#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c7d s ARG 4 N 0.00 0.66 0.31 6.28 6.06 -1.26 -5.05 118.95 125.94 2c7d s ARG 4 Ca 0.00 -0.10 -0.30 0.00 -2.50 0.00 0.00 55.73 52.84 2c7d s ARG 4 Cb 0.00 0.11 -0.11 0.00 0.06 0.00 0.00 34.95 35.01 2c7d s ARG 4 CO 0.00 -0.99 1.56 -1.25 -2.50 0.00 0.00 175.30 172.12 2c7d s PRO 5 N 2.05 4.13 -1.21 5.12 0.04 -1.26 -4.90 135.00 138.97 2c7d s PRO 5 Ca 0.15 2.55 -0.05 0.00 0.04 0.00 0.00 61.00 63.70 2c7d s PRO 5 Cb -0.04 -3.02 0.20 0.00 0.04 0.00 0.00 34.50 31.69 2c7d s PRO 5 CO -0.12 -0.59 2.05 -0.11 0.04 0.00 0.00 177.00 178.28 2c7d n LEU 6 N 1.85 7.47 -1.58 -3.56 -0.00 -1.26 -4.23 117.00 115.70 2c7d n LEU 6 Ca 0.07 -5.03 0.00 0.00 -0.00 0.00 0.00 56.01 51.05 2c7d n LEU 6 Cb 0.38 -1.32 0.00 0.00 -0.00 0.00 0.00 43.42 42.48 2c7d n LEU 6 CO 0.63 1.91 -0.45 0.00 -0.00 0.00 0.00 177.39 179.49 2c7d n HIS 7 N 1.51 -4.36 0.00 1.96 1.44 -1.26 -4.67 115.22 109.84 2c7d n HIS 7 Ca 0.51 2.32 0.00 0.00 -2.01 0.00 0.00 57.72 58.54 2c7d n HIS 7 Cb 0.28 -3.51 0.00 0.00 0.12 0.00 0.00 29.99 26.88 2c7d n HIS 7 CO 0.00 0.00 0.00 -3.47 -2.81 0.00 0.00 176.34 170.06 2c7d n ASP 8 N -1.02 0.00 -4.81 4.39 2.03 0.27 -4.92 116.55 112.49 2c7d n ASP 8 Ca 0.00 0.00 -0.33 0.00 0.52 0.00 0.00 54.79 54.98 2c7d n ASP 8 Cb 0.04 -0.22 -0.03 0.00 -0.72 0.00 0.00 41.12 40.18 2c7d n ASP 8 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2c7d s ARG 9 N 0.00 3.80 0.06 -0.67 1.81 -1.26 -2.64 118.95 120.05 2c7d s ARG 9 Ca 0.00 1.25 0.05 0.00 -1.72 0.00 0.00 55.73 55.31 2c7d s ARG 9 Cb 0.00 -2.10 -0.03 0.00 -0.45 0.00 0.00 34.95 32.37 2c7d s ARG 9 CO 0.00 -0.41 -0.14 0.08 -0.68 0.00 0.00 175.30 174.14 2c7d s VAL 10 N -2.16 1.11 -0.11 3.52 1.01 0.96 -1.29 120.40 123.43 2c7d s VAL 10 Ca 0.65 -1.16 0.03 0.00 0.00 0.00 0.00 61.98 61.50 2c7d s VAL 10 Cb -0.14 -1.04 0.01 0.00 0.00 0.00 0.00 36.38 35.21 2c7d s VAL 10 CO 0.23 -0.12 -0.21 -0.63 0.00 0.00 0.00 175.10 174.38 2c7d s ILE 11 N -1.07 1.86 0.10 2.22 1.01 0.31 -1.62 121.20 124.01 2c7d s ILE 11 Ca -0.00 -0.88 0.03 0.00 0.00 0.00 0.00 60.65 59.79 2c7d s ILE 11 Cb -0.09 -1.63 -0.04 0.00 0.01 0.00 0.00 42.46 40.71 2c7d s ILE 11 CO 0.02 0.51 -0.08 0.68 0.00 0.00 0.00 174.94 176.07 2c7d s VAL 12 N 0.62 0.82 0.29 2.92 -7.23 0.18 -0.68 120.40 117.33 2c7d s VAL 12 Ca -0.13 -1.86 -0.12 0.00 -1.81 0.00 0.00 61.98 58.06 2c7d s VAL 12 Cb -0.16 -1.59 -0.08 0.00 0.56 0.00 0.00 36.38 35.10 2c7d s VAL 12 CO 0.03 -0.77 0.67 -1.59 -0.31 0.00 0.00 175.10 173.13 2c7d s LYS 13 N -3.51 3.90 0.40 4.82 -2.85 0.08 -0.42 119.74 122.17 2c7d s LYS 13 Ca 0.10 0.49 -0.25 0.00 -1.00 0.00 0.00 55.97 55.31 2c7d s LYS 13 Cb 0.02 -2.51 -0.08 0.00 -2.06 0.00 0.00 37.83 33.20 2c7d s LYS 13 CO -0.03 0.20 1.17 0.50 0.10 0.00 0.00 175.35 177.30 2c7d s ARG 14 N -3.01 4.06 -0.09 1.78 3.52 -1.26 -0.71 118.95 123.25 2c7d s ARG 14 Ca 0.51 1.85 -0.00 0.00 -0.13 0.00 0.00 55.73 57.96 2c7d s ARG 14 Cb -0.11 -2.69 -0.00 0.00 -1.56 0.00 0.00 34.95 30.60 2c7d s ARG 14 CO 0.20 -0.31 -0.01 0.87 -0.81 0.00 0.00 175.30 175.24 2c7d h LYS 