#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2edr s SER 2 N 0.00 3.97 0.21 1.61 1.04 -1.26 -5.11 113.70 114.17 2edr s SER 2 Ca 0.00 -1.48 -0.30 0.00 0.48 0.00 0.00 55.95 54.65 2edr s SER 2 Cb 0.00 -1.08 -0.16 0.00 0.10 0.00 0.00 66.02 64.88 2edr s SER 2 CO 0.00 -0.33 0.95 -1.20 0.98 0.00 0.00 173.24 173.64 2edr n SER 3 N 4.70 0.66 0.00 7.02 7.64 -1.26 -4.87 113.62 127.51 2edr n SER 3 Ca -0.05 1.15 0.00 0.00 1.01 0.00 0.00 58.87 60.98 2edr n SER 3 Cb 0.43 -1.17 0.00 0.00 -1.01 0.00 0.00 64.21 62.47 2edr n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2edr n GLY 4 N 1.68 -1.40 3.52 0.23 0.00 -1.26 -5.07 105.19 102.89 2edr n GLY 4 Ca 0.14 0.59 -0.27 0.00 0.00 0.00 0.00 46.02 46.48 2edr n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2edr n SER 5 N 0.00 0.43 -0.25 1.61 3.41 -1.26 -4.76 113.62 112.79 2edr n SER 5 Ca 0.00 -0.60 -0.02 0.00 -0.26 0.00 0.00 58.87 57.99 2edr n SER 5 Cb 0.00 -1.09 0.04 0.00 -0.26 0.00 0.00 64.21 62.90 2edr n SER 5 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2edr h SER 6 N 13.19 -1.03 -0.06 4.04 0.02 -1.97 -3.47 113.55 124.26 2edr h SER 6 Ca -0.04 0.24 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 2edr h SER 6 Cb 1.17 0.56 0.00 0.00 0.14 0.00 0.00 62.40 64.27 2edr h SER 6 CO 1.33 -0.28 0.00 0.61 -1.14 0.00 0.00 176.83 177.35 2edr n GLY 7 N -1.47 -0.73 3.59 -3.77 0.00 -1.26 -5.04 105.19 96.51 2edr n GLY 7 Ca 0.07 -2.14 -0.30 0.00 0.00 0.00 0.00 46.02 43.65 2edr n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2edr s PRO 8 N 0.00 -1.29 -0.09 1.61 0.04 -1.26 -4.92 135.00 129.09 2edr s PRO 8 Ca 0.00 -0.10 -0.29 0.00 0.04 0.00 0.00 61.00 60.65 2edr s PRO 8 Cb 0.00 -1.59 -0.06 0.00 0.04 0.00 0.00 34.50 32.89 2edr s PRO 8 CO 0.00 -3.75 1.79 0.00 0.04 0.00 0.00 177.00 175.08 2edr s ALA 9 N -3.01 3.43 0.65 8.56 0.00 -1.26 -4.95 121.76 125.17 2edr s ALA 9 Ca 0.71 0.91 -0.12 0.00 0.00 0.00 0.00 51.96 53.46 2edr s ALA 9 Cb -0.09 -3.83 -0.02 0.00 0.00 0.00 0.00 23.12 19.17 2edr s ALA 9 CO 0.56 -1.73 1.04 -1.58 0.00 0.00 0.00 175.76 174.05 2edr s HIS 10 N 4.90 3.35 -0.51 0.00 2.46 -1.26 -4.64 115.29 119.58 2edr s HIS 10 Ca 0.80 1.37 -0.25 0.00 0.47 0.00 0.00 55.06 57.45 2edr s HIS 10 Cb -0.34 -2.81 0.03 0.00 -0.13 0.00 0.00 32.58 29.33 2edr s HIS 10 CO 0.33 -0.94 0.97 -0.06 -2.47 0.00 0.00 174.74 172.57 2edr s PHE 11 N -3.04 2.83 -0.09 3.88 0.08 -1.26 0.50 117.98 120.88 2edr s PHE 11 Ca 0.57 0.26 0.12 0.00 0.12 0.00 0.00 56.93 58.00 2edr s PHE 11 Cb -0.13 -4.09 -0.24 0.00 -0.57 0.00 0.00 43.02 38.00 2edr s PHE 11 CO 0.52 -1.25 0.47 0.44 -0.10 0.00 0.00 175.22 175.29 2edr n ILE 12 N 6.39 1.57 -3.42 0.64 -5.35 -1.17 -4.57 119.36 113.45 2edr n ILE 12 Ca 0.05 -0.79 -0.29 0.00 -0.27 0.00 0.00 62.75 61.45 2edr n ILE 12 Cb 0.48 -0.98 -0.07 0.00 -1.74 0.00 0.00 39.64 37.33 2edr n ILE 12 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2edr n GLY 13 N 1.66 4.77 3.37 3.28 0.00 -1.11 -5.00 105.19 112.16 2edr n GLY 13 Ca -0.23 -2.74 -0.43 0.00 0.00 0.00 0.00 46.02 42.61 2edr n GLY 13 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2edr n ARG 14 N 1.06 0.19 -0.30 1.61 5.12 -1.26 -2.45 116.66 120.63 