#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 0.57 0.31 6.28 6.06 -1.26 -5.13 118.95 125.77 2c7d s ARG 4 Ca 0.00 1.09 -0.30 0.00 -2.50 0.00 0.00 55.73 54.03 2c7d s ARG 4 Cb 0.00 0.61 -0.11 0.00 0.06 0.00 0.00 34.95 35.50 2c7d s ARG 4 CO 0.00 -0.53 1.59 -0.35 -2.50 0.00 0.00 175.30 173.50 2c7d n PRO 5 N 5.43 2.72 -1.75 5.12 -0.04 -1.26 -4.89 135.00 140.33 2c7d n PRO 5 Ca -0.03 0.96 -0.35 0.00 -0.04 0.00 0.00 63.50 64.04 2c7d n PRO 5 Cb 0.51 -2.74 -0.03 0.00 -0.04 0.00 0.00 33.50 31.19 2c7d n PRO 5 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 2c7d n LEU 6 N 1.91 7.59 -1.65 1.53 -0.00 -1.26 -2.96 117.00 122.16 2c7d n LEU 6 Ca 0.07 -4.55 0.00 0.00 -0.00 0.00 0.00 56.01 51.53 2c7d n LEU 6 Cb 0.37 -1.35 0.00 0.00 -0.00 0.00 0.00 43.42 42.44 2c7d n LEU 6 CO 0.64 1.96 -0.46 0.00 -0.00 0.00 0.00 177.39 179.53 2c7d n HIS 7 N 1.72 -4.51 0.00 1.96 1.44 -1.26 -4.67 115.22 109.90 2c7d n HIS 7 Ca 0.60 2.39 0.00 0.00 -2.01 0.00 0.00 57.72 58.70 2c7d n HIS 7 Cb 0.35 -3.58 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 -0.67 0.00 -4.80 4.39 2.03 0.49 -4.89 116.55 113.10 2c7d n ASP 8 Ca 0.00 0.00 -0.35 0.00 0.52 0.00 0.00 54.79 54.96 2c7d n ASP 8 Cb 0.00 -0.22 -0.06 0.00 -0.72 0.00 0.00 41.12 40.11 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 4.32 0.04 -0.67 1.81 -1.26 -1.03 118.95 122.16 2c7d s ARG 9 Ca 0.00 1.26 0.04 0.00 -1.72 0.00 0.00 55.73 55.31 2c7d s ARG 9 Cb 0.00 -2.44 -0.02 0.00 -0.45 0.00 0.00 34.95 32.04 2c7d s ARG 9 CO 0.00 0.04 -0.13 0.08 -0.68 0.00 0.00 175.30 174.62 2c7d s VAL 10 N -1.90 0.98 -0.08 3.52 1.01 0.74 -1.28 120.40 123.39 2c7d s VAL 10 Ca 0.58 -1.00 0.03 0.00 0.00 0.00 0.00 61.98 61.58 2c7d s VAL 10 Cb -0.15 -0.91 0.01 0.00 0.00 0.00 0.00 36.38 35.34 2c7d s VAL 10 CO 0.19 -0.08 -0.15 -0.63 0.00 0.00 0.00 175.10 174.43 2c7d s ILE 11 N -0.94 1.36 0.17 2.22 1.01 0.31 -1.68 121.20 123.66 2c7d s ILE 11 Ca -0.01 -0.60 -0.00 0.00 0.00 0.00 0.00 60.65 60.03 2c7d s ILE 11 Cb -0.08 -1.23 -0.04 0.00 0.01 0.00 0.00 42.46 41.12 2c7d s ILE 11 CO 0.01 0.41 0.08 0.68 0.00 0.00 0.00 174.94 176.12 2c7d s VAL 12 N 0.65 0.18 -0.23 2.92 -7.23 0.42 -0.76 120.40 116.35 2c7d s VAL 12 Ca -0.14 -1.96 -0.04 0.00 -1.81 0.00 0.00 61.98 58.03 2c7d s VAL 12 Cb -0.16 -2.26 -0.01 0.00 0.56 0.00 0.00 36.38 34.51 2c7d s VAL 12 CO 0.04 -0.27 -0.02 -1.59 -0.31 0.00 0.00 175.10 172.95 2c7d s LYS 13 N -4.07 3.38 0.42 4.82 -2.85 -0.06 -0.70 119.74 120.67 2c7d s LYS 13 Ca 0.30 -0.63 -0.26 0.00 -1.00 0.00 0.00 55.97 54.38 2c7d s LYS 13 Cb 0.07 -3.08 -0.09 0.00 -2.06 0.00 0.00 37.83 32.68 2c7d s LYS 13 CO 0.06 -0.22 1.37 0.50 0.10 0.00 0.00 175.35 177.17 2c7d s ARG 14 N 1.49 3.89 0.03 1.78 3.52 -1.26 -0.82 118.95 127.58 2c7d s ARG 14 Ca 0.05 2.31 0.09 0.00 -0.13 0.00 0.00 55.73 58.05 2c7d s ARG 14 Cb -0.15 -2.75 -0.03 0.00 -1.56 0.00 0.00 34.95 30.46 2c7d s ARG 14 CO -0.02 -0.61 -0.25 0.15 -0.81 0.00 0.00 175.30 173.75 2c7d s LYS 15 N -2.29 1.89 0.00 5.12 1.02 -1.05 -4.92 119.74 119.52 2c7d s LYS 15 Ca 0.58 -1.06 0.00 0.00 0.02 0.00 0.00 55.97 55.50 2c7d s LYS 15 Cb -0.41 -2.02 0.00 0.00 -0.52 0.00 0.00 37.83 34.88 2c7d s LYS 15 CO 0.54 0.52 0.00 0.39 -0.92 0.00 0.00 175.35 175.88 2c7d n GLU 16 N 1.86 0.00 -2.33 1.68 -0.58 -1.26 -4.88 120.64 115.13 2c7d n GLU 16 Ca -0.17 0.00 -0.41 0.00 -0.42 0.00 0.00 57.16 56.16 2c7d n GLU 16 Cb 0.52 0.00 -0.03 0.00 -0.57 0.00 0.00 31.44 31.35 2c7d n GLU 16 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2c7d s VAL 17 N 0.00 3.45 -1.35 2.62 1.01 -1.26 -3.67 120.40 121.20 2c7d s VAL 17 Ca 0.00 1.23 -0.21 0.00 0.00 0.00 0.00 61.98 63.01 2c7d s VAL 17 Cb 0.00 -3.79 0.03 0.00 0.00 0.00 0.00 36.38 32.62 2c7d s VAL 17 CO 0.00 0.20 0.41 -0.62 0.00 0.00 0.00 175.10 175.09 2c7d n GLU 18 N 2.40 -0.57 -1.50 2.72 1.02 -0.38 -4.41 120.64 119.92 2c7d n GLU 18 Ca 0.04 0.08 -0.43 0.00 -0.02 0.00 0.00 57.16 56.84 2c7d n GLU 18 Cb 0.44 -2.97 -0.08 0.00 -0.02 0.00 0.00 31.44 28.82 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 -4.87 0.05 0.81 2.62 -1.04 -1.24 -4.81 114.28 105.80 2c7d n THR 19 Ca -0.20 -0.39 0.08 0.00 -2.04 0.00 0.00 64.05 61.50 2c7d n THR 19 Cb 0.62 -1.79 0.43 0.00 -1.82 0.00 0.00 70.33 67.77 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 8.57 0.26 0.03 -2.82 4.01 -1.26 -1.68 118.16 125.28 2c7d n LYS 20 Ca 0.46 0.12 0.12 0.00 -0.51 0.00 0.00 58.31 58.50 2c7d n LYS 20 Cb 0.30 -1.50 0.50 0.00 -0.51 0.00 0.00 35.03 33.82 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 -1.26 0.23 0.00 4.39 3.41 -1.26 -1.28 113.62 117.84 2c7d n SER 21 Ca 0.08 0.53 0.03 0.00 -0.26 0.00 0.00 58.87 59.25 2c7d n SER 21 Cb 0.13 -0.59 0.17 0.00 -0.26 0.00 0.00 64.21 63.66 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 -1.58 1.83 0.19 7.33 0.00 -0.67 -1.80 120.51 125.79 2c7d n ALA 22 Ca 0.06 -0.04 0.09 0.00 0.00 0.00 0.00 53.44 53.55 2c7d n ALA 22 Cb 0.31 -1.10 0.11 0.00 0.00 0.00 0.00 19.45 18.78 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 1.59 0.00 0.00 0.00 0.00 -1.73 -3.49 103.07 99.45 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 1.15 1.84 0.13 4.60 0.00 -0.75 -4.44 105.19 107.72 2c7d n GLY 24 Ca 0.03 -0.73 -0.18 0.00 0.00 0.00 0.00 46.02 45.14 2c7d n GLY 24 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2c7d n ILE 25 N 0.00 1.42 -1.96 -0.61 5.41 -1.26 -5.02 119.36 117.34 2c7d n ILE 25 Ca 0.00 -0.53 -0.41 0.00 1.00 0.00 0.00 62.75 62.81 2c7d n ILE 25 Cb 0.00 -1.40 -0.02 0.00 -0.71 0.00 0.00 39.64 37.51 2c7d n ILE 25 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 2c7d s VAL 26 N -2.49 2.44 -0.67 1.39 1.01 -1.26 -4.96 120.40 115.86 2c7d s VAL 26 Ca -0.34 0.42 -0.27 0.00 0.00 0.00 0.00 61.98 61.80 2c7d s VAL 26 Cb 0.09 -3.27 0.00 0.00 0.00 0.00 0.00 36.38 33.20 2c7d s VAL 26 CO 0.56 0.09 1.62 -0.22 0.00 0.00 0.00 175.10 177.15 2c7d s LEU 27 N -1.37 3.23 0.56 3.92 0.20 -1.26 -3.53 118.68 120.44 2c7d