#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ke0 s PRO 2 N 0.00 1.25 0.00 1.61 0.04 -1.26 -5.06 135.00 131.59 2ke0 s PRO 2 Ca 0.00 0.82 0.00 0.00 0.04 0.00 0.00 61.00 61.86 2ke0 s PRO 2 Cb 0.00 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.73 2ke0 s PRO 2 CO 0.00 -2.24 0.00 0.41 0.04 0.00 0.00 177.00 175.21 2ke0 n GLY 3 N -1.13 4.48 3.79 0.56 0.00 -1.26 -5.14 105.19 106.49 2ke0 n GLY 3 Ca 0.07 -0.48 -0.38 0.00 0.00 0.00 0.00 46.02 45.23 2ke0 n GLY 3 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ke0 s SER 4 N 1.42 6.84 -0.03 1.61 1.04 -1.26 -5.07 113.70 118.26 2ke0 s SER 4 Ca 0.00 1.00 -0.28 0.00 0.48 0.00 0.00 55.95 57.15 2ke0 s SER 4 Cb 0.00 -2.30 0.06 0.00 0.10 0.00 0.00 66.02 63.88 2ke0 s SER 4 CO 0.00 0.19 0.62 0.00 0.98 0.00 0.00 173.24 175.03 2ke0 s MET 5 N -0.44 1.03 0.03 4.02 0.23 -1.26 -5.17 119.30 117.74 2ke0 s MET 5 Ca 0.26 0.13 0.05 0.00 -1.03 0.00 0.00 55.69 55.11 2ke0 s MET 5 Cb -0.17 0.48 -0.02 0.00 -1.53 0.00 0.00 34.83 33.59 2ke0 s MET 5 CO 0.14 -0.33 -0.16 -0.08 -2.03 0.00 0.00 175.02 172.56 2ke0 s THR 6 N -1.47 1.27 -0.21 3.16 -1.32 -1.26 -5.13 115.64 110.68 2ke0 s THR 6 Ca -0.10 -0.95 -0.05 0.00 -1.21 0.00 0.00 61.69 59.38 2ke0 s THR 6 Cb -0.01 -1.11 -0.02 0.00 -1.51 0.00 0.00 72.50 69.85 2ke0 s THR 6 CO 0.07 0.14 -0.01 -0.69 -2.21 0.00 0.00 174.62 171.92 2ke0 s VAL 7 N -0.71 3.77 0.18 5.08 1.01 -1.26 -4.91 120.40 123.57 2ke0 s VAL 7 Ca 0.04 -0.37 -0.11 0.00 0.00 0.00 0.00 61.98 61.54 2ke0 s VAL 7 Cb -0.08 -2.71 -0.07 0.00 0.00 0.00 0.00 36.38 33.53 2ke0 s VAL 7 CO 0.01 0.43 0.53 0.54 0.00 0.00 0.00 175.10 176.60 2ke0 s VAL 8 N 1.14 4.93 -0.10 2.92 0.11 -1.21 -4.99 120.40 123.20 2ke0 s VAL 8 Ca 0.02 0.57 -0.01 0.00 -2.93 0.00 0.00 61.98 59.63 2ke0 s VAL 8 Cb -0.14 -3.66 0.03 0.00 -1.53 0.00 0.00 36.38 31.08 2ke0 s VAL 8 CO 0.01 0.07 -0.01 0.28 -3.33 0.00 0.00 175.10 172.12 2ke0 s THR 9 N -1.65 0.55 1.10 5.04 -1.32 -1.26 -2.56 115.64 115.54 2ke0 s THR 9 Ca 0.42 -0.09 -0.12 0.00 -1.21 0.00 0.00 61.69 60.69 2ke0 s THR 9 Cb -0.13 -0.74 0.25 0.00 -1.51 0.00 0.00 72.50 70.37 2ke0 s THR 9 CO 0.20 0.21 1.05 0.42 -2.21 0.00 0.00 174.62 174.29 2ke0 s THR 10 N 1.89 2.07 0.17 5.08 -4.23 -0.51 -4.86 115.64 115.25 2ke0 s THR 10 Ca 0.04 0.02 0.33 0.00 -1.18 0.00 0.00 61.69 60.90 2ke0 s THR 10 Cb -0.13 -2.22 0.34 0.00 1.34 0.00 0.00 