#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 0.54 0.35 6.28 6.06 -1.26 -5.13 118.95 125.80 2c7c s ARG 4 Ca 0.00 0.66 -0.26 0.00 -2.50 0.00 0.00 55.73 53.63 2c7c s ARG 4 Cb 0.00 0.26 -0.09 0.00 0.06 0.00 0.00 34.95 35.18 2c7c s ARG 4 CO 0.00 -0.89 1.06 -1.25 -2.50 0.00 0.00 175.30 171.73 2c7c s PRO 5 N 2.80 4.35 -0.97 5.12 0.04 -1.26 -5.00 135.00 140.08 2c7c s PRO 5 Ca 0.14 1.61 -0.00 0.00 0.04 0.00 0.00 61.00 62.78 2c7c s PRO 5 Cb -0.12 -2.79 0.32 0.00 0.04 0.00 0.00 34.50 31.96 2c7c s PRO 5 CO -0.24 0.00 1.73 -0.11 0.04 0.00 0.00 177.00 178.42 2c7c n LEU 6 N 0.41 7.02 -1.62 -3.56 -0.00 -1.26 -4.70 117.00 113.28 2c7c n LEU 6 Ca 0.03 -5.41 0.00 0.00 -0.00 0.00 0.00 56.01 50.63 2c7c n LEU 6 Cb 0.48 -1.09 0.00 0.00 -0.00 0.00 0.00 43.42 42.81 2c7c n LEU 6 CO 0.48 2.08 -0.43 0.00 -0.00 0.00 0.00 177.39 179.52 2c7c n HIS 7 N -0.10 -4.07 0.00 1.96 1.44 -1.26 -4.64 115.22 108.55 2c7c n HIS 7 Ca 0.45 2.18 0.00 0.00 -2.01 0.00 0.00 57.72 58.34 2c7c n HIS 7 Cb 0.28 -3.28 0.00 0.00 0.12 0.00 0.00 29.99 27.11 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 -1.16 0.00 -4.77 4.39 2.03 -0.08 -4.95 116.55 112.01 2c7c n ASP 8 Ca 0.00 0.00 -0.39 0.00 0.52 0.00 0.00 54.79 54.92 2c7c n ASP 8 Cb 0.07 -0.13 -0.02 0.00 -0.72 0.00 0.00 41.12 40.32 2c7c n ASP 8 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2c7c s ARG 9 N 0.00 4.13 -0.08 -0.67 1.81 -1.26 -2.59 118.95 120.29 2c7c s ARG 9 Ca 0.00 1.94 0.05 0.00 -1.72 0.00 0.00 55.73 56.00 2c7c s ARG 9 Cb 0.00 -2.79 -0.01 0.00 -0.45 0.00 0.00 34.95 31.71 2c7c s ARG 9 CO 0.00 -0.28 -0.24 0.08 -0.68 0.00 0.00 175.30 174.18 2c7c s VAL 10 N -1.33 2.03 -0.23 3.52 1.01 0.46 -1.03 120.40 124.85 2c7c s VAL 10 Ca 0.55 -1.03 -0.09 0.00 0.00 0.00 0.00 61.98 61.40 2c7c s VAL 10 Cb -0.33 -1.74 -0.04 0.00 0.00 0.00 0.00 36.38 34.27 2c7c s VAL 10 CO 0.42 0.56 0.12 -0.63 0.00 0.00 0.00 175.10 175.58 2c7c s ILE 11 N 0.06 5.06 0.35 2.22 1.01 0.58 -1.28 121.20 129.20 2c7c s ILE 11 Ca -0.10 0.07 0.05 0.00 0.00 0.00 0.00 60.65 60.68 2c7c s ILE 11 Cb -0.16 -3.34 -0.03 0.00 0.01 0.00 0.00 42.46 38.94 2c7c s ILE 11 CO 0.06 0.38 0.21 0.68 0.00 0.00 0.00 174.94 176.27 2c7c s VAL 12 N 0.95 0.21 -0.02 2.92 -7.23 0.40 -0.59 120.40 117.04 2c7c s VAL 12 Ca 0.06 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.25 2c7c s VAL 12 Cb -0.13 -2.44 0.01 0.00 0.56 0.00 0.00 36.38 34.37 2c7c s VAL 12 CO 0.03 0.00 -0.05 -1.59 -0.31 0.00 0.00 175.10 173.18 2c7c s LYS 13 N -3.59 0.54 0.47 4.82 -2.85 -0.14 -0.76 119.74 118.24 2c7c s LYS 13 Ca 0.35 -0.15 -0.22 0.00 -1.00 0.00 0.00 55.97 54.95 2c7c s LYS 13 Cb 0.03 -0.55 -0.07 0.00 -2.06 0.00 0.00 37.83 35.17 2c7c s LYS 13 CO 0.22 0.04 1.11 0.50 0.10 0.00 0.00 175.35 177.32 2c7c s ARG 14 N 0.26 3.74 1.05 1.78 3.52 -1.26 -1.02 118.95 127.01 2c7c s ARG 14 Ca -0.03 1.61 -0.12 0.00 -0.13 0.00 0.00 55.73 57.06 2c7c s ARG 14 Cb -0.07 -2.27 0.22 0.00 -1.56 0.00 0.00 34.95 31.27 2c7c s ARG 14 CO -0.00 -0.53 1.07 0.15 -0.81 0.00 0.00 175.30 