s LEU 27 Ca 0.54 -0.00 -0.17 0.00 0.69 0.00 0.00 54.13 55.19 2c7d s LEU 27 Cb -0.43 -2.54 -0.05 0.00 -0.43 0.00 0.00 46.19 42.74 2c7d s LEU 27 CO 0.53 -2.15 1.06 0.28 -0.29 0.00 0.00 176.35 175.77 2c7d s THR 28 N 7.67 3.78 0.00 3.68 -1.32 -0.41 -5.00 115.64 124.05 2c7d s THR 28 Ca 0.54 0.92 0.00 0.00 -1.21 0.00 0.00 61.69 61.93 2c7d s THR 28 Cb -0.11 -3.40 0.00 0.00 -1.51 0.00 0.00 72.50 67.49 2c7d s THR 28 CO 0.18 -0.43 0.00 0.61 -2.21 0.00 0.00 174.62 172.77 2c7d n GLY 29 N -0.76 0.59 3.02 6.08 0.00 -1.26 -4.62 105.19 108.25 2c7d n GLY 29 Ca 0.09 -1.54 -0.23 0.00 0.00 0.00 0.00 46.02 44.34 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 -1.00 1.58 0.00 1.61 0.01 -1.26 -4.87 113.70 109.76 2c7d s SER 30 Ca 0.00 -0.26 0.08 0.00 1.31 0.00 0.00 55.95 57.08 2c7d s SER 30 Cb 0.00 -0.58 0.13 0.00 0.21 0.00 0.00 66.02 65.78 2c7d s SER 30 CO 0.00 0.06 1.02 0.00 0.41 0.00 0.00 173.24 174.72 2c7d n ALA 31 N 3.54 3.13 -2.47 1.44 0.00 -1.26 -5.03 120.51 119.85 2c7d n ALA 31 Ca -0.21 -1.17 -0.05 0.00 0.00 0.00 0.00 53.44 52.02 2c7d n ALA 31 Cb 0.53 -0.44 0.02 0.00 0.00 0.00 0.00 19.45 19.56 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 0.15 -0.49 -4.32 0.00 0.00 -1.26 -5.09 120.51 109.50 2c7d n ALA 32 Ca -0.14 0.01 -0.20 0.00 0.00 0.00 0.00 53.44 53.11 2c7d n ALA 32 Cb 0.82 -1.20 -0.03 0.00 0.00 0.00 0.00 19.45 19.04 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 -2.14 0.33 0.04 0.00 0.00 -1.26 -5.12 120.51 112.36 2c7d n ALA 33 Ca -0.06 -1.44 0.00 0.00 0.00 0.00 0.00 53.44 51.95 2c7d n ALA 33 Cb 0.54 0.74 0.00 0.00 0.00 0.00 0.00 19.45 20.73 2c7d n ALA 33 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2c7d n LYS 34 N -0.91 0.00 0.00 0.00 3.00 -1.26 -4.78 118.16 114.20 2c7d n LYS 34 Ca -0.11 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.20 2c7d n LYS 34 Cb 0.41 -0.34 0.00 0.00 0.00 0.00 0.00 35.03 35.09 2c7d n LYS 34 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2c7d n SER 35 N -3.14 0.00 0.00 3.14 2.88 -1.26 -1.25 113.62 113.99 2c7d n SER 35 Ca 0.00 0.00 0.14 0.00 -1.33 0.00 0.00 58.87 57.68 2c7d n SER 35 Cb 0.19 0.00 0.61 0.00 -0.75 0.00 0.00 64.21 64.25 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 -1.07 0.01 -3.86 2.46 -2.24 -1.26 -4.75 114.28 103.57 2c7d n THR 36 Ca 0.00 -0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.43 2c7d n THR 36 Cb 0.00 -0.48 -0.09 0.00 -2.10 0.00 0.00 70.33 67.66 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 -3.00 4.05 0.01 -0.78 3.00 -1.26 -0.94 118.95 120.02 2c7d s ARG 37 Ca 0.14 -0.30 -0.10 0.00 0.00 0.00 0.00 55.73 55.47 2c7d s ARG 37 Cb 0.19 -3.33 0.01 0.00 0.00 0.00 0.00 34.95 31.82 2c7d s ARG 37 CO 0.54 0.24 0.20 0.20 0.00 0.00 0.00 175.30 176.47 2c7d s GLY 38 N 0.50 0.00 -0.15 -3.53 0.00 -0.49 -2.52 107.32 101.13 2c7d s GLY 38 Ca 0.05 -0.10 -0.20 0.00 0.00 0.00 0.00 44.72 44.47 2c7d s GLY 38 CO 0.00 -0.27 0.56 1.85 0.00 0.00 0.00 173.10 175.24 