 -1.56 0.00 0.00 34.95 30.59 2c7c s ARG 14 CO 0.14 -0.32 0.42 1.63 -0.81 0.00 0.00 175.30 176.35 2c7c n LYS 15 N 0.09 0.62 -1.69 5.12 5.02 -0.24 -4.92 118.16 122.16 2c7c n LYS 15 Ca 0.04 -1.42 -0.62 0.00 -2.02 0.00 0.00 58.31 54.29 2c7c n LYS 15 Cb 0.46 -0.19 -0.09 0.00 -0.02 0.00 0.00 35.03 35.20 2c7c n LYS 15 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2c7c n GLU 16 N -1.70 0.55 -2.12 1.97 -0.58 -1.26 -4.79 120.64 112.72 2c7c n GLU 16 Ca 0.08 0.20 -0.42 0.00 -0.42 0.00 0.00 57.16 56.60 2c7c n GLU 16 Cb 0.28 -1.80 -0.03 0.00 -0.57 0.00 0.00 31.44 29.32 2c7c n GLU 16 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2c7c s VAL 17 N 3.60 3.32 -1.22 2.62 1.01 -1.26 -3.39 120.40 125.09 2c7c s VAL 17 Ca 1.03 0.85 -0.26 0.00 0.00 0.00 0.00 61.98 63.60 2c7c s VAL 17 Cb -1.29 -3.55 0.02 0.00 0.00 0.00 0.00 36.38 31.57 2c7c s VAL 17 CO 0.73 0.03 0.66 -0.62 0.00 0.00 0.00 175.10 175.90 2c7c n GLU 18 N 4.77 -0.80 -1.50 2.72 1.02 -0.15 -4.55 120.64 122.15 2c7c n GLU 18 Ca 0.13 0.22 -0.41 0.00 -0.02 0.00 0.00 57.16 57.09 2c7c n GLU 18 Cb 0.42 -3.25 -0.11 0.00 -0.02 0.00 0.00 31.44 28.48 2c7c n GLU 18 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 2c7c n THR 19 N -4.70 -0.02 0.37 2.62 -1.04 -1.22 -4.79 114.28 105.51 2c7c n THR 19 Ca -0.13 -0.23 0.09 0.00 -2.04 0.00 0.00 64.05 61.74 2c7c n THR 19 Cb 0.59 -1.19 0.40 0.00 -1.82 0.00 0.00 70.33 68.31 2c7c n THR 19 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 2c7c n LYS 20 N 8.60 0.11 -0.19 -2.82 4.01 -1.26 -1.17 118.16 125.44 2c7c n LYS 20 Ca 0.57 0.40 0.10 0.00 -0.51 0.00 0.00 58.31 58.87 2c7c n LYS 20 Cb 0.18 -1.73 0.27 0.00 -0.51 0.00 0.00 35.03 33.24 2c7c n LYS 20 CO 0.00 0.00 0.00 -1.13 -1.11 0.00 0.00 177.40 175.16 2c7c n SER 21 N -1.94 2.76 0.00 4.39 3.41 -1.26 -1.71 113.62 119.26 2c7c n SER 21 Ca 0.02 -1.92 0.08 0.00 -0.26 0.00 0.00 58.87 56.79 2c7c n SER 21 Cb 0.17 -0.25 0.48 0.00 -0.26 0.00 0.00 64.21 64.35 2c7c n SER 21 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2c7c n ALA 22 N 1.02 2.14 -1.20 7.33 0.00 -0.31 -4.22 120.51 125.26 2c7c n ALA 22 Ca 0.18 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2c7c n ALA 22 Cb 0.48 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.66 2c7c n ALA 22 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c7c n GLY 23 N 0.08 1.54 0.00 0.00 0.00 -1.26 -5.05 105.19 100.49 2c7c n GLY 23 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2c7c n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c7c n GLY 24 N 3.92 -0.31 0.23 -0.02 0.00 -1.26 -4.96 105.19 102.79 2c7c n GLY 24 Ca 0.00 0.57 -0.13 0.00 0.00 0.00 0.00 46.02 46.46 2c7c n GLY 24 