#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 0.52 0.52 6.28 6.06 -1.26 -4.86 118.95 126.21 2c7d s ARG 4 Ca 0.00 1.02 -0.17 0.00 -2.50 0.00 0.00 55.73 54.08 2c7d s ARG 4 Cb 0.00 0.43 -0.07 0.00 0.06 0.00 0.00 34.95 35.37 2c7d s ARG 4 CO 0.00 -0.51 1.01 -1.25 -2.50 0.00 0.00 175.30 172.04 2c7d s PRO 5 N 2.80 3.78 -1.18 5.12 0.04 -1.26 -4.97 135.00 139.34 2c7d s PRO 5 Ca 0.13 1.11 -0.05 0.00 0.04 0.00 0.00 61.00 62.23 2c7d s PRO 5 Cb -0.14 -2.11 0.14 0.00 0.04 0.00 0.00 34.50 32.43 2c7d s PRO 5 CO -0.19 -0.42 2.36 -0.11 0.04 0.00 0.00 177.00 178.68 2c7d n LEU 6 N -1.49 7.78 -1.07 -3.56 -0.00 -1.26 -3.90 117.00 113.50 2c7d n LEU 6 Ca 0.08 -4.85 0.00 0.00 -0.00 0.00 0.00 56.01 51.24 2c7d n LEU 6 Cb 0.53 -1.32 0.00 0.00 -0.00 0.00 0.00 43.42 42.64 2c7d n LEU 6 CO 0.44 2.02 -0.30 0.00 -0.00 0.00 0.00 177.39 179.55 2c7d n HIS 7 N 1.37 -2.90 0.00 1.96 1.44 -1.26 -4.70 115.22 111.12 2c7d n HIS 7 Ca 0.59 1.54 0.00 0.00 -2.01 0.00 0.00 57.72 57.84 2c7d n HIS 7 Cb 0.28 -2.70 0.00 0.00 0.12 0.00 0.00 29.99 27.69 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 -0.68 0.00 -4.76 4.39 2.03 0.29 -4.90 116.55 112.91 2c7d n ASP 8 Ca 0.00 0.00 -0.37 0.00 0.52 0.00 0.00 54.79 54.94 2c7d n ASP 8 Cb 0.00 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.41 2c7d n ASP 8 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2c7d s ARG 9 N 0.00 3.56 0.08 -0.67 3.03 -1.26 -2.27 118.95 121.42 2c7d s ARG 9 Ca 0.00 1.92 0.06 0.00 2.03 0.00 0.00 55.73 59.74 2c7d s ARG 9 Cb 0.00 -2.36 -0.03 0.00 -1.03 0.00 0.00 34.95 31.53 2c7d s ARG 9 CO 0.00 -0.75 -0.16 0.08 -1.13 0.00 0.00 175.30 173.33 2c7d s VAL 10 N -1.47 1.30 -0.11 4.99 1.01 0.72 -2.26 120.40 124.58 2c7d s VAL 10 Ca 0.66 -1.34 0.03 0.00 0.00 0.00 0.00 61.98 61.33 2c7d s VAL 10 Cb -0.32 -1.21 0.01 0.00 0.00 0.00 0.00 36.38 34.85 2c7d s VAL 10 CO 0.39 -0.14 -0.20 -0.63 0.00 0.00 0.00 175.10 174.52 2c7d s ILE 11 N -1.19 1.80 0.11 2.22 1.01 0.32 -1.86 121.20 123.61 2c7d s ILE 11 Ca 0.01 -0.85 -0.00 0.00 0.00 0.00 0.00 60.65 59.81 2c7d s ILE 11 Cb -0.10 -1.59 -0.04 0.00 0.01 0.00 0.00 42.46 40.74 2c7d s ILE 11 CO 0.03 0.50 0.01 0.68 0.00 0.00 0.00 174.94 176.15 2c7d s VAL 12 N 0.64 0.30 -0.17 2.92 -7.23 0.02 -0.96 120.40 115.93 2c7d s VAL 12 Ca -0.13 -1.89 -0.07 0.00 -1.81 0.00 0.00 61.98 58.08 2c7d s VAL 12 Cb -0.16 -1.86 -0.04 0.00 0.56 0.00 0.00 36.38 34.88 2c7d s VAL 12 CO 0.03 -0.67 0.06 -1.59 -0.31 0.00 0.00 175.10 172.62 2c7d s LYS 13 N -3.96 3.83 0.36 4.82 -2.85 -0.03 -0.42 119.74 121.49 2c7d s LYS 13 Ca 0.18 -0.34 -0.27 0.00 -1.00 0.00 0.00 55.97 54.54 2c7d s LYS 13 Cb 0.07 -3.16 -0.09 0.00 -2.06 0.00 0.00 37.83 32.59 2c7d s LYS 13 CO -0.02 0.36 1.18 0.50 0.10 0.00 0.00 175.35 177.47 2c7d s ARG 14 N 0.13 4.24 0.32 1.78 3.52 -1.26 -0.65 118.95 127.02 2c7d s ARG 14 Ca 0.05 1.91 -0.28 0.00 -0.13 0.00 0.00 55.73 57.28 2c7d s ARG 14 Cb -0.12 -2.87 -0.09 0.00 -1.56 0.00 0.00 34.95 