72.50 71.82 2ke0 s THR 10 CO -0.06 -0.03 2.00 -0.33 -0.54 0.00 0.00 174.62 175.66 2ke0 h GLU 11 N -2.35 0.00 0.13 3.99 5.08 -2.01 -2.32 114.58 117.10 2ke0 h GLU 11 Ca -0.58 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 57.56 2ke0 h GLU 11 Cb 1.33 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.59 2ke0 h GLU 11 CO 0.52 0.00 -1.02 0.77 -1.00 0.00 0.00 179.01 178.28 2ke0 h SER 12 N 0.00 0.44 0.00 1.42 0.02 -2.05 -3.49 113.55 109.89 2ke0 h SER 12 Ca 0.00 -0.91 0.00 0.00 -0.84 0.00 0.00 61.79 60.04 2ke0 h SER 12 Cb 0.09 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.49 2ke0 h SER 12 CO 0.00 1.47 0.00 0.61 -1.14 0.00 0.00 176.83 177.77 2ke0 n GLY 13 N 1.69 3.74 3.44 -3.77 0.00 -0.87 -5.09 105.19 104.32 2ke0 n GLY 13 Ca -0.18 -0.55 -0.35 0.00 0.00 0.00 0.00 46.02 44.94 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 0.41 -4.08 0.99 -0.00 -1.26 -4.52 117.00 108.53 2ke0 n LEU 14 Ca 0.00 0.50 -0.15 0.00 -0.00 0.00 0.00 56.01 56.37 2ke0 n LEU 14 Cb 0.00 -1.21 -0.12 0.00 -0.00 0.00 0.00 43.42 42.09 2ke0 n LEU 14 CO 0.00 -3.32 -0.42 -0.54 -0.00 0.00 0.00 177.39 173.12 2ke0 s LYS 15 N -3.02 0.61 0.19 1.47 1.02 -0.72 -1.43 119.74 117.86 2ke0 s LYS 15 Ca 0.62 -0.75 -0.10 0.00 0.02 0.00 0.00 55.97 55.76 2ke0 s LYS 15 Cb -0.30 -0.45 -0.01 0.00 -0.52 0.00 0.00 37.83 36.55 2ke0 s LYS 15 CO 0.61 0.09 0.34 1.52 -0.92 0.00 0.00 175.35 177.00 2ke0 s TYR 16 N -1.23 0.38 -0.09 3.18 -0.85 -1.06 0.76 117.35 118.44 2ke0 s TYR 16 Ca -0.07 -0.73 -0.04 0.00 -0.52 0.00 0.00 57.07 55.72 2ke0 s TYR 16 Cb -0.09 0.01 0.05 0.00 0.38 0.00 0.00 41.96 42.31 2ke0 s TYR 16 CO 0.01 -0.79 0.19 -2.00 -1.52 0.00 0.00 175.55 171.44 2ke0 s GLU 17 N -3.98 0.09 0.29 -3.49 2.12 0.86 -3.30 118.70 111.29 2ke0 s GLU 17 Ca 0.19 0.57 -0.30 0.00 0.36 0.00 0.00 54.97 55.79 2ke0 s GLU 17 Cb 0.02 -0.18 -0.13 0.00 0.26 0.00 0.00 34.13 34.10 2ke0 s GLU 17 CO 0.02 -0.26 1.41 -0.40 -0.54 0.00 0.00 175.26 175.49 2ke0 n ASP 18 N 5.00 3.04 -0.01 -1.70 5.75 -1.26 -1.14 116.55 126.23 2ke0 n ASP 18 Ca -0.11 1.17 -0.02 0.00 -0.01 0.00 0.00 54.79 55.81 2ke0 n ASP 18 Cb 0.50 -1.49 -0.01 0.00 -1.03 0.00 0.00 41.12 39.10 2ke0 n ASP 18 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2ke0 n LEU 19 N 1.60 0.80 -4.11 -2.12 4.77 0.01 -4.81 117.00 113.14 2ke0 n LEU 19 Ca 0.08 0.12 -0.18 0.00 -0.03 0.00 0.00 