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2c7c h ILE 25 N 0.00 1.29 -3.55 -0.61 2.04 -2.01 -3.44 117.51 111.24 2c7c h ILE 25 Ca 0.00 -1.48 -0.52 0.00 1.00 0.00 0.00 64.86 63.86 2c7c h ILE 25 Cb 0.00 1.52 -0.01 0.00 -0.74 0.00 0.00 36.82 37.59 2c7c h ILE 25 CO 0.00 0.48 0.40 -0.69 0.00 0.00 0.00 178.15 178.34 2c7c s VAL 26 N -4.37 4.34 0.08 1.67 1.01 -1.26 -5.05 120.40 116.81 2c7c s VAL 26 Ca -0.12 1.94 -0.30 0.00 0.00 0.00 0.00 61.98 63.50 2c7c s VAL 26 Cb 0.09 -4.24 -0.05 0.00 0.00 0.00 0.00 36.38 32.18 2c7c s VAL 26 CO 0.85 0.30 0.99 -0.22 0.00 0.00 0.00 175.10 177.01 2c7c s LEU 27 N -0.03 4.45 0.13 3.92 0.20 -1.26 -4.38 118.68 121.71 2c7c s LEU 27 Ca 0.48 1.78 -0.07 0.00 0.69 0.00 0.00 54.13 57.01 2c7c s LEU 27 Cb -0.25 -3.58 -0.06 0.00 -0.43 0.00 0.00 46.19 41.87 2c7c s LEU 27 CO 0.31 -0.16 0.40 0.28 -0.29 0.00 0.00 176.35 176.89 2c7c s THR 28 N 0.37 5.13 0.00 3.68 -1.32 -0.70 -5.03 115.64 117.77 2c7c s THR 28 Ca 0.49 0.20 0.00 0.00 -1.21 0.00 0.00 61.69 61.17 2c7c s THR 28 Cb -0.23 -3.63 0.00 0.00 -1.51 0.00 0.00 72.50 67.13 2c7c s THR 28 CO 0.30 0.10 0.00 0.61 -2.21 0.00 0.00 174.62 173.42 2c7c n GLY 29 N 0.31 0.47 3.74 6.08 0.00 -1.26 -4.49 105.19 110.03 2c7c n GLY 29 Ca -0.04 -1.90 -0.34 0.00 0.00 0.00 0.00 46.02 43.74 2c7c n GLY 29 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2c7c s SER 30 N -1.00 5.52 -0.01 1.61 0.01 -1.26 -4.86 113.70 113.71 2c7c s SER 30 Ca 0.00 0.16 0.01 0.00 1.31 0.00 0.00 55.95 57.43 2c7c s SER 30 Cb 0.00 -1.58 0.02 0.00 0.21 0.00 0.00 66.02 64.67 2c7c s SER 30 CO 0.00 0.33 0.73 0.00 0.41 0.00 0.00 173.24 174.71 2c7c n ALA 31 N 1.67 1.47 -2.12 1.44 0.00 -1.26 -5.03 120.51 116.67 2c7c n ALA 31 Ca -0.16 -0.83 -0.00 0.00 0.00 0.00 0.00 53.44 52.45 2c7c n ALA 31 Cb 0.53 -0.15 0.00 0.00 0.00 0.00 0.00 19.45 19.83 2c7c n ALA 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c7c n ALA 32 N -0.16 -0.01 -1.00 0.00 0.00 -1.26 -5.09 120.51 112.99 2c7c n ALA 32 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2c7c n ALA 32 Cb 0.53 -0.53 0.00 0.00 0.00 0.00 0.00 19.45 19.44 2c7c n ALA 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c7c n ALA 33 N -1.35 0.00 -2.00 0.00 0.00 -1.26 -5.15 120.51 110.75 2c7c n ALA 33 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2c7c n ALA 33 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 2c7c n ALA 33 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2c7c n LYS 34 N 0.00 0.00 -3.39 0.00 3.00 -1.26 -4.80 118.16 111.72 2c7c n LYS 34 Ca 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 58.31 58.33 2c7c n LYS 34 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 35.03 35.01 2c7c n LYS 34 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2c7c