175.18 2c7c s LYS 15 N -2.91 0.02 0.74 5.12 -0.14 0.07 -4.90 119.74 117.74 2c7c s LYS 15 Ca 0.66 1.02 -0.15 0.00 -1.36 0.00 0.00 55.97 56.14 2c7c s LYS 15 Cb -0.24 -1.65 0.04 0.00 -1.68 0.00 0.00 37.83 34.30 2c7c s LYS 15 CO 0.29 -3.15 1.17 -0.85 -0.76 0.00 0.00 175.35 172.05 2c7c n GLU 16 N -4.54 0.52 -2.67 1.68 0.00 -1.26 -4.76 120.64 109.62 2c7c n GLU 16 Ca 0.06 0.24 -0.43 0.00 0.00 0.00 0.00 57.16 57.04 2c7c n GLU 16 Cb 0.54 -2.41 -0.02 0.00 0.00 0.00 0.00 31.44 29.54 2c7c n GLU 16 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 2c7c s VAL 17 N -1.84 4.50 0.19 3.84 1.01 -1.26 -4.71 120.40 122.12 2c7c s VAL 17 Ca 0.76 1.60 0.00 0.00 0.00 0.00 0.00 61.98 64.34 2c7c s VAL 17 Cb -0.33 -4.41 0.00 0.00 0.00 0.00 0.00 36.38 31.64 2c7c s VAL 17 CO 0.48 -0.53 0.00 -0.62 0.00 0.00 0.00 175.10 174.43 2c7c n GLU 18 N 6.93 -2.53 -2.70 2.72 1.02 -1.22 -4.90 120.64 119.96 2c7c n GLU 18 Ca 0.11 1.83 -0.42 0.00 -0.02 0.00 0.00 57.16 58.65 2c7c n GLU 18 Cb 0.47 -2.01 -0.03 0.00 -0.02 0.00 0.00 31.44 29.85 2c7c n GLU 18 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2c7c s THR 19 N -1.55 4.13 -2.00 2.62 2.01 -1.26 -4.92 115.64 114.68 2c7c s THR 19 Ca 0.00 0.41 0.15 0.00 0.31 0.00 0.00 61.69 62.55 2c7c s THR 19 Cb 0.00 -4.69 0.42 0.00 0.01 0.00 0.00 72.50 68.23 2c7c s THR 19 CO 0.00 -1.38 1.30 0.29 -0.69 0.00 0.00 174.62 174.13 2c7c n LYS 20 N 8.18 0.48 -0.03 4.92 4.01 -1.26 -2.54 118.16 131.92 2c7c n LYS 20 Ca 0.03 0.00 0.03 0.00 -0.51 0.00 0.00 58.31 57.86 2c7c n LYS 20 Cb 0.48 -1.48 0.04 0.00 -0.51 0.00 0.00 35.03 33.55 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 -0.98 1.86 0.05 4.39 3.41 -1.26 -1.30 113.62 119.80 2c7c n SER 21 Ca 0.11 -2.19 0.03 0.00 -0.26 0.00 0.00 58.87 56.56 2c7c n SER 21 Cb 0.05 -0.12 0.17 0.00 -0.26 0.00 0.00 64.21 64.05 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 -0.68 0.91 0.10 7.33 0.00 -1.05 -1.45 120.51 125.68 2c7c n ALA 22 Ca 0.04 0.06 -0.03 0.00 0.00 0.00 0.00 53.44 53.51 2c7c n ALA 22 Cb 0.38 -0.99 0.03 0.00 0.00 0.00 0.00 19.45 18.87 2c7c n ALA 22 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2c7c h GLY 23 N 0.00 0.00 0.00 0.00 0.00 -1.90 -3.49 103.07 97.68 2c7c h GLY 23 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2c7c h GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 2c7c n GLY 24 N 0.87 2.87 0.06 4.60 0.00 -0.53 -4.80 105.19 108.26 2c7c n GLY 24 Ca -0.00 -0.69 -0.08 0.00 0.00 0.00 0.00 46.02 45.25 2c7c n GLY 24 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2c7c n ILE 25 N 0.00 0.66 -1.69 -0.61 5.41 -1.26 -5.03 119.36 116.84 2c7c n ILE 25 Ca 0.00 -0.28 -0.43 0.00 1.00 0.00 0.00 62.75 63.04 2c7c n ILE 25 Cb 0.00 -0.89 -0.03 0.00 -0.71 0.00 0.00 39.64 38.01 2c7c n ILE 25 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 2c7c n VAL 26 N -2.76 0.29 -2.47 1.39 0.31 -1.26 -4.96 118.33 108.87 2c7c n VAL 26 Ca -0.20 -0.05 -0.31 0.00 -0.01 0.00 0.00 64.34 63.77 2c7c n VAL 26 Cb 0.73 -2.02 -0.02 0.00 -0.91 0.00 