15 N 2.66 0.00 -3.37 5.12 1.57 -1.56 -3.45 116.57 117.53 2c7d h LYS 15 Ca -0.49 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.25 2c7d h LYS 15 Cb 1.23 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 33.42 2c7d h LYS 15 CO 0.63 0.00 -0.04 -1.21 -0.57 0.00 0.00 179.45 178.25 2c7d s GLU 16 N -1.51 1.15 0.64 3.15 0.41 -1.26 -5.09 118.70 116.19 2c7d s GLU 16 Ca -0.01 -0.75 -0.13 0.00 -0.41 0.00 0.00 54.97 53.67 2c7d s GLU 16 Cb 0.00 0.48 -0.01 0.00 -1.78 0.00 0.00 34.13 32.82 2c7d s GLU 16 CO 0.01 -0.46 1.06 0.08 -0.49 0.00 0.00 175.26 175.45 2c7d s VAL 17 N -3.82 3.94 0.00 2.63 1.01 -1.26 -4.72 120.40 118.17 2c7d s VAL 17 Ca 0.05 0.77 0.00 0.00 0.00 0.00 0.00 61.98 62.79 2c7d s VAL 17 Cb 0.01 -3.40 0.00 0.00 0.00 0.00 0.00 36.38 33.00 2c7d s VAL 17 CO -0.10 -0.69 0.00 -0.62 0.00 0.00 0.00 175.10 173.70 2c7d n GLU 18 N -2.58 0.00 -1.51 2.72 1.02 -0.44 -4.50 120.64 115.34 2c7d n GLU 18 Ca 0.08 0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.81 2c7d n GLU 18 Cb 0.53 0.00 -0.07 0.00 -0.02 0.00 0.00 31.44 31.88 2c7d n GLU 18 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 2c7d n THR 19 N 0.00 0.02 0.36 2.62 -1.04 -1.26 -4.78 114.28 110.20 2c7d n THR 19 Ca 0.00 -0.43 0.00 0.00 -2.04 0.00 0.00 64.05 61.58 2c7d n THR 19 Cb 0.00 -1.88 0.00 0.00 -1.82 0.00 0.00 70.33 66.63 2c7d n THR 19 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 2c7d n LYS 20 N 8.66 0.67 -0.50 -2.82 4.01 -1.26 -2.50 118.16 124.41 2c7d n LYS 20 Ca 0.46 0.00 -0.01 0.00 -0.51 0.00 0.00 58.31 58.25 2c7d n LYS 20 Cb 0.32 -1.17 -0.01 0.00 -0.51 0.00 0.00 35.03 33.66 2c7d n LYS 20 CO 0.00 0.00 0.00 -1.13 -1.11 0.00 0.00 177.40 175.16 2c7d n SER 21 N 0.97 -0.18 0.00 4.39 3.41 -1.26 -3.26 113.62 117.69 2c7d n SER 21 Ca 0.00 -0.95 0.11 0.00 -0.26 0.00 0.00 58.87 57.76 2c7d n SER 21 Cb 0.33 0.06 0.52 0.00 -0.26 0.00 0.00 64.21 64.86 2c7d n SER 21 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2c7d n ALA 22 N 0.00 2.09 0.14 7.33 0.00 -1.04 -3.76 120.51 125.27 2c7d n ALA 22 Ca -0.05 -0.09 0.02 0.00 0.00 0.00 0.00 53.44 53.31 2c7d n ALA 22 Cb 0.44 -1.36 0.03 0.00 0.00 0.00 0.00 19.45 18.56 2c7d n ALA 22 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2c7d h GLY 23 N 3.71 0.00 0.00 0.00 0.00 -1.90 -3.50 103.07 101.38 2c7d h GLY 23 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2c7d h GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 2c7d n GLY 24 N 1.19 1.41 0.14 4.60 0.00 -1.25 -4.74 105.19 106.54 2c7d n GLY 24 Ca 0.02 -0.64 -0.20 0.00 0.00 0.00 0.00 46.02 45.20 2c7d n GLY 24 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2c7d h ILE 25 N 0.00 1.42 -2.81 -0.61 2.04 -1.96 -3.48 117.51 112.11 2c7d h ILE 25 Ca 0.00 -2.39 -0.53 0.00 1.00 0.00 0.00 64.86 62.94 2c7d h ILE 25 Cb 0.00 2.89 0.02 0.00 -0.74 0.00 0.00 36.82 39.00 2c7d h ILE 25 CO 0.00 0.70 0.89 -0.69 0.00 0.00 0.00 178.15 179.05 2c7d s VAL 26 N -2.80 3.07 -1.07 1.67 1.01 -1.26 -4.93 120.40 116.08 2c7d s VAL 26 Ca -0.12 0.64 -0.22 0.00 0.00 0.00 0.00 61.98 62.28 2c7d s VAL 26 Cb 