2edr n ARG 14 Ca 0.28 0.07 -0.13 0.00 -1.93 0.00 0.00 57.85 56.14 2edr n ARG 14 Cb 0.39 -1.15 0.12 0.00 -1.16 0.00 0.00 32.46 30.66 2edr n ARG 14 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2edr n LEU 15 N 1.96 0.00 -3.63 0.55 4.77 -1.26 -4.85 117.00 114.54 2edr n LEU 15 Ca 0.13 -0.36 -0.13 0.00 -0.03 0.00 0.00 56.01 55.61 2edr n LEU 15 Cb 0.36 -0.55 -0.12 0.00 -2.33 0.00 0.00 43.42 40.77 2edr n LEU 15 CO 0.55 -2.14 -0.12 0.00 -1.33 0.00 0.00 177.39 174.35 2edr s ARG 16 N -3.21 0.18 -0.31 3.23 3.03 -1.26 -4.93 118.95 115.68 2edr s ARG 16 Ca 0.28 0.71 -0.43 0.00 2.03 0.00 0.00 55.73 58.32 2edr s ARG 16 Cb -0.05 -0.14 -0.19 0.00 -1.03 0.00 0.00 34.95 33.54 2edr s ARG 16 CO 0.23 -0.34 1.51 -2.39 -1.13 0.00 0.00 175.30 173.18 2edr n HIS 17 N 5.35 1.59 -4.90 5.89 1.44 -1.26 -4.89 115.22 118.44 2edr n HIS 17 Ca -0.06 0.97 -0.29 0.00 -2.01 0.00 0.00 57.72 56.33 2edr n HIS 17 Cb 0.50 -2.26 -0.17 0.00 0.12 0.00 0.00 29.99 28.18 2edr n HIS 17 CO 0.00 0.00 0.00 1.14 -2.81 0.00 0.00 176.34 174.67 2edr s GLN 18 N 2.35 2.44 -0.53 -1.40 -2.07 -1.02 -4.97 119.66 114.46 2edr s GLN 18 Ca 0.99 -0.67 -0.23 0.00 -1.82 0.00 0.00 55.36 53.64 2edr s GLN 18 Cb -1.33 -1.91 0.04 0.00 -1.09 0.00 0.00 33.01 28.73 2edr s GLN 18 CO 0.71 0.10 0.85 -2.00 -1.32 0.00 0.00 175.29 173.63 2edr s GLU 19 N 0.53 3.28 0.63 9.60 2.12 -1.26 -2.96 118.70 130.63 2edr s GLU 19 Ca -0.16 -0.42 0.04 0.00 0.36 0.00 0.00 54.97 54.79 2edr s GLU 19 Cb -0.17 -4.06 0.09 0.00 0.26 0.00 0.00 34.13 30.26 2edr s GLU 19 CO 0.06 -1.40 0.86 -1.54 -0.54 0.00 0.00 175.26 172.71 2edr s SER 20 N 2.76 4.82 0.04 -1.70 1.04 0.39 -4.92 113.70 116.13 2edr s SER 20 Ca 0.26 -0.50 0.08 0.00 0.48 0.00 0.00 55.95 56.27 2edr s SER 20 Cb -0.14 -0.05 -0.02 0.00 0.10 0.00 0.00 66.02 65.90 2edr s SER 20 CO 0.17 -1.51 -0.22 -0.63 0.98 0.00 0.00 173.24 172.03 2edr s ILE 21 N -2.87 1.79 0.25 -1.02 1.01 -1.26 -1.85 121.20 117.25 2edr s ILE 21 Ca 0.63 -1.21 -0.31 0.00 0.00 0.00 0.00 60.65 59.76 2edr s ILE 21 Cb -0.06 -1.54 -0.14 0.00 0.01 0.00 0.00 42.46 40.73 2edr s ILE 21 CO 0.41 0.29 1.29 1.21 0.00 0.00 0.00 174.94 178.14 2edr n GLU 22 N 1.93 1.80 0.00 2.79 2.13 -0.19 -1.16 120.64 127.93 2edr n GLU 22 Ca -0.17 0.64 0.00 0.00 0.66 0.00 0.00 57.16 58.29 2edr n GLU 22 Cb 0.53 -2.22 0.00 0.00 0.27 0.00 0.00 31.44 30.02 2edr n GLU 22 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2edr n GLY 23 N 1.79 2.35 3.61 8.31 0.00 -0.16 -4.20 105.19 116.88 2edr n GLY 23 Ca 0.11 -0.06 -0.29 0.00 0.00 0.00 0.00 46.02 45.78 2edr n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2edr s ALA 24 N -0.66 0.46 -0.44 4.61 0.00 -0.31 -3.66 121.76 121.76 2edr s ALA 24 Ca 0.00 -0.20 -0.14 0.00 0.00 0.00 0.00 51.96 51.62 2edr s ALA 24 Cb 0.00 -3.19 0.06 0.00 0.00 0.00 0.00 23.12 19.99 2edr s ALA 24 CO 0.00 -3.20 0.33 0.99 0.00 0.00 0.00 175.76 173.89 2edr s THR 25 N -2.75 4.97 0.21 0.00 2.01 -1.26 -1.93 115.64 116.88 2edr s THR 25 Ca 0.66 -1.05 -0.30 0.00 0.31 0.00 0.00 61.69 61.31 2edr s THR 25 Cb -0.21 -3.93 -0.09 0.00 0.01 0.00 0.00 72.50 68.27 2edr s THR 25 CO 0.60 -0.49 1.39 0.00 -0.69 0.00 0.00 174.62 175.44 2edr s ALA 26 N 1.59 3.60 -0.36 7.40 0.00 -0.20 -4.80 121.76 129.00 2edr s ALA 26 Ca 0.04 1.23 0.00 0.00 0.00 0.00 0.00 51.96 53.23 2edr s ALA 26 Cb -0.23 -3.53 0.12 0.00 0.00 0.00 0.00 23.12 19.48 2edr s ALA 26 CO 0.06 -0.65 0.17 0.99 0.00 0.00 0.00 175.76 176.32 2edr s THR 27 N 0.21 0.83 0.60 0.00 2.01 -1.25 -0.41 115.64 117.63 2edr s THR 27 Ca 0.59 -1.77 -0.06 0.00 0.31 0.00 0.00 61.69 60.76 2edr s THR 27 Cb -0.39 -1.61 0.01 0.00 0.01 0.00 0.00 72.50 70.52 2edr s THR 27 CO 0.39 -0.81 0.92 -0.76 -0.69 0.00 0.00 174.62 173.67 2edr s LEU 28 N 1.16 3.19 -0.18 4.42 1.43 -0.14 -4.88 118.68 123.68 2edr s LEU 28 Ca 0.14 0.71 -0.19 0.00 -1.03 0.00 0.00 54.13 53.76 2edr s LEU 28 Cb -0.21 -3.53 0.05 0.00 0.03 0.00 0.00 46.19 42.54 2edr s LEU 28 CO -0.13 -1.11 0.52 -0.60 0.23 0.00 0.00 176.35 175.26 2edr s ARG 29 N -5.02 0.64 0.28 1.70 3.52 -1.26 -1.94 118.95 116.87 2edr s ARG 29 Ca 0.54 0.65 0.03 0.00 -0.13 0.00 0.00 55.73 56.83 2edr s ARG 29 Cb -0.11 0.31 -0.03 0.00 -1.56 0.00 0.00 34.95 33.56 2edr s ARG 29 CO 0.45 -0.09 0.25 0.00 -0.81 0.00 0.00 175.30 175.10 2edr s GLU 31 N -3.68 0.68 0.27 0.00 2.12 -1.02 -2.40 118.70 114.67 2edr s GLU 31 Ca 0.39 -0.81 0.04 0.00 0.36 0.00 0.00 54.97 54.96 2edr s GLU 31 Cb 0.04 -0.59 -0.06 0.00 0.26 0.00 0.00 34.13 33.78 2edr s GLU 31 CO 0.21 0.13 -0.00 -0.51 -0.54 0.00 0.00 175.26 174.55 2edr s LEU 32 N -1.51 2.26 0.57 2.70 1.43 -0.55 -2.76 118.68 120.81 2edr s LEU 32 Ca -0.05 -1.25 0.35 0.00 -1.03 0.00 0.00 54.13 52.15 2edr s LEU 32 Cb -0.09 -0.40 1.54 0.00 0.03 0.00 0.00 46.19 47.27 2edr s LEU 32 CO 0.01 -0.49 2.05 -1.28 0.23 0.00 0.00 176.35 176.87 2edr h SER 33 N 2.32 0.00 -3.20 2.29 0.87 -0.22 -3.43 113.55 112.19 2edr h SER 33 Ca -0.39 0.00 0.10 0.00 -1.23 0.00 0.00 61.79 60.26 2edr h SER 33 Cb 1.23 0.00 -0.27 0.00 -0.44 0.00 0.00 62.40 62.92 2edr h SER 33 CO 0.67 0.00 0.58 -1.59 -0.53 0.00 0.00 176.83 175.96 2edr s LYS 34 N -3.75 0.42 -0.47 2.24 -2.85 -1.26 -4.95 119.74 109.12 2edr s LYS 34 Ca 0.00 0.37 -0.42 0.00 -1.00 0.00 0.00 55.97 54.93 2edr s LYS 34 Cb 0.10 0.20 -0.18 0.00 -2.06 0.00 0.00 37.83 35.89 2edr s LYS 34 CO 0.52 -0.08 1.82 0.00 0.10 0.00 0.00 175.35 177.72 2edr n ALA 35 N 1.69 -0.30 -3.32 0.59 0.00 -1.25 -4.74 120.51 113.18 2edr n ALA 35 Ca -0.11 0.28 -0.15 0.00 0.00 0.00 0.00 53.44 53.46 2edr n ALA 35 Cb 0.57 -1.89 -0.07 0.00 0.00 0.00 0.00 19.45 18.06 2edr n ALA 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2edr s ALA 36 N 4.64 -1.25 0.35 0.00 0.00 -1.26 -4.98 121.76 119.26 2edr s ALA 36 Ca 1.07 0.68 -0.28 0.00 0.00 0.00 0.00 51.96 53.43 2edr s ALA 36 Cb -1.40 0.19 -0.09 0.00 0.00 0.00 0.00 23.12 21.82 2edr s ALA 36 CO 0.67 -0.40 1.21 -1.25 0.00 0.00 0.00 175.76 175.99 2edr s PRO 37 N -1.82 4.30 0.44 0.00 0.04 -1.26 -5.01 135.00 131.69 2edr s PRO 37 Ca -0.09 1.99 0.03 0.00 0.04 0.00 0.00 61.00 62.97 2edr s PRO 37 Cb -0.02 -2.95 -0.02 0.00 0.04 0.00 0.00 34.50 31.56 2edr s PRO 37 CO 0.03 -0.16 0.11 0.14 0.04 0.00 0.00 177.00 177.16 2edr s VAL 38 N -1.24 0.67 -0.26 -0.36 -7.23 -1.26 -4.56 120.40 106.16 2edr s VAL 38 Ca 0.51 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.67 2edr s VAL 38 Cb -0.35 -2.28 0.14 0.00 