0.00 33.84 31.62 2c7c n VAL 26 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 2c7c s LEU 27 N 2.42 3.62 0.20 7.52 0.20 -1.26 -3.98 118.68 127.40 2c7c s LEU 27 Ca 0.82 1.38 -0.12 0.00 0.69 0.00 0.00 54.13 56.90 2c7c s LEU 27 Cb -0.53 -4.32 -0.00 0.00 -0.43 0.00 0.00 46.19 40.92 2c7c s LEU 27 CO 0.38 -0.57 0.39 0.28 -0.29 0.00 0.00 176.35 176.53 2c7c s THR 28 N -2.64 0.03 0.00 3.68 -1.32 -0.42 -4.96 115.64 110.01 2c7c s THR 28 Ca 0.55 -1.29 0.00 0.00 -1.21 0.00 0.00 61.69 59.74 2c7c s THR 28 Cb -0.10 -1.93 0.00 0.00 -1.51 0.00 0.00 72.50 68.96 2c7c s THR 28 CO 0.36 -0.15 0.00 0.61 -2.21 0.00 0.00 174.62 173.22 2c7c n GLY 29 N -0.30 0.98 2.79 6.08 0.00 -1.26 -4.80 105.19 108.68 2c7c n GLY 29 Ca -0.06 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.81 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 0.20 0.34 1.61 0.01 -1.26 -4.85 113.70 108.75 2c7c s SER 30 Ca 0.00 0.01 0.15 0.00 1.31 0.00 0.00 55.95 57.42 2c7c s SER 30 Cb 0.00 -0.12 0.58 0.00 0.21 0.00 0.00 66.02 66.69 2c7c s SER 30 CO 0.00 -0.11 1.71 0.00 0.41 0.00 0.00 173.24 175.25 2c7c h ALA 31 N 7.21 1.04 -1.94 1.44 0.00 -1.98 -3.48 119.26 121.55 2c7c h ALA 31 Ca -0.44 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.05 2c7c h ALA 31 Cb 1.13 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.85 2c7c h ALA 31 CO 0.48 0.58 0.00 0.00 0.00 0.00 0.00 179.25 180.31 2c7c n ALA 32 N -2.36 -0.32 -2.02 0.00 0.00 -1.26 -5.14 120.51 109.41 2c7c n ALA 32 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2c7c n ALA 32 Cb 0.53 -0.33 0.00 0.00 0.00 0.00 0.00 19.45 19.65 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 -0.97 0.00 -2.85 0.00 0.00 -1.26 -5.18 120.51 110.25 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 0.33 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.78 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 -3.65 0.00 3.00 -1.26 -4.99 118.16 111.26 2c7c n LYS 34 Ca 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 58.31 58.25 2c7c n LYS 34 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 35.03 34.96 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 1.00 -0.92 0.25 3.14 0.15 -1.26 -3.37 113.70 112.69 2c7c s SER 35 Ca 0.00 1.44 0.25 0.00 0.70 0.00 0.00 55.95 58.34 2c7c s SER 35 Cb 0.00 1.59 0.52 0.00 -1.71 0.00 0.00 66.02 66.42 2c7c s SER 35 CO 0.00 -0.23 1.58 0.71 1.20 0.00 0.00 173.24 176.50 2c7c h THR 36 N 5.42 0.00 -3.15 6.45 1.35 -1.93 -3.45 112.91 117.59 2c7c h THR 36 Ca -0.26 -0.67 -0.60 0.00 -0.55 0.00 0.00 66.41 64.33 2c7c h THR 36 Cb 1.18 1.54 -0.07 0.00 -1.73 0.00 0.00 68.15 69.07 2c7c h THR 36 CO 0.15 0.00 -0.20 -0.13 -0.25 0.00 0.00 175.52 175.10 2c7c s ARG 37 N -3.17 4.10 0.03 4.72 3.00 -1.26 -1.90 118.95 124.47 2c7c s ARG 37 Ca 0.08 0.39 -0.07 0.00 0.00 0.00 0.00 55.73 56.13 2c7c s ARG 37 Cb 0.10 -3.32 -0.01 0.00 0.00 0.00 0.00 34.95 31.73 2c7c s ARG 37 CO 0.66 0.46 0.12 0.20 0.00 0.00 0.00 175.30 176.74 2c7c s GLY 38 N -0.33 0.12 -0.14 -3.53 0.00 -0.17 -0.75 