56.01 56.01 2ke0 n LEU 19 Cb 0.34 -0.39 -0.13 0.00 -2.33 0.00 0.00 43.42 40.92 2ke0 n LEU 19 CO 0.63 -0.52 -0.44 -0.89 -1.33 0.00 0.00 177.39 174.84 2ke0 s THR 20 N -1.76 0.91 -0.14 -5.08 2.01 0.91 -4.89 115.64 107.60 2ke0 s THR 20 Ca -0.07 -1.00 -0.08 0.00 0.31 0.00 0.00 61.69 60.85 2ke0 s THR 20 Cb 0.01 -0.86 -0.04 0.00 0.01 0.00 0.00 72.50 71.62 2ke0 s THR 20 CO 0.11 -0.12 0.15 -1.83 -0.69 0.00 0.00 174.62 172.23 2ke0 s GLU 21 N -1.25 3.63 0.51 4.92 1.03 -1.26 -0.22 118.70 126.05 2ke0 s GLU 21 Ca -0.02 -0.13 -0.06 0.00 0.03 0.00 0.00 54.97 54.79 2ke0 s GLU 21 Cb -0.08 -3.24 -0.04 0.00 -0.80 0.00 0.00 34.13 29.97 2ke0 s GLU 21 CO 0.01 0.67 0.84 0.20 -1.33 0.00 0.00 175.26 175.64 2ke0 s GLY 22 N -0.71 1.53 -0.02 -3.83 0.00 -1.26 -4.58 107.32 98.46 2ke0 s GLY 22 Ca 0.14 -0.42 0.05 0.00 0.00 0.00 0.00 44.72 44.49 2ke0 s GLY 22 CO 0.03 -0.23 0.08 -1.26 0.00 0.00 0.00 173.10 171.71 2ke0 n SER 23 N -2.35 3.78 0.00 1.64 2.88 -1.17 -4.87 113.62 113.53 2ke0 n SER 23 Ca 0.02 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.56 2ke0 n SER 23 Cb 0.55 0.99 0.00 0.00 -0.75 0.00 0.00 64.21 64.99 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 2.40 -1.76 3.10 0.46 0.00 -1.25 -4.99 105.19 103.15 2ke0 n GLY 24 Ca -0.04 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.17 0.67 -0.07 4.61 0.00 -1.26 -4.89 121.76 118.66 2ke0 s ALA 25 Ca 0.00 -1.02 -0.17 0.00 0.00 0.00 0.00 51.96 50.77 2ke0 s ALA 25 Cb 0.00 0.12 -0.05 0.00 0.00 0.00 0.00 23.12 23.20 2ke0 s ALA 25 CO 0.00 -0.16 0.45 -2.00 0.00 0.00 0.00 175.76 174.06 2ke0 s GLU 26 N -2.70 4.19 0.29 0.00 2.12 -1.26 -1.00 118.70 120.35 2ke0 s GLU 26 Ca -0.00 0.44 -0.30 0.00 0.36 0.00 0.00 54.97 55.47 2ke0 s GLU 26 Cb -0.02 -3.35 -0.12 0.00 0.26 0.00 0.00 34.13 30.90 2ke0 s GLU 26 CO -0.03 0.37 1.50 0.00 -0.54 0.00 0.00 175.26 176.56 2ke0 n ALA 27 N 2.92 1.96 -2.40 6.30 0.00 -0.55 -4.98 120.51 123.77 2ke0 n ALA 27 Ca -0.10 0.38 -0.28 0.00 0.00 0.00 0.00 53.44 53.44 2ke0 n ALA 27 Cb 0.52 -2.38 -0.15 0.00 0.00 0.00 0.00 19.45 17.43 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 -0.73 1.75 0.14 0.00 1.81 -1.26 -4.07 118.95 116.59 2ke0 s ARG 28 Ca 0.64 -0.84 -0.35 0.00 -1.72 0.00 0.00 55.73 53.46 2ke0 s ARG 28 Cb -0.55 -1.73 -0.15 0.00 -0.45 0.00 0.00 34.95 32.07 2ke0 s ARG 28 CO 0.51 0.47 1.45 0.00 -0.68 0.00 0.00 