#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ke0 h PRO 2 N 0.00 0.00 0.00 1.61 0.13 -2.06 -2.80 132.00 128.87 2ke0 h PRO 2 Ca 0.00 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.05 2ke0 h PRO 2 Cb 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 2ke0 h PRO 2 CO 0.00 0.00 -0.89 0.78 -0.23 0.00 0.00 178.00 177.66 2ke0 h GLY 3 N 2.04 0.00 -3.00 1.56 0.00 -2.01 -3.48 103.07 98.18 2ke0 h GLY 3 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 47.33 46.93 2ke0 h GLY 3 CO 0.00 0.00 -0.53 1.44 0.00 0.00 0.00 176.54 177.45 2ke0 n SER 4 N -2.94 -5.80 -3.57 0.19 7.64 -1.06 -2.06 113.62 106.02 2ke0 n SER 4 Ca -0.02 -0.04 -0.22 0.00 1.01 0.00 0.00 58.87 59.60 2ke0 n SER 4 Cb 0.69 -4.81 0.08 0.00 -1.01 0.00 0.00 64.21 59.16 2ke0 n SER 4 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 2ke0 n MET 5 N -3.02 -7.16 -2.93 1.43 2.81 -1.26 -4.97 117.12 102.02 2ke0 n MET 5 Ca -0.23 0.81 -0.33 0.00 -1.81 0.00 0.00 57.70 56.14 2ke0 n MET 5 Cb 0.68 -5.81 -0.07 0.00 -0.71 0.00 0.00 33.22 27.31 2ke0 n MET 5 CO 0.00 0.00 0.00 -0.08 1.51 0.00 0.00 175.97 177.40 2ke0 s THR 6 N -3.35 4.48 -0.17 2.03 -1.32 -0.87 -5.06 115.64 111.38 2ke0 s THR 6 Ca 0.35 1.33 -0.07 0.00 -1.21 0.00 0.00 61.69 62.08 2ke0 s THR 6 Cb -0.16 -3.63 -0.04 0.00 -1.51 0.00 0.00 72.50 67.17 2ke0 s THR 6 CO 0.74 -0.24 0.08 0.54 -2.21 0.00 0.00 174.62 173.53 2ke0 s VAL 7 N -2.08 4.97 -0.42 5.08 0.11 -1.26 -4.88 120.40 121.92 2ke0 s VAL 7 Ca 0.59 0.03 -0.08 0.00 -2.93 0.00 0.00 61.98 59.59 2ke0 s VAL 7 Cb -0.10 -3.22 0.09 0.00 -1.53 0.00 0.00 36.38 31.62 2ke0 s VAL 7 CO 0.15 0.50 0.25 -0.69 -3.33 0.00 0.00 175.10 171.98 2ke0 s VAL 8 N 0.02 3.97 -0.33 2.04 1.01 -1.20 -5.04 120.40 120.86 2ke0 s VAL 8 Ca 0.07 -1.62 -0.11 0.00 0.00 0.00 0.00 61.98 60.32 2ke0 s VAL 8 Cb -0.12 -3.52 0.00 0.00 0.00 0.00 0.00 36.38 32.74 2ke0 s VAL 8 CO 0.00 -0.58 0.19 0.42 0.00 0.00 0.00 175.10 175.13 2ke0 s THR 9 N 1.34 4.74 1.07 3.92 -4.23 -1.26 -2.88 115.64 118.33 2ke0 s THR 9 Ca 0.04 -0.49 -0.16 0.00 -1.18 0.00 0.00 61.69 59.90 2ke0 s THR 9 Cb -0.24 -3.48 0.22 0.00 1.34 0.00 0.00 72.50 70.35 2ke0 s THR 9 CO -0.00 -0.03 1.13 0.42 -0.54 0.00 0.00 174.62 175.60 2ke0 s THR 10 N 1.62 1.83 0.43 3.99 -4.23 -1.09 -4.91 115.64 113.27 2ke0 s THR 10 Ca 0.04 0.00 0.22 0.00 -1.18 0.00 0.00 61.69 60.78 2ke0 s THR 10 Cb -0.18 -2.59 0.25 0.00 1.34 0.00 0.00 72.50 71.32 2ke0 s THR 10 CO 0.07 0.00 2.03 -0.33 -0.54 0.00 0.00 174.62 175.86 2ke0 h GLU 11 N -2.10 0.00 -0.24 3.99 5.08 -1.98 -2.71 114.58 116.62 2ke0 h GLU 11 Ca -0.49 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 57.77 2ke0 h GLU 11 Cb 1.31 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.55 2ke0 h GLU 11 CO 0.47 0.15 -0.24 0.66 -1.00 0.00 0.00 179.01 179.05 2ke0 h SER 12 N 0.00 0.62 0.00 1.42 4.64 -2.03 -3.47 113.55 114.73 2ke0 h SER 12 Ca -0.00 -0.47 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 2ke0 h SER 12 Cb 0.34 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 2ke0 h SER 12 CO 0.02 0.97 0.00 0.61 -0.87 0.00 0.00 176.83 177.56 2ke0 n GLY 13 N 0.17 1.33 3.55 -0.77 0.00 -1.02 -5.03 105.19 103.41 2ke0 n GLY 13 Ca -0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.67 2ke0 n GLY 13 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2ke0 n LEU 14 N 0.00 0.77 -3.87 0.99 -0.00 -1.26 -4.72 117.00 108.90 2ke0 n LEU 14 Ca 0.00 0.14 -0.12 0.00 -0.00 0.00 0.00 56.01 56.02 2ke0 n LEU 14 Cb 0.00 -1.34 -0.14 0.00 -0.00 0.00 0.00 43.42 41.94 2ke0 n LEU 14 CO 0.00 -2.79 -0.36 -1.59 -0.00 0.00 0.00 177.39 172.64 2ke0 s LYS 15 N -4.40 0.03 0.18 1.47 -2.85 -0.63 -2.69 119.74 110.85 2ke0 s LYS 15 Ca 0.66 -0.01 -0.11 0.00 -1.00 0.00 0.00 55.97 55.52 2ke0 s LYS 15 Cb -0.23 -0.04 -0.00 0.00 -2.06 0.00 0.00 37.83 35.50 2ke0 s LYS 15 CO 0.62 0.00 0.35 1.52 0.10 0.00 0.00 