0.03 -3.41 -0.00 0.00 0.00 0.00 0.00 36.38 32.99 2c7d s VAL 26 CO 0.86 0.02 1.75 -0.22 0.00 0.00 0.00 175.10 177.51 2c7d s LEU 27 N 1.93 3.38 0.46 3.92 0.20 -1.26 -3.98 118.68 123.33 2c7d s LEU 27 Ca 0.70 -1.47 -0.22 0.00 0.69 0.00 0.00 54.13 53.83 2c7d s LEU 27 Cb -0.39 -2.57 -0.08 0.00 -0.43 0.00 0.00 46.19 42.72 2c7d s LEU 27 CO 0.31 -2.13 1.10 0.28 -0.29 0.00 0.00 176.35 175.62 2c7d s THR 28 N 7.58 3.44 0.18 3.68 -1.32 -1.20 -4.92 115.64 123.08 2c7d s THR 28 Ca 0.59 1.01 -0.03 0.00 -1.21 0.00 0.00 61.69 62.06 2c7d s THR 28 Cb -0.01 -3.47 0.04 0.00 -1.51 0.00 0.00 72.50 67.54 2c7d s THR 28 CO 0.01 -0.09 0.25 0.61 -2.21 0.00 0.00 174.62 173.19 2c7d n GLY 29 N 0.20 -0.95 3.74 6.08 0.00 -1.26 -4.27 105.19 108.73 2c7d n GLY 29 Ca 0.08 -1.72 -0.36 0.00 0.00 0.00 0.00 46.02 44.02 2c7d n GLY 29 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2c7d s SER 30 N -1.92 6.35 -0.03 1.61 0.01 -1.26 -4.79 113.70 113.67 2c7d s SER 30 Ca 0.14 0.41 -0.00 0.00 1.31 0.00 0.00 55.95 57.81 2c7d s SER 30 Cb -0.00 -2.14 0.02 0.00 0.21 0.00 0.00 66.02 64.11 2c7d s SER 30 CO 0.10 0.15 1.87 0.00 0.41 0.00 0.00 173.24 175.77 2c7d n ALA 31 N 3.46 3.92 -4.06 1.44 0.00 -1.26 -4.78 120.51 119.23 2c7d n ALA 31 Ca -0.14 -0.17 -0.33 0.00 0.00 0.00 0.00 53.44 52.80 2c7d n ALA 31 Cb 0.52 -1.04 -0.00 0.00 0.00 0.00 0.00 19.45 18.93 2c7d n ALA 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c7d n ALA 32 N 1.25 -1.31 -3.31 0.00 0.00 -1.26 -5.00 120.51 110.87 2c7d n ALA 32 Ca 0.03 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.55 2c7d n ALA 32 Cb 0.51 -3.87 0.00 0.00 0.00 0.00 0.00 19.45 16.10 2c7d n ALA 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c7d n ALA 33 N -4.53 0.00 -2.00 0.00 0.00 -1.26 -5.16 120.51 107.56 2c7d n ALA 33 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2c7d n ALA 33 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 2c7d n ALA 33 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2c7d n LYS 34 N -0.46 0.00 0.00 0.00 4.01 -1.26 -4.79 118.16 115.66 2c7d n LYS 34 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 2c7d n LYS 34 Cb 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.52 2c7d n LYS 34 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 2c7d n SER 35 N 0.00 0.00 0.02 4.39 2.88 -1.26 -1.32 113.62 118.33 2c7d n SER 35 Ca 0.00 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.67 2c7d n SER 35 Cb 0.00 0.00 0.55 0.00 -0.75 0.00 0.00 64.21 64.01 2c7d n SER 35 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2c7d n THR 36 N -0.22 0.24 -3.51 2.46 -2.24 -1.26 -4.80 114.28 104.95 2c7d n THR 36 Ca 0.00 -0.02 -0.38 0.00 -2.27 0.00 0.00 64.05 61.39 2c7d n THR 36 Cb 0.00 -0.59 -0.09 0.00 -2.10 0.00 0.00 70.33 67.55 2c7d n THR 36 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2c7d s ARG 37 N -3.03 4.06 0.25 -0.78 3.00 -1.26 -1.05 118.95 120.15 2c7d s ARG 37 Ca 0.12 -0.08 0.04 0.00 0.00 0.00 0.00 55.73 55.81 2c7d s ARG 37 Cb 0.17 -3.59 -0.01 0.00 0.00 0.00 0.00 34.95 31.51 2c7d s ARG 37 CO 0.51 -0.09 0.13 