2c7d s GLU 39 N -1.86 4.29 -0.03 2.90 2.12 -0.00 -0.25 118.70 125.87 2c7d s GLU 39 Ca -0.11 0.56 -0.30 0.00 0.36 0.00 0.00 54.97 55.48 2c7d s GLU 39 Cb -0.04 -3.50 -0.04 0.00 0.26 0.00 0.00 34.13 30.81 2c7d s GLU 39 CO -0.00 -0.03 1.18 0.08 -0.54 0.00 0.00 175.26 175.95 2c7d s VAL 40 N 1.20 4.27 -0.23 3.70 1.01 0.38 -0.88 120.40 129.85 2c7d s VAL 40 Ca 0.28 1.60 0.04 0.00 0.00 0.00 0.00 61.98 63.90 2c7d s VAL 40 Cb -0.16 -4.03 -0.16 0.00 0.00 0.00 0.00 36.38 32.03 2c7d s VAL 40 CO 0.11 0.04 -0.17 0.18 0.00 0.00 0.00 175.10 175.26 2c7d n LEU 41 N 4.82 2.57 -3.52 3.92 4.77 0.06 -2.61 117.00 127.02 2c7d n LEU 41 Ca 0.10 -0.11 -0.15 0.00 -0.03 0.00 0.00 56.01 55.82 2c7d n LEU 41 Cb 0.47 -0.65 -0.05 0.00 -2.33 0.00 0.00 43.42 40.86 2c7d n LEU 41 CO 0.55 0.84 0.36 0.00 -1.33 0.00 0.00 177.39 177.80 2c7d s ALA 42 N -2.47 -1.53 0.01 -1.18 0.00 -0.60 -4.91 121.76 111.08 2c7d s ALA 42 Ca -0.29 0.80 0.04 0.00 0.00 0.00 0.00 51.96 52.51 2c7d s ALA 42 Cb 0.08 0.39 -0.01 0.00 0.00 0.00 0.00 23.12 23.57 2c7d s ALA 42 CO 0.57 -0.53 -0.11 0.08 0.00 0.00 0.00 175.76 175.77 2c7d s VAL 43 N -2.37 0.88 1.12 0.00 1.01 -1.26 -0.53 120.40 119.25 2c7d s VAL 43 Ca -0.06 -0.64 -0.13 0.00 0.00 0.00 0.00 61.98 61.16 2c7d s VAL 43 Cb -0.01 -0.77 0.26 0.00 0.00 0.00 0.00 36.38 35.87 2c7d s VAL 43 CO -0.01 0.13 1.05 -0.83 0.00 0.00 0.00 175.10 175.43 2c7d s GLY 44 N -0.58 1.55 -0.98 4.51 0.00 -0.41 -4.69 107.32 106.73 2c7d s GLY 44 Ca 0.02 -0.18 -0.07 0.00 0.00 0.00 0.00 44.72 44.50 2c7d s GLY 44 CO 0.00 0.51 2.18 0.70 0.00 0.00 0.00 173.10 176.49 2c7d n ASN 45 N -4.74 5.15 0.00 1.64 3.02 -1.15 -4.80 115.26 114.38 2c7d n ASN 45 Ca 0.04 -2.37 0.00 0.00 -0.03 0.00 0.00 54.58 52.22 2c7d n ASN 45 Cb 0.55 -1.15 0.00 0.00 -0.61 0.00 0.00 39.78 38.57 2c7d n ASN 45 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2c7d n GLY 46 N 3.79 1.96 2.76 7.41 0.00 -1.26 -4.56 105.19 115.28 2c7d n GLY 46 Ca 0.48 -0.55 -0.27 0.00 0.00 0.00 0.00 46.02 45.67 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 0.00 0.74 -1.38 1.61 3.52 0.19 -0.38 118.95 123.25 2c7d s ARG 47 Ca 0.00 -0.42 -0.08 0.00 -0.13 0.00 0.00 55.73 55.09 2c7d s ARG 47 Cb 0.00 -2.06 0.09 0.00 -1.56 0.00 0.00 34.95 31.43 2c7d s ARG 47 CO 0.00 -0.61 2.30 -0.89 -0.81 0.00 0.00 175.30 175.29 2c7d n ILE 48 N 5.03 4.59 -4.08 4.11 5.41 -1.26 -3.33 119.36 129.83 2c7d n ILE 48 Ca -0.09 -3.91 -0.10 0.00 1.00 0.00 0.00 62.75 59.65 2c7d n ILE 48 Cb 0.47 -2.32 -0.08 0.00 -0.71 0.00 0.00 39.64 37.00 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 -0.60 0.97 -0.58 1.39 1.43 -1.26 -4.97 118.68 115.06 2c7d s LEU 49 Ca 0.51 -1.12 -0.02 0.00 -1.03 0.00 0.00 54.13 52.47 2c7d s LEU 49 Cb 0.15 0.92 0.00 0.00 0.03 0.00 0.00 46.19 47.30 2c7d s LEU 49 CO -0.06 -0.92 0.49 1.21 0.23 0.00 0.00 176.35 177.31 2c7d n GLU 50 N -0.26 -3.30 0.00 1.70 4.07 -1.26 -4.69 120.64 116.89 2c7d n GLU 50 Ca -0.02 0.38 0.00 0.00 -0.06 0.00 0.00 57.16 