30.31 2c7d s ARG 14 CO 0.01 -0.18 1.14 0.15 -0.81 0.00 0.00 175.30 175.61 2c7d s LYS 15 N -2.01 4.44 0.08 5.12 -0.14 -0.22 -4.88 119.74 122.13 2c7d s LYS 15 Ca 0.53 1.84 -0.37 0.00 -1.36 0.00 0.00 55.97 56.61 2c7d s LYS 15 Cb -0.33 -3.01 -0.17 0.00 -1.68 0.00 0.00 37.83 32.64 2c7d s LYS 15 CO 0.42 0.02 1.35 -0.85 -0.76 0.00 0.00 175.35 175.53 2c7d n GLU 16 N 0.80 1.13 -1.73 1.68 0.00 -1.26 -4.81 120.64 116.45 2c7d n GLU 16 Ca 0.01 0.41 -0.42 0.00 0.00 0.00 0.00 57.16 57.15 2c7d n GLU 16 Cb 0.45 -2.05 -0.02 0.00 0.00 0.00 0.00 31.44 29.82 2c7d n GLU 16 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 2c7d n VAL 17 N 2.56 1.06 -4.08 3.84 0.31 -1.26 -3.45 118.33 117.32 2c7d n VAL 17 Ca 0.19 -0.27 -0.36 0.00 -0.01 0.00 0.00 64.34 63.89 2c7d n VAL 17 Cb 0.19 -1.86 -0.03 0.00 -0.91 0.00 0.00 33.84 31.23 2c7d n VAL 17 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2c7d n GLU 18 N 2.03 -0.58 -1.47 5.55 1.02 -0.10 -4.46 120.64 122.64 2c7d n GLU 18 Ca 0.09 0.02 -0.45 0.00 -0.02 0.00 0.00 57.16 56.80 2c7d n GLU 18 Cb 0.36 -2.52 -0.09 0.00 -0.02 0.00 0.00 31.44 29.17 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 -4.41 0.04 0.67 2.62 -1.04 -1.22 -4.76 114.28 106.17 2c7d n THR 19 Ca -0.18 -0.28 0.08 0.00 -2.04 0.00 0.00 64.05 61.62 2c7d n THR 19 Cb 0.55 -1.45 0.38 0.00 -1.82 0.00 0.00 70.33 67.99 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 8.42 0.13 0.05 -2.82 4.01 -1.26 -1.69 118.16 125.00 2c7d n LYS 20 Ca 0.50 0.17 0.13 0.00 -0.51 0.00 0.00 58.31 58.60 2c7d n LYS 20 Cb 0.22 -1.50 0.42 0.00 -0.51 0.00 0.00 35.03 33.65 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 -1.38 0.49 0.00 4.39 3.41 -1.26 -1.93 113.62 117.34 2c7d n SER 21 Ca 0.06 0.38 0.03 0.00 -0.26 0.00 0.00 58.87 59.08 2c7d n SER 21 Cb 0.15 -0.41 0.18 0.00 -0.26 0.00 0.00 64.21 63.88 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 -1.66 2.07 0.65 7.33 0.00 -0.68 -3.92 120.51 124.30 2c7d n ALA 22 Ca 0.06 -0.04 0.12 0.00 0.00 0.00 0.00 53.44 53.58 2c7d n ALA 22 Cb 0.39 -1.10 0.28 0.00 0.00 0.00 0.00 19.45 19.02 2c7d n ALA 22 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c7d n GLY 23 N 0.05 -1.50 0.00 0.00 0.00 -1.24 -4.97 105.19 97.52 2c7d n GLY 23 Ca 0.05 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2c7d n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c7d n GLY 24 N 1.35 0.14 0.12 -0.02 0.00 -1.25 -4.40 105.19 101.13 2c7d n GLY 24 Ca 0.04 -1.44 -0.13 0.00 0.00 0.00 0.00 46.02 44.49 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 1.48 -3.78 -0.61 2.04 -1.97 -3.47 117.51 111.20 2c7d h ILE 25 Ca 0.00 -2.79 -0.53 0.00 1.00 0.00 0.00 64.86 62.53 2c7d h ILE 25 Cb 0.00 2.68 0.09 0.00 -0.74 0.00 0.00 36.82 38.85 2c7d h ILE 25 CO 0.00 0.82 0.78 -0.69 0.00 0.00 0.00 178.15 179.06 2c7d s VAL 26 N -2.96 2.20 -0.27 1.67 1.01 -1.26 -5.00 120.40 115.78 2c7d s VAL 26 Ca -0.04 0.19 -0.26 0.00 0.00 0.00 0.00 61.98 61.86 2c7d