0.56 0.00 0.00 36.38 34.45 2edr s VAL 38 CO 0.45 0.00 0.35 -0.70 -0.31 0.00 0.00 175.10 174.89 2edr s GLU 39 N -3.72 0.34 0.60 4.82 2.12 0.41 -4.92 118.70 118.35 2edr s GLU 39 Ca 0.19 0.23 -0.17 0.00 0.36 0.00 0.00 54.97 55.58 2edr s GLU 39 Cb 0.02 -0.56 -0.03 0.00 0.26 0.00 0.00 34.13 33.82 2edr s GLU 39 CO 0.12 -0.84 1.11 -1.58 -0.54 0.00 0.00 175.26 173.54 2edr s TRP 40 N 2.48 2.68 -0.19 5.30 0.52 -1.26 -0.81 118.94 127.66 2edr s TRP 40 Ca 0.10 1.55 -0.04 0.00 0.02 0.00 0.00 56.10 57.73 2edr s TRP 40 Cb -0.14 -3.20 0.08 0.00 -1.15 0.00 0.00 33.47 29.06 2edr s TRP 40 CO -0.23 -1.56 0.18 1.03 0.02 0.00 0.00 176.95 176.39 2edr s ARG 41 N -3.72 0.15 -1.16 4.98 0.52 0.33 -0.81 118.95 119.24 2edr s ARG 41 Ca 0.69 0.12 -0.21 0.00 -0.52 0.00 0.00 55.73 55.81 2edr s ARG 41 Cb -0.21 -1.38 -0.01 0.00 0.52 0.00 0.00 34.95 33.87 2edr s ARG 41 CO 0.34 -0.66 1.80 0.21 0.02 0.00 0.00 175.30 177.01 2edr s LYS 42 N 2.27 3.17 0.52 3.54 2.20 -1.14 -0.79 119.74 129.52 2edr s LYS 42 Ca 0.05 -1.31 0.00 0.00 -0.36 0.00 0.00 55.97 54.36 2edr s LYS 42 Cb -0.16 -5.33 0.00 0.00 -1.51 0.00 0.00 37.83 30.83 2edr s LYS 42 CO -0.11 -3.05 0.00 0.41 -0.36 0.00 0.00 175.35 172.24 2edr n GLY 43 N 5.99 2.38 1.40 5.54 0.00 0.15 -3.32 105.19 117.34 2edr n GLY 43 Ca 0.44 -0.02 0.03 0.00 0.00 0.00 0.00 46.02 46.47 2edr n GLY 43 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2edr n ARG 44 N 0.00 0.65 -4.40 1.61 1.85 -1.26 -4.93 116.66 110.18 2edr n ARG 44 Ca 0.00 -2.52 -0.20 0.00 -1.00 0.00 0.00 57.85 54.14 2edr n ARG 44 Cb 0.00 -0.61 -0.10 0.00 -1.05 0.00 0.00 32.46 30.70 2edr n ARG 44 CO 0.00 0.00 0.00 -2.00 -0.01 0.00 0.00 177.63 175.62 2edr s GLU 45 N -1.23 1.55 -0.27 2.89 2.12 -1.21 -5.14 118.70 117.42 2edr s GLU 45 Ca 0.35 -1.85 -0.03 0.00 0.36 0.00 0.00 54.97 53.80 2edr s GLU 45 Cb 0.38 -0.65 0.02 0.00 0.26 0.00 0.00 34.13 34.14 2edr s GLU 45 CO -0.13 -0.22 -0.01 0.45 -0.54 0.00 0.00 175.26 174.81 2edr s SER 46 N -3.42 4.62 -0.02 -1.70 0.15 -1.26 -2.86 113.70 109.21 2edr s SER 46 Ca 0.37 -0.86 -0.24 0.00 0.70 0.00 0.00 55.95 55.91 2edr s SER 46 Cb 0.08 -1.73 -0.04 0.00 -1.71 0.00 0.00 66.02 62.62 2edr s SER 46 CO 0.15 -0.16 0.73 -0.76 1.20 0.00 0.00 173.24 174.39 2edr s LEU 47 N 1.37 4.37 0.09 3.45 1.43 0.00 -4.96 118.68 124.43 2edr s LEU 47 Ca 0.00 1.30 0.03 0.00 -1.03 0.00 0.00 54.13 54.43 2edr s LEU 47 Cb -0.17 -3.15 -0.04 0.00 0.03 0.00 0.00 46.19 42.87 2edr s LEU 47 CO -0.02 -0.06 -0.09 -0.13 0.23 0.00 0.00 176.35 176.27 2edr s ARG 48 N 0.46 0.81 -0.05 1.70 0.52 -1.26 -4.22 118.95 116.90 2edr s ARG 48 Ca 0.38 -1.14 -0.30 0.00 -0.52 0.00 0.00 55.73 54.16 2edr s ARG 48 Cb -0.19 -0.46 -0.06 0.00 0.52 0.00 0.00 34.95 34.77 2edr s ARG 48 CO 0.20 0.06 1.63 0.34 0.02 0.00 0.00 175.30 177.55 2edr s ASP 49 N -2.43 6.68 0.00 0.23 2.15 -1.26 -4.68 116.67 117.36 2edr s ASP 49 Ca 0.04 2.22 0.00 0.00 0.43 0.00 0.00 52.55 55.25 2edr s ASP 49 Cb -0.03 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 40.06 2edr s ASP 49 CO -0.01 -0.91 0.00 0.61 -0.17 0.00 0.00 175.17 174.70 2edr n GLY 50 N 4.08 4.47 0.00 2.66 0.00 -0.36 -5.01 105.19 111.04 2edr n GLY 50 Ca 0.17 