57.46 2c7d n GLU 50 Cb 0.64 -4.03 0.00 0.00 -0.06 0.00 0.00 31.44 27.98 2c7d n GLU 50 CO 0.00 0.00 0.00 -1.71 -0.06 0.00 0.00 177.13 175.36 2c7d n ASN 51 N -1.31 0.00 -4.57 4.31 5.15 -1.26 -4.70 115.26 112.88 2c7d n ASN 51 Ca -0.07 0.00 -0.36 0.00 -0.60 0.00 0.00 54.58 53.56 2c7d n ASN 51 Cb 0.55 0.00 -0.03 0.00 -0.53 0.00 0.00 39.78 39.77 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 0.89 0.00 8.20 0.00 -1.26 -4.81 107.32 110.34 2c7d s GLY 52 Ca 0.00 -2.29 0.00 0.00 0.00 0.00 0.00 44.72 42.43 2c7d s GLY 52 CO 0.00 3.08 0.00 1.18 0.00 0.00 0.00 173.10 177.36 2c7d n GLU 53 N 8.58 0.00 -3.83 2.90 4.71 -1.26 -4.85 120.64 126.88 2c7d n GLU 53 Ca 0.42 0.00 -0.36 0.00 -0.01 0.00 0.00 57.16 57.22 2c7d n GLU 53 Cb 0.48 0.00 -0.07 0.00 -1.01 0.00 0.00 31.44 30.83 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 0.00 5.35 0.11 2.62 1.01 -1.26 -4.68 120.40 123.55 2c7d s VAL 54 Ca 0.00 0.16 0.03 0.00 0.00 0.00 0.00 61.98 62.17 2c7d s VAL 54 Cb 0.00 -3.39 -0.04 0.00 0.00 0.00 0.00 36.38 32.95 2c7d s VAL 54 CO 0.00 0.51 0.17 -1.59 0.00 0.00 0.00 175.10 174.19 2c7d s LYS 55 N -0.18 3.13 0.97 2.72 0.00 -1.21 -4.91 119.74 120.25 2c7d s LYS 55 Ca 0.10 -0.66 -0.15 0.00 0.00 0.00 0.00 55.97 55.27 2c7d s LYS 55 Cb -0.11 -2.83 0.18 0.00 0.00 0.00 0.00 37.83 35.06 2c7d s LYS 55 CO 0.01 0.55 1.19 -1.25 0.00 0.00 0.00 175.35 175.84 2c7d s PRO 56 N -2.78 0.65 0.30 1.78 0.04 -1.26 -0.64 135.00 133.09 2c7d s PRO 56 Ca 0.32 0.02 0.08 0.00 0.04 0.00 0.00 61.00 61.46 2c7d s PRO 56 Cb -0.12 -1.81 -0.03 0.00 0.04 0.00 0.00 34.50 32.58 2c7d s PRO 56 CO 0.25 -2.48 0.20 -0.51 0.04 0.00 0.00 177.00 174.50 2c7d s LEU 57 N -6.12 3.56 0.00 -3.56 1.43 -1.26 -4.62 118.68 108.11 2c7d s LEU 57 Ca 0.68 -0.48 0.19 0.00 -1.03 0.00 0.00 54.13 53.48 2c7d s LEU 57 Cb -0.11 -2.11 0.02 0.00 0.03 0.00 0.00 46.19 44.02 2c7d s LEU 57 CO 0.53 -0.19 0.98 -0.67 0.23 0.00 0.00 176.35 177.23 2c7d n ASP 58 N -1.21 1.94 -4.93 2.29 4.64 -1.26 -4.93 116.55 113.10 2c7d n ASP 58 Ca -0.05 -1.47 -0.25 0.00 -1.38 0.00 0.00 54.79 51.64 2c7d n ASP 58 Cb 0.59 0.39 0.00 0.00 -1.04 0.00 0.00 41.12 41.07 2c7d n ASP 58 CO 0.00 0.00 0.00 0.68 -0.82 0.00 0.00 177.20 177.06 2c7d s VAL 59 N -2.05 4.64 0.14 5.18 -7.23 -1.26 -5.14 120.40 114.68 2c7d s VAL 59 Ca 0.17 -0.17 -0.13 0.00 -1.81 0.00 0.00 61.98 60.04 2c7d s VAL 59 Cb 0.15 -3.74 0.01 0.00 0.56 0.00 0.00 36.38 33.37 2c7d s VAL 59 CO 0.43 -0.61 0.35 -1.59 -0.31 0.00 0.00 175.10 173.38 2c7d s LYS 60 N -4.60 1.11 0.33 4.82 0.00 -1.26 -5.00 119.74 115.14 2c7d s LYS 60 Ca 0.46 -0.92 -0.29 0.00 0.00 0.00 0.00 55.97 55.22 2c7d s LYS 60 Cb -0.10 0.43 -0.11 0.00 0.00 0.00 0.00 37.83 38.05 2c7d s LYS 60 CO 0.41 -0.42 1.54 0.08 0.00 0.00 0.00 175.35 176.95 2c7d s VAL 61 N -3.87 2.09 0.00 1.79 1.01 -1.26 -2.53 120.40 117.63 2c7d s VAL 61 Ca 0.08 0.08 0.00 0.00 0.00 0.00 0.00 61.98 62.15 2c7d s VAL 61 Cb 0.02 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.35 