175.30 177.06 2ke0 n ALA 29 N 2.39 0.35 0.00 2.13 0.00 -1.26 -1.25 120.51 122.87 2ke0 n ALA 29 Ca -0.16 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.75 2ke0 n ALA 29 Cb 0.52 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.75 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 2.90 0.94 3.84 0.00 0.00 0.15 -4.93 105.19 108.09 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 -0.98 3.64 -0.80 1.61 0.74 -0.38 -4.80 119.66 118.69 2ke0 s GLN 31 Ca 0.00 -0.13 -0.24 0.00 0.05 0.00 0.00 55.36 55.05 2ke0 s GLN 31 Cb 0.00 -3.25 0.06 0.00 1.10 0.00 0.00 33.01 30.92 2ke0 s GLN 31 CO 0.00 0.66 1.20 0.99 -0.55 0.00 0.00 175.29 177.58 2ke0 s THR 32 N -0.69 4.08 0.20 -0.34 2.01 -1.26 -1.54 115.64 118.10 2ke0 s THR 32 Ca 0.14 -0.33 0.05 0.00 0.31 0.00 0.00 61.69 61.85 2ke0 s THR 32 Cb -0.12 -4.86 -0.03 0.00 0.01 0.00 0.00 72.50 67.50 2ke0 s THR 32 CO 0.03 -1.71 0.26 0.68 -0.69 0.00 0.00 174.62 173.20 2ke0 s VAL 33 N 4.66 4.99 -0.25 3.82 -7.23 -0.97 -4.81 120.40 120.61 2ke0 s VAL 33 Ca 0.33 -0.98 -0.05 0.00 -1.81 0.00 0.00 61.98 59.47 2ke0 s VAL 33 Cb -0.09 -3.63 -0.00 0.00 0.56 0.00 0.00 36.38 33.22 2ke0 s VAL 33 CO 0.05 -0.21 0.01 -0.44 -0.31 0.00 0.00 175.10 174.20 2ke0 s SER 34 N -3.53 4.69 0.17 4.85 0.01 -0.22 -1.48 113.70 118.18 2ke0 s SER 34 Ca 0.33 -0.50 0.10 0.00 1.31 0.00 0.00 55.95 57.19 2ke0 s SER 34 Cb -0.10 -1.80 -0.04 0.00 0.21 0.00 0.00 66.02 64.29 2ke0 s SER 34 CO 0.27 -0.08 -0.21 0.68 0.41 0.00 0.00 173.24 174.31 2ke0 s VAL 35 N 1.49 2.04 -0.11 3.43 -7.23 -0.51 -1.40 120.40 118.11 2ke0 s VAL 35 Ca 0.04 -1.94 -0.00 0.00 -1.81 0.00 0.00 61.98 58.27 2ke0 s VAL 35 Cb -0.15 -1.94 -0.02 0.00 0.56 0.00 0.00 36.38 34.82 2ke0 s VAL 35 CO -0.01 -0.21 -0.10 -1.00 -0.31 0.00 0.00 175.10 173.48 2ke0 s HIS 36 N -1.81 2.88 -0.14 2.82 3.76 -0.07 -0.01 115.29 122.71 2ke0 s HIS 36 Ca 0.17 -0.35 -0.02 0.00 -0.15 0.00 0.00 55.06 54.72 2ke0 s HIS 36 Cb -0.07 -1.82 -0.02 0.00 1.11 0.00 0.00 32.58 31.78 2ke0 s HIS 36 CO 0.08 0.00 -0.08 1.52 -0.85 0.00 0.00 174.74 175.41 2ke0 s TYR 37 N -0.04 2.92 -0.31 1.40 1.13 -1.24 -1.27 117.35 119.94 2ke0 s TYR 37 Ca -0.01 -0.45 0.03 0.00 -1.41 0.00 0.00 57.07 55.23 2ke0 s TYR 37 Cb -0.14 -1.90 0.09 0.00 -1.10 0.00 0.00 41.96 38.91 2ke0 s TYR 37 CO 0.03 -0.11 0.00 0.99 -2.51 0.00 0.00 175.55 173.96 2ke0 s THR 38 N 0.33 