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.76 2edr n GLY 50 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2edr n ASP 51 N 0.00 0.00 -0.08 1.61 8.00 -1.26 -4.15 116.55 120.68 2edr n ASP 51 Ca 0.00 0.68 -0.16 0.00 0.71 0.00 0.00 54.79 56.02 2edr n ASP 51 Cb 0.00 -0.30 -0.06 0.00 -0.02 0.00 0.00 41.12 40.74 2edr n ASP 51 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2edr n ARG 52 N -2.37 0.33 -1.48 -1.24 5.12 -1.26 -4.99 116.66 110.77 2edr n ARG 52 Ca 0.00 0.13 -0.62 0.00 -1.93 0.00 0.00 57.85 55.44 2edr n ARG 52 Cb 0.00 -1.08 -0.10 0.00 -1.16 0.00 0.00 32.46 30.12 2edr n ARG 52 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 2edr n HIS 53 N -3.58 1.45 -4.53 -1.55 8.25 -1.25 -4.80 115.22 109.23 2edr n HIS 53 Ca -0.29 0.95 -0.31 0.00 -0.26 0.00 0.00 57.72 57.80 2edr n HIS 53 Cb 0.72 -2.15 -0.16 0.00 1.12 0.00 0.00 29.99 29.52 2edr n HIS 53 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2edr s SER 54 N 3.99 2.93 -0.34 0.41 0.15 -0.29 -1.22 113.70 119.34 2edr s SER 54 Ca 1.06 -0.56 0.07 0.00 0.70 0.00 0.00 55.95 57.22 2edr s SER 54 Cb -1.43 -1.35 0.51 0.00 -1.71 0.00 0.00 66.02 62.03 2edr s SER 54 CO 0.72 0.05 1.51 0.18 1.20 0.00 0.00 173.24 176.90 2edr n LEU 55 N 4.20 4.77 -4.33 3.45 7.99 -1.26 -0.05 117.00 131.77 2edr n LEU 55 Ca -0.20 -3.98 -0.38 0.00 -0.01 0.00 0.00 56.01 51.45 2edr n LEU 55 Cb 0.51 -0.64 0.04 0.00 -0.11 0.00 0.00 43.42 43.22 2edr n LEU 55 CO 0.26 1.41 -0.37 -2.11 -1.51 0.00 0.00 177.39 175.07 2edr n ARG 56 N -1.05 0.20 -4.00 3.23 1.85 -1.21 -4.64 116.66 111.04 2edr n ARG 56 Ca 0.40 0.08 -0.13 0.00 -1.00 0.00 0.00 57.85 57.20 2edr n ARG 56 Cb 1.03 -1.39 -0.13 0.00 -1.05 0.00 0.00 32.46 30.92 2edr n ARG 56 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 2edr s GLN 57 N -1.84 0.24 -0.54 2.89 -0.21 -1.26 -2.56 119.66 116.37 2edr s GLN 57 Ca 0.60 -0.24 0.06 0.00 0.02 0.00 0.00 55.36 55.80 2edr s GLN 57 Cb -0.41 -0.14 0.22 0.00 1.00 0.00 0.00 33.01 33.68 2edr s GLN 57 CO 0.63 0.03 0.57 -3.47 -2.12 0.00 0.00 175.29 170.93 2edr n ASP 58 N 2.62 1.90 0.00 5.90 2.03 -0.61 -5.03 116.55 123.35 2edr n ASP 58 Ca -0.15 -3.01 0.00 0.00 0.52 0.00 0.00 54.79 52.14 2edr n ASP 58 Cb 0.58 -0.66 0.00 0.00 -0.72 0.00 0.00 41.12 40.32 2edr n ASP 58 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2edr n GLY 59 N 1.52 1.59 1.78 0.27 0.00 -1.26 -3.59 105.19 105.51 2edr n GLY 59 Ca 0.25 -0.54 -0.04 0.00 0.00 0.00 0.00 46.02 45.70 2edr n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2edr n ALA 60 N 6.06 4.34 -3.82 4.61 0.00 -1.26 -3.92 120.51 126.52 2edr n ALA 60 Ca 0.00 -2.41 -0.24 0.00 0.00 0.00 0.00 53.44 50.79 2edr n ALA 60 Cb 0.00 -1.13 -0.17 0.00 0.00 0.00 0.00 19.45 18.15 2edr n ALA 60 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2edr s VAL 61 N -3.00 0.65 0.21 0.00 1.01 -1.24 -1.48 120.40 116.54 2edr s VAL 61 Ca 0.53 -0.05 0.04 0.00 0.00 0.00 0.00 61.98 62.50 2edr s VAL 61 Cb 0.43 -0.74 -0.03 0.00 0.00 0.00 0.00 36.38 36.03 2edr s VAL 61 CO 0.12 0.30 0.31 0.00 0.00 0.00 0.00 175.10 175.84 2edr s GLU 63 N -3.67 0.28 -0.22 0.00 2.02 -1.06 -1.71 118.70 114.34 2edr s GLU 63 Ca 0.34 0.79 -0.07 0.00 0.02 0.00 0.00 