2c7d s VAL 61 CO -0.07 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.66 2c7d n GLY 62 N 1.43 1.08 3.78 4.51 0.00 -1.07 -5.03 105.19 109.90 2c7d n GLY 62 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.93 4.64 -0.31 1.61 1.01 -1.05 -4.84 116.67 114.80 2c7d s ASP 63 Ca 0.00 1.68 0.02 0.00 0.71 0.00 0.00 52.55 54.95 2c7d s ASP 63 Cb 0.00 -2.43 0.08 0.00 1.01 0.00 0.00 42.92 41.58 2c7d s ASP 63 CO 0.00 -1.93 -0.01 -0.63 0.21 0.00 0.00 175.17 172.81 2c7d s ILE 64 N -2.97 2.49 0.16 0.77 1.01 -1.26 -0.47 121.20 120.92 2c7d s ILE 64 Ca 0.60 -1.84 0.02 0.00 0.00 0.00 0.00 60.65 59.43 2c7d s ILE 64 Cb -0.16 -2.60 -0.04 0.00 0.01 0.00 0.00 42.46 39.68 2c7d s ILE 64 CO 0.56 -0.29 0.30 0.68 0.00 0.00 0.00 174.94 176.19 2c7d s VAL 65 N 1.08 5.31 -0.20 2.92 -7.23 0.66 -4.75 120.40 118.18 2c7d s VAL 65 Ca -0.00 -0.66 -0.06 0.00 -1.81 0.00 0.00 61.98 59.44 2c7d s VAL 65 Cb -0.20 -3.75 -0.03 0.00 0.56 0.00 0.00 36.38 32.96 2c7d s VAL 65 CO -0.05 -0.11 0.04 -0.63 -0.31 0.00 0.00 175.10 174.04 2c7d s ILE 66 N -1.77 4.39 0.25 -0.62 1.01 0.69 -1.40 121.20 123.76 2c7d s ILE 66 Ca 0.35 -0.16 0.03 0.00 0.00 0.00 0.00 60.65 60.87 2c7d s ILE 66 Cb -0.11 -2.99 -0.05 0.00 0.01 0.00 0.00 42.46 39.31 2c7d s ILE 66 CO 0.29 0.42 0.01 0.72 0.00 0.00 0.00 174.94 176.38 2c7d s PHE 67 N 0.82 1.61 -0.13 3.97 -0.12 -0.12 -0.23 117.98 123.79 2c7d s PHE 67 Ca 0.02 -0.95 -0.29 0.00 -0.05 0.00 0.00 56.93 55.66 2c7d s PHE 67 Cb -0.14 -0.95 -0.03 0.00 -0.63 0.00 0.00 43.02 41.27 2c7d s PHE 67 CO 0.02 -0.07 1.43 1.21 -0.05 0.00 0.00 175.22 177.76 2c7d s ASN 68 N -3.33 6.81 0.00 1.98 3.84 -0.47 -4.54 114.94 119.24 2c7d s ASN 68 Ca 0.30 1.89 0.00 0.00 0.21 0.00 0.00 52.86 55.26 2c7d s ASN 68 Cb 0.06 -2.54 0.00 0.00 -0.55 0.00 0.00 41.25 38.23 2c7d s ASN 68 CO 0.10 -0.85 1.03 -0.67 -2.79 0.00 0.00 177.10 173.92 2c7d n ASP 69 N 6.90 2.94 0.00 -4.21 2.03 -1.26 -4.63 116.55 118.32 2c7d n ASP 69 Ca 0.15 -1.76 0.00 0.00 0.52 0.00 0.00 54.79 53.70 2c7d n ASP 69 Cb 0.44 -0.54 0.00 0.00 -0.72 0.00 0.00 41.12 40.30 2c7d n ASP 69 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2c7d n GLY 70 N 0.85 6.70 0.34 0.27 0.00 -1.26 -4.86 105.19 107.22 2c7d n GLY 70 Ca 0.00 -1.96 0.16 0.00 0.00 0.00 0.00 46.02 44.22 2c7d n GLY 70 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2c7d h TYR 71 N 0.00 0.00 0.00 1.61 3.20 -2.04 -0.35 116.97 119.39 2c7d h TYR 71 Ca 0.00 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.81 2c7d h TYR 71 Cb 0.00 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.26 2c7d h TYR 71 CO 0.00 0.00 -0.29 0.78 -1.64 0.00 0.00 178.16 177.01 2c7d h GLY 72 N 0.00 0.00 -5.66 1.82 0.00 -1.95 -3.44 103.07 93.84 2c7d h GLY 72 Ca 0.01 0.00 -0.59 0.00 0.00 0.00 0.00 47.33 46.75 2c7d h GLY 72 CO -0.00 0.00 0.61 0.14 0.00 0.00 0.00 176.54 177.29 2c7d s VAL 73 N -3.77 4.73 0.44 4.60 1.01 -0.14 -4.41 120.40 122.86 2c7d s VAL 73 Ca -0.01 1.65 0.08 0.00 0.00 0.00 