s SER 35 N 1.18 -1.23 0.30 3.14 0.15 -1.26 -0.98 113.70 115.00 2c7c s SER 35 Ca 0.00 1.18 0.25 0.00 0.70 0.00 0.00 55.95 58.08 2c7c s SER 35 Cb 0.00 2.19 1.03 0.00 -1.71 0.00 0.00 66.02 67.53 2c7c s SER 35 CO 0.00 -0.23 1.75 0.71 1.20 0.00 0.00 173.24 176.67 2c7c h THR 36 N 5.96 0.00 -3.36 6.45 1.35 -1.93 -3.44 112.91 117.94 2c7c h THR 36 Ca -0.20 -0.29 -0.57 0.00 -0.55 0.00 0.00 66.41 64.80 2c7c h THR 36 Cb 1.13 1.07 -0.07 0.00 -1.73 0.00 0.00 68.15 68.56 2c7c h THR 36 CO 0.17 0.00 0.04 -0.13 -0.25 0.00 0.00 175.52 175.35 2c7c s ARG 37 N -3.36 4.37 0.14 4.72 3.00 -1.26 -0.94 118.95 125.62 2c7c s ARG 37 Ca 0.04 0.73 0.02 0.00 0.00 0.00 0.00 55.73 56.52 2c7c s ARG 37 Cb 0.09 -3.47 -0.01 0.00 0.00 0.00 0.00 34.95 31.57 2c7c s ARG 37 CO 0.43 0.03 0.07 0.41 0.00 0.00 0.00 175.30 176.23 2c7c n GLY 38 N 3.27 3.74 3.34 -3.53 0.00 -0.14 -1.07 105.19 110.79 2c7c n GLY 38 Ca -0.03 -1.90 -0.08 0.00 0.00 0.00 0.00 46.02 44.01 2c7c n GLY 38 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2c7c s GLU 39 N -2.53 0.39 0.10 1.61 2.12 -0.59 -3.25 118.70 116.55 2c7c s GLU 39 Ca 0.10 1.04 -0.31 0.00 0.36 0.00 0.00 54.97 56.16 2c7c s GLU 39 Cb 0.00 0.30 -0.07 0.00 0.26 0.00 0.00 34.13 34.63 2c7c s GLU 39 CO 0.07 -0.22 1.27 0.08 -0.54 0.00 0.00 175.26 175.93 2c7c s VAL 40 N 2.30 3.70 -0.23 3.70 1.01 0.34 -1.21 120.40 130.01 2c7c s VAL 40 Ca -0.05 1.24 0.06 0.00 0.00 0.00 0.00 61.98 63.24 2c7c s VAL 40 Cb -0.11 -3.79 -0.20 0.00 0.00 0.00 0.00 36.38 32.28 2c7c s VAL 40 CO -0.14 0.11 -0.09 0.18 0.00 0.00 0.00 175.10 175.16 2c7c n LEU 41 N 3.77 2.06 -3.51 3.92 4.77 0.23 -1.88 117.00 126.37 2c7c n LEU 41 Ca 0.09 -0.07 -0.17 0.00 -0.03 0.00 0.00 56.01 55.84 2c7c n LEU 41 Cb 0.45 -0.50 -0.05 0.00 -2.33 0.00 0.00 43.42 40.99 2c7c n LEU 41 CO 0.57 0.80 0.46 0.00 -1.33 0.00 0.00 177.39 177.88 2c7c s ALA 42 N -2.52 -1.76 0.06 -1.18 0.00 -0.45 -4.81 121.76 111.10 2c7c s ALA 42 Ca -0.26 1.22 0.09 0.00 0.00 0.00 0.00 51.96 53.00 2c7c s ALA 42 Cb 0.08 0.09 -0.03 0.00 0.00 0.00 0.00 23.12 23.26 2c7c s ALA 42 CO 0.68 -0.42 -0.24 0.08 0.00 0.00 0.00 175.76 175.86 2c7c s VAL 43 N -1.56 1.95 1.01 0.00 1.01 -1.26 -0.47 120.40 121.08 2c7c s VAL 43 Ca -0.09 -1.39 -0.17 0.00 0.00 0.00 0.00 61.98 60.33 2c7c s VAL 43 Cb -0.00 -1.70 0.22 0.00 0.00 0.00 0.00 36.38 34.90 2c7c s VAL 43 CO 0.06 0.23 1.30 -0.83 0.00 0.00 0.00 175.10 175.86 2c7c s GLY 44 N -1.40 1.76 0.00 4.51 0.00 -0.97 -4.72 107.32 106.50 2c7c s GLY 44 Ca 0.10 -1.20 0.05 0.00 0.00 0.00 0.00 44.72 43.67 2c7c s GLY 44 CO 0.03 -0.39 1.10 0.70 0.00 0.00 0.00 173.10 174.53 2c7c n ASN 45 N -3.95 0.00 0.00 1.64 3.02 -1.26 -4.91 115.26 109.80 2c7c n