s VAL 26 Cb 0.08 -3.12 0.00 0.00 0.00 0.00 0.00 36.38 33.35 2c7d s VAL 26 CO 0.86 0.04 0.93 -0.22 0.00 0.00 0.00 175.10 176.72 2c7d s LEU 27 N -1.63 4.06 -0.35 3.92 0.20 -1.26 -3.65 118.68 119.96 2c7d s LEU 27 Ca 0.55 1.06 -0.23 0.00 0.69 0.00 0.00 54.13 56.19 2c7d s LEU 27 Cb -0.45 -3.34 0.01 0.00 -0.43 0.00 0.00 46.19 41.98 2c7d s LEU 27 CO 0.57 -0.66 0.78 0.28 -0.29 0.00 0.00 176.35 177.04 2c7d s THR 28 N 3.14 4.75 -0.04 3.68 -1.32 -0.81 -4.96 115.64 120.08 2c7d s THR 28 Ca 0.39 0.95 -0.23 0.00 -1.21 0.00 0.00 61.69 61.60 2c7d s THR 28 Cb -0.14 -4.19 -0.25 0.00 -1.51 0.00 0.00 72.50 66.40 2c7d s THR 28 CO 0.10 -0.39 1.01 1.23 -2.21 0.00 0.00 174.62 174.36 2c7d h GLY 29 N 9.67 0.30 0.00 6.08 0.00 -1.91 -3.39 103.07 113.82 2c7d h GLY 29 Ca -0.25 -0.57 0.00 0.00 0.00 0.00 0.00 47.33 46.51 2c7d h GLY 29 CO 0.90 0.50 0.00 1.44 0.00 0.00 0.00 176.54 179.39 2c7d n SER 30 N -4.34 0.00 0.00 0.19 7.64 -1.26 -4.92 113.62 110.92 2c7d n SER 30 Ca -0.11 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.77 2c7d n SER 30 Cb 0.62 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.82 2c7d n SER 30 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2c7d n ALA 31 N -0.65 0.18 -0.50 -0.43 0.00 -1.26 -5.05 120.51 112.79 2c7d n ALA 31 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2c7d n ALA 31 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 -0.09 0.00 -1.54 0.00 0.00 -1.26 -5.09 120.51 112.53 2c7d n ALA 32 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2c7d n ALA 32 Cb 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 19.45 19.21 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 -0.49 0.00 -0.46 0.00 0.00 -1.26 -5.14 120.51 113.16 2c7d n ALA 33 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2c7d n ALA 33 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 0.00 0.00 0.00 0.00 3.00 -1.26 -4.92 118.16 114.98 2c7d n LYS 34 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 2c7d n LYS 34 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.03 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 -1.81 0.00 -0.02 3.14 2.88 -1.26 -0.92 113.62 115.62 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 0.00 0.00 0.65 0.00 -0.75 0.00 0.00 64.21 64.11 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 0.00 0.00 -4.40 2.46 -2.24 -1.26 -4.87 114.28 103.97 2c7d n THR 36 Ca 0.00 -0.01 -0.34 0.00 -2.27 0.00 0.00 64.05 61.43 2c7d n THR 36 Cb 0.00 -0.39 -0.10 0.00 -2.10 0.00 0.00 70.33 67.75 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 -2.74 2.93 0.04 -0.78 3.00 -1.26 -1.12 118.95 119.01 2c7d s ARG 37 Ca 0.22 -0.45 -0.12 0.00 0.00 0.00 0.00 55.73 55.39 2c7d s ARG 37 Cb 0.20 -2.75 0.01 0.00 0.00 0.00 0.00 34.95 32.41 2c7d s ARG 37 CO 0.50 0.69 0.25 0.20 0.00 0.00 0.00 175.30 176.94 2c7d s GLY 38 N -0.95 -0.05 -0.20 -3.53 0.00 -0.50 -1.05 107.32 101.04 2c7d s GLY 38 Ca 0.14 -0.12 -0.07 0.00 0.00 0.00 