54.97 56.05 2edr s GLU 63 Cb -0.10 0.04 -0.03 0.00 0.10 0.00 0.00 34.13 34.14 2edr s GLU 63 CO 0.28 -0.21 0.05 -1.17 0.02 0.00 0.00 175.26 174.24 2edr s LEU 64 N 1.89 3.49 -0.23 1.80 2.96 -0.82 -3.28 118.68 124.48 2edr s LEU 64 Ca -0.05 -0.14 -0.04 0.00 -0.22 0.00 0.00 54.13 53.67 2edr s LEU 64 Cb -0.10 -1.91 -0.01 0.00 0.50 0.00 0.00 46.19 44.67 2edr s LEU 64 CO -0.11 0.03 -0.02 -1.58 -1.32 0.00 0.00 176.35 173.35 2edr s GLN 65 N 1.21 3.35 -0.28 1.98 0.74 0.92 -0.96 119.66 126.61 2edr s GLN 65 Ca 0.04 -0.65 0.01 0.00 0.05 0.00 0.00 55.36 54.82 2edr s GLN 65 Cb -0.14 -3.08 0.08 0.00 1.10 0.00 0.00 33.01 30.97 2edr s GLN 65 CO 0.03 -0.23 0.01 0.42 -0.55 0.00 0.00 175.29 174.97 2edr s ILE 66 N 1.49 1.60 0.77 -2.34 1.01 0.45 -1.14 121.20 123.04 2edr s ILE 66 Ca 0.05 -1.59 -0.11 0.00 0.00 0.00 0.00 60.65 59.00 2edr s ILE 66 Cb -0.15 -2.03 0.07 0.00 0.01 0.00 0.00 42.46 40.36 2edr s ILE 66 CO -0.02 -0.38 1.13 0.00 0.00 0.00 0.00 174.94 175.67 2edr n GLY 68 N -3.18 -0.51 3.35 0.00 0.00 -1.24 -4.92 105.19 98.69 2edr n GLY 68 Ca 0.08 0.22 -0.34 0.00 0.00 0.00 0.00 46.02 45.98 2edr n GLY 68 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2edr n LEU 69 N -4.83 -1.08 -3.71 0.99 4.77 -0.81 -4.64 117.00 107.67 2edr n LEU 69 Ca -0.03 0.33 -0.11 0.00 -0.03 0.00 0.00 56.01 56.17 2edr n LEU 69 Cb 0.57 -1.13 -0.11 0.00 -2.33 0.00 0.00 43.42 40.41 2edr n LEU 69 CO 0.67 -3.98 0.01 0.00 -1.33 0.00 0.00 177.39 172.75 2edr s ALA 70 N -2.28 -0.90 0.63 -1.18 0.00 -1.26 -0.99 121.76 115.77 2edr s ALA 70 Ca 0.55 1.29 0.19 0.00 0.00 0.00 0.00 51.96 53.99 2edr s ALA 70 Cb -0.22 -0.79 0.75 0.00 0.00 0.00 0.00 23.12 22.87 2edr s ALA 70 CO 0.69 -0.23 1.33 0.28 0.00 0.00 0.00 175.76 177.83 2edr h VAL 71 N 5.41 0.04 0.13 0.00 2.07 -1.89 1.49 116.25 123.51 2edr h VAL 71 Ca -0.35 0.00 -0.30 0.00 0.82 0.00 0.00 66.70 66.87 2edr h VAL 71 Cb 1.18 0.13 0.03 0.00 -1.52 0.00 0.00 31.29 31.10 2edr h VAL 71 CO 0.31 0.00 -1.27 0.00 0.02 0.00 0.00 177.57 176.64 2edr h ALA 72 N 0.53 0.01 -0.68 1.67 0.00 -1.95 -3.25 119.26 115.59 2edr h ALA 72 Ca 0.27 -0.79 0.17 0.00 0.00 0.00 0.00 54.91 54.55 2edr h ALA 72 Cb 2.26 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 20.12 2edr h ALA 72 CO -0.00 0.73 0.47 -0.44 0.00 0.00 0.00 179.25 180.01 2edr h ASP 73 N 0.24 0.15 -3.14 0.00 5.19 0.17 -3.42 116.42 115.60 2edr h ASP 73 Ca -0.19 0.01 -0.58 0.00 -0.62 0.00 0.00 57.03 55.65 2edr h ASP 73 Cb 1.94 -0.02 0.17 0.00 0.18 0.00 0.00 39.33 41.60 2edr h ASP 73 CO 0.24 0.08 -0.24 0.00 -3.12 0.00 0.00 179.24 176.19 2edr n ALA 74 N -2.61 -0.76 0.00 3.45 0.00 -1.19 -4.69 120.51 114.72 2edr n ALA 74 Ca 0.13 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.55 2edr n ALA 74 Cb 0.64 -1.91 0.00 0.00 0.00 0.00 0.00 19.45 18.17 2edr n ALA 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2edr n GLY 75 N 1.64 -1.30 3.28 0.00 0.00 -0.91 -5.00 105.19 102.90 2edr n GLY 75 Ca 0.12 0.47 0.03 0.00 0.00 0.00 0.00 46.02 46.64 2edr n GLY 75 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2edr s GLU 76 N 0.00 0.32 0.01 1.61 2.12 -1.26 -3.51 118.70 117.98 2edr s GLU 76 Ca 0.00 0.67 -0.05 0.00 0.36 0.00 0.00 54.97 