0.41 0.00 0.00 0.00 175.30 176.26 2c7d n GLY 38 N 4.42 3.43 3.04 -3.53 0.00 -0.15 -1.49 105.19 110.91 2c7d n GLY 38 Ca -0.11 -1.96 -0.13 0.00 0.00 0.00 0.00 46.02 43.82 2c7d n GLY 38 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2c7d s GLU 39 N -2.98 0.19 0.18 1.61 2.12 0.11 -0.68 118.70 119.26 2c7d s GLU 39 Ca 0.19 0.56 -0.30 0.00 0.36 0.00 0.00 54.97 55.78 2c7d s GLU 39 Cb 0.01 -0.11 -0.08 0.00 0.26 0.00 0.00 34.13 34.21 2c7d s GLU 39 CO 0.13 -0.18 1.19 0.08 -0.54 0.00 0.00 175.26 175.94 2c7d s VAL 40 N 1.45 3.60 -0.16 3.70 1.01 0.43 -0.74 120.40 129.70 2c7d s VAL 40 Ca -0.08 1.34 0.02 0.00 0.00 0.00 0.00 61.98 63.27 2c7d s VAL 40 Cb -0.11 -3.86 -0.11 0.00 0.00 0.00 0.00 36.38 32.31 2c7d s VAL 40 CO -0.08 0.21 -0.12 0.18 0.00 0.00 0.00 175.10 175.28 2c7d n LEU 41 N 2.54 2.68 -3.48 3.92 4.77 0.15 -1.09 117.00 126.49 2c7d n LEU 41 Ca 0.04 -0.08 -0.15 0.00 -0.03 0.00 0.00 56.01 55.79 2c7d n LEU 41 Cb 0.45 -0.48 -0.04 0.00 -2.33 0.00 0.00 43.42 41.02 2c7d n LEU 41 CO 0.56 0.73 0.42 0.00 -1.33 0.00 0.00 177.39 177.76 2c7d s ALA 42 N -2.32 -1.68 -0.01 -1.18 0.00 -0.40 -4.84 121.76 111.33 2c7d s ALA 42 Ca -0.20 0.92 0.01 0.00 0.00 0.00 0.00 51.96 52.69 2c7d s ALA 42 Cb 0.05 0.41 0.01 0.00 0.00 0.00 0.00 23.12 23.59 2c7d s ALA 42 CO 0.39 -0.55 -0.04 0.08 0.00 0.00 0.00 175.76 175.64 2c7d s VAL 43 N -2.38 0.38 0.99 0.00 1.01 -1.26 -0.53 120.40 118.61 2c7d s VAL 43 Ca -0.05 -0.15 -0.13 0.00 0.00 0.00 0.00 61.98 61.64 2c7d s VAL 43 Cb -0.00 -0.36 0.18 0.00 0.00 0.00 0.00 36.38 36.20 2c7d s VAL 43 CO -0.01 0.13 1.12 -0.83 0.00 0.00 0.00 175.10 175.52 2c7d s GLY 44 N 0.23 1.58 0.24 4.51 0.00 -0.41 -4.70 107.32 108.76 2c7d s GLY 44 Ca -0.02 -0.55 -0.02 0.00 0.00 0.00 0.00 44.72 44.13 2c7d s GLY 44 CO -0.00 0.08 1.69 3.43 0.00 0.00 0.00 173.10 178.30 2c7d h ASN 45 N -1.83 0.68 0.00 1.64 2.35 -1.88 -3.42 115.58 113.13 2c7d h ASN 45 Ca -0.51 -0.22 0.00 0.00 -0.55 0.00 0.00 56.30 55.01 2c7d h ASN 45 Cb 1.32 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 39.51 2c7d h ASN 45 CO 0.56 0.87 0.00 0.61 -1.65 0.00 0.00 177.43 177.82 2c7d n GLY 46 N -0.36 -1.24 3.28 2.83 0.00 -1.26 -4.19 105.19 104.25 2c7d n GLY 46 Ca 0.00 -1.21 -0.44 0.00 0.00 0.00 0.00 46.02 44.37 2c7d n GLY 46 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2c7d s ARG 47 N -1.99 2.82 -1.32 1.61 3.52 -0.33 -0.56 118.95 122.70 2c7d s ARG 47 Ca 0.00 -1.70 -0.12 0.00 -0.13 0.00 0.00 55.73 53.78 2c7d s ARG 47 Cb 0.00 -4.16 0.13 0.00 -1.56 0.00 0.00 34.95 29.36 2c7d s ARG 47 CO 0.00 -1.26 1.91 -0.89 -0.81 0.00 0.00 175.30 174.25 2c7d n ILE 48 N 5.13 4.06 -4.25 4.11 5.41 -1.26 -4.19 119.36 128.38 2c7d n ILE 48 Ca -0.12 -4.03 -0.14 0.00 1.00 0.00 0.00 62.75 59.45 2c7d n ILE 48 Cb 0.41 -2.44 -0.10 0.00 -0.71 0.00 0.00 39.64 36.80 2c7d n ILE 48 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 2c7d s LEU 49 N 1.03 1.36 0.00 1.39 1.43 -1.26 -4.95 118.68 117.69 2c7d s LEU 49 Ca 0.43 -1.44 0.00 0.00 -1.03 0.00 0.00 54.13 52.09 2c7d s LEU 49 Cb 0.09 0.30 0.00 0.00 0.03 0.00 0.00 46.19 