175.35 177.94 2ke0 s TYR 16 N 0.02 0.33 -0.21 1.78 -0.85 -1.14 0.73 117.35 118.01 2ke0 s TYR 16 Ca -0.00 -0.69 -0.19 0.00 -0.52 0.00 0.00 57.07 55.68 2ke0 s TYR 16 Cb -0.00 0.04 0.05 0.00 0.38 0.00 0.00 41.96 42.42 2ke0 s TYR 16 CO -0.00 -0.79 0.54 -2.00 -1.52 0.00 0.00 175.55 171.79 2ke0 s GLU 17 N -3.97 0.63 0.59 -3.49 2.12 0.52 -3.22 118.70 111.89 2ke0 s GLU 17 Ca 0.17 0.77 -0.20 0.00 0.36 0.00 0.00 54.97 56.07 2ke0 s GLU 17 Cb 0.02 0.30 -0.03 0.00 0.26 0.00 0.00 34.13 34.68 2ke0 s GLU 17 CO 0.01 -0.08 1.33 0.34 -0.54 0.00 0.00 175.26 176.33 2ke0 s ASP 18 N 0.36 4.94 -0.02 -1.70 2.15 -1.26 -0.47 116.67 120.67 2ke0 s ASP 18 Ca -0.01 2.71 0.00 0.00 0.43 0.00 0.00 52.55 55.69 2ke0 s ASP 18 Cb -0.04 -2.63 -0.01 0.00 -0.30 0.00 0.00 42.92 39.94 2ke0 s ASP 18 CO -0.00 -1.79 -0.02 0.18 -0.17 0.00 0.00 175.17 173.37 2ke0 n LEU 19 N -1.44 2.90 -3.49 -1.34 4.77 0.19 -4.68 117.00 113.91 2ke0 n LEU 19 Ca 0.13 -0.01 -0.15 0.00 -0.03 0.00 0.00 56.01 55.95 2ke0 n LEU 19 Cb 0.46 -0.06 -0.04 0.00 -2.33 0.00 0.00 43.42 41.45 2ke0 n LEU 19 CO 0.50 0.51 0.46 -0.89 -1.33 0.00 0.00 177.39 176.64 2ke0 s THR 20 N -2.03 0.00 0.67 -5.08 2.01 0.10 -4.96 115.64 106.35 2ke0 s THR 20 Ca -0.02 0.00 -0.09 0.00 0.31 0.00 0.00 61.69 61.88 2ke0 s THR 20 Cb 0.01 -1.00 0.01 0.00 0.01 0.00 0.00 72.50 71.53 2ke0 s THR 20 CO 0.04 0.00 1.03 -1.61 -0.69 0.00 0.00 174.62 173.39 2ke0 s GLU 21 N -2.09 2.86 -0.17 4.92 2.02 -1.26 -1.02 118.70 123.96 2ke0 s GLU 21 Ca -0.06 0.28 0.12 0.00 0.02 0.00 0.00 54.97 55.33 2ke0 s GLU 21 Cb -0.00 -2.11 -0.19 0.00 0.10 0.00 0.00 34.13 31.92 2ke0 s GLU 21 CO 0.01 -0.93 0.01 0.41 0.02 0.00 0.00 175.26 174.79 2ke0 n GLY 22 N -2.86 -0.72 2.33 -1.39 0.00 -1.26 -3.99 105.19 97.30 2ke0 n GLY 22 Ca 0.06 -0.25 -0.17 0.00 0.00 0.00 0.00 46.02 45.66 2ke0 n GLY 22 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2ke0 n SER 23 N -2.70 -5.00 0.00 1.61 2.88 -1.25 -4.46 113.62 104.70 2ke0 n SER 23 Ca -0.29 -0.02 0.00 0.00 -1.33 0.00 0.00 58.87 57.23 2ke0 n SER 23 Cb 1.01 -4.09 0.00 0.00 -0.75 0.00 0.00 64.21 60.38 2ke0 n SER 23 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ke0 n GLY 24 N -1.02 1.27 3.11 0.46 0.00 -1.21 -5.00 105.19 102.80 2ke0 n GLY 24 Ca -0.20 -0.09 -0.13 0.00 0.00 0.00 0.00 46.02 45.61 2ke0 n GLY 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ke0 s ALA 25 N -2.00 -0.54 0.11 4.61 0.00 -1.26 -4.81 121.76 117.87 2ke0 s ALA 25 Ca 0.00 0.59 -0.30 0.00 0.00 0.00 0.00 51.96 52.25 2ke0 s ALA 25 Cb 0.00 -0.34 -0.06 0.00 0.00 0.00 0.00 23.12 22.72 2ke0 s ALA 25 CO 0.00 -0.11 1.02 -2.00 0.00 0.00 0.00 175.76 174.67 2ke0 s GLU 26 N 0.04 4.64 0.78 0.00 2.12 -1.26 -0.37 118.70 124.65 2ke0 s GLU 26 Ca -0.01 1.54 -0.14 0.00 0.36 0.00 0.00 54.97 56.72 2ke0 s GLU 26 Cb -0.02 -3.36 0.05 0.00 0.26 0.00 0.00 34.13 31.06 2ke0 s GLU 26 CO 0.00 0.11 1.05 0.00 -0.54 0.00 0.00 175.26 175.89 2ke0 n ALA 27 N 2.90 -0.27 -2.62 6.30 0.00 -0.63 -4.96 120.51 121.23 2ke0 n ALA 27 Ca 0.03 -0.28 -0.21 0.00 0.00 0.00 0.00 53.44 52.98 2ke0 n ALA 27 Cb 0.48 -2.16 -0.15 0.00 0.00 0.00 0.00 19.45 17.62 2ke0 n ALA 27 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2ke0 s ARG 28 N -3.74 0.97 0.16 0.00 0.52 -1.26 -4.35 118.95 111.26 2ke0 s ARG 28 Ca 0.72 -0.50 -0.33 0.00 -0.52 0.00 0.00 55.73 55.11 2ke0 s ARG 28 Cb -0.31 -0.95 -0.13 0.00 0.52 0.00 0.00 34.95 34.09 2ke0 s ARG 28 CO 0.51 0.25 1.67 0.00 0.02 0.00 0.00 175.30 177.76 2ke0 n ALA 29 N 2.61 1.93 0.00 2.13 0.00 -1.26 -1.38 120.51 124.54 2ke0 n ALA 29 Ca -0.15 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.70 2ke0 n ALA 29 Cb 0.56 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.56 2ke0 n ALA 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ke0 n GLY 30 N 3.74 0.52 3.85 0.00 0.00 0.94 -4.94 105.19 109.30 2ke0 n GLY 30 