107.32 102.52 2c7c s GLY 38 Ca 0.24 -0.41 -0.17 0.00 0.00 0.00 0.00 44.72 44.37 2c7c s GLY 38 CO 0.11 -0.56 0.44 1.85 0.00 0.00 0.00 173.10 174.95 2c7c s GLU 39 N -2.32 4.31 0.00 2.90 2.12 -0.19 -0.33 118.70 125.18 2c7c s GLU 39 Ca -0.07 0.37 -0.30 0.00 0.36 0.00 0.00 54.97 55.33 2c7c s GLU 39 Cb -0.03 -3.45 -0.04 0.00 0.26 0.00 0.00 34.13 30.88 2c7c s GLU 39 CO -0.03 0.14 1.06 0.08 -0.54 0.00 0.00 175.26 175.97 2c7c s VAL 40 N 0.72 4.58 -0.14 3.70 1.01 0.28 -0.96 120.40 129.58 2c7c s VAL 40 Ca 0.24 1.85 0.06 0.00 0.00 0.00 0.00 61.98 64.13 2c7c s VAL 40 Cb -0.15 -4.19 -0.13 0.00 0.00 0.00 0.00 36.38 31.91 2c7c s VAL 40 CO 0.09 0.12 -0.04 0.18 0.00 0.00 0.00 175.10 175.45 2c7c n LEU 41 N 4.09 1.40 -3.51 3.92 4.77 0.24 -1.52 117.00 126.39 2c7c n LEU 41 Ca 0.07 -0.04 -0.12 0.00 -0.03 0.00 0.00 56.01 55.89 2c7c n LEU 41 Cb 0.49 -0.10 -0.04 0.00 -2.33 0.00 0.00 43.42 41.44 2c7c n LEU 41 CO 0.53 0.53 0.60 0.00 -1.33 0.00 0.00 177.39 177.71 2c7c s ALA 42 N -2.31 -1.80 -0.00 -1.18 0.00 -0.74 -4.88 121.76 110.85 2c7c s ALA 42 Ca -0.13 1.16 0.02 0.00 0.00 0.00 0.00 51.96 53.01 2c7c s ALA 42 Cb 0.05 0.09 -0.01 0.00 0.00 0.00 0.00 23.12 23.25 2c7c s ALA 42 CO 0.45 -0.52 -0.08 0.08 0.00 0.00 0.00 175.76 175.69 2c7c s VAL 43 N -2.18 0.60 1.07 0.00 1.01 -1.26 -0.31 120.40 119.32 2c7c s VAL 43 Ca -0.02 -0.34 -0.13 0.00 0.00 0.00 0.00 61.98 61.49 2c7c s VAL 43 Cb -0.01 -0.51 0.23 0.00 0.00 0.00 0.00 36.38 36.09 2c7c s VAL 43 CO -0.02 0.15 1.07 -0.83 0.00 0.00 0.00 175.10 175.48 2c7c s GLY 44 N -0.22 1.55 0.63 4.51 0.00 -0.19 -4.80 107.32 108.80 2c7c s GLY 44 Ca 0.03 -0.34 0.41 0.00 0.00 0.00 0.00 44.72 44.82 2c7c s GLY 44 CO -0.00 0.33 2.28 3.43 0.00 0.00 0.00 173.10 179.14 2c7c h ASN 45 N -2.18 0.00 -0.04 1.64 4.21 -1.88 -3.43 115.58 113.90 2c7c h ASN 45 Ca -0.57 0.00 0.00 0.00 1.21 0.00 0.00 56.30 56.94 2c7c h ASN 45 Cb 1.34 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.54 2c7c h ASN 45 CO 0.55 0.01 0.00 0.61 -1.29 0.00 0.00 177.43 177.31 2c7c n GLY 46 N -0.87 0.68 3.10 2.83 0.00 -1.26 -4.35 105.19 105.33 2c7c n GLY 46 Ca -0.02 -2.16 -0.30 0.00 0.00 0.00 0.00 46.02 43.54 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 -0.64 2.50 -0.14 1.61 3.52 -0.02 -0.90 118.95 124.88 2c7c s ARG 47 Ca 0.00 -0.67 -0.27 0.00 -0.13 0.00 0.00 55.73 54.66 2c7c s ARG 47 Cb 0.00 -2.06 -0.24 0.00 -1.56 0.00 0.00 34.95 31.09 2c7c s ARG 47 CO 0.00 -0.02 0.69 0.82 -0.81 0.00 0.00 175.30 175.98 2c7c h ILE 48 N 5.90 1.65 -4.02 4.11 2.04 -1.88 -1.61 117.51 123.69 2c7c h ILE 48 Ca -0.30 -2.28 -0.54 0.00 1.00 0.00 0.00 64.86 62.74 2c7c h ILE 48 Cb 1.19 3.15 0.19 0.00 -0.74 0.00 0.00 36.82 40.61 2c7c h ILE 48 CO 0.51 0.56 0.17 0.18 0.00 0.00 0.00 178.15 179.57 2c7c n LEU 49 N -4.60 3.59 0.00 1.44 4.77 -1.26 -3.04 117.00 117.90 2c7c n LEU 49 Ca -0.12 0.56 0.00 0.00 -0.03 0.00 0.00 56.01 56.42 2c7c n LEU 49 Cb 0.48 -1.