46.61 2c7d s LEU 49 CO -0.02 -0.84 0.00 -0.62 0.23 0.00 0.00 176.35 175.10 2c7d n GLU 50 N -0.38 0.00 0.00 1.70 1.02 -1.26 -4.24 120.64 117.48 2c7d n GLU 50 Ca 0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 2c7d n GLU 50 Cb 0.66 -2.75 0.00 0.00 -0.02 0.00 0.00 31.44 29.33 2c7d n GLU 50 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2c7d n ASN 51 N 0.00 0.00 -4.57 1.62 5.15 -1.26 -4.90 115.26 111.30 2c7d n ASN 51 Ca 0.00 0.00 -0.43 0.00 -0.60 0.00 0.00 54.58 53.55 2c7d n ASN 51 Cb 0.00 0.00 -0.00 0.00 -0.53 0.00 0.00 39.78 39.25 2c7d n ASN 51 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 2c7d s GLY 52 N 0.00 1.64 0.17 8.20 0.00 -1.26 -4.90 107.32 111.18 2c7d s GLY 52 Ca 0.00 -2.88 0.00 0.00 0.00 0.00 0.00 44.72 41.84 2c7d s GLY 52 CO 0.00 2.69 0.00 1.18 0.00 0.00 0.00 173.10 176.97 2c7d n GLU 53 N 8.31 -0.92 -2.54 2.90 4.71 -1.26 -4.67 120.64 127.16 2c7d n GLU 53 Ca 0.47 0.75 -0.41 0.00 -0.01 0.00 0.00 57.16 57.96 2c7d n GLU 53 Cb 0.46 -1.07 -0.02 0.00 -1.01 0.00 0.00 31.44 29.80 2c7d n GLU 53 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 2c7d s VAL 54 N -3.38 3.98 -0.17 2.62 1.01 -1.26 -4.72 120.40 118.48 2c7d s VAL 54 Ca 0.00 -1.26 -0.29 0.00 0.00 0.00 0.00 61.98 60.43 2c7d s VAL 54 Cb 0.00 -5.07 -0.01 0.00 0.00 0.00 0.00 36.38 31.30 2c7d s VAL 54 CO 0.00 -1.92 1.15 -1.59 0.00 0.00 0.00 175.10 172.74 2c7d s LYS 55 N 4.77 4.27 0.30 2.72 -2.85 -1.26 -4.68 119.74 123.01 2c7d s LYS 55 Ca 0.51 1.52 -0.27 0.00 -1.00 0.00 0.00 55.97 56.74 2c7d s LYS 55 Cb 0.01 -3.68 -0.10 0.00 -2.06 0.00 0.00 37.83 32.01 2c7d s LYS 55 CO -0.01 -0.62 0.93 -1.25 0.10 0.00 0.00 175.35 174.50 2c7d s PRO 56 N 3.12 4.63 0.96 1.78 0.04 -1.26 -1.18 135.00 143.09 2c7d s PRO 56 Ca 0.50 1.34 -0.11 0.00 0.04 0.00 0.00 61.00 62.77 2c7d s PRO 56 Cb -0.19 -2.91 0.17 0.00 0.04 0.00 0.00 34.50 31.61 2c7d s PRO 56 CO 0.12 0.34 1.10 -0.51 0.04 0.00 0.00 177.00 178.09 2c7d s LEU 57 N -1.85 2.20 0.00 -3.56 1.43 -1.26 -4.94 118.68 110.70 2c7d s LEU 57 Ca 0.48 1.84 0.12 0.00 -1.03 0.00 0.00 54.13 55.53 2c7d s LEU 57 Cb -0.20 -4.12 0.16 0.00 0.03 0.00 0.00 46.19 42.05 2c7d s LEU 57 CO 0.25 -3.21 0.99 -0.67 0.23 0.00 0.00 176.35 173.94 2c7d n ASP 58 N -4.29 2.28 -4.92 2.29 2.03 -1.26 -4.95 116.55 107.73 2c7d n ASP 58 Ca 0.08 -1.64 -0.26 0.00 0.52 0.00 0.00 54.79 53.49 2c7d n ASP 58 Cb 0.53 -0.07 0.01 0.00 -0.72 0.00 0.00 41.12 40.88 2c7d n ASP 58 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 2c7d s VAL 59 N -1.00 4.27 0.09 5.18 -7.23 -1.26 -5.10 120.40 115.35 2c7d s VAL 59 Ca 0.17 0.00 -0.04 0.00 -1.81 0.00 0.00 61.98 60.31 2c7d s VAL 59 Cb 0.11 -3.64 -0.03 0.00 0.56 0.00 0.00 36.38 33.38 2c7d s VAL 59 CO 0.16 -0.61 0.07 -1.59 -0.31 0.00 0.00 175.10 172.81 2c7d s LYS 60 N -4.81 0.78 0.34 4.82 0.00 -1.26 -4.97 119.74 114.64 2c7d s LYS 60 Ca 0.50 -1.19 -0.29 0.00 0.00 0.00 0.00 55.97 54.99 2c7d s LYS 60 Cb -0.10 0.27 -0.10 0.00 0.00 0.00 0.00 37.83 37.89 2c7d s LYS 60 CO 0.44 -0.21 1.36 0.08 0.00 0.00 0.00 175.35 177.02 2c7d s VAL 61 N -3.94 2.54 0.00 