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 2ke0 n GLY 30 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2ke0 s GLN 31 N -0.89 3.72 -0.80 1.61 0.74 -0.48 -4.77 119.66 118.80 2ke0 s GLN 31 Ca 0.00 0.11 -0.23 0.00 0.05 0.00 0.00 55.36 55.29 2ke0 s GLN 31 Cb 0.00 -3.23 0.06 0.00 1.10 0.00 0.00 33.01 30.95 2ke0 s GLN 31 CO 0.00 0.69 1.18 0.99 -0.55 0.00 0.00 175.29 177.60 2ke0 s THR 32 N -0.90 4.13 0.25 -0.34 2.01 -1.26 -1.38 115.64 118.15 2ke0 s THR 32 Ca 0.19 -0.40 0.07 0.00 0.31 0.00 0.00 61.69 61.85 2ke0 s THR 32 Cb -0.14 -4.84 -0.04 0.00 0.01 0.00 0.00 72.50 67.49 2ke0 s THR 32 CO 0.08 -1.68 0.21 0.68 -0.69 0.00 0.00 174.62 173.22 2ke0 s VAL 33 N 4.52 4.48 -0.05 3.82 -7.23 -0.60 -4.75 120.40 120.59 2ke0 s VAL 33 Ca 0.32 -1.38 0.04 0.00 -1.81 0.00 0.00 61.98 59.16 2ke0 s VAL 33 Cb -0.09 -3.43 -0.02 0.00 0.56 0.00 0.00 36.38 33.40 2ke0 s VAL 33 CO 0.05 -0.35 -0.17 -0.44 -0.31 0.00 0.00 175.10 173.88 2ke0 s SER 34 N -3.85 3.80 0.08 4.85 0.01 -0.47 -1.37 113.70 116.74 2ke0 s SER 34 Ca 0.33 -0.27 -0.07 0.00 1.31 0.00 0.00 55.95 57.25 2ke0 s SER 34 Cb -0.08 -0.80 -0.01 0.00 0.21 0.00 0.00 66.02 65.34 2ke0 s SER 34 CO 0.25 0.32 0.14 0.68 0.41 0.00 0.00 173.24 175.05 2ke0 s VAL 35 N -0.61 0.16 -0.11 3.43 -7.23 -0.37 0.03 120.40 115.70 2ke0 s VAL 35 Ca 0.09 -1.33 -0.00 0.00 -1.81 0.00 0.00 61.98 58.93 2ke0 s VAL 35 Cb -0.11 -1.40 -0.02 0.00 0.56 0.00 0.00 36.38 35.41 2ke0 s VAL 35 CO 0.01 -0.71 -0.10 -1.00 -0.31 0.00 0.00 175.10 172.98 2ke0 s HIS 36 N -3.88 2.86 -0.16 2.82 3.76 0.08 -0.50 115.29 120.28 2ke0 s HIS 36 Ca 0.06 -0.36 -0.04 0.00 -0.15 0.00 0.00 55.06 54.58 2ke0 s HIS 36 Cb 0.06 -1.81 -0.03 0.00 1.11 0.00 0.00 32.58 31.91 2ke0 s HIS 36 CO -0.10 0.00 -0.04 1.52 -0.85 0.00 0.00 174.74 175.27 2ke0 s TYR 37 N -0.06 3.02 -0.31 1.40 1.13 -1.24 -0.70 117.35 120.60 2ke0 s TYR 37 Ca -0.01 -0.33 0.03 0.00 -1.41 0.00 0.00 57.07 55.35 2ke0 s TYR 37 Cb -0.14 -1.96 0.09 0.00 -1.10 0.00 0.00 41.96 38.85 2ke0 s TYR 37 CO 0.03 -0.06 0.00 0.99 -2.51 0.00 0.00 175.55 174.01 2ke0 s THR 38 N 0.41 2.05 0.41 -3.49 2.01 -0.12 -2.39 115.64 114.53 2ke0 s THR 38 Ca -0.04 -1.97 -0.22 0.00 0.31 0.00 0.00 61.69 59.76 2ke0 s THR 38 Cb -0.14 -2.41 -0.10 0.00 0.01 0.00 0.00 72.50 69.86 2ke0 s THR 38 CO 0.03 -0.41 0.97 -0.83 -0.69 0.00 0.00 174.62 173.68 2ke0 s GLY 39 N 1.06 2.53 -0.12 4.40 0.00 0.17 -0.10 107.32 115.25 2ke0 s GLY 39 Ca 0.04 0.48 -0.09 0.00 0.00 0.00 0.00 44.72 45.15 2ke0 s GLY 39 CO -0.09 0.81 0.31 -0.98 0.00 0.00 0.00 173.10 173.16 2ke0 s TRP 40 N -1.98 -0.40 0.72 1.90 0.51 0.13 -3.89 118.94 115.93 2ke0 s TRP 40 Ca 0.59 0.92 -0.12 0.00 -2.12 0.00 0.00 56.10 55.37 2ke0 s TRP 40 Cb -0.13 0.13 0.18 0.00 -0.81 0.00 0.00 33.47 32.84 2ke0 s TRP 40 CO 0.18 -0.22 0.60 1.28 -0.51 0.00 0.00 176.95 178.27 2ke0 n LEU 41 N 3.60 0.00 -0.01 2.99 4.77 0.92 -1.62 117.00 127.65 2ke0 n LEU 41 Ca -0.19 -0.63 0.15 0.00 -0.03 0.00 0.00 56.01 55.31 2ke0 n LEU 41 Cb 0.56 -0.57 0.82 0.00 -2.33 0.00 0.00 43.42 41.91 2ke0 n LEU 41 CO 0.14 -1.76 1.05 0.35 -1.33 0.00 0.00 177.39 175.84 2ke0 n THR 42 N -3.96 0.00 -0.01 -5.08 -2.24 -1.26 -3.12 114.28 98.61 2ke0 n THR 42 Ca 0.08 -0.01 0.07 0.00 -2.27 0.00 0.00 64.05 61.93 2ke0 n THR 42 Cb 0.33 -0.47 -0.12 0.00 -2.10 0.00 0.00 70.33 67.97 2ke0 n THR 42 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2ke0 n ASP 43 N -1.14 1.31 0.00 3.42 2.03 -1.26 -4.99 116.55 115.92 2ke0 n ASP 43 Ca 0.18 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.49 2ke0 n ASP 43 Cb 0.19 1.67 0.00 0.00 -0.72 0.00 0.00 41.12 42.27 2ke0 n ASP 43 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2ke0 n GLY 44 N 1.62 1.18 3.83 0.27 0.00 -1.18 -5.11 105.19 105.79 2ke0 n GLY 44 Ca -0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.63 2ke0 n GLY 44 