55.95 2edr s GLU 76 Cb 0.00 0.39 -0.04 0.00 0.26 0.00 0.00 34.13 34.73 2edr s GLU 76 CO 0.00 -0.24 0.24 0.71 -0.54 0.00 0.00 175.26 175.43 2edr s TYR 77 N 2.73 3.56 -0.01 5.30 1.51 -1.11 0.34 117.35 129.68 2edr s TYR 77 Ca 0.02 0.49 0.04 0.00 -1.01 0.00 0.00 57.07 56.61 2edr s TYR 77 Cb -0.09 -1.93 -0.01 0.00 -0.11 0.00 0.00 41.96 39.82 2edr s TYR 77 CO -0.16 0.62 -0.13 -1.12 -1.11 0.00 0.00 175.55 173.65 2edr s SER 78 N -1.82 1.53 -0.33 2.29 0.01 0.03 -0.63 113.70 114.79 2edr s SER 78 Ca 0.28 -0.24 -0.05 0.00 1.31 0.00 0.00 55.95 57.25 2edr s SER 78 Cb -0.13 -0.19 0.04 0.00 0.21 0.00 0.00 66.02 65.96 2edr s SER 78 CO 0.17 0.16 0.07 0.00 0.41 0.00 0.00 173.24 174.05 2edr s VAL 80 N 1.35 5.17 -0.02 0.00 1.01 0.01 -2.69 120.40 125.23 2edr s VAL 80 Ca -0.03 0.92 0.03 0.00 0.00 0.00 0.00 61.98 62.90 2edr s VAL 80 Cb -0.20 -3.80 -0.04 0.00 0.00 0.00 0.00 36.38 32.35 2edr s VAL 80 CO 0.01 0.36 0.03 0.00 0.00 0.00 0.00 175.10 175.50 2edr n GLY 82 N 2.62 -1.59 0.13 0.00 0.00 -1.26 -4.79 105.19 100.30 2edr n GLY 82 Ca -0.03 0.67 0.09 0.00 0.00 0.00 0.00 46.02 46.75 2edr n GLY 82 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2edr h GLU 83 N 0.00 0.00 -6.66 1.61 4.39 -1.92 -3.46 114.58 108.54 2edr h GLU 83 Ca 0.00 0.00 -0.66 0.00 0.34 0.00 0.00 59.36 59.04 2edr h GLU 83 Cb 0.00 0.00 -0.18 0.00 -0.10 0.00 0.00 28.75 28.47 2edr h GLU 83 CO 0.00 0.08 -0.81 -1.83 -1.16 0.00 0.00 179.01 175.29 2edr s GLU 84 N -3.24 1.62 -0.10 2.33 1.03 -1.26 -5.14 118.70 113.95 2edr s GLU 84 Ca 0.00 -1.40 -0.10 0.00 0.03 0.00 0.00 54.97 53.51 2edr s GLU 84 Cb 0.09 -1.95 0.03 0.00 -0.80 0.00 0.00 34.13 31.50 2edr s GLU 84 CO 0.77 0.43 0.27 0.50 -1.33 0.00 0.00 175.26 175.90 2edr s ARG 85 N -2.51 0.34 0.34 -4.83 3.52 -1.26 -3.09 118.95 111.45 2edr s ARG 85 Ca 0.20 0.33 0.08 0.00 -0.13 0.00 0.00 55.73 56.22 2edr s ARG 85 Cb -0.09 0.16 -0.05 0.00 -1.56 0.00 0.00 34.95 33.42 2edr s ARG 85 CO 0.10 -0.05 0.09 -0.08 -0.81 0.00 0.00 175.30 174.56 2edr s THR 86 N 0.04 2.87 0.05 4.11 -1.32 -1.10 -4.94 115.64 115.35 2edr s THR 86 Ca -0.01 -1.80 -0.00 0.00 -1.21 0.00 0.00 61.69 58.67 2edr s THR 86 Cb -0.02 -2.91 -0.04 0.00 -1.51 0.00 0.00 72.50 68.02 2edr s THR 86 CO 0.01 -0.19 -0.04 -0.94 -2.21 0.00 0.00 174.62 171.25 2edr s SER 87 N -3.80 0.54 -0.27 8.08 1.04 -1.26 -0.79 113.70 117.24 2edr s SER 87 Ca 0.37 -0.90 -0.04 0.00 0.48 0.00 0.00 55.95 55.85 2edr s SER 87 Cb -0.01 0.16 0.15 0.00 0.10 0.00 0.00 66.02 66.42 2edr s SER 87 CO 0.21 -0.52 0.53 0.00 0.98 0.00 0.00 173.24 174.44 2edr s ALA 88 N -3.38 -1.76 0.49 5.32 0.00 0.20 -4.54 121.76 118.09 2edr s ALA 88 Ca 0.03 1.66 -0.22 0.00 0.00 0.00 0.00 51.96 53.43 2edr s ALA 88 Cb 0.04 -1.84 -0.08 0.00 0.00 0.00 0.00 23.12 21.23 2edr s ALA 88 CO -0.07 -1.15 1.03 2.41 0.00 0.00 0.00 175.76 177.97 2edr n THR 89 N 5.41 2.90 -3.88 0.00 -1.04 -1.26 -2.73 114.28 113.68 2edr n THR 89 Ca -0.05 -0.50 -0.29 0.00 -2.04 0.00 0.00 64.05 61.17 2edr n THR 89 Cb 0.50 -1.22 -0.16 0.00 -1.82 0.00 0.00 70.33 67.63 2edr n THR 89 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 2edr s LEU 90 N -1.25 1.99 -0.20 -4.42 2.96 -1.23 -2.42 118.68 114.11 2edr