0.00 44.72 44.67 2c7d s GLY 38 CO 0.03 -0.32 0.06 1.85 0.00 0.00 0.00 173.10 174.72 2c7d s GLU 39 N -2.48 3.84 0.09 2.90 2.12 0.17 -0.30 118.70 125.05 2c7d s GLU 39 Ca -0.06 -0.41 -0.31 0.00 0.36 0.00 0.00 54.97 54.56 2c7d s GLU 39 Cb -0.01 -3.22 -0.06 0.00 0.26 0.00 0.00 34.13 31.09 2c7d s GLU 39 CO -0.03 0.11 1.23 0.08 -0.54 0.00 0.00 175.26 176.11 2c7d s VAL 40 N 0.79 3.83 -0.22 3.70 1.01 0.36 -0.85 120.40 129.02 2c7d s VAL 40 Ca 0.03 1.35 0.01 0.00 0.00 0.00 0.00 61.98 63.38 2c7d s VAL 40 Cb -0.14 -3.87 -0.14 0.00 0.00 0.00 0.00 36.38 32.23 2c7d s VAL 40 CO 0.02 0.13 -0.20 0.18 0.00 0.00 0.00 175.10 175.23 2c7d n LEU 41 N 3.65 2.96 -3.52 3.92 4.77 -0.14 -1.69 117.00 126.96 2c7d n LEU 41 Ca 0.08 -0.11 -0.15 0.00 -0.03 0.00 0.00 56.01 55.80 2c7d n LEU 41 Cb 0.45 -0.77 -0.05 0.00 -2.33 0.00 0.00 43.42 40.72 2c7d n LEU 41 CO 0.56 0.87 0.37 0.00 -1.33 0.00 0.00 177.39 177.86 2c7d s ALA 42 N -2.44 -1.58 0.08 -1.18 0.00 -0.42 -4.82 121.76 111.40 2c7d s ALA 42 Ca -0.30 0.89 0.06 0.00 0.00 0.00 0.00 51.96 52.61 2c7d s ALA 42 Cb 0.08 0.32 -0.03 0.00 0.00 0.00 0.00 23.12 23.49 2c7d s ALA 42 CO 0.51 -0.50 -0.15 0.08 0.00 0.00 0.00 175.76 175.70 2c7d s VAL 43 N -2.16 1.20 1.06 0.00 1.01 -1.26 -0.52 120.40 119.73 2c7d s VAL 43 Ca -0.07 -1.39 -0.15 0.00 0.00 0.00 0.00 61.98 60.37 2c7d s VAL 43 Cb -0.01 -1.18 0.22 0.00 0.00 0.00 0.00 36.38 35.41 2c7d s VAL 43 CO 0.01 -0.24 1.12 -0.83 0.00 0.00 0.00 175.10 175.16 2c7d s GLY 44 N -1.86 1.59 -0.50 4.51 0.00 -0.96 -4.49 107.32 105.61 2c7d s GLY 44 Ca 0.00 -0.67 -0.07 0.00 0.00 0.00 0.00 44.72 43.98 2c7d s GLY 44 CO 0.03 0.05 3.19 0.70 0.00 0.00 0.00 173.10 177.06 2c7d n ASN 45 N -4.31 5.89 0.00 1.64 3.02 -1.25 -4.84 115.26 115.40 2c7d n ASN 45 Ca 0.09 -2.44 0.00 0.00 -0.03 0.00 0.00 54.58 52.20 2c7d n ASN 45 Cb 0.59 -1.36 0.00 0.00 -0.61 0.00 0.00 39.78 38.40 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 2.90 0.92 2.96 7.41 0.00 -1.26 -4.56 105.19 113.56 2c7d n GLY 46 Ca 0.50 -0.75 -0.31 0.00 0.00 0.00 0.00 46.02 45.46 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 1.60 -1.03 1.61 3.52 -0.53 -0.55 118.95 123.58 2c7d s ARG 47 Ca 0.00 -1.29 -0.05 0.00 -0.13 0.00 0.00 55.73 54.26 2c7d s ARG 47 Cb 0.00 -2.73 0.08 0.00 -1.56 0.00 0.00 34.95 30.74 2c7d s ARG 47 CO 0.00 -0.72 2.56 -0.89 -0.81 0.00 0.00 175.30 175.44 2c7d n ILE 48 N 4.54 4.56 -3.99 4.11 5.41 -1.26 -4.19 119.36 128.54 2c7d n ILE 48 Ca -0.07 -3.77 -0.09 0.00 1.00 0.00 0.00 62.75 59.82 2c7d n ILE 48 Cb 0.43 -1.94 -0.10 0.00 -0.71 0.00 0.00 39.64 37.31 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 -2.01 2.15 -0.19 1.39 1.43 -1.26 -4.83 118.68 115.36 2c7d s LEU 49 Ca 0.57 -0.61 0.00 0.00 -1.03 0.00 0.00 54.13 53.05 2c7d s LEU 49 Cb 0.25 0.29 0.00 0.00 0.03 0.00 0.00 46.19 46.76 2c7d s LEU 49 CO -0.13 -0.43 0.00 1.21 0.23 0.00 0.00 176.35 177.23 2c7d n GLU 50 N 1.01 -0.24 0.00 1.70 2.13 -1.26 -4.36 120.64 119.61 