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2ke0 s GLN 45 N -0.27 4.16 -0.34 1.61 -1.52 -1.26 -4.78 119.66 117.26 2ke0 s GLN 45 Ca 0.00 0.84 -0.13 0.00 -1.95 0.00 0.00 55.36 54.12 2ke0 s GLN 45 Cb 0.00 -2.60 -0.02 0.00 -0.22 0.00 0.00 33.01 30.18 2ke0 s GLN 45 CO 0.00 0.23 0.25 0.21 -0.25 0.00 0.00 175.29 175.74 2ke0 s LYS 46 N -2.57 3.52 -0.11 2.91 2.20 -1.26 -0.06 119.74 124.37 2ke0 s LYS 46 Ca 0.51 -0.61 0.20 0.00 -0.36 0.00 0.00 55.97 55.70 2ke0 s LYS 46 Cb -0.13 -3.80 -0.28 0.00 -1.51 0.00 0.00 37.83 32.10 2ke0 s LYS 46 CO 0.19 -0.45 0.28 1.97 -0.36 0.00 0.00 175.35 176.98 2ke0 n PHE 47 N 5.14 0.04 -3.76 4.03 1.16 -1.25 -4.95 117.46 117.87 2ke0 n PHE 47 Ca -0.12 0.01 -0.13 0.00 -1.87 0.00 0.00 57.45 55.35 2ke0 n PHE 47 Cb 0.50 -0.79 -0.13 0.00 -1.61 0.00 0.00 39.48 37.45 2ke0 n PHE 47 CO 0.00 0.00 0.00 0.16 -1.87 0.00 0.00 176.76 175.05 2ke0 s ASP 48 N -5.08 -0.24 -0.25 5.98 1.47 -1.26 -5.06 116.67 112.22 2ke0 s ASP 48 Ca -0.09 0.48 -0.02 0.00 1.18 0.00 0.00 52.55 54.10 2ke0 s ASP 48 Cb 0.10 0.42 0.14 0.00 -0.34 0.00 0.00 42.92 43.23 2ke0 s ASP 48 CO 0.86 -0.13 0.41 -0.94 0.68 0.00 0.00 175.17 176.05 2ke0 s SER 49 N 0.80 0.01 0.18 2.11 1.04 -1.26 -0.66 113.70 115.92 2ke0 s SER 49 Ca -0.06 0.31 -0.06 0.00 0.48 0.00 0.00 55.95 56.62 2ke0 s SER 49 Cb -0.07 1.27 0.07 0.00 0.10 0.00 0.00 66.02 67.39 2ke0 s SER 49 CO -0.05 -0.30 1.52 0.77 0.98 0.00 0.00 173.24 176.17 2ke0 h SER 50 N 8.16 0.80 0.32 7.02 4.64 -1.75 -2.71 113.55 130.03 2ke0 h SER 50 Ca -0.20 -0.37 0.00 0.00 -0.47 0.00 0.00 61.79 60.75 2ke0 h SER 50 Cb 1.16 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 63.02 2ke0 h SER 50 CO 0.27 1.12 0.00 0.07 -0.87 0.00 0.00 176.83 177.42 2ke0 h LYS 51 N 0.61 0.00 0.00 4.77 5.09 -1.81 0.74 116.57 125.96 2ke0 h LYS 51 Ca 0.04 0.00 -0.15 0.00 0.09 0.00 0.00 60.65 60.64 2ke0 h LYS 51 Cb 0.97 0.00 -0.02 0.00 0.10 0.00 0.00 32.23 33.28 2ke0 h LYS 51 CO 0.09 0.00 -0.87 0.22 -2.09 0.00 0.00 179.45 176.80 2ke0 h ASP 52 N 0.00 0.00 -0.32 7.07 3.58 -1.86 -3.28 116.42 121.60 2ke0 h ASP 52 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2ke0 h ASP 52 Cb 0.16 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.21 2ke0 h ASP 52 CO 0.00 0.64 0.00 -2.11 -2.88 0.00 0.00 179.24 174.89 2ke0 n ARG 53 N -3.16 3.12 -3.63 0.28 1.85 -0.43 -4.95 116.66 109.74 2ke0 n ARG 53 Ca -0.02 -2.72 -0.27 0.00 -1.00 0.00 0.00 57.85 53.84 2ke0 n ARG 53 Cb 0.81 -1.77 0.01 0.00 -1.05 0.00 0.00 32.46 30.46 2ke0 n ARG 53 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 2ke0 n ASN 54 N -0.13 -4.34 -3.89 2.89 4.13 -0.49 -4.90 115.26 108.54 2ke0 n ASN 54 Ca 0.20 -0.59 -0.33 0.00 1.68 0.00 0.00 54.58 55.53 2ke0 n ASN 54 Cb 0.83 -3.52 -0.07 0.00 -1.54 0.00 0.00 39.78 35.48 2ke0 n ASN 54 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 2ke0 n ASP 55 N -2.55 4.23 -4.65 6.41 2.03 0.12 -5.01 116.55 117.13 2ke0 n ASP 55 Ca 0.01 -3.27 -0.43 0.00 0.52 0.00 0.00 54.79 51.63 2ke0 n ASP 55 Cb 0.54 -0.94 -0.03 0.00 -0.72 0.00 0.00 41.12 39.97 2ke0 n ASP 55 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2ke0 s PRO 56 N -1.88 4.04 -0.47 -0.67 0.04 -1.26 -4.60 135.00 130.20 2ke0 s PRO 56 Ca 0.31 1.87 -0.28 0.00 0.04 0.00 0.00 61.00 62.95 2ke0 s PRO 56 Cb 0.01 -3.96 -0.02 0.00 0.04 0.00 0.00 34.50 30.57 2ke0 s PRO 56 CO -0.07 -0.99 1.78 0.12 0.04 0.00 0.00 177.00 177.88 2ke0 s PHE 57 N 4.36 1.82 -0.16 0.56 2.19 0.35 -4.76 117.98 122.34 2ke0 s PHE 57 Ca 0.69 0.70 -0.05 0.00 0.33 0.00 0.00 56.93 58.60 2ke0 s PHE 57 Cb -0.28 -4.14 -0.03 0.00 -1.31 0.00 0.00 43.02 37.27 2ke0 s PHE 57 CO 0.26 -2.52 -0.01 0.00 1.83 0.00 0.00 175.22 174.78 2ke0 s ALA 58 N 7.73 3.11 0.20 11.12 0.00 -1.26 -1.23 121.76 141.43 2ke0 s ALA 58 Ca 0.71 -0.80 -0.23 0.00 0.00 0.00 0.00 51.96 51.65 2ke0 s ALA 58 Cb -0.17 -1.65 0.05 0.00 0.00 0.00 0.00 23.12 