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.12 2c7c n LEU 49 CO 0.31 -2.04 0.00 1.21 -1.33 0.00 0.00 177.39 175.55 2c7c n GLU 50 N -2.92 0.00 0.00 3.23 4.07 -1.26 -4.79 120.64 118.97 2c7c n GLU 50 Ca 0.13 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.23 2c7c n GLU 50 Cb 0.51 -1.52 0.00 0.00 -0.06 0.00 0.00 31.44 30.37 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 0.00 0.00 -4.57 4.31 4.05 -1.17 -4.87 115.26 113.01 2c7c n ASN 51 Ca 0.00 0.00 -0.39 0.00 0.45 0.00 0.00 54.58 54.64 2c7c n ASN 51 Cb 0.00 -0.10 -0.02 0.00 1.23 0.00 0.00 39.78 40.89 2c7c n ASN 51 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 177.26 173.38 2c7c s GLY 52 N -0.25 1.22 0.15 8.20 0.00 -1.26 -4.83 107.32 110.55 2c7c s GLY 52 Ca 0.00 -2.45 0.00 0.00 0.00 0.00 0.00 44.72 42.27 2c7c s GLY 52 CO 0.00 2.86 0.00 1.18 0.00 0.00 0.00 173.10 177.14 2c7c n GLU 53 N 8.63 -1.34 -3.17 2.90 1.02 -1.26 -4.53 120.64 122.89 2c7c n GLU 53 Ca 0.41 0.88 -0.44 0.00 -0.02 0.00 0.00 57.16 57.99 2c7c n GLU 53 Cb 0.48 -1.63 -0.05 0.00 -0.02 0.00 0.00 31.44 30.21 2c7c n GLU 53 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2c7c s VAL 54 N -1.37 4.91 -0.17 2.62 1.01 -1.26 -4.72 120.40 121.42 2c7c s VAL 54 Ca 0.00 -0.87 -0.29 0.00 0.00 0.00 0.00 61.98 60.82 2c7c s VAL 54 Cb 0.00 -4.38 -0.00 0.00 0.00 0.00 0.00 36.38 32.00 2c7c s VAL 54 CO 0.00 -0.94 1.04 -1.59 0.00 0.00 0.00 175.10 173.60 2c7c s LYS 55 N 2.48 4.33 0.60 2.72 0.00 -0.61 -4.65 119.74 124.61 2c7c s LYS 55 Ca 0.11 1.39 -0.16 0.00 0.00 0.00 0.00 55.97 57.31 2c7c s LYS 55 Cb -0.23 -3.60 -0.03 0.00 0.00 0.00 0.00 37.83 33.97 2c7c s LYS 55 CO 0.08 -0.49 1.07 -1.25 0.00 0.00 0.00 175.35 174.76 2c7c s PRO 56 N 2.66 3.24 1.02 1.78 0.04 -1.26 -0.84 135.00 141.65 2c7c s PRO 56 Ca 0.47 1.29 -0.12 0.00 0.04 0.00 0.00 61.00 62.67 2c7c s PRO 56 Cb -0.17 -2.02 0.20 0.00 0.04 0.00 0.00 34.50 32.55 2c7c s PRO 56 CO 0.12 -0.88 1.09 -0.51 0.04 0.00 0.00 177.00 176.86 2c7c s LEU 57 N -4.44 1.51 0.02 -3.56 1.43 -1.26 -4.86 118.68 107.51 2c7c s LEU 57 Ca 0.65 1.19 0.22 0.00 -1.03 0.00 0.00 54.13 55.17 2c7c s LEU 57 Cb -0.18 -3.34 -0.25 0.00 0.03 0.00 0.00 46.19 42.45 2c7c s LEU 57 CO 0.36 -3.24 0.63 0.47 0.23 0.00 0.00 176.35 174.80 2c7c n ASP 58 N -4.25 0.23 -4.93 2.29 9.92 -1.26 -5.01 116.55 113.55 2c7c n ASP 58 Ca 0.05 0.02 -0.25 0.00 -0.53 0.00 0.00 54.79 54.08 2c7c n ASP 58 Cb 0.57 1.60 0.01 0.00 -0.64 0.00 0.00 41.12 42.66 2c7c n ASP 58 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 2c7c s VAL 59 N -3.46 4.11 0.15 2.53 -7.23 -1.26 -5.14 120.40 110.11 2c7c s VAL 59 Ca -0.05 -0.20 -0.02 0.00 -1.81 0.00 0.00 61.98 59.89 2c7c s VAL 59 Cb 0.13 -3.56 -0.04 0.00 0.56 0.00 0.00 36.38 33.47 2c7c s VAL 59 CO 0.88 -0.48 0.10 -1.59 -0.31 0.00 0.00 175.10 173.70 2c7c s LYS 60 N -4.72 1.01 0.20 4.82 0.00 -1.26 -4.99 119.74 114.80 2c7c s LYS 60 Ca 0.49 -1.44 -0.30 0.00 0.00 0.00 0.00 55.97 54.72 2c7c s LYS 60 Cb -0.10 0.27 -0.09 0.00 0.00 0.00 0.00 37.83 37.91 2c7c s LYS 60 CO 0.41 -0.31 1.36 0.08 0.00 0.00 0.00 175.35 176.89 2c7c s VAL 61 N -4.06 3.07 0.00 1.79 