ASN 45 Ca 0.15 0.40 0.00 0.00 -0.03 0.00 0.00 54.58 55.10 2c7c n ASN 45 Cb 0.59 -0.42 0.00 0.00 -0.61 0.00 0.00 39.78 39.34 2c7c n ASN 45 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2c7c n GLY 46 N -0.95 -0.91 3.04 7.41 0.00 -1.26 -4.96 105.19 107.56 2c7c n GLY 46 Ca 0.02 -2.14 -0.31 0.00 0.00 0.00 0.00 46.02 43.59 2c7c n GLY 46 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2c7c s ARG 47 N 0.00 2.43 -0.10 1.61 3.52 -0.08 -0.95 118.95 125.38 2c7c s ARG 47 Ca 0.00 -0.61 -0.26 0.00 -0.13 0.00 0.00 55.73 54.72 2c7c s ARG 47 Cb 0.00 -2.18 -0.27 0.00 -1.56 0.00 0.00 34.95 30.94 2c7c s ARG 47 CO 0.00 -0.22 0.86 0.82 -0.81 0.00 0.00 175.30 175.95 2c7c h ILE 48 N 6.02 1.67 -3.27 4.11 2.04 -1.85 -0.15 117.51 126.09 2c7c h ILE 48 Ca -0.39 -2.30 -0.58 0.00 1.00 0.00 0.00 64.86 62.59 2c7c h ILE 48 Cb 1.14 3.21 0.16 0.00 -0.74 0.00 0.00 36.82 40.59 2c7c h ILE 48 CO 0.55 0.62 -0.00 0.18 0.00 0.00 0.00 178.15 179.49 2c7c n LEU 49 N -4.47 2.63 0.00 1.44 4.77 -1.26 -3.94 117.00 116.17 2c7c n LEU 49 Ca -0.11 0.85 0.00 0.00 -0.03 0.00 0.00 56.01 56.72 2c7c n LEU 49 Cb 0.57 -1.32 0.00 0.00 -2.33 0.00 0.00 43.42 40.33 2c7c n LEU 49 CO 0.39 -2.07 0.00 1.21 -1.33 0.00 0.00 177.39 175.59 2c7c n GLU 50 N -0.45 0.00 0.00 3.23 4.07 -1.26 -4.81 120.64 121.42 2c7c n GLU 50 Ca 0.12 0.11 0.00 0.00 -0.06 0.00 0.00 57.16 57.33 2c7c n GLU 50 Cb 0.45 -2.25 0.00 0.00 -0.06 0.00 0.00 31.44 29.58 2c7c n GLU 50 CO 0.00 0.00 0.00 -1.71 -0.06 0.00 0.00 177.13 175.36 2c7c n ASN 51 N 1.22 0.00 -4.63 4.31 5.15 -1.25 -4.92 115.26 115.15 2c7c n ASN 51 Ca 0.00 0.00 -0.43 0.00 -0.60 0.00 0.00 54.58 53.55 2c7c n ASN 51 Cb 0.19 -0.04 -0.02 0.00 -0.53 0.00 0.00 39.78 39.38 2c7c n ASN 51 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 2c7c s GLY 52 N -0.13 1.42 0.00 8.20 0.00 -1.26 -4.89 107.32 110.66 2c7c s GLY 52 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 44.72 44.69 2c7c s GLY 52 CO 0.00 2.47 0.00 1.18 0.00 0.00 0.00 173.10 176.75 2c7c n GLU 53 N 7.26 0.00 -3.64 2.90 4.71 -1.26 -4.56 120.64 126.06 2c7c n GLU 53 Ca 0.14 0.00 -0.10 0.00 -0.01 0.00 0.00 57.16 57.19 2c7c n GLU 53 Cb 0.47 0.00 -0.07 0.00 -1.01 0.00 0.00 31.44 30.83 2c7c n GLU 53 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 2c7c s VAL 54 N 0.00 0.00 0.03 2.62 1.01 -1.26 -4.72 120.40 118.08 2c7c s VAL 54 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 61.98 61.97 2c7c s VAL 54 Cb 0.00 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.34 2c7c s VAL 54 CO 0.00 0.00 0.18 -1.59 0.00 0.00 0.00 175.10 173.69 2c7c s LYS 55 N 1.03 3.37 0.94 2.72 0.00 -0.07 -4.89 119.74 122.84 2c7c s LYS 55 Ca -0.05 -0.42 -0.13 0.00 0.00 0.00 0.00 55.97 