21.35 2ke0 s ALA 58 CO 0.27 0.21 0.71 -0.59 0.00 0.00 0.00 175.76 176.36 2ke0 s PHE 59 N 0.34 -0.32 -0.14 0.00 -0.71 -0.47 -4.98 117.98 111.69 2ke0 s PHE 59 Ca -0.02 -0.01 -0.26 0.00 -1.04 0.00 0.00 56.93 55.61 2ke0 s PHE 59 Cb -0.14 0.64 -0.02 0.00 -1.21 0.00 0.00 43.02 42.29 2ke0 s PHE 59 CO 0.02 -1.01 0.83 0.08 -1.34 0.00 0.00 175.22 173.80 2ke0 s VAL 60 N -3.75 4.90 -0.56 -2.49 1.01 -1.26 -1.55 120.40 116.70 2ke0 s VAL 60 Ca 0.07 1.65 -0.27 0.00 0.00 0.00 0.00 61.98 63.44 2ke0 s VAL 60 Cb -0.03 -4.14 -0.09 0.00 0.00 0.00 0.00 36.38 32.11 2ke0 s VAL 60 CO -0.02 0.07 2.46 -0.11 0.00 0.00 0.00 175.10 177.50 2ke0 n LEU 61 N 4.92 2.02 0.00 3.92 7.94 -0.48 -1.31 117.00 134.02 2ke0 n LEU 61 Ca 0.04 -0.40 0.00 0.00 -1.11 0.00 0.00 56.01 54.54 2ke0 n LEU 61 Cb 0.49 -1.49 0.00 0.00 0.53 0.00 0.00 43.42 42.96 2ke0 n LEU 61 CO 0.48 -1.44 0.00 0.61 -1.11 0.00 0.00 177.39 175.93 2ke0 n GLY 62 N 6.08 -0.04 0.00 -3.96 0.00 -1.26 -0.04 105.19 105.97 2ke0 n GLY 62 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.43 2ke0 n GLY 62 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ke0 n GLY 63 N 0.00 -1.94 0.65 -0.02 0.00 -0.42 -5.03 105.19 98.42 2ke0 n GLY 63 Ca 0.00 -0.96 -0.01 0.00 0.00 0.00 0.00 46.02 45.05 2ke0 n GLY 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ke0 n GLY 64 N 1.87 0.82 1.88 -0.02 0.00 -1.26 -4.91 105.19 103.58 2ke0 n GLY 64 Ca 0.00 -0.04 -0.09 0.00 0.00 0.00 0.00 46.02 45.89 2ke0 n GLY 64 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2ke0 n MET 65 N 0.03 3.11 -2.05 1.61 2.81 -1.26 -4.96 117.12 116.41 2ke0 n MET 65 Ca -0.05 -3.07 -0.03 0.00 -1.81 0.00 0.00 57.70 52.74 2ke0 n MET 65 Cb 0.60 -2.14 -0.01 0.00 -0.71 0.00 0.00 33.22 30.97 2ke0 n MET 65 CO 0.00 0.00 0.00 1.33 1.51 0.00 0.00 175.97 178.81 2ke0 n VAL 66 N -0.53 0.00 -4.08 2.03 0.24 -1.26 -5.16 118.33 109.56 2ke0 n VAL 66 Ca 0.43 -0.33 -0.24 0.00 -2.04 0.00 0.00 64.34 62.17 2ke0 n VAL 66 Cb 1.39 0.20 -0.07 0.00 -1.47 0.00 0.00 33.84 33.89 2ke0 n VAL 66 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 2ke0 s ILE 67 N -2.46 2.70 0.19 1.34 -0.00 -1.26 -4.96 121.20 116.75 2ke0 s ILE 67 Ca 0.05 -1.69 -0.18 0.00 -0.00 0.00 0.00 60.65 58.83 2ke0 s ILE 67 Cb -0.00 -2.97 0.16 0.00 -0.00 0.00 0.00 42.46 39.65 2ke0 s ILE 67 CO 0.04 -0.10 1.60 0.11 -0.00 0.00 0.00 174.94 176.59 2ke0 h LYS 68 N 1.48 -0.11 -1.00 0.37 1.79 -1.99 0.16 116.57 117.26 2ke0 h LYS 68 Ca -0.43 0.01 0.19 0.00 -2.18 0.00 0.00 60.65 58.24 2ke0 h LYS 68 Cb 1.25 0.03 -0.11 0.00 -1.58 0.00 0.00 32.23 31.82 2ke0 h LYS 68 CO 0.65 -0.08 0.61 0.78 -1.08 0.00 0.00 179.45 180.34 2ke0 h GLY 69 N -0.12 1.76 0.55 3.86 0.00 -1.98 0.20 103.07 107.34 2ke0 h GLY 69 Ca 0.25 -0.35 -0.01 0.00 0.00 0.00 0.00 47.33 47.22 2ke0 h GLY 69 CO -0.64 -0.07 -0.07 1.49 0.00 0.00 0.00 176.54 177.25 2ke0 h TRP 70 N 0.74 -0.19 -0.38 5.60 4.06 -1.15 -1.64 115.95 122.99 2ke0 h TRP 70 Ca 0.58 -0.00 0.05 0.00 2.06 0.00 0.00 58.89 61.57 2ke0 h TRP 70 Cb 0.93 0.06 -0.04 0.00 -1.00 0.00 0.00 29.16 29.11 2ke0 h TRP 70 CO -0.00 0.21 0.12 0.22 -3.56 0.00 0.00 178.44 175.43 2ke0 h ASP 71 N -0.66 0.11 -0.52 -3.49 3.58 -0.46 0.90 116.42 115.88 2ke0 h ASP 71 Ca -0.02 0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.48 2ke0 h ASP 71 Cb 0.49 0.04 -0.03 0.00 1.72 0.00 0.00 39.33 41.55 2ke0 h ASP 71 CO 0.03 0.10 0.35 -0.08 -2.88 0.00 0.00 179.24 176.76 2ke0 h GLU 72 N 0.27 0.69 -0.69 0.28 4.57 -0.68 -1.30 114.58 117.73 2ke0 h GLU 72 Ca 0.18 -0.04 -0.08 0.00 -1.18 0.00 0.00 59.36 58.24 2ke0 h GLU 72 Cb 0.17 -0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 28.58 2ke0 h GLU 72 CO -0.19 0.46 0.13 0.78 -1.18 0.00 0.00 179.01 179.01 2ke0 h GLY 73 N 0.71 1.21 0.90 1.92 0.00 -0.74 -3.10 103.07 103.97 2ke0 h GLY 73 Ca 0.19 -0.79 -0.02 0.00 0.00 0.00 0.00 47.33 46.71 2ke0 