1.79 1.01 -1.26 -3.21 120.40 117.34 2c7d s VAL 61 Ca 0.11 0.54 0.00 0.00 0.00 0.00 0.00 61.98 62.63 2c7d s VAL 61 Cb 0.07 -3.34 0.00 0.00 0.00 0.00 0.00 36.38 33.10 2c7d s VAL 61 CO -0.07 0.12 0.00 0.61 0.00 0.00 0.00 175.10 175.77 2c7d n GLY 62 N 0.84 2.32 3.77 4.51 0.00 -0.25 -4.98 105.19 111.41 2c7d n GLY 62 Ca 0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 2c7d n GLY 62 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2c7d s ASP 63 N -1.97 6.43 -0.07 1.61 1.01 -1.20 -4.59 116.67 117.89 2c7d s ASP 63 Ca 0.00 2.63 -0.23 0.00 0.71 0.00 0.00 52.55 55.66 2c7d s ASP 63 Cb 0.00 -2.64 -0.04 0.00 1.01 0.00 0.00 42.92 41.26 2c7d s ASP 63 CO 0.00 -0.77 0.69 -0.63 0.21 0.00 0.00 175.17 174.67 2c7d s ILE 64 N -1.25 5.05 0.11 0.77 1.01 -1.26 -0.43 121.20 125.21 2c7d s ILE 64 Ca 0.55 1.42 0.01 0.00 0.00 0.00 0.00 60.65 62.64 2c7d s ILE 64 Cb -0.38 -4.03 -0.04 0.00 0.01 0.00 0.00 42.46 38.02 2c7d s ILE 64 CO 0.49 0.25 -0.03 0.68 0.00 0.00 0.00 174.94 176.33 2c7d s VAL 65 N 0.82 0.56 -0.06 2.92 -7.23 0.15 -3.85 120.40 113.71 2c7d s VAL 65 Ca 0.37 -1.93 0.06 0.00 -1.81 0.00 0.00 61.98 58.67 2c7d s VAL 65 Cb -0.18 -1.80 -0.01 0.00 0.56 0.00 0.00 36.38 34.95 2c7d s VAL 65 CO 0.18 -0.76 -0.24 -0.63 -0.31 0.00 0.00 175.10 173.34 2c7d s ILE 66 N -3.72 2.02 0.09 -0.62 1.01 0.48 -0.98 121.20 119.48 2c7d s ILE 66 Ca 0.15 -1.04 -0.01 0.00 0.00 0.00 0.00 60.65 59.76 2c7d s ILE 66 Cb 0.06 -1.71 -0.04 0.00 0.01 0.00 0.00 42.46 40.78 2c7d s ILE 66 CO -0.03 0.56 -0.01 0.72 0.00 0.00 0.00 174.94 176.19 2c7d s PHE 67 N -0.11 0.71 -1.07 3.97 -0.12 -0.22 -0.29 117.98 120.85 2c7d s PHE 67 Ca -0.05 -1.10 -0.22 0.00 -0.05 0.00 0.00 56.93 55.51 2c7d s PHE 67 Cb -0.14 -0.45 0.03 0.00 -0.63 0.00 0.00 43.02 41.84 2c7d s PHE 67 CO 0.04 -0.39 1.60 1.21 -0.05 0.00 0.00 175.22 177.64 2c7d s ASN 68 N -2.99 6.31 -1.02 1.98 2.47 0.10 -4.55 114.94 117.24 2c7d s ASN 68 Ca 0.14 -1.56 -0.25 0.00 0.42 0.00 0.00 52.86 51.61 2c7d s ASN 68 Cb 0.07 -2.57 -0.13 0.00 -1.45 0.00 0.00 41.25 37.18 2c7d s ASN 68 CO -0.05 -1.68 2.08 -0.62 -3.72 0.00 0.00 177.10 173.10 2c7d s ASP 69 N 5.31 4.39 0.00 -4.21 2.15 -1.26 -4.67 116.67 118.39 2c7d s ASP 69 Ca 0.52 -0.93 0.00 0.00 0.43 0.00 0.00 52.55 52.57 2c7d s ASP 69 Cb -0.00 -2.58 0.00 0.00 -0.30 0.00 0.00 42.92 40.04 2c7d s ASP 69 CO -0.04 -3.63 0.00 0.61 -0.17 0.00 0.00 175.17 171.94 2c7d n GLY 70 N 6.33 3.15 0.00 2.66 0.00 -1.26 -4.98 105.19 111.09 2c7d n GLY 70 Ca 0.43 -0.31 0.08 0.00 0.00 0.00 0.00 46.02 46.22 2c7d n GLY 70 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2c7d n TYR 71 N 0.00 0.00 0.00 1.61 9.36 -1.26 -4.26 117.16 122.61 2c7d n TYR 71 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 2c7d n TYR 71 Cb 0.00 -0.25 0.00 0.00 -0.63 0.00 0.00 39.34 38.46 2c7d n TYR 71 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2c7d n GLY 72 N 0.08 0.91 0.00 2.98 0.00 -1.26 -4.96 105.19 102.94 2c7d n GLY 72 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 2c7d n GLY 72 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2c7d