1.01 -1.26 -2.49 120.40 118.45 2c7c s VAL 61 Ca 0.26 0.86 0.00 0.00 0.00 0.00 0.00 61.98 63.10 2c7c s VAL 61 Cb 0.07 -3.55 0.00 0.00 0.00 0.00 0.00 36.38 32.89 2c7c s VAL 61 CO 0.03 0.12 0.00 0.61 0.00 0.00 0.00 175.10 175.87 2c7c n GLY 62 N 2.48 0.78 3.76 4.51 0.00 -0.57 -5.03 105.19 111.11 2c7c n GLY 62 Ca 0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.99 5.30 -0.50 1.61 1.01 -1.04 -4.81 116.67 115.25 2c7c s ASP 63 Ca 0.00 2.30 -0.05 0.00 0.71 0.00 0.00 52.55 55.51 2c7c s ASP 63 Cb 0.00 -2.59 0.13 0.00 1.01 0.00 0.00 42.92 41.47 2c7c s ASP 63 CO 0.00 -1.51 0.33 -0.63 0.21 0.00 0.00 175.17 173.57 2c7c s ILE 64 N -1.70 3.78 0.30 0.77 1.01 -1.26 -0.56 121.20 123.54 2c7c s ILE 64 Ca 0.75 -2.22 -0.05 0.00 0.00 0.00 0.00 60.65 59.13 2c7c s ILE 64 Cb -0.28 -3.51 -0.05 0.00 0.01 0.00 0.00 42.46 38.63 2c7c s ILE 64 CO 0.32 -0.78 0.57 0.68 0.00 0.00 0.00 174.94 175.73 2c7c s VAL 65 N 0.86 5.01 -0.11 2.92 -7.23 0.55 -3.72 120.40 118.67 2c7c s VAL 65 Ca 0.10 0.08 0.01 0.00 -1.81 0.00 0.00 61.98 60.36 2c7c s VAL 65 Cb -0.23 -3.74 -0.01 0.00 0.56 0.00 0.00 36.38 32.96 2c7c s VAL 65 CO -0.03 -0.35 -0.15 -0.63 -0.31 0.00 0.00 175.10 173.62 2c7c s ILE 66 N -2.12 2.89 0.06 -0.62 1.01 0.39 -1.00 121.20 121.80 2c7c s ILE 66 Ca 0.44 -0.73 -0.06 0.00 0.00 0.00 0.00 60.65 60.31 2c7c s ILE 66 Cb -0.11 -2.19 -0.01 0.00 0.01 0.00 0.00 42.46 40.16 2c7c s ILE 66 CO 0.30 0.54 0.10 0.72 0.00 0.00 0.00 174.94 176.60 2c7c s PHE 67 N 0.20 0.26 -0.69 3.97 -0.12 -0.80 -0.69 117.98 120.12 2c7c s PHE 67 Ca -0.09 -0.68 -0.27 0.00 -0.05 0.00 0.00 56.93 55.83 2c7c s PHE 67 Cb -0.15 -0.17 0.03 0.00 -0.63 0.00 0.00 43.02 42.09 2c7c s PHE 67 CO 0.05 -0.44 1.29 1.21 -0.05 0.00 0.00 175.22 177.28 2c7c s ASN 68 N -2.64 6.19 -1.12 1.98 2.47 0.21 -4.75 114.94 117.29 2c7c s ASN 68 Ca 0.02 -0.24 -0.17 0.00 0.42 0.00 0.00 52.86 52.89 2c7c s ASN 68 Cb 0.04 -2.56 -0.06 0.00 -1.45 0.00 0.00 41.25 37.22 2c7c s ASN 68 CO -0.09 -1.77 2.12 -0.67 -3.72 0.00 0.00 177.10 172.98 2c7c n ASP 69 N 9.30 3.59 -3.83 -4.21 -0.08 -1.26 -4.73 116.55 115.33 2c7c n ASP 69 Ca 0.06 -2.72 -0.24 0.00 -1.51 0.00 0.00 54.79 50.38 2c7c n ASP 69 Cb 0.49 -1.37 -0.06 0.00 2.34 0.00 0.00 41.12 42.53 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 4.24 3.58 0.18 0.27 0.00 -1.26 -5.03 105.19 107.17 2c7c n GLY 70 Ca 0.52 -2.23 0.12 0.00 0.00 0.00 0.00 46.02 44.43 2c7c n GLY 70 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2c7c h TYR 71 N 1.34 0.00 0.00 1.61 3.20 -2.04 0.11 116.97 121.20 2c7c h TYR 71 Ca -0.30 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.57 2c7c h TYR 71 Cb 1.00 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.27 2c7c h TYR 71 CO 0.00 0.00 0.00 0.78 -1.64 0.00 0.00 178.16 177.30 2c7c h GLY 72 N 0.00 0.00 -5.21 1.82 0.00 -1.97 -3.41 103.07 94.30 2c7c h GLY 72 Ca 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.76 2c7c h GLY 72 CO 0.00 0.00 0.15 0.14 0.00 0.00 0.00 176.54 176.83 2c7c s VAL 73 N -3.49 5.01 0.23 4.60 