h GLY 73 CO -0.04 0.73 0.09 -2.08 0.00 0.00 0.00 176.54 175.25 2ke0 h VAL 74 N 1.06 1.19 0.00 4.60 2.07 -0.52 0.43 116.25 125.07 2ke0 h VAL 74 Ca 0.21 -0.59 -0.50 0.00 0.82 0.00 0.00 66.70 66.65 2ke0 h VAL 74 Cb 0.42 1.08 0.01 0.00 -1.52 0.00 0.00 31.29 31.28 2ke0 h VAL 74 CO 0.01 0.20 2.80 0.00 0.02 0.00 0.00 177.57 180.59 2ke0 n GLN 75 N -4.75 2.89 0.00 1.57 10.64 -0.52 -3.07 117.38 124.15 2ke0 n GLN 75 Ca -0.03 -1.75 0.00 0.00 -1.83 0.00 0.00 57.00 53.39 2ke0 n GLN 75 Cb 0.15 -2.55 0.00 0.00 -0.86 0.00 0.00 30.24 26.98 2ke0 n GLN 75 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2ke0 n GLY 76 N 3.46 0.25 3.77 2.61 0.00 -1.22 -4.96 105.19 109.10 2ke0 n GLY 76 Ca 0.62 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 46.26 2ke0 n GLY 76 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2ke0 s MET 77 N 0.00 4.11 0.22 1.61 0.00 0.14 -4.77 119.30 120.60 2ke0 s MET 77 Ca 0.00 1.72 0.04 0.00 0.00 0.00 0.00 55.69 57.45 2ke0 s MET 77 Cb 0.00 -2.65 -0.03 0.00 0.00 0.00 0.00 34.83 32.15 2ke0 s MET 77 CO 0.00 -0.24 0.34 0.15 0.00 0.00 0.00 175.02 175.27 2ke0 s LYS 78 N -2.33 3.44 0.08 4.11 1.02 -1.26 -1.61 119.74 123.19 2ke0 s LYS 78 Ca 0.57 -0.72 -0.31 0.00 0.02 0.00 0.00 55.97 55.52 2ke0 s LYS 78 Cb -0.28 -2.91 -0.11 0.00 -0.52 0.00 0.00 37.83 34.02 2ke0 s LYS 78 CO 0.35 0.45 1.86 0.28 -0.92 0.00 0.00 175.35 177.37 2ke0 n VAL 79 N -1.19 0.46 -0.62 3.17 0.31 0.50 -0.84 118.33 120.12 2ke0 n VAL 79 Ca -0.08 -0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.16 2ke0 n VAL 79 Cb 0.56 -2.10 0.00 0.00 -0.91 0.00 0.00 33.84 31.39 2ke0 n VAL 79 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2ke0 n GLY 80 N 4.28 0.81 3.87 2.92 0.00 0.75 -3.32 105.19 114.49 2ke0 n GLY 80 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 2ke0 n GLY 80 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ke0 s GLY 81 N -1.64 2.03 -0.08 -0.02 0.00 -0.02 -4.22 107.32 103.37 2ke0 s GLY 81 Ca 0.00 -0.11 0.03 0.00 0.00 0.00 0.00 44.72 44.64 2ke0 s GLY 81 CO 0.00 0.09 -0.16 0.14 0.00 0.00 0.00 173.10 173.17 2ke0 s VAL 82 N -2.33 1.44 -0.04 1.40 1.01 -0.19 -1.39 120.40 120.29 2ke0 s VAL 82 Ca 0.53 -0.65 0.02 0.00 0.00 0.00 0.00 61.98 61.87 2ke0 s VAL 82 Cb -0.10 -1.28 0.01 0.00 0.00 0.00 0.00 36.38 35.01 2ke0 s VAL 82 CO 0.29 0.42 -0.07 -0.60 0.00 0.00 0.00 175.10 175.14 2ke0 s ARG 83 N 0.60 1.00 -0.09 2.72 3.52 -0.46 0.01 118.95 126.24 2ke0 s ARG 83 Ca -0.15 -0.22 -0.26 0.00 -0.13 0.00 0.00 55.73 54.97 2ke0 s ARG 83 Cb -0.16 -0.93 -0.02 0.00 -1.56 0.00 0.00 34.95 32.27 2ke0 s ARG 83 CO 0.05 0.00 0.85 0.50 -0.81 0.00 0.00 175.30 175.89 2ke0 s ARG 84 N 0.62 4.42 -0.06 5.12 3.52 0.38 -1.50 118.95 131.45 2ke0 s ARG 84 Ca -0.09 1.13 0.03 0.00 -0.13 0.00 0.00 55.73 56.67 2ke0 s ARG 84 Cb -0.13 -3.50 -0.02 0.00 -1.56 0.00 0.00 34.95 29.74 2ke0 s ARG 84 CO 0.01 -0.14 -0.16 -0.51 -0.81 0.00 0.00 175.30 173.69 2ke0 s LEU 85 N 1.45 2.62 -0.23 -0.88 1.43 0.97 -0.36 118.68 123.69 2ke0 s LEU 85 Ca 0.43 -0.27 0.01 0.00 -1.03 0.00 0.00 54.13 53.27 2ke0 s LEU 85 Cb -0.18 -1.53 0.06 0.00 0.03 0.00 0.00 46.19 44.56 2ke0 s LEU 85 CO 0.19 0.30 -0.06 -0.89 0.23 0.00 0.00 176.35 176.11 2ke0 s THR 86 N -0.46 1.60 -0.20 5.49 2.01 0.22 0.06 115.64 124.36 2ke0 s THR 86 Ca 0.06 -1.23 -0.01 0.00 0.31 0.00 0.00 61.69 60.81 2ke0 s THR 86 Cb -0.12 -1.83 0.01 0.00 0.01 0.00 0.00 72.50 70.57 2ke0 s THR 86 CO 0.02 -0.06 -0.13 -0.63 -0.69 0.00 0.00 174.62 173.13 2ke0 s ILE 87 N 1.37 2.61 0.98 1.82 1.01 -0.49 -1.60 121.20 126.89 2ke0 s ILE 87 Ca -0.06 -0.82 -0.12 0.00 0.00 0.00 0.00 60.65 59.65 2ke0 s ILE 87 Cb -0.19 -2.17 0.18 0.00 0.01 0.00 0.00 42.46 40.29 2ke0 s ILE 87 CO -0.06 0.44 1.09 -2.16 0.00 0.00 0.00 174.94 174.25 2ke0 s PRO 88 N 1.35 0.56 0.42 2.79 0.04 -1.26 -1.41 135.00 137.49 2ke0 s PRO 88 Ca 0.04 0.57 0.21 