n VAL 73 N 0.00 0.00 -4.22 1.61 0.31 -1.26 -5.01 118.33 109.77 2c7d n VAL 73 Ca 0.00 0.00 -0.24 0.00 -0.01 0.00 0.00 64.34 64.09 2c7d n VAL 73 Cb 0.00 0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 32.87 2c7d n VAL 73 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2c7d s LYS 74 N 0.00 2.52 0.45 5.55 -0.14 -0.14 -4.88 119.74 123.09 2c7d s LYS 74 Ca 0.00 -1.22 -0.01 0.00 -1.36 0.00 0.00 55.97 53.39 2c7d s LYS 74 Cb 0.00 -2.34 -0.01 0.00 -1.68 0.00 0.00 37.83 33.80 2c7d s LYS 74 CO 0.00 0.40 0.68 0.45 -0.76 0.00 0.00 175.35 176.12 2c7d s SER 75 N -3.51 5.91 0.06 2.83 0.15 -1.26 -0.74 113.70 117.14 2c7d s SER 75 Ca 0.31 0.39 -0.27 0.00 0.70 0.00 0.00 55.95 57.07 2c7d s SER 75 Cb -0.08 -1.67 0.09 0.00 -1.71 0.00 0.00 66.02 62.65 2c7d s SER 75 CO 0.21 -0.66 0.96 -1.61 1.20 0.00 0.00 173.24 173.34 2c7d s GLU 76 N -4.57 0.94 -0.34 5.44 0.41 -0.38 -4.87 118.70 115.34 2c7d s GLU 76 Ca 0.47 -0.45 -0.00 0.00 -0.41 0.00 0.00 54.97 54.58 2c7d s GLU 76 Cb -0.10 0.37 0.11 0.00 -1.78 0.00 0.00 34.13 32.73 2c7d s GLU 76 CO 0.39 -0.42 0.14 0.21 -0.49 0.00 0.00 175.26 175.08 2c7d s LYS 77 N -3.12 0.77 -0.19 1.61 2.47 -1.26 -0.20 119.74 119.81 2c7d s LYS 77 Ca 0.09 -1.24 -0.01 0.00 -1.56 0.00 0.00 55.97 53.25 2c7d s LYS 77 Cb -0.01 -1.92 0.00 0.00 -1.46 0.00 0.00 37.83 34.44 2c7d s LYS 77 CO -0.03 -1.05 -0.11 0.42 0.16 0.00 0.00 175.35 174.74 2c7d s ILE 78 N 1.35 2.86 -1.02 5.43 1.09 -0.66 -4.65 121.20 125.60 2c7d s ILE 78 Ca 0.12 -0.68 -0.07 0.00 -1.10 0.00 0.00 60.65 58.93 2c7d s ILE 78 Cb -0.19 -2.26 0.06 0.00 -1.06 0.00 0.00 42.46 39.01 2c7d s ILE 78 CO -0.19 0.48 0.29 0.47 -0.10 0.00 0.00 174.94 175.90 2c7d n ASP 79 N 4.51 -2.98 0.00 3.58 8.00 -1.26 -0.54 116.55 127.86 2c7d n ASP 79 Ca -0.19 -0.16 0.00 0.00 0.71 0.00 0.00 54.79 55.15 2c7d n ASP 79 Cb 0.51 -2.53 0.00 0.00 -0.02 0.00 0.00 41.12 39.08 2c7d n ASP 79 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2c7d n ASN 80 N -2.03 0.00 -4.79 -2.24 2.85 -1.26 -5.04 115.26 102.75 2c7d n ASN 80 Ca -0.03 0.00 -0.36 0.00 -0.11 0.00 0.00 54.58 54.09 2c7d n ASN 80 Cb 0.54 -0.36 -0.05 0.00 1.24 0.00 0.00 39.78 41.15 2c7d n ASN 80 CO 0.00 0.00 0.00 -1.61 -2.11 0.00 0.00 177.26 173.54 2c7d s GLU 81 N -0.12 4.20 -0.25 1.20 8.01 0.30 -5.03 118.70 127.01 2c7d s GLU 81 Ca 0.00 1.42 -0.29 0.00 0.01 0.00 0.00 54.97 56.11 2c7d s GLU 81 Cb 0.00 -2.49 0.00 0.00 -4.31 0.00 0.00 34.13 27.33 2c7d s GLU 81 CO 0.00 -0.09 1.17 -1.21 0.01 0.00 0.00 175.26 175.13 2c7d s GLU 82 N -2.59 4.13 -0.10 1.61 0.41 -1.26 -1.65 118.70 119.25 2c7d s GLU 82 Ca 0.58 1.35 -0.04 0.00 -0.41 0.00 0.00 54.97 56.44 2c7d s GLU 82 Cb -0.19 -3.75 -0.04 0.00 -1.78 0.00 0.00 34.13 28.37 2c7d s GLU 82 CO 0.24 -0.83 0.08 0.14 -0.49 0.00 0.00 175.26 174.41 2c7d s VAL 83 N 3.65 4.98 -0.16 2.63 -7.23 0.71 -4.61 120.40 120.38 2c7d s VAL 83 Ca 0.50 -0.02 -0.18 0.00 -1.81 0.00 0.00 61.98 60.47 2c7d s VAL 83 Cb -0.16 -3.15 -0.04 0.00 0.56 0.00 0.00 36.38 33.58 2c7d s VAL 83 CO 0.14 0.59 0.48 -0.76 -0.31 0.00 0.00 175.10 175.24 2c7d s LEU 84 