2c7d n GLU 50 Ca -0.20 0.38 0.00 0.00 0.66 0.00 0.00 57.16 58.00 2c7d n GLU 50 Cb 0.57 -3.84 0.00 0.00 0.27 0.00 0.00 31.44 28.45 2c7d n GLU 50 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 2c7d n ASN 51 N 0.81 0.00 -3.81 4.31 5.15 -1.26 -4.89 115.26 115.57 2c7d n ASN 51 Ca -0.02 0.00 -0.42 0.00 -0.60 0.00 0.00 54.58 53.54 2c7d n ASN 51 Cb 0.09 0.00 -0.02 0.00 -0.53 0.00 0.00 39.78 39.32 2c7d n ASN 51 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2c7d n GLY 52 N 0.00 3.55 4.64 8.20 0.00 -1.26 -4.87 105.19 115.44 2c7d n GLY 52 Ca 0.00 -1.44 0.06 0.00 0.00 0.00 0.00 46.02 44.63 2c7d n GLY 52 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2c7d n GLU 53 N 6.67 -0.87 -2.12 1.61 4.71 -1.26 -4.46 120.64 124.92 2c7d n GLU 53 Ca 0.51 0.57 -0.42 0.00 -0.01 0.00 0.00 57.16 57.81 2c7d n GLU 53 Cb 0.40 -1.06 -0.03 0.00 -1.01 0.00 0.00 31.44 29.75 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 -0.76 3.71 -0.01 2.62 1.01 -1.26 -4.70 120.40 121.00 2c7d s VAL 54 Ca 0.00 0.93 0.03 0.00 0.00 0.00 0.00 61.98 62.94 2c7d s VAL 54 Cb 0.00 -3.60 -0.03 0.00 0.00 0.00 0.00 36.38 32.75 2c7d s VAL 54 CO 0.00 -0.06 -0.07 -1.59 0.00 0.00 0.00 175.10 173.38 2c7d s LYS 55 N 3.53 2.59 0.90 2.72 0.00 -1.26 -4.98 119.74 123.23 2c7d s LYS 55 Ca 0.68 -0.69 -0.12 0.00 0.00 0.00 0.00 55.97 55.85 2c7d s LYS 55 Cb -0.31 -2.51 0.13 0.00 0.00 0.00 0.00 37.83 35.14 2c7d s LYS 55 CO 0.26 0.62 1.09 -1.25 0.00 0.00 0.00 175.35 176.07 2c7d s PRO 56 N -1.26 1.24 -0.04 1.78 0.04 -1.26 -1.45 135.00 134.04 2c7d s PRO 56 Ca 0.16 0.74 -0.01 0.00 0.04 0.00 0.00 61.00 61.93 2c7d s PRO 56 Cb -0.11 -1.81 -0.04 0.00 0.04 0.00 0.00 34.50 32.58 2c7d s PRO 56 CO 0.06 -2.23 0.03 -0.51 0.04 0.00 0.00 177.00 174.38 2c7d s LEU 57 N -6.19 3.67 0.00 -3.56 1.43 -1.26 -4.68 118.68 108.09 2c7d s LEU 57 Ca 0.63 0.11 0.01 0.00 -1.03 0.00 0.00 54.13 53.85 2c7d s LEU 57 Cb -0.17 -2.01 0.04 0.00 0.03 0.00 0.00 46.19 44.07 2c7d s LEU 57 CO 0.57 0.32 0.98 -0.67 0.23 0.00 0.00 176.35 177.77 2c7d n ASP 58 N 1.64 0.00 -4.74 2.29 2.03 -1.26 -4.79 116.55 111.73 2c7d n ASP 58 Ca -0.16 -1.89 -0.22 0.00 0.52 0.00 0.00 54.79 53.04 2c7d n ASP 58 Cb 0.53 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.87 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 -2.00 3.68 0.23 5.18 -7.23 -1.26 -5.10 120.40 113.89 2c7d s VAL 59 Ca 0.01 -1.67 -0.22 0.00 -1.81 0.00 0.00 61.98 58.29 2c7d s VAL 59 Cb 0.00 -3.07 0.04 0.00 0.56 0.00 0.00 36.38 33.91 2c7d s VAL 59 CO 0.01 -0.31 0.72 -1.59 -0.31 0.00 0.00 175.10 173.62 2c7d s LYS 60 N -3.79 1.56 0.21 4.82 0.00 -1.26 -4.97 119.74 116.31 2c7d s LYS 60 Ca 0.34 -0.80 -0.31 0.00 0.00 0.00 0.00 55.97 55.20 2c7d s LYS 60 Cb -0.06 0.58 -0.11 0.00 0.00 0.00 0.00 37.83 38.24 2c7d s LYS 60 CO 0.23 -0.71 1.58 0.08 0.00 0.00 0.00 175.35 176.52 2c7d s VAL 61 N -3.78 2.41 0.00 1.79 1.01 -1.26 -2.70 120.40 117.87 2c7d s VAL 61 Ca 0.08 0.31 0.00 0.00 0.00 