0.00 0.04 0.00 0.00 61.00 61.86 2ke0 s PRO 88 Cb -0.14 -1.75 0.89 0.00 0.04 0.00 0.00 34.50 33.55 2ke0 s PRO 88 CO -0.08 -2.66 1.84 -1.00 0.04 0.00 0.00 177.00 175.14 2ke0 h PRO 89 N -1.84 0.00 -0.01 0.56 0.13 -1.93 0.12 132.00 129.03 2ke0 h PRO 89 Ca -0.54 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.43 2ke0 h PRO 89 Cb 1.32 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.44 2ke0 h PRO 89 CO 0.57 0.29 -0.75 -0.56 -0.23 0.00 0.00 178.00 177.33 2ke0 h GLN 90 N 0.00 0.11 -0.14 0.86 3.07 -1.92 -1.59 115.11 115.50 2ke0 h GLN 90 Ca -0.00 -0.10 -0.00 0.00 0.09 0.00 0.00 58.65 58.63 2ke0 h GLN 90 Cb 0.71 0.03 -0.00 0.00 0.08 0.00 0.00 27.48 28.30 2ke0 h GLN 90 CO 0.04 0.81 -0.01 -0.11 0.09 0.00 0.00 178.83 179.65 2ke0 n LEU 91 N -3.71 3.19 0.00 0.06 7.94 -1.10 -4.81 117.00 118.56 2ke0 n LEU 91 Ca -0.02 -3.08 0.00 0.00 -1.11 0.00 0.00 56.01 51.80 2ke0 n LEU 91 Cb 0.72 -0.50 0.00 0.00 0.53 0.00 0.00 43.42 44.17 2ke0 n LEU 91 CO 0.45 0.71 0.00 0.61 -1.11 0.00 0.00 177.39 178.05 2ke0 n GLY 92 N -0.95 2.96 0.38 -3.96 0.00 0.40 -4.76 105.19 99.27 2ke0 n GLY 92 Ca 0.19 -0.24 0.15 0.00 0.00 0.00 0.00 46.02 46.12 2ke0 n GLY 92 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2ke0 h TYR 93 N 0.00 0.74 0.00 1.61 -1.99 -1.77 -3.48 116.97 112.07 2ke0 h TYR 93 Ca 0.00 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.75 2ke0 h TYR 93 Cb 0.00 -0.23 0.00 0.00 2.00 0.00 0.00 36.73 38.50 2ke0 h TYR 93 CO 0.00 0.23 0.00 0.41 -0.00 0.00 0.00 178.16 178.80 2ke0 n GLY 94 N -1.45 -1.76 0.20 3.88 0.00 -0.60 -4.33 105.19 101.13 2ke0 n GLY 94 Ca 0.19 -2.00 0.08 0.00 0.00 0.00 0.00 46.02 44.28 2ke0 n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ke0 h ALA 95 N 0.00 0.97 0.17 4.61 0.00 -1.93 -3.24 119.26 119.84 2ke0 h ALA 95 Ca 0.00 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 2ke0 h ALA 95 Cb 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2ke0 h ALA 95 CO 0.00 0.38 -0.09 0.00 0.00 0.00 0.00 179.25 179.54 2ke0 h ARG 96 N 0.00 -0.23 -1.80 0.00 3.08 -1.96 -3.40 114.38 110.07 2ke0 h ARG 96 Ca -0.00 0.02 0.19 0.00 0.07 0.00 0.00 59.98 60.25 2ke0 h ARG 96 Cb 0.88 0.05 -0.09 0.00 0.08 0.00 0.00 29.97 30.89 2ke0 h ARG 96 CO 0.04 -0.15 -0.60 0.41 -1.07 0.00 0.00 179.97 178.60 2ke0 n GLY 97 N -1.20 -2.78 0.33 0.04 0.00 -1.22 -4.75 105.19 95.61 2ke0 n GLY 97 Ca -0.09 -1.26 -0.03 0.00 0.00 0.00 0.00 46.02 44.65 2ke0 n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ke0 n ALA 98 N -3.12 -0.26 0.04 4.61 0.00 0.79 -4.87 120.51 117.71 2ke0 n ALA 98 Ca -0.04 -0.15 0.21 0.00 0.00 0.00 0.00 53.44 53.46 2ke0 n ALA 98 Cb 0.36 -0.01 0.73 0.00 0.00 0.00 0.00 19.45 20.53 2ke0 n ALA 98 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2ke0 h GLY 99 N -0.53 0.00 0.00 0.00 0.00 -1.93 -3.43 103.07 97.19 2ke0 h GLY 99 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.29 2ke0 h GLY 99 CO 0.03 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.18 2ke0 n GLY 100 N -1.55 0.24 0.20 4.60 0.00 -1.26 -4.98 105.19 102.43 2ke0 n GLY 100 Ca 0.09 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.15 2ke0 n GLY 100 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2ke0 h VAL 101 N 0.00 1.16 -2.50 1.61 2.07 -1.99 -3.31 116.25 113.29 2ke0 h VAL 101 Ca 0.00 -1.19 -0.60 0.00 0.82 0.00 0.00 66.70 65.73 2ke0 h VAL 101 Cb 0.00 1.65 -0.42 0.00 -1.52 0.00 0.00 31.29 31.01 2ke0 h VAL 101 CO 0.00 0.33 -0.64 -0.38 0.02 0.00 0.00 177.57 176.90 2ke0 n ILE 102 N -4.02 1.70 -1.18 4.57 5.41 -1.26 -5.01 119.36 119.57 2ke0 n ILE 102 Ca -0.02 -4.92 -0.29 0.00 1.00 0.00 0.00 62.75 58.52 2ke0 n ILE 102 Cb 0.39 -2.10 0.16 0.00 -0.71 0.00 0.00 39.64 37.38 2ke0 n ILE 102 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 2ke0 s PRO 103 N -1.90 0.69 0.75 0.38 0.04 -1.25 -0.15 135.00 133.56 2ke0 s PRO 103 Ca 