N -1.04 4.21 -0.11 1.32 1.02 0.45 -1.24 118.68 123.28 2c7d s LEU 84 Ca 0.15 0.72 0.03 0.00 0.02 0.00 0.00 54.13 55.05 2c7d s LEU 84 Cb -0.12 -2.67 -0.00 0.00 0.02 0.00 0.00 46.19 43.42 2c7d s LEU 84 CO 0.04 -0.07 -0.21 -0.63 0.02 0.00 0.00 176.35 175.50 2c7d s ILE 85 N 1.06 2.27 0.20 -0.59 1.01 0.08 -0.64 121.20 124.59 2c7d s ILE 85 Ca 0.24 -0.94 -0.06 0.00 0.00 0.00 0.00 60.65 59.90 2c7d s ILE 85 Cb -0.15 -1.90 -0.02 0.00 0.01 0.00 0.00 42.46 40.40 2c7d s ILE 85 CO 0.10 0.55 0.26 0.00 0.00 0.00 0.00 174.94 175.84 2c7d s MET 86 N 0.44 1.28 0.61 2.79 0.23 -0.64 -0.97 119.30 123.04 2c7d s MET 86 Ca -0.15 -1.43 -0.12 0.00 -1.03 0.00 0.00 55.69 52.96 2c7d s MET 86 Cb -0.17 0.35 -0.04 0.00 -1.53 0.00 0.00 34.83 33.44 2c7d s MET 86 CO 0.06 -0.46 1.03 -1.54 -2.03 0.00 0.00 175.02 172.08 2c7d s SER 87 N -3.08 6.15 0.58 -1.18 1.04 -1.26 -0.03 113.70 115.92 2c7d s SER 87 Ca 0.29 1.49 0.28 0.00 0.48 0.00 0.00 55.95 58.49 2c7d s SER 87 Cb 0.04 -2.48 1.55 0.00 0.10 0.00 0.00 66.02 65.23 2c7d s SER 87 CO 0.08 -0.92 2.03 -0.08 0.98 0.00 0.00 173.24 175.33 2c7d h GLU 88 N -0.15 0.00 0.00 4.02 4.81 -1.85 -1.92 114.58 119.49 2c7d h GLU 88 Ca -0.45 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.78 2c7d h GLU 88 Cb 1.19 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.57 2c7d h GLU 88 CO 0.61 0.00 0.00 0.66 -0.73 0.00 0.00 179.01 179.55 2c7d h SER 89 N 0.00 0.00 1.09 1.04 4.64 -1.94 -2.22 113.55 116.17 2c7d h SER 89 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 2c7d h SER 89 Cb 0.75 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 2c7d h SER 89 CO -0.00 0.00 -0.59 0.44 -0.87 0.00 0.00 176.83 175.81 2c7d h ASP 90 N 0.00 0.00 -3.08 4.97 3.32 -1.73 -3.46 116.42 116.43 2c7d h ASP 90 Ca 0.00 -0.11 -0.58 0.00 0.02 0.00 0.00 57.03 56.36 2c7d h ASP 90 Cb 0.17 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.66 2c7d h ASP 90 CO 0.00 0.06 0.83 -0.63 -1.72 0.00 0.00 179.24 177.77 2c7d s ILE 91 N -3.22 4.59 -0.08 0.35 1.01 -0.84 -0.72 121.20 122.30 2c7d s ILE 91 Ca 0.05 1.90 -0.07 0.00 0.00 0.00 0.00 60.65 62.54 2c7d s ILE 91 Cb 0.11 -4.27 -0.28 0.00 0.01 0.00 0.00 42.46 38.03 2c7d s ILE 91 CO 0.72 -0.22 0.55 -0.07 0.00 0.00 0.00 174.94 175.92 2c7d h LEU 92 N 9.60 0.47 -7.00 2.97 3.38 -0.96 -3.48 115.31 120.29 2c7d h LEU 92 Ca -0.20 -0.86 0.05 0.00 0.09 0.00 0.00 57.88 56.96 2c7d h LEU 92 Cb 1.07 -0.15 -0.17 0.00 0.09 0.00 0.00 40.66 41.49 2c7d h LEU 92 CO 0.99 1.75 0.40 0.00 0.09 0.00 0.00 178.44 181.67 2c7d s ALA 93 N -2.57 -1.80 0.25 1.53 0.00 -0.83 -5.00 121.76 113.33 2c7d s ALA 93 Ca -0.18 1.12 0.00 0.00 0.00 0.00 0.00 51.96 52.90 2c7d s ALA 93 Cb 0.06 0.15 0.00 0.00 0.00 0.00 0.00 23.12 23.33 2c7d s ALA 93 CO 0.81 -0.55 0.00 -0.89 0.00 0.00 0.00 175.76 175.13 2c7d n ILE 94 N 0.18 0.00 0.00 0.00 5.41 -1.26 -0.39 119.36 123.30 2c7d n ILE 94 Ca -0.12 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.63 2c7d n ILE 94 Cb 0.61 -1.25 0.00 0.00 -0.71 0.00 0.00 39.64 38.29 2c7d n ILE 94 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07