55.37 2c7c s LYS 55 Cb -0.05 -3.02 0.16 0.00 0.00 0.00 0.00 37.83 34.91 2c7c s LYS 55 CO -0.10 0.63 1.15 -1.25 0.00 0.00 0.00 175.35 175.78 2c7c s PRO 56 N -2.25 0.89 0.06 1.78 0.04 -1.26 -0.90 135.00 133.36 2c7c s PRO 56 Ca 0.31 0.20 0.03 0.00 0.04 0.00 0.00 61.00 61.58 2c7c s PRO 56 Cb -0.13 -1.82 -0.04 0.00 0.04 0.00 0.00 34.50 32.56 2c7c s PRO 56 CO 0.23 -2.35 0.03 -0.51 0.04 0.00 0.00 177.00 174.45 2c7c s LEU 57 N -6.10 3.63 0.07 -3.56 1.43 -1.26 -4.65 118.68 108.24 2c7c s LEU 57 Ca 0.65 -0.06 0.24 0.00 -1.03 0.00 0.00 54.13 53.94 2c7c s LEU 57 Cb -0.13 -2.27 0.37 0.00 0.03 0.00 0.00 46.19 44.19 2c7c s LEU 57 CO 0.54 0.20 1.32 -0.67 0.23 0.00 0.00 176.35 177.97 2c7c n ASP 58 N 0.75 0.62 -4.83 2.29 4.64 -1.26 -4.90 116.55 113.86 2c7c n ASP 58 Ca -0.11 -0.02 -0.30 0.00 -1.38 0.00 0.00 54.79 52.99 2c7c n ASP 58 Cb 0.52 0.25 0.10 0.00 -1.04 0.00 0.00 41.12 40.94 2c7c n ASP 58 CO 0.00 0.00 0.00 0.68 -0.82 0.00 0.00 177.20 177.06 2c7c s VAL 59 N -3.12 2.71 0.08 5.18 -7.23 -1.26 -5.12 120.40 111.64 2c7c s VAL 59 Ca 0.07 0.23 -0.14 0.00 -1.81 0.00 0.00 61.98 60.34 2c7c s VAL 59 Cb 0.15 -3.05 0.02 0.00 0.56 0.00 0.00 36.38 34.06 2c7c s VAL 59 CO 0.72 -0.30 0.32 -1.59 -0.31 0.00 0.00 175.10 173.94 2c7c s LYS 60 N -5.28 0.92 0.02 4.82 -2.85 -1.26 -5.08 119.74 111.03 2c7c s LYS 60 Ca 0.61 -0.68 -0.30 0.00 -1.00 0.00 0.00 55.97 54.60 2c7c s LYS 60 Cb -0.13 0.40 -0.06 0.00 -2.06 0.00 0.00 37.83 35.97 2c7c s LYS 60 CO 0.53 -0.32 1.45 0.08 0.10 0.00 0.00 175.35 177.19 2c7c s VAL 61 N -3.32 3.53 0.00 1.79 1.01 -1.26 -3.06 120.40 119.09 2c7c s VAL 61 Ca 0.00 0.95 0.00 0.00 0.00 0.00 0.00 61.98 62.93 2c7c s VAL 61 Cb 0.02 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.78 2c7c s VAL 61 CO -0.08 0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.63 2c7c n GLY 62 N 3.71 1.27 3.79 4.51 0.00 -0.79 -5.02 105.19 112.67 2c7c n GLY 62 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 2c7c n GLY 62 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2c7c s ASP 63 N -1.64 6.02 -0.50 1.61 1.01 -1.17 -4.39 116.67 117.61 2c7c s ASP 63 Ca 0.00 1.94 -0.01 0.00 0.71 0.00 0.00 52.55 55.18 2c7c s ASP 63 Cb 0.00 -2.55 0.36 0.00 1.01 0.00 0.00 42.92 41.73 2c7c s ASP 63 CO 0.00 -1.00 2.00 -0.38 0.21 0.00 0.00 175.17 176.00 2c7c n ILE 64 N -1.41 3.21 -0.74 0.77 5.41 -1.26 -0.50 119.36 124.83 2c7c n ILE 64 Ca 0.10 -2.29 -0.32 0.00 1.00 0.00 0.00 62.75 61.24 2c7c n ILE 64 Cb 0.52 -1.18 0.14 0.00 -0.71 0.00 0.00 39.64 38.41 2c7c n ILE 64 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 176.55 177.88 2c7c n VAL 65 N -0.39 0.00 -5.21 1.39 0.24 -1.20 -4.48 118.33 108.68 2c7c n VAL 65 Ca 0.48 -0.12 -0.32 0.00 -2.04 0.00 0.00 64.34 62.34 2c7c n VAL 65 Cb 0.69 -0.76 -0.16 0.00 -1.47 0.00 0.00 33.84 32.13 2c7c n VAL 65 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2c7c s ILE 66 N -2.49 2.20 0.07 1.34 1.01 0.21 -0.97 121.20 122.57 2c7c s ILE 66 Ca 0.61 -1.02 -0.04 0.00 0.00 0.00 0.00 60.65 60.21 2c7c s ILE 66 Cb -0.22 -1.81 -0.03 0.00 0.01 0.00 0.00 42.46 40.42 2c7c s ILE 66 CO 0.64 0.57 0.05 0.72 0.00 0.00 0.00 174.94 176.92 2c7c s PHE 67 N -0.22 0.42 -0.76 3.97 -0.12 -0.12 -0.63 117.98 120.52 2c7c s PHE 67 Ca -0.02 -0.92 -0.26 0.00 -0.05 0.00 0.00 56.93 55.68 2c7c s PHE 67 Cb -0.13 -0.28 0.01 0.00 -0.63 0.00 0.00 43.02 41.98 2c7c s PHE 67 CO 0.03 -0.44 1.55 1.21 -0.05 0.00 0.00 175.22 177.52 2c7c s ASN 68 N -2.91 5.84 -1.08 1.98 2.47 0.21 -4.48 114.94 116.98 2c7c s ASN 68 Ca 0.07 -0.40 -0.23 0.00 0.42 0.00 0.00 52.86 52.72 2c7c s ASN 68 Cb 0.07 -2.55 -0.12 0.00 -1.45 0.00 0.00 41.25 37.20 2c7c s ASN 68 CO -0.10 -2.04 1.94 -0.67 -3.72 0.00 0.00 177.10 172.50 2c7c n ASP 69 N 10.79 2.83 -0.69 -4.21 -0.08 -1.26 -4.73 116.55 119.19 2c7c n ASP 69 Ca 0.17 -2.68 0.00 0.00 -1.51 0.00 0.00 54.79 50.77 2c7c n ASP 69 Cb 0.50 -1.61 0.00 0.00 2.34 0.00 0.00 41.12 42.35 2c7c n ASP 69 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2c7c n GLY 70 N 5.57 3.67 0.13 0.27 0.00 -1.26 -4.99 105.19 108.59 2c7c n GLY 70 Ca 0.46 -1.36 0.11 0.00 0.00 0.00 0.00 46.02 45.22 2c7c n GLY 70 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2c7c n TYR 71 N 0.00 0.72 0.23 1.61 9.36 -1.26 -2.40 117.16 125.42 2c7c n TYR 71 Ca 0.00 0.32 -0.14 0.00 3.32 0.00 0.00 57.90 61.40 2c7c n TYR 71 Cb 0.00 -1.02 -0.08 0.00 -0.63 0.00 0.00 39.34 37.61 2c7c n TYR 71 CO 0.00 0.00 0.00 0.78 0.22 0.00 0.00 176.86 177.86 2c7c h GLY 72 N 1.22 -0.64 -6.74 2.98 0.00 -1.97 -3.41 103.07 94.51 2c7c h GLY 72 Ca 0.00 0.24 -0.80 0.00 0.00 0.00 0.00 47.33 46.77 2c7c h GLY 72 CO 0.00 -0.23 0.90 -0.62 0.00 0.00 0.00 176.54 176.59 2c7c n VAL 73 N -5.24 0.13 -3.15 4.60 0.31 -1.01 -4.55 118.33 109.42 2c7c n VAL 73 Ca -0.10 -0.04 -0.18 0.00 -0.01 0.00 0.00 64.34 64.00 2c7c n VAL 73 Cb 0.30 -0.86 0.01 0.00 -0.91 0.00 0.00 33.84 32.37 2c7c n VAL 73 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2c7c s LYS 74 N 3.81 2.71 0.22 5.55 -0.14 0.10 -4.83 119.74 127.16 2c7c s LYS 74 Ca 1.05 -1.36 0.04 0.00 -1.36 0.00 0.00 55.97 54.34 2c7c s LYS 74 Cb -1.29 -2.65 -0.05 0.00 -1.68 0.00 0.00 37.83 32.16 2c7c s LYS 74 CO 0.72 -0.31 -0.03 0.45 -0.76 0.00 0.00 175.35 175.42 2c7c s SER 75 N -4.33 1.88 0.16 2.83 0.15 -1.26 -0.74 113.70 112.39 2c7c s SER 75 Ca 0.54 -1.18 -0.25 0.00 0.70 0.00 0.00 55.95 55.76 2c7c s SER 75 Cb -0.08 -0.01 0.06 0.00 -1.71 0.00 0.00 