1.01 0.39 -2.31 120.40 125.84 2c7c s VAL 73 Ca 0.03 1.46 0.07 0.00 0.00 0.00 0.00 61.98 63.54 2c7c s VAL 73 Cb 0.09 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.38 2c7c s VAL 73 CO 0.53 0.19 0.13 -0.54 0.00 0.00 0.00 175.10 175.40 2c7c s LYS 74 N 1.21 2.75 0.00 2.72 -0.14 0.27 -4.85 119.74 121.71 2c7c s LYS 74 Ca 0.37 -1.09 0.02 0.00 -1.36 0.00 0.00 55.97 53.91 2c7c s LYS 74 Cb -0.17 -2.49 -0.01 0.00 -1.68 0.00 0.00 37.83 33.49 2c7c s LYS 74 CO 0.16 0.42 -0.06 0.45 -0.76 0.00 0.00 175.35 175.55 2c7c s SER 75 N -3.58 0.75 0.17 2.83 0.15 -1.26 -0.85 113.70 111.91 2c7c s SER 75 Ca 0.32 -0.16 -0.16 0.00 0.70 0.00 0.00 55.95 56.64 2c7c s SER 75 Cb -0.08 -0.07 0.03 0.00 -1.71 0.00 0.00 66.02 64.19 2c7c s SER 75 CO 0.23 0.04 0.46 -1.61 1.20 0.00 0.00 173.24 173.56 2c7c s GLU 76 N -0.32 1.25 -0.32 5.44 0.41 0.06 -4.99 118.70 120.23 2c7c s GLU 76 Ca 0.01 -0.84 -0.02 0.00 -0.41 0.00 0.00 54.97 53.71 2c7c s GLU 76 Cb -0.03 0.49 0.11 0.00 -1.78 0.00 0.00 34.13 32.91 2c7c s GLU 76 CO -0.00 -0.51 0.13 0.21 -0.49 0.00 0.00 175.26 174.60 2c7c s LYS 77 N -3.86 0.56 -0.42 1.61 2.47 -1.26 -1.07 119.74 117.77 2c7c s LYS 77 Ca 0.08 -0.99 -0.14 0.00 -1.56 0.00 0.00 55.97 53.36 2c7c s LYS 77 Cb 0.00 -1.66 0.04 0.00 -1.46 0.00 0.00 37.83 34.75 2c7c s LYS 77 CO -0.06 -1.04 0.30 0.42 0.16 0.00 0.00 175.35 175.13 2c7c s ILE 78 N 1.62 5.04 -1.13 5.43 1.09 -0.29 -4.58 121.20 128.39 2c7c s ILE 78 Ca 0.11 -0.83 -0.09 0.00 -1.10 0.00 0.00 60.65 58.74 2c7c s ILE 78 Cb -0.18 -3.87 0.08 0.00 -1.06 0.00 0.00 42.46 37.43 2c7c s ILE 78 CO -0.25 -0.36 0.38 0.47 -0.10 0.00 0.00 174.94 175.08 2c7c n ASP 79 N 5.12 -3.03 0.00 3.58 8.00 -1.26 -0.50 116.55 128.46 2c7c n ASP 79 Ca -0.11 -0.30 0.00 0.00 0.71 0.00 0.00 54.79 55.09 2c7c n ASP 79 Cb 0.46 -2.56 0.00 0.00 -0.02 0.00 0.00 41.12 39.00 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 -2.13 0.00 -4.72 -2.24 5.15 -1.26 -5.09 115.26 104.96 2c7c n ASN 80 Ca -0.01 0.00 -0.41 0.00 -0.60 0.00 0.00 54.58 53.56 2c7c n ASN 80 Cb 0.53 0.00 -0.04 0.00 -0.53 0.00 0.00 39.78 39.74 2c7c n ASN 80 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 2c7c s GLU 81 N -0.89 4.56 0.05 1.20 8.01 0.34 -5.03 118.70 126.95 2c7c s GLU 81 Ca 0.00 1.26 -0.31 0.00 0.01 0.00 0.00 54.97 55.93 2c7c s GLU 81 Cb 0.00 -3.42 -0.08 0.00 -4.31 0.00 0.00 34.13 26.33 2c7c s GLU 81 CO 0.00 0.11 1.63 -1.21 0.01 0.00 0.00 175.26 175.80 2c7c s GLU 82 N 0.48 4.20 0.04 1.61 0.41 -1.26 -1.13 118.70 123.05 2c7c s GLU 82 Ca 0.45 2.28 -0.02 0.00 -0.41 0.00 0.00 54.97 57.28 2c7c s GLU 82 Cb -0.21 -3.64 -0.03 0.00 -1.78 0.00 0.00 34.13 28.47 2c7c s GLU 82 CO 0.26 -0.73 -0.00 0.14 -0.49 0.00 0.00 175.26 174.43 2c7c s VAL 83 N 2.77 0.16 0.03 2.63 -7.23 -0.23 -4.72 120.40 113.80 2c7c s VAL 83 Ca 0.73 -1.31 -0.00 0.00 -1.81 0.00 0.00 61.98 59.58 2c7c s VAL 83 Cb -0.38 -0.91 -0.03 0.00 0.56 0.00 0.00 36.38 35.62 2c7c s VAL 83 CO 0.32 -0.72 -0.03 -0.76 -0.31 0.00 0.00 175.10 173.59 2c7c s LEU 84 N -2.20 2.32 -0.19 1.32 