0.00 0.00 61.98 62.38 2c7d s VAL 61 Cb -0.04 -3.20 0.00 0.00 0.00 0.00 0.00 36.38 33.14 2c7d s VAL 61 CO 0.01 0.03 0.00 0.61 0.00 0.00 0.00 175.10 175.75 2c7d n GLY 62 N 3.18 1.32 3.79 4.51 0.00 -0.68 -5.00 105.19 112.31 2c7d n GLY 62 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 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 -3.01 5.30 -0.25 1.61 1.11 -1.10 -4.76 116.67 115.57 2c7d s ASP 63 Ca 0.00 1.82 -0.00 0.00 0.18 0.00 0.00 52.55 54.55 2c7d s ASP 63 Cb 0.00 -2.53 0.04 0.00 1.07 0.00 0.00 42.92 41.50 2c7d s ASP 63 CO 0.00 -1.49 -0.08 -0.63 1.18 0.00 0.00 175.17 174.15 2c7d s ILE 64 N -2.63 2.60 0.17 0.77 1.01 -1.26 -0.49 121.20 121.36 2c7d s ILE 64 Ca 0.63 -1.26 0.06 0.00 0.00 0.00 0.00 60.65 60.08 2c7d s ILE 64 Cb -0.17 -2.38 -0.04 0.00 0.01 0.00 0.00 42.46 39.88 2c7d s ILE 64 CO 0.45 0.12 0.08 0.68 0.00 0.00 0.00 174.94 176.28 2c7d s VAL 65 N 1.24 4.20 -0.09 2.92 -7.23 0.60 -4.38 120.40 117.66 2c7d s VAL 65 Ca -0.03 -1.20 0.04 0.00 -1.81 0.00 0.00 61.98 58.98 2c7d s VAL 65 Cb -0.18 -3.13 -0.01 0.00 0.56 0.00 0.00 36.38 33.62 2c7d s VAL 65 CO -0.05 -0.10 -0.21 -0.63 -0.31 0.00 0.00 175.10 173.79 2c7d s ILE 66 N -1.74 2.35 0.06 -0.62 1.01 0.57 -1.41 121.20 121.43 2c7d s ILE 66 Ca 0.30 -0.94 -0.05 0.00 0.00 0.00 0.00 60.65 59.96 2c7d s ILE 66 Cb -0.10 -1.91 -0.02 0.00 0.01 0.00 0.00 42.46 40.45 2c7d s ILE 66 CO 0.22 0.56 0.08 0.72 0.00 0.00 0.00 174.94 176.51 2c7d s PHE 67 N 0.09 0.30 -0.75 3.97 -0.12 -0.28 -0.21 117.98 120.98 2c7d s PHE 67 Ca -0.10 -0.73 -0.26 0.00 -0.05 0.00 0.00 56.93 55.79 2c7d s PHE 67 Cb -0.16 -0.20 0.01 0.00 -0.63 0.00 0.00 43.02 42.04 2c7d s PHE 67 CO 0.06 -0.43 1.59 1.21 -0.05 0.00 0.00 175.22 177.60 2c7d s ASN 68 N -2.64 5.77 0.71 1.98 2.47 -0.81 -4.64 114.94 117.77 2c7d s ASN 68 Ca 0.02 -0.33 -0.15 0.00 0.42 0.00 0.00 52.86 52.82 2c7d s ASN 68 Cb 0.04 -2.55 0.03 0.00 -1.45 0.00 0.00 41.25 37.32 2c7d s ASN 68 CO -0.09 -2.10 1.19 -0.62 -3.72 0.00 0.00 177.10 171.77 2c7d s ASP 69 N 5.97 4.44 0.00 -4.21 -1.08 -1.26 -4.37 116.67 116.16 2c7d s ASP 69 Ca 0.52 2.30 0.00 0.00 -0.52 0.00 0.00 52.55 54.85 2c7d s ASP 69 Cb -0.08 -2.58 0.00 0.00 -1.46 0.00 0.00 42.92 38.79 2c7d s ASP 69 CO 0.12 -2.10 0.00 0.61 0.52 0.00 0.00 175.17 174.32 2c7d n GLY 70 N 0.25 0.48 0.00 2.66 0.00 -1.26 -4.80 105.19 102.52 2c7d n GLY 70 Ca 0.13 -1.57 0.12 0.00 0.00 0.00 0.00 46.02 44.70 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 -4.69 117.16 122.18 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 -0.02 0.00 0.00 -0.63 0.00 0.00 39.34 38.69 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 0.50 0.27 0.00 2.98 0.00 -1.26 -4.99 105.19 102.69 2c7d n GLY 72 Ca 0.17 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.90 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 -3.09 1.61 0.31 -1.26 -5.02 118.33 110.88 2c7d n VAL 73 Ca 0.00 0.00 -0.20 0.00 -0.01 0.00 0.00 64.34 64.13 2c7d n VAL 