66.02 64.29 2c7c s SER 75 CO 0.32 -0.47 0.91 -0.70 1.20 0.00 0.00 173.24 174.50 2c7c s GLU 76 N -3.83 1.25 -0.59 5.44 -6.30 -0.40 -4.89 118.70 109.38 2c7c s GLU 76 Ca 0.26 -0.67 0.05 0.00 -2.50 0.00 0.00 54.97 52.12 2c7c s GLU 76 Cb 0.05 0.44 0.20 0.00 0.00 0.00 0.00 34.13 34.82 2c7c s GLU 76 CO 0.07 -0.57 0.53 1.17 0.02 0.00 0.00 175.26 176.49 2c7c n LYS 77 N -0.45 1.55 -3.33 4.30 3.00 -1.26 -1.08 118.16 120.89 2c7c n LYS 77 Ca -0.06 -4.12 -0.38 0.00 -0.00 0.00 0.00 58.31 53.75 2c7c n LYS 77 Cb 0.61 -2.02 -0.06 0.00 0.00 0.00 0.00 35.03 33.55 2c7c n LYS 77 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 2c7c s ILE 78 N -1.40 5.10 -0.41 3.15 1.09 -1.26 -4.56 121.20 122.91 2c7c s ILE 78 Ca 0.32 0.99 0.00 0.00 -1.10 0.00 0.00 60.65 60.86 2c7c s ILE 78 Cb 0.05 -3.82 0.00 0.00 -1.06 0.00 0.00 42.46 37.63 2c7c s ILE 78 CO -0.13 0.39 0.00 0.47 -0.10 0.00 0.00 174.94 175.58 2c7c n ASP 79 N 3.12 -5.10 -2.05 3.58 8.00 -1.26 -0.85 116.55 121.98 2c7c n ASP 79 Ca -0.08 0.10 -0.19 0.00 0.71 0.00 0.00 54.79 55.32 2c7c n ASP 79 Cb 0.52 -3.35 -0.03 0.00 -0.02 0.00 0.00 41.12 38.24 2c7c n ASP 79 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2c7c n ASN 80 N -0.59 -5.52 -4.71 -2.24 2.85 -1.26 -5.05 115.26 98.73 2c7c n ASN 80 Ca -0.04 0.09 -0.29 0.00 -0.11 0.00 0.00 54.58 54.23 2c7c n ASN 80 Cb 0.47 -4.60 0.13 0.00 1.24 0.00 0.00 39.78 37.02 2c7c n ASN 80 CO 0.00 0.00 0.00 -1.61 -2.11 0.00 0.00 177.26 173.54 2c7c s GLU 81 N -4.68 1.28 -0.49 1.20 8.01 -0.03 -5.06 118.70 118.94 2c7c s GLU 81 Ca 0.00 0.13 -0.20 0.00 0.01 0.00 0.00 54.97 54.91 2c7c s GLU 81 Cb 0.00 -1.87 0.05 0.00 -4.31 0.00 0.00 34.13 28.00 2c7c s GLU 81 CO 0.00 -2.07 0.64 -1.21 0.01 0.00 0.00 175.26 172.64 2c7c s GLU 82 N -5.46 3.17 -0.36 1.61 0.41 -1.26 -4.39 118.70 112.42 2c7c s GLU 82 Ca 0.65 -0.71 -0.15 0.00 -0.41 0.00 0.00 54.97 54.34 2c7c s GLU 82 Cb -0.12 -4.05 -0.00 0.00 -1.78 0.00 0.00 34.13 28.17 2c7c s GLU 82 CO 0.52 -1.17 0.35 0.14 -0.49 0.00 0.00 175.26 174.61 2c7c s VAL 83 N 2.76 5.18 0.04 2.63 -7.23 -0.25 -4.20 120.40 119.32 2c7c s VAL 83 Ca 0.18 -0.11 -0.27 0.00 -1.81 0.00 0.00 61.98 59.97 2c7c s VAL 83 Cb -0.17 -3.85 -0.05 0.00 0.56 0.00 0.00 36.38 32.87 2c7c s VAL 83 CO 0.14 -0.15 0.87 -0.76 -0.31 0.00 0.00 175.10 174.88 2c7c s LEU 84 N 1.97 4.42 -0.40 1.32 1.02 0.03 -1.28 118.68 125.78 2c7c s LEU 84 Ca 0.11 1.56 0.03 0.00 0.02 0.00 0.00 54.13 55.85 2c7c s LEU 84 Cb -0.17 -3.40 0.11 0.00 0.02 0.00 0.00 46.19 42.76 2c7c s LEU 84 CO 0.12 -0.10 0.14 -0.63 0.02 0.00 0.00 176.35 175.90 2c7c s ILE 85 N 0.36 1.98 0.47 -0.59 1.01 0.08 -1.05 121.20 123.46 2c7c s ILE 85 Ca 0.44 -2.46 0.07 0.00 0.00 0.00 0.00 60.65 58.69 