0.00 61.98 63.71 2c7d s VAL 73 Cb 0.11 -4.22 0.00 0.00 0.00 0.00 0.00 36.38 32.27 2c7d s VAL 73 CO 0.66 -0.20 0.48 -0.54 0.00 0.00 0.00 175.10 175.50 2c7d s LYS 74 N 3.09 2.60 0.16 2.72 -0.14 0.44 -4.94 119.74 123.66 2c7d s LYS 74 Ca 0.39 -1.48 -0.00 0.00 -1.36 0.00 0.00 55.97 53.52 2c7d s LYS 74 Cb -0.14 -2.51 -0.04 0.00 -1.68 0.00 0.00 37.83 33.45 2c7d s LYS 74 CO 0.09 -0.30 0.06 0.45 -0.76 0.00 0.00 175.35 174.89 2c7d s SER 75 N -4.25 0.53 -0.16 2.83 0.15 -1.26 -0.95 113.70 110.59 2c7d s SER 75 Ca 0.51 -1.24 -0.25 0.00 0.70 0.00 0.00 55.95 55.67 2c7d s SER 75 Cb -0.06 0.26 0.06 0.00 -1.71 0.00 0.00 66.02 64.58 2c7d s SER 75 CO 0.30 -0.71 0.63 -1.61 1.20 0.00 0.00 173.24 173.05 2c7d s GLU 76 N -4.04 0.85 -0.19 5.44 0.41 -0.43 -4.96 118.70 115.78 2c7d s GLU 76 Ca 0.27 0.60 -0.01 0.00 -0.41 0.00 0.00 54.97 55.43 2c7d s GLU 76 Cb 0.07 0.41 0.01 0.00 -1.78 0.00 0.00 34.13 32.84 2c7d s GLU 76 CO 0.04 -0.18 -0.15 0.21 -0.49 0.00 0.00 175.26 174.70 2c7d s LYS 77 N -0.31 3.09 -0.03 1.61 2.47 -1.26 -0.31 119.74 125.01 2c7d s LYS 77 Ca -0.05 -0.78 -0.00 0.00 -1.56 0.00 0.00 55.97 53.58 2c7d s LYS 77 Cb -0.03 -2.72 0.03 0.00 -1.46 0.00 0.00 37.83 33.65 2c7d s LYS 77 CO 0.04 -0.22 0.01 0.42 0.16 0.00 0.00 175.35 175.77 2c7d s ILE 78 N 1.35 0.09 -1.70 5.43 1.09 -0.39 -4.79 121.20 122.28 2c7d s ILE 78 Ca 0.05 0.16 0.00 0.00 -1.10 0.00 0.00 60.65 59.76 2c7d s ILE 78 Cb -0.14 -0.22 0.00 0.00 -1.06 0.00 0.00 42.46 41.04 2c7d s ILE 78 CO -0.10 0.14 0.00 0.47 -0.10 0.00 0.00 174.94 175.35 2c7d n ASP 79 N 4.31 -4.88 0.00 3.58 8.00 -1.26 -0.54 116.55 125.77 2c7d n ASP 79 Ca -0.24 0.40 0.00 0.00 0.71 0.00 0.00 54.79 55.66 2c7d n ASP 79 Cb 0.50 -4.17 0.00 0.00 -0.02 0.00 0.00 41.12 37.43 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 -1.01 0.00 -4.83 -2.24 2.85 -1.26 -5.05 115.26 103.71 2c7d n ASN 80 Ca -0.16 0.00 -0.32 0.00 -0.11 0.00 0.00 54.58 53.99 2c7d n ASN 80 Cb 0.58 -0.32 -0.06 0.00 1.24 0.00 0.00 39.78 41.22 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 4.09 -0.10 1.20 8.01 0.30 -5.06 118.70 127.03 2c7d s GLU 81 Ca 0.00 0.98 -0.25 0.00 0.01 0.00 0.00 54.97 55.70 2c7d s GLU 81 Cb 0.00 -2.21 -0.03 0.00 -4.31 0.00 0.00 34.13 27.59 2c7d s GLU 81 CO 0.00 -0.09 0.80 -1.21 0.01 0.00 0.00 175.26 174.78 2c7d s GLU 82 N -3.48 4.40 -0.24 1.61 0.41 -1.26 -1.26 118.70 118.87 2c7d s GLU 82 Ca 0.59 1.03 -0.06 0.00 -0.41 0.00 0.00 54.97 56.13 2c7d s GLU 82 Cb -0.09 -3.50 -0.02 0.00 -1.78 0.00 0.00 34.13 28.73 2c7d s GLU 82 CO 0.20 -0.12 0.03 0.14 -0.49 0.00 0.00 175.26 175.02 2c7d s VAL 83 N 1.41 3.99 -0.12 2.63 -7.23 0.58 -4.73 120.40 116.91 2c7d s VAL 83 Ca 0.40 -0.28 -0.06 0.00 -1.81 0.00 0.00 61.98 60.23 2c7d s VAL 83 Cb -0.18 -2.85 -0.04 0.00 0.56 0.00 0.00 36.38 33.88 2c7d s VAL 83 CO 0.17 0.37 0.10 -0.76 -0.31 0.00 0.00 175.10 174.67 2c7d s LEU 84 N 1.52 4.12 -0.05 1.32 1.43 0.12 -1.32 118.68 125.83 2c7d s LEU 84 Ca 0.06 0.34 0.02 0.00 -1.03 