73 Cb 0.00 0.00 0.06 0.00 -0.91 0.00 0.00 33.84 32.99 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 2.24 0.43 5.55 -0.14 0.10 -4.92 119.74 123.00 2c7d s LYS 74 Ca 0.00 -1.71 0.04 0.00 -1.36 0.00 0.00 55.97 52.94 2c7d s LYS 74 Cb 0.00 -2.60 -0.05 0.00 -1.68 0.00 0.00 37.83 33.49 2c7d s LYS 74 CO 0.00 -0.92 0.02 0.45 -0.76 0.00 0.00 175.35 174.14 2c7d s SER 75 N -4.68 3.64 -0.08 2.83 0.15 -1.26 -1.11 113.70 113.19 2c7d s SER 75 Ca 0.61 -1.48 -0.30 0.00 0.70 0.00 0.00 55.95 55.48 2c7d s SER 75 Cb -0.05 0.01 0.12 0.00 -1.71 0.00 0.00 66.02 64.38 2c7d s SER 75 CO 0.39 -0.64 0.97 -1.61 1.20 0.00 0.00 173.24 173.55 2c7d s GLU 76 N -3.79 0.68 -0.71 5.44 0.41 -0.32 -4.78 118.70 115.62 2c7d s GLU 76 Ca 0.25 -0.15 -0.02 0.00 -0.41 0.00 0.00 54.97 54.64 2c7d s GLU 76 Cb 0.07 0.31 0.18 0.00 -1.78 0.00 0.00 34.13 32.91 2c7d s GLU 76 CO 0.13 -0.28 0.54 0.21 -0.49 0.00 0.00 175.26 175.37 2c7d s LYS 77 N -2.46 2.77 -0.20 1.61 2.47 -1.26 -0.55 119.74 122.12 2c7d s LYS 77 Ca 0.04 -2.80 -0.05 0.00 -1.56 0.00 0.00 55.97 51.60 2c7d s LYS 77 Cb -0.01 -3.78 -0.03 0.00 -1.46 0.00 0.00 37.83 32.55 2c7d s LYS 77 CO -0.05 -1.21 0.01 0.42 0.16 0.00 0.00 175.35 174.68 2c7d s ILE 78 N -0.52 4.08 -0.74 5.43 1.09 -0.27 -4.44 121.20 125.84 2c7d s ILE 78 Ca 0.20 -0.27 0.00 0.00 -1.10 0.00 0.00 60.65 59.48 2c7d s ILE 78 Cb -0.16 -2.85 0.00 0.00 -1.06 0.00 0.00 42.46 38.40 2c7d s ILE 78 CO -0.07 0.43 0.00 -0.67 -0.10 0.00 0.00 174.94 174.53 2c7d n ASP 79 N 4.18 -5.43 0.00 3.58 2.03 -1.26 -0.63 116.55 119.02 2c7d n ASP 79 Ca -0.17 0.17 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2c7d n ASP 79 Cb 0.52 -3.75 0.00 0.00 -0.72 0.00 0.00 41.12 37.17 2c7d n ASP 79 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 2c7d n ASN 80 N -0.90 0.00 -4.91 1.67 2.85 -1.26 -5.07 115.26 107.63 2c7d n ASN 80 Ca -0.07 0.00 -0.27 0.00 -0.11 0.00 0.00 54.58 54.13 2c7d n ASN 80 Cb 0.53 0.00 0.01 0.00 1.24 0.00 0.00 39.78 41.56 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 -0.36 3.32 -0.18 1.20 8.01 0.19 -5.05 118.70 125.83 2c7d s GLU 81 Ca 0.00 0.10 -0.27 0.00 0.01 0.00 0.00 54.97 54.81 2c7d s GLU 81 Cb 0.00 -2.35 -0.01 0.00 -4.31 0.00 0.00 34.13 27.46 2c7d s GLU 81 CO 0.00 -0.37 0.92 -1.21 0.01 0.00 0.00 175.26 174.61 2c7d s GLU 82 N -4.82 4.31 -0.11 1.61 0.41 -1.26 -1.11 118.70 117.73 2c7d s GLU 82 Ca 0.50 1.17 0.00 0.00 -0.41 0.00 0.00 54.97 56.23 2c7d s GLU 82 Cb -0.10 -3.59 -0.02 0.00 -1.78 0.00 0.00 34.13 28.64 2c7d s GLU 82 CO 0.45 -0.41 -0.11 0.14 -0.49 0.00 0.00 175.26 174.84 2c7d s VAL 83 N 2.42 3.30 0.20 2.63 -7.23 0.28 -4.73 120.40 117.26 2c7d s VAL 83 Ca 0.41 -0.60 -0.30 0.00 -1.81 0.00 0.00 61.98 59.69 2c7d s VAL 83 Cb -0.16 -2.37 -0.08 0.00 0.56 0.00 0.00 36.38 34.33 2c7d s VAL 83 CO 0.12 0.55 0.96 -0.76 -0.31 0.00 0.00 175.10 175.66 2c7d s LEU 84 N -0.07 4.59 -0.08 1.32 1.02 0.44 -1.18 118.68 124.72 2c7d s LEU 84 Ca -0.01 1.92 0.01 0.00 