2.15 0.39 -3.49 2.01 -0.15 -3.64 115.64 113.24 2ke0 s THR 38 Ca -0.07 -2.05 -0.24 0.00 0.31 0.00 0.00 61.69 59.64 2ke0 s THR 38 Cb -0.15 -2.48 -0.09 0.00 0.01 0.00 0.00 72.50 69.79 2ke0 s THR 38 CO 0.04 -0.42 1.05 -0.83 -0.69 0.00 0.00 174.62 173.78 2ke0 s GLY 39 N 1.02 2.76 -0.12 4.40 0.00 0.87 -0.30 107.32 115.94 2ke0 s GLY 39 Ca 0.04 0.71 -0.08 0.00 0.00 0.00 0.00 44.72 45.39 2ke0 s GLY 39 CO -0.08 1.15 0.29 -0.98 0.00 0.00 0.00 173.10 173.48 2ke0 s TRP 40 N -1.63 -0.36 1.13 1.90 0.51 0.13 -3.63 118.94 116.99 2ke0 s TRP 40 Ca 0.57 0.85 -0.17 0.00 -2.12 0.00 0.00 56.10 55.23 2ke0 s TRP 40 Cb -0.22 0.11 0.25 0.00 -0.81 0.00 0.00 33.47 32.80 2ke0 s TRP 40 CO 0.28 -0.21 1.12 -0.51 -0.51 0.00 0.00 176.95 177.13 2ke0 s LEU 41 N 0.70 1.10 0.58 2.99 1.43 0.91 -1.54 118.68 124.85 2ke0 s LEU 41 Ca -0.04 0.73 0.30 0.00 -1.03 0.00 0.00 54.13 54.09 2ke0 s LEU 41 Cb -0.06 -2.61 1.80 0.00 0.03 0.00 0.00 46.19 45.35 2ke0 s LEU 41 CO -0.04 -3.74 2.23 0.71 0.23 0.00 0.00 176.35 175.74 2ke0 h THR 42 N -2.31 0.50 0.00 5.49 1.35 -1.90 -0.81 112.91 115.22 2ke0 h THR 42 Ca -0.47 -0.09 -0.01 0.00 -0.55 0.00 0.00 66.41 65.29 2ke0 h THR 42 Cb 1.30 1.06 -0.00 0.00 -1.73 0.00 0.00 68.15 68.78 2ke0 h THR 42 CO 0.41 0.02 -1.21 0.47 -0.25 0.00 0.00 175.52 174.95 2ke0 n ASP 43 N -3.77 0.69 0.00 5.36 8.00 -1.26 -4.96 116.55 120.61 2ke0 n ASP 43 Ca -0.03 0.27 0.00 0.00 0.71 0.00 0.00 54.79 55.74 2ke0 n ASP 43 Cb 0.11 0.72 0.00 0.00 -0.02 0.00 0.00 41.12 41.93 2ke0 n ASP 43 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ke0 n GLY 44 N 1.21 1.17 3.71 0.44 0.00 -0.31 -5.09 105.19 106.32 2ke0 n GLY 44 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 2ke0 n GLY 44 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2ke0 s GLN 45 N -0.27 4.35 -0.56 1.61 0.74 -1.26 -4.58 119.66 119.69 2ke0 s GLN 45 Ca 0.00 1.94 -0.28 0.00 0.05 0.00 0.00 55.36 57.07 2ke0 s GLN 45 Cb 0.00 -3.36 0.03 0.00 1.10 0.00 0.00 33.01 30.78 2ke0 s GLN 45 CO 0.00 -0.41 1.15 0.21 -0.55 0.00 0.00 175.29 175.69 2ke0 s LYS 46 N 1.41 3.52 -0.07 1.67 2.20 -1.26 -0.07 119.74 127.15 2ke0 s LYS 46 Ca 0.62 0.23 0.18 0.00 -0.36 0.00 0.00 55.97 56.65 2ke0 s LYS 46 Cb -0.33 -4.00 -0.27 0.00 -1.51 0.00 0.00 37.83 31.72 2ke0 s LYS 46 CO 0.29 -1.61 0.32 1.97 -0.36 0.00 0.00 175.35 175.96 2ke0 n PHE 47 N 8.22 0.00 -4.06 4.03 1.16 -1.24 -4.94 117.46 120.63 2ke0 n PHE 47 Ca 0.08 0.00 -0.19 0.00 -1.87 0.00 0.00 57.45 55.47 2ke0 n PHE 47 Cb 0.49 -0.56 -0.16 0.00 -1.61 0.00 0.00 39.48 37.64 2ke0 n PHE 47 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 2ke0 s ASP 48 N -4.47 0.82 -0.29 5.98 1.01 -1.25 -5.02 116.67 113.44 2ke0 s ASP 48 Ca -0.07 -0.09 0.04 0.00 0.71 0.00 0.00 52.55 53.13 2ke0 s ASP 48 Cb 0.10 -0.37 0.19 0.00 1.01 0.00 0.00 42.92 43.85 2ke0 s ASP 48 CO 0.77 -0.08 0.55 -0.94 0.21 0.00 0.00 175.17 175.69 2ke0 s SER 49 N 1.02 -1.19 0.30 0.27 1.04 -1.26 -0.09 113.70 113.79 2ke0 s SER 49 Ca -0.10 0.24 0.09 0.00 0.48 0.00 0.00 55.95 56.67 2ke0 s SER 49 Cb -0.14 1.88 0.47 0.00 0.10 0.00 0.00 66.02 68.33 2ke0 s SER 49 CO -0.01 -0.30 1.69 -1.28 0.98 0.00 0.00 173.24 174.32 2ke0 h SER 50 N 8.03 0.10 -0.00 7.02 0.87 -1.85 -2.77 113.55 124.96 2ke0 h SER 50 Ca -0.07 -0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.44 2ke0 h SER 50 Cb 1.17 -0.03 -0.00 0.00 -0.44 0.00 0.00 62.40 63.10 2ke0 h SER 50 CO 0.20 0.58 0.00 0.07 -0.53 0.00 0.00 176.83 177.15 2ke0 h LYS 51 N 0.08 0.00 -0.19 2.24 5.09 -1.83 -0.88 116.57 121.07 2ke0 h LYS 51 Ca 0.00 0.00 0.05 0.00 0.09 0.00 0.00 60.65 60.80 2ke0 h LYS 51 Cb 0.90 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 33.22 2ke0 h LYS 51 CO 0.07 0.00 0.23 0.22 -2.09 0.00 0.00 179.45 177.88 2ke0 h ASP 52 N 0.00 0.00 0.00 7.07 3.58 -1.89 -0.97 116.42 124.21 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 0.01 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.06 2ke0 h ASP 52 CO -0.00 0.00 -0.11 -1.14 -2.88 0.00 0.00 179.24 175.11 2ke0 n ARG 53 N -3.71 1.19 -3.79 0.28 3.00 -0.46 -4.99 116.66 108.19 2ke0 n ARG 53 Ca 0.02 -1.96 -0.26 0.00 -0.00 0.00 0.00 57.85 55.64 2ke0 n ARG 53 Cb 0.35 -1.15 0.04 0.00 0.00 0.00 0.00 32.46 31.70 2ke0 n ARG 53 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 2ke0 n ASN 54 N -0.91 -3.88 -3.91 6.15 3.02 -0.37 -4.93 115.26 110.43 2ke0 n ASN 54 Ca 0.09 -0.75 -0.34 0.00 -0.03 0.00 0.00 54.58 53.56 2ke0 n ASN 54 Cb 0.59 -4.16 -0.07 0.00 -0.61 0.00 0.00 39.78 35.53 2ke0 n ASN 54 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2ke0 n ASP 55 N -2.94 4.19 -4.73 6.41 9.92 -0.48 -4.99 116.55 123.94 2ke0 n ASP 55 Ca -0.08 -3.25 -0.42 0.00 -0.53 0.00 0.00 54.79 50.52 2ke0 n ASP 55 Cb 0.58 -0.95 -0.03 0.00 -0.64 