1.02 0.06 -0.76 118.68 120.25 2c7c s LEU 84 Ca -0.04 -0.68 -0.04 0.00 0.02 0.00 0.00 54.13 53.39 2c7c s LEU 84 Cb -0.01 0.14 0.06 0.00 0.02 0.00 0.00 46.19 46.41 2c7c s LEU 84 CO -0.05 -0.41 0.07 -0.63 0.02 0.00 0.00 176.35 175.35 2c7c s ILE 85 N -2.36 0.16 0.23 -0.59 1.01 -0.03 -0.45 121.20 119.17 2c7c s ILE 85 Ca -0.08 -0.38 0.07 0.00 0.00 0.00 0.00 60.65 60.26 2c7c s ILE 85 Cb -0.03 -0.79 -0.04 0.00 0.01 0.00 0.00 42.46 41.60 2c7c s ILE 85 CO -0.04 -0.30 0.14 0.00 0.00 0.00 0.00 174.94 174.74 2c7c s MET 86 N 2.02 2.80 0.25 2.79 0.23 -0.40 -0.56 119.30 126.43 2c7c s MET 86 Ca 0.02 -1.06 -0.30 0.00 -1.03 0.00 0.00 55.69 53.32 2c7c s MET 86 Cb -0.16 -2.52 -0.10 0.00 -1.53 0.00 0.00 34.83 30.52 2c7c s MET 86 CO -0.11 0.42 1.44 -1.54 -2.03 0.00 0.00 175.02 173.20 2c7c s SER 87 N -3.57 6.65 0.49 -1.18 1.04 -0.98 -0.40 113.70 115.75 2c7c s SER 87 Ca 0.32 2.67 0.28 0.00 0.48 0.00 0.00 55.95 59.70 2c7c s SER 87 Cb -0.08 -2.62 1.35 0.00 0.10 0.00 0.00 66.02 64.77 2c7c s SER 87 CO 0.23 -0.70 1.83 -0.08 0.98 0.00 0.00 173.24 175.50 2c7c h GLU 88 N 4.99 0.15 0.00 4.02 4.81 -1.85 -2.15 114.58 124.55 2c7c h GLU 88 Ca -0.46 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 2c7c h GLU 88 Cb 1.22 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.56 2c7c h GLU 88 CO 0.77 0.10 0.03 -1.13 -0.73 0.00 0.00 179.01 178.05 2c7c n SER 89 N -4.37 0.04 0.02 1.04 3.41 -1.26 -0.61 113.62 111.89 2c7c n SER 89 Ca 0.23 0.49 0.12 0.00 -0.26 0.00 0.00 58.87 59.44 2c7c n SER 89 Cb 1.00 -0.50 0.14 0.00 -0.26 0.00 0.00 64.21 64.59 2c7c n SER 89 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2c7c n ASP 90 N -1.53 0.61 -4.69 4.04 8.00 -0.81 -4.92 116.55 117.26 2c7c n ASP 90 Ca -0.00 -0.18 -0.42 0.00 0.71 0.00 0.00 54.79 54.89 2c7c n ASP 90 Cb 0.03 0.43 -0.03 0.00 -0.02 0.00 0.00 41.12 41.53 2c7c n ASP 90 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2c7c s ILE 91 N -3.10 4.76 -0.23 0.53 1.01 0.22 -0.62 121.20 123.77 2c7c s ILE 91 Ca 0.07 2.02 0.05 0.00 0.00 0.00 0.00 60.65 62.80 2c7c s ILE 91 Cb 0.15 -4.30 -0.20 0.00 0.01 0.00 0.00 42.46 38.13 2c7c s ILE 91 CO 0.74 0.02 -0.08 0.18 0.00 0.00 0.00 174.94 175.81 2c7c n LEU 92 N 4.88 2.19 -3.51 2.97 4.77 0.13 -4.96 117.00 123.47 2c7c n LEU 92 Ca 0.09 -0.06 -0.09 0.00 -0.03 0.00 0.00 56.01 55.92 2c7c n LEU 92 Cb 0.49 -0.57 -0.02 0.00 -2.33 0.00 0.00 43.42 40.99 2c7c n LEU 92 CO 0.52 0.81 0.61 0.00 -1.33 0.00 0.00 177.39 178.01 2c7c s ALA 93 N -2.52 -1.74 -1.14 -1.18 0.00 -1.01 -5.02 121.76 109.15 2c7c s ALA 93 Ca -0.27 0.77 -0.06 0.00 0.00 0.00 0.00 51.96 52.40 2c7c s ALA 93 Cb 0.08 0.56 0.26 0.00 0.00 0.00 0.00 23.12 24.03 2c7c s ALA 93 CO 0.68 -0.75 1.56 -0.89 0.00 0.00 0.00 175.76 176.36 2c7c n ILE 94 N -0.30 4.97 0.00 0.00 5.41 -1.26 -0.46 119.36 127.71 2c7c n ILE 94 Ca -0.10 -5.43 0.00 0.00 1.00 0.00 0.00 62.75 58.22 2c7c n ILE 94 Cb 0.62 -2.21 0.00 0.00 -0.71 0.00 0.00 39.64 37.34 2c7c n ILE 94 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07