0.34 0.62 -0.12 0.00 0.04 0.00 0.00 61.00 61.88 2ke0 s PRO 103 Cb 0.08 -1.76 0.04 0.00 0.04 0.00 0.00 34.50 32.90 2ke0 s PRO 103 CO -0.08 -2.58 1.10 -1.25 0.04 0.00 0.00 177.00 174.23 2ke0 s PRO 104 N -4.95 2.38 -1.64 0.56 0.04 -1.26 -3.52 135.00 126.61 2ke0 s PRO 104 Ca 0.65 1.22 0.00 0.00 0.04 0.00 0.00 61.00 62.91 2ke0 s PRO 104 Cb -0.18 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.45 2ke0 s PRO 104 CO 0.57 -1.55 0.00 0.09 0.04 0.00 0.00 177.00 176.15 2ke0 n ASN 105 N -3.26 -5.17 -3.87 6.66 3.02 -1.26 -4.98 115.26 106.40 2ke0 n ASN 105 Ca 0.09 0.13 -0.28 0.00 -0.03 0.00 0.00 54.58 54.49 2ke0 n ASN 105 Cb 0.53 -4.25 -0.16 0.00 -0.61 0.00 0.00 39.78 35.29 2ke0 n ASN 105 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ke0 s ALA 106 N -2.81 1.49 0.40 5.41 0.00 -1.23 -4.94 121.76 120.07 2ke0 s ALA 106 Ca 0.00 -0.90 -0.25 0.00 0.00 0.00 0.00 51.96 50.81 2ke0 s ALA 106 Cb 0.00 -1.19 -0.08 0.00 0.00 0.00 0.00 23.12 21.85 2ke0 s ALA 106 CO 0.00 -0.92 1.16 0.99 0.00 0.00 0.00 175.76 176.99 2ke0 s THR 107 N 1.63 3.19 -0.02 0.00 2.01 -1.26 -4.02 115.64 117.17 2ke0 s THR 107 Ca -0.01 1.00 0.07 0.00 0.31 0.00 0.00 61.69 63.06 2ke0 s THR 107 Cb -0.16 -3.56 -0.02 0.00 0.01 0.00 0.00 72.50 68.77 2ke0 s THR 107 CO -0.07 0.09 -0.23 -1.48 -0.69 0.00 0.00 174.62 172.23 2ke0 s LEU 108 N -2.48 2.04 -0.20 4.42 0.05 -0.50 -4.17 118.68 117.84 2ke0 s LEU 108 Ca 0.57 -0.42 -0.06 0.00 0.05 0.00 0.00 54.13 54.27 2ke0 s LEU 108 Cb -0.30 -1.19 -0.03 0.00 -2.05 0.00 0.00 46.19 42.61 2ke0 s LEU 108 CO 0.38 0.28 0.03 -0.69 -0.55 0.00 0.00 176.35 175.80 2ke0 s VAL 109 N -0.51 4.28 -0.12 1.48 1.01 -0.64 -1.40 120.40 124.50 2ke0 s VAL 109 Ca 0.08 -0.20 0.00 0.00 0.00 0.00 0.00 61.98 61.86 2ke0 s VAL 109 Cb -0.09 -2.94 -0.02 0.00 0.00 0.00 0.00 36.38 33.33 2ke0 s VAL 109 CO -0.01 0.42 -0.13 -0.36 0.00 0.00 0.00 175.10 175.02 2ke0 s PHE 110 N 0.92 2.80 -0.33 5.22 0.08 0.11 0.19 117.98 126.96 2ke0 s PHE 110 Ca 0.02 -0.54 -0.12 0.00 0.12 0.00 0.00 56.93 56.41 2ke0 s PHE 110 Cb -0.14 -1.81 -0.02 0.00 -0.57 0.00 0.00 43.02 40.49 2ke0 s PHE 110 CO 0.02 -0.13 0.23 -2.00 -0.10 0.00 0.00 175.22 173.24 2ke0 s GLU 111 N 0.14 3.50 -0.15 0.44 2.12 0.85 -0.02 118.70 125.58 2ke0 s GLU 111 Ca -0.07 -0.64 -0.17 0.00 0.36 0.00 0.00 54.97 54.46 2ke0 s GLU 111 Cb -0.15 -3.77 -0.04 0.00 0.26 0.00 0.00 34.13 30.43 2ke0 s GLU 111 CO 0.05 -0.43 0.43 0.08 -0.54 0.00 0.00 175.26 174.85 2ke0 s VAL 112 N 1.71 5.20 -0.29 3.70 1.01 -0.56 -0.94 120.40 130.23 2ke0 s VAL 112 Ca 0.06 0.83 0.00 0.00 0.00 0.00 0.00 61.98 62.87 2ke0 s VAL 112 Cb -0.17 -3.77 0.09 0.00 0.00 0.00 0.00 36.38 32.53 2ke0 s VAL 112 CO 0.10 0.30 0.06 -0.70 0.00 0.00 0.00 175.10 174.86 2ke0 s GLU 113 N 0.86 1.02 0.21 2.72 2.12 0.13 -1.35 118.70 124.40 2ke0 s GLU 113 Ca 0.23 -1.16 -0.31 0.00 0.36 0.00 0.00 54.97 54.09 2ke0 s GLU 113 Cb -0.15 -2.35 -0.11 0.00 0.26 0.00 0.00 34.13 31.79 2ke0 s GLU 113 CO 0.09 -0.88 1.62 -1.17 -0.54 0.00 0.00 175.26 174.38 2ke0 s LEU 114 N 1.46 4.37 -0.22 2.70 1.98 -0.49 -0.74 118.68 127.74 2ke0 s LEU 114 Ca 0.06 2.76 -0.16 0.00 -2.89 0.00 0.00 54.13 53.91 2ke0 s LEU 114 Cb -0.18 -3.60 -0.09 0.00 0.66 0.00 0.00 46.19 42.98 2ke0 s LEU 114 CO -0.17 -0.88 -0.34 0.18 -1.89 0.00 0.00 176.35 173.24 2ke0 n LEU 115 N 3.58 1.91 -3.61 -0.68 4.77 0.10 -0.18 117.00 122.89 2ke0 n LEU 115 Ca 0.13 0.33 -0.04 0.00 -0.03 0.00 0.00 56.01 56.40 2ke0 n LEU 115 Cb 0.37 -0.76 -0.01 0.00 -2.33 0.00 0.00 43.42 40.69 2ke0 n LEU 115 CO 0.63 0.11 0.88 -0.62 -1.33 0.00 0.00 177.39 177.05 2ke0 s ASP 116 N -6.61 -0.18 0.00 -1.43 2.15 -1.20 -4.27 116.67 105.12 2ke0 s ASP 116 Ca -0.33 -0.12 0.11 0.00 0.43 0.00 0.00 52.55 52.65 2ke0 s ASP 116 Cb 0.09 0.28 0.09 0.00 -0.30 0.00 0.00 42.92 43.07 2ke0 s ASP 116 CO 0.44 -0.49 0.85 1.33 -0.17 0.00 0.00 175.17 177.14