0.02 0.00 0.00 54.13 56.07 2c7d s LEU 84 Cb -0.14 -3.60 0.02 0.00 0.02 0.00 0.00 46.19 42.49 2c7d s LEU 84 CO 0.03 0.05 -0.10 -0.63 0.02 0.00 0.00 176.35 175.73 2c7d s ILE 85 N -0.75 1.04 0.16 -0.59 1.01 -0.27 -0.80 121.20 121.01 2c7d s ILE 85 Ca 0.44 -0.38 -0.05 0.00 0.00 0.00 0.00 60.65 60.66 2c7d s ILE 85 Cb -0.26 -0.99 -0.02 0.00 0.01 0.00 0.00 42.46 41.20 2c7d s ILE 85 CO 0.32 0.35 0.19 0.00 0.00 0.00 0.00 174.94 175.79 2c7d s MET 86 N 1.05 1.09 0.66 2.79 0.23 -0.78 -0.72 119.30 123.62 2c7d s MET 86 Ca -0.07 -1.33 -0.08 0.00 -1.03 0.00 0.00 55.69 53.18 2c7d s MET 86 Cb -0.15 0.32 0.03 0.00 -1.53 0.00 0.00 34.83 33.50 2c7d s MET 86 CO -0.01 -0.36 1.00 -1.54 -2.03 0.00 0.00 175.02 172.07 2c7d s SER 87 N -3.02 5.33 0.49 -1.18 1.04 -1.26 -0.20 113.70 114.90 2c7d s SER 87 Ca 0.22 0.79 0.21 0.00 0.48 0.00 0.00 55.95 57.64 2c7d s SER 87 Cb 0.05 -1.62 1.27 0.00 0.10 0.00 0.00 66.02 65.82 2c7d s SER 87 CO 0.02 -1.30 2.06 -0.08 0.98 0.00 0.00 173.24 174.93 2c7d h GLU 88 N -0.45 0.00 0.00 4.02 4.81 -1.82 -2.53 114.58 118.61 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 1.27 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.65 2c7d h GLU 88 CO 0.62 0.13 0.00 0.43 -0.73 0.00 0.00 179.01 179.46 2c7d n SER 89 N -4.06 0.04 0.22 1.04 7.64 -1.26 -1.77 113.62 115.46 2c7d n SER 89 Ca -0.02 0.51 0.12 0.00 1.01 0.00 0.00 58.87 60.48 2c7d n SER 89 Cb 0.21 -0.52 0.18 0.00 -1.01 0.00 0.00 64.21 63.08 2c7d n SER 89 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 2c7d h ASP 90 N 0.00 0.00 -3.37 6.43 3.32 -1.84 -3.47 116.42 117.49 2c7d h ASP 90 Ca 0.00 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.48 2c7d h ASP 90 Cb 0.26 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.73 2c7d h ASP 90 CO 0.00 0.02 0.04 -0.63 -1.72 0.00 0.00 179.24 176.94 2c7d s ILE 91 N -3.22 5.08 -0.12 0.35 1.01 -0.73 -1.93 121.20 121.64 2c7d s ILE 91 Ca 0.07 1.23 0.01 0.00 0.00 0.00 0.00 60.65 61.96 2c7d s ILE 91 Cb 0.05 -3.95 -0.24 0.00 0.01 0.00 0.00 42.46 38.33 2c7d s ILE 91 CO 0.67 0.23 0.34 0.18 0.00 0.00 0.00 174.94 176.36 2c7d n LEU 92 N 4.13 2.07 -3.51 2.97 4.77 0.71 -4.96 117.00 123.17 2c7d n LEU 92 Ca -0.03 0.20 -0.08 0.00 -0.03 0.00 0.00 56.01 56.07 2c7d n LEU 92 Cb 0.51 -0.66 -0.02 0.00 -2.33 0.00 0.00 43.42 40.92 2c7d n LEU 92 CO 0.45 0.73 0.66 0.00 -1.33 0.00 0.00 177.39 177.89 2c7d s ALA 93 N -2.56 -1.78 0.00 -1.18 0.00 -1.03 -5.02 121.76 110.20 2c7d s ALA 93 Ca -0.19 0.89 0.00 0.00 0.00 0.00 0.00 51.96 52.66 2c7d s ALA 93 Cb 0.07 0.49 0.00 0.00 0.00 0.00 0.00 23.12 23.68 2c7d s ALA 93 CO 0.76 -0.72 0.00 -0.89 0.00 0.00 0.00 175.76 174.91 2c7d n ILE 94 N -0.28 0.00 0.00 0.00 5.41 -1.26 -0.31 119.36 122.92 2c7d n ILE 94 Ca -0.09 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.66 2c7d n ILE 94 Cb 0.62 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.55 2c7d n ILE 94 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07