0.00 0.00 41.12 40.08 2ke0 n ASP 55 CO 0.00 0.00 0.00 -2.16 0.13 0.00 0.00 177.20 175.17 2ke0 s PRO 56 N -1.82 4.37 -0.69 -0.24 0.04 -1.26 -4.58 135.00 130.82 2ke0 s PRO 56 Ca 0.30 2.04 -0.27 0.00 0.04 0.00 0.00 61.00 63.12 2ke0 s PRO 56 Cb -0.00 -3.23 0.00 0.00 0.04 0.00 0.00 34.50 31.31 2ke0 s PRO 56 CO -0.08 -0.32 1.60 0.12 0.04 0.00 0.00 177.00 178.36 2ke0 s PHE 57 N 0.55 1.96 -0.20 0.56 2.19 0.99 -4.79 117.98 119.23 2ke0 s PHE 57 Ca 0.60 0.37 -0.09 0.00 0.33 0.00 0.00 56.93 58.14 2ke0 s PHE 57 Cb -0.36 -4.34 -0.05 0.00 -1.31 0.00 0.00 43.02 36.96 2ke0 s PHE 57 CO 0.35 -2.18 0.12 0.00 1.83 0.00 0.00 175.22 175.33 2ke0 s ALA 58 N 7.55 3.59 0.06 11.12 0.00 -1.26 -1.43 121.76 141.40 2ke0 s ALA 58 Ca 0.53 -0.74 -0.26 0.00 0.00 0.00 0.00 51.96 51.48 2ke0 s ALA 58 Cb -0.10 -2.12 0.08 0.00 0.00 0.00 0.00 23.12 20.97 2ke0 s ALA 58 CO 0.17 0.10 0.70 -0.59 0.00 0.00 0.00 175.76 176.14 2ke0 s PHE 59 N 0.48 -0.52 -0.11 0.00 -0.71 -0.55 -4.97 117.98 111.61 2ke0 s PHE 59 Ca 0.07 0.50 -0.30 0.00 -1.04 0.00 0.00 56.93 56.16 2ke0 s PHE 59 Cb -0.12 0.52 -0.03 0.00 -1.21 0.00 0.00 43.02 42.18 2ke0 s PHE 59 CO -0.00 -0.71 1.28 0.54 -1.34 0.00 0.00 175.22 174.99 2ke0 s VAL 60 N -2.90 4.19 -0.44 -2.49 0.11 -1.26 -2.29 120.40 115.31 2ke0 s VAL 60 Ca -0.01 1.47 -0.31 0.00 -2.93 0.00 0.00 61.98 60.20 2ke0 s VAL 60 Cb -0.01 -3.95 -0.10 0.00 -1.53 0.00 0.00 36.38 30.79 2ke0 s VAL 60 CO -0.06 -0.08 2.32 -0.11 -3.33 0.00 0.00 175.10 173.84 2ke0 n LEU 61 N 6.10 2.17 0.00 2.54 7.94 -0.59 -0.12 117.00 135.04 2ke0 n LEU 61 Ca 0.13 0.08 0.00 0.00 -1.11 0.00 0.00 56.01 55.12 2ke0 n LEU 61 Cb 0.45 -1.37 0.00 0.00 0.53 0.00 0.00 43.42 43.03 2ke0 n LEU 61 CO 0.56 -0.96 0.00 0.61 -1.11 0.00 0.00 177.39 176.49 2ke0 n GLY 62 N 6.25 1.08 0.00 -3.96 0.00 -1.26 -0.68 105.19 106.63 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 -0.40 -1.57 0.00 -0.02 0.00 0.82 -4.98 105.19 99.04 2ke0 n GLY 63 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.01 0.00 1.60 -0.02 0.00 -1.26 -5.06 105.19 100.44 2ke0 n GLY 64 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 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 0.00 0.35 -1.88 1.61 2.81 -1.26 -5.10 117.12 113.65 2ke0 n MET 65 Ca 0.00 -2.29 -0.02 0.00 -1.81 0.00 0.00 57.70 53.58 2ke0 n MET 65 Cb 0.00 -0.32 -0.00 0.00 -0.71 0.00 0.00 33.22 