2c7c s ILE 85 Cb -0.21 -2.43 -0.00 0.00 0.01 0.00 0.00 42.46 39.83 2c7c s ILE 85 CO 0.25 -0.71 0.35 0.00 0.00 0.00 0.00 174.94 174.83 2c7c s MET 86 N 0.64 2.34 0.71 2.79 0.23 -0.49 -0.72 119.30 124.80 2c7c s MET 86 Ca 0.13 -1.81 -0.11 0.00 -1.03 0.00 0.00 55.69 52.87 2c7c s MET 86 Cb -0.21 -2.17 0.02 0.00 -1.53 0.00 0.00 34.83 30.93 2c7c s MET 86 CO -0.08 -0.37 1.07 -1.54 -2.03 0.00 0.00 175.02 172.07 2c7c s SER 87 N -4.15 5.25 0.47 -1.18 1.04 -1.26 -0.12 113.70 113.75 2c7c s SER 87 Ca 0.41 1.54 0.15 0.00 0.48 0.00 0.00 55.95 58.53 2c7c s SER 87 Cb -0.01 -2.40 1.11 0.00 0.10 0.00 0.00 66.02 64.82 2c7c s SER 87 CO 0.24 -1.52 2.04 -0.08 0.98 0.00 0.00 173.24 174.90 2c7c h GLU 88 N -0.77 0.27 0.00 4.02 4.81 -1.63 -2.89 114.58 118.39 2c7c h GLU 88 Ca -0.44 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 2c7c h GLU 88 Cb 1.22 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.54 2c7c h GLU 88 CO 0.58 0.18 0.00 0.77 -0.73 0.00 0.00 179.01 179.80 2c7c h SER 89 N 0.28 0.00 1.22 1.04 0.02 -1.93 0.39 113.55 114.57 2c7c h SER 89 Ca 0.19 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 61.07 2c7c h SER 89 Cb 0.38 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.91 2c7c h SER 89 CO -0.04 0.00 -0.31 0.44 -1.14 0.00 0.00 176.83 175.78 2c7c h ASP 90 N 0.00 0.00 -3.35 3.07 3.32 -1.88 -3.46 116.42 114.12 2c7c h ASP 90 Ca 0.00 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.48 2c7c h ASP 90 Cb 0.23 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.71 2c7c h ASP 90 CO 0.00 0.31 0.25 -0.63 -1.72 0.00 0.00 179.24 177.45 2c7c s ILE 91 N -3.36 4.95 -0.23 0.35 1.01 0.13 -0.62 121.20 123.44 2c7c s ILE 91 Ca 0.02 1.51 -0.05 0.00 0.00 0.00 0.00 60.65 62.13 2c7c s ILE 91 Cb 0.09 -4.08 -0.18 0.00 0.01 0.00 0.00 42.46 38.30 2c7c s ILE 91 CO 0.68 0.11 -0.07 0.18 0.00 0.00 0.00 174.94 175.84 2c7c n LEU 92 N 4.74 2.63 -3.52 2.97 4.77 0.20 -4.95 117.00 123.84 2c7c n LEU 92 Ca 0.02 0.08 -0.08 0.00 -0.03 0.00 0.00 56.01 56.00 2c7c n LEU 92 Cb 0.50 -0.95 -0.02 0.00 -2.33 0.00 0.00 43.42 40.62 2c7c n LEU 92 CO 0.47 0.80 0.73 0.00 -1.33 0.00 0.00 177.39 178.06 2c7c s ALA 93 N -2.51 -1.85 0.00 -1.18 0.00 -0.97 -5.04 121.76 110.20 2c7c s ALA 93 Ca -0.32 1.05 0.00 0.00 0.00 0.00 0.00 51.96 52.69 2c7c s ALA 93 Cb 0.09 0.36 0.00 0.00 0.00 0.00 0.00 23.12 23.58 2c7c s ALA 93 CO 0.62 -0.69 0.00 -0.89 0.00 0.00 0.00 175.76 174.80 2c7c n ILE 94 N -0.24 0.00 0.00 0.00 5.41 -1.26 -0.62 119.36 122.65 2c7c n ILE 94 Ca -0.08 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.67 2c7c n ILE 94 Cb 0.61 -0.52 0.00 0.00 -0.71 0.00 0.00 39.64 39.03 2c7c n ILE 94 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07