0.00 0.00 54.13 53.52 2c7d s LEU 84 Cb -0.15 -2.00 0.01 0.00 0.03 0.00 0.00 46.19 44.08 2c7d s LEU 84 CO 0.01 0.37 -0.10 -0.63 0.23 0.00 0.00 176.35 176.22 2c7d s ILE 85 N -0.78 0.95 0.33 -0.59 1.01 -0.12 -0.44 121.20 121.57 2c7d s ILE 85 Ca 0.13 -0.41 0.01 0.00 0.00 0.00 0.00 60.65 60.39 2c7d s ILE 85 Cb -0.12 -0.87 -0.01 0.00 0.01 0.00 0.00 42.46 41.47 2c7d s ILE 85 CO 0.03 0.30 0.38 0.00 0.00 0.00 0.00 174.94 175.65 2c7d s MET 86 N 0.47 1.82 0.38 2.79 0.23 -0.68 -0.42 119.30 123.89 2c7d s MET 86 Ca -0.09 -1.85 -0.02 0.00 -1.03 0.00 0.00 55.69 52.69 2c7d s MET 86 Cb -0.13 0.39 -0.04 0.00 -1.53 0.00 0.00 34.83 33.52 2c7d s MET 86 CO 0.02 -0.72 0.62 -1.54 -2.03 0.00 0.00 175.02 171.38 2c7d s SER 87 N -3.29 6.32 0.39 -1.18 1.04 -1.26 -0.18 113.70 115.54 2c7d s SER 87 Ca 0.35 0.66 0.09 0.00 0.48 0.00 0.00 55.95 57.53 2c7d s SER 87 Cb 0.01 -2.12 0.87 0.00 0.10 0.00 0.00 66.02 64.88 2c7d s SER 87 CO 0.23 -0.36 1.97 -0.08 0.98 0.00 0.00 173.24 175.98 2c7d h GLU 88 N 0.79 0.58 0.00 4.02 4.81 -1.42 -1.05 114.58 122.31 2c7d h GLU 88 Ca -0.48 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.71 2c7d h GLU 88 Cb 1.21 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.46 2c7d h GLU 88 CO 0.62 0.38 0.00 0.43 -0.73 0.00 0.00 179.01 179.72 2c7d n SER 89 N -4.48 0.00 -0.39 1.04 7.64 -1.26 -1.03 113.62 115.13 2c7d n SER 89 Ca 0.10 0.39 0.09 0.00 1.01 0.00 0.00 58.87 60.46 2c7d n SER 89 Cb 0.27 -0.39 -0.01 0.00 -1.01 0.00 0.00 64.21 63.07 2c7d n SER 89 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2c7d n ASP 90 N -1.39 1.74 -4.82 6.43 8.00 -0.40 -5.01 116.55 121.10 2c7d n ASP 90 Ca 0.00 -1.37 -0.38 0.00 0.71 0.00 0.00 54.79 53.75 2c7d n ASP 90 Cb 0.00 0.52 -0.06 0.00 -0.02 0.00 0.00 41.12 41.57 2c7d n ASP 90 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2c7d s ILE 91 N -2.23 4.95 -0.15 0.53 1.01 -0.20 -1.37 121.20 123.75 2c7d s ILE 91 Ca 0.15 0.97 -0.04 0.00 0.00 0.00 0.00 60.65 61.74 2c7d s ILE 91 Cb 0.15 -3.78 -0.08 0.00 0.01 0.00 0.00 42.46 38.76 2c7d s ILE 91 CO 0.51 0.55 -0.16 0.18 0.00 0.00 0.00 174.94 176.02 2c7d n LEU 92 N 1.97 1.95 -3.60 2.97 4.77 0.69 -4.95 117.00 120.79 2c7d n LEU 92 Ca -0.12 0.06 -0.05 0.00 -0.03 0.00 0.00 56.01 55.88 2c7d n LEU 92 Cb 0.52 -0.47 -0.02 0.00 -2.33 0.00 0.00 43.42 41.13 2c7d n LEU 92 CO 0.39 0.51 0.82 0.00 -1.33 0.00 0.00 177.39 177.78 2c7d s ALA 93 N -2.28 -1.90 0.00 -1.18 0.00 -1.01 -5.01 121.76 110.38 2c7d s ALA 93 Ca -0.20 0.88 0.00 0.00 0.00 0.00 0.00 51.96 52.64 2c7d s ALA 93 Cb 0.07 0.34 0.00 0.00 0.00 0.00 0.00 23.12 23.53 2c7d s ALA 93 CO 0.29 -0.81 0.00 -0.89 0.00 0.00 0.00 175.76 174.36 2c7d n ILE 94 N -0.30 0.00 0.00 0.00 5.41 -1.26 -0.22 119.36 122.99 2c7d n ILE 94 Ca -0.06 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.69 2c7d n ILE 94 Cb 0.61 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.54 2c7d n ILE 94 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07