s LEU 90 Ca 0.67 -0.95 -0.14 0.00 -0.22 0.00 0.00 54.13 53.49 2edr s LEU 90 Cb -0.49 -0.98 -0.04 0.00 0.50 0.00 0.00 46.19 45.18 2edr s LEU 90 CO 0.53 -0.24 0.32 -0.89 -1.32 0.00 0.00 176.35 174.76 2edr s THR 91 N 1.56 5.26 -0.05 3.68 2.01 -1.15 -2.14 115.64 124.81 2edr s THR 91 Ca -0.03 0.56 0.01 0.00 0.31 0.00 0.00 61.69 62.54 2edr s THR 91 Cb -0.17 -3.66 -0.03 0.00 0.01 0.00 0.00 72.50 68.65 2edr s THR 91 CO -0.07 0.31 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.42 2edr s VAL 92 N 1.03 3.75 0.38 3.82 1.01 -1.25 0.15 120.40 129.28 2edr s VAL 92 Ca 0.16 -0.54 0.04 0.00 0.00 0.00 0.00 61.98 61.64 2edr s VAL 92 Cb -0.14 -2.56 0.04 0.00 0.00 0.00 0.00 36.38 33.72 2edr s VAL 92 CO 0.06 0.54 0.31 0.29 0.00 0.00 0.00 175.10 176.30 2edr n LYS 93 N 2.02 0.92 -3.64 2.72 4.76 -0.77 -4.85 118.16 119.32 2edr n LYS 93 Ca -0.17 -2.32 -0.39 0.00 -2.87 0.00 0.00 58.31 52.55 2edr n LYS 93 Cb 0.53 0.21 -0.10 0.00 -1.84 0.00 0.00 35.03 33.83 2edr n LYS 93 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2edr s ALA 94 N -2.53 3.26 0.44 7.82 0.00 -1.26 -1.02 121.76 128.46 2edr s ALA 94 Ca 0.23 -2.26 -0.24 0.00 0.00 0.00 0.00 51.96 49.69 2edr s ALA 94 Cb -0.02 -2.60 -0.09 0.00 0.00 0.00 0.00 23.12 20.41 2edr s ALA 94 CO 0.15 -1.69 1.20 1.47 0.00 0.00 0.00 175.76 176.89 2edr n LEU 95 N 4.84 3.85 -4.57 0.00 -0.00 -1.26 -4.86 117.00 115.00 2edr n LEU 95 Ca -0.09 1.06 -0.40 0.00 -0.00 0.00 0.00 56.01 56.58 2edr n LEU 95 Cb 0.42 -1.47 -0.03 0.00 -0.00 0.00 0.00 43.42 42.35 2edr n LEU 95 CO 0.38 -0.90 1.55 -2.16 -0.00 0.00 0.00 177.39 176.25 2edr s PRO 96 N -2.27 2.94 -0.05 1.47 0.04 -1.26 -4.76 135.00 131.12 2edr s PRO 96 Ca 0.63 0.89 -0.03 0.00 0.04 0.00 0.00 61.00 62.54 2edr s PRO 96 Cb -0.50 -4.29 -0.02 0.00 0.04 0.00 0.00 34.50 29.72 2edr s PRO 96 CO 0.56 -2.34 -0.08 0.45 0.04 0.00 0.00 177.00 175.63 2edr n SER 97 N 11.58 0.53 0.00 6.66 2.88 -1.26 -5.00 113.62 129.01 2edr n SER 97 Ca 0.21 0.09 0.00 0.00 -1.33 0.00 0.00 58.87 57.83 2edr n SER 97 Cb 0.50 -0.21 0.00 0.00 -0.75 0.00 0.00 64.21 63.75 2edr n SER 97 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2edr n GLY 98 N 2.67 1.68 3.63 0.46 0.00 -1.26 -4.87 105.19 107.51 2edr n GLY 98 Ca -0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.48 2edr n GLY 98 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2edr s PRO 99 N 0.13 3.80 0.16 1.61 0.04 -1.26 -5.00 135.00 134.48 2edr s PRO 99 Ca 0.00 1.66 -0.04 0.00 0.04 0.00 0.00 61.00 62.66 2edr s PRO 99 Cb 0.00 -4.03 -0.05 0.00 0.04 0.00 0.00 34.50 30.46 2edr s PRO 99 CO 0.00 -1.29 0.39 -1.12 0.04 0.00 0.00 177.00 175.02 2edr s SER 100 N 4.19 6.47 0.17 6.66 0.01 -1.26 -4.97 113.70 124.97 2edr s SER 100 Ca 0.71 0.56 -0.31 0.00 1.31 0.00 0.00 55.95 58.23 2edr s SER 100 Cb -0.25 -2.08 -0.09 0.00 0.21 0.00 0.00 66.02 63.81 2edr s SER 100 CO 0.29 0.02 1.40 -0.44 0.41 0.00 0.00 173.24 174.92 2edr s SER 101 N -2.62 6.77 0.00 2.44 0.01 -1.26 -5.19 113.70 113.85 2edr s SER 101 Ca 0.41 2.46 0.27 0.00 1.31 0.00 0.00 55.95 60.40 2edr s SER 101 Cb -0.12 -2.60 0.75 0.00 0.21 0.00 0.00 66.02 64.26 2edr s SER 101 CO 0.26 -0.65 1.58 0.61 0.41 0.00 0.00 173.24 175.44