32.19 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 0.25 0.00 -4.00 2.03 0.24 -1.26 -5.16 118.33 110.43 2ke0 n VAL 66 Ca 0.07 -0.23 -0.22 0.00 -2.04 0.00 0.00 64.34 61.92 2ke0 n VAL 66 Cb 1.08 0.14 -0.04 0.00 -1.47 0.00 0.00 33.84 33.55 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 -2.48 4.15 0.23 1.34 -0.00 -1.26 -4.95 121.20 118.22 2ke0 s ILE 67 Ca 0.04 -1.38 -0.12 0.00 -0.00 0.00 0.00 60.65 59.19 2ke0 s ILE 67 Cb -0.00 -3.34 0.29 0.00 -0.00 0.00 0.00 42.46 39.41 2ke0 s ILE 67 CO 0.03 -0.29 1.61 0.07 -0.00 0.00 0.00 174.94 176.36 2ke0 h LYS 68 N 1.39 0.00 -0.93 0.37 2.10 -1.99 0.23 116.57 117.74 2ke0 h LYS 68 Ca -0.47 -0.00 0.14 0.00 -2.00 0.00 0.00 60.65 58.32 2ke0 h LYS 68 Cb 1.24 -0.00 -0.09 0.00 -0.90 0.00 0.00 32.23 32.48 2ke0 h LYS 68 CO 0.60 0.00 0.55 0.78 -2.00 0.00 0.00 179.45 179.37 2ke0 h GLY 69 N 0.00 1.55 0.66 0.07 0.00 -1.98 0.54 103.07 103.90 2ke0 h GLY 69 Ca 0.34 -0.34 -0.01 0.00 0.00 0.00 0.00 47.33 47.33 2ke0 h GLY 69 CO -0.73 0.04 -0.06 1.49 0.00 0.00 0.00 176.54 177.28 2ke0 h TRP 70 N 0.80 -0.15 -0.51 5.60 4.06 -0.99 -1.77 115.95 122.99 2ke0 h TRP 70 Ca 0.49 -0.00 0.06 0.00 2.06 0.00 0.00 58.89 61.50 2ke0 h TRP 70 Cb 0.62 0.05 -0.06 0.00 -1.00 0.00 0.00 29.16 28.77 2ke0 h TRP 70 CO -0.04 0.20 0.20 0.22 -3.56 0.00 0.00 178.44 175.46 2ke0 h ASP 71 N -0.50 0.23 -0.44 -3.49 3.58 -0.69 0.66 116.42 115.76 2ke0 h ASP 71 Ca -0.02 0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.49 2ke0 h ASP 71 Cb 0.41 0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.46 2ke0 h ASP 71 CO 0.03 0.16 0.29 -0.08 -2.88 0.00 0.00 179.24 176.76 2ke0 h GLU 72 N 0.39 0.58 -0.70 0.28 4.22 -0.90 -1.43 114.58 117.02 2ke0 h GLU 72 Ca 0.24 -0.03 -0.07 0.00 0.08 0.00 0.00 59.36 59.57 2ke0 h GLU 72 Cb 0.24 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 2ke0 h GLU 72 CO -0.23 0.38 0.16 0.78 -2.18 0.00 0.00 179.01 177.92 2ke0 h GLY 73 N 0.60 1.22 0.90 1.92 0.00 -0.69 -3.09 103.07 103.93 2ke0 h GLY 73 Ca 0.16 -0.77 -0.01 0.00 0.00 0.00 0.00 47.33 46.71 2ke0 h GLY 73 CO -0.03 0.72 0.09 -2.08 0.00 0.00 0.00 176.54 175.23 2ke0 h VAL 74 N 1.07 1.15 0.00 4.60 2.07 -0.58 -0.90 116.25 123.65 2ke0 h VAL 74 Ca 0.22 -0.45 -0.55 0.00 0.82 0.00 0.00 66.70 66.74 2ke0 h VAL 74 Cb 0.39 1.07 0.02 0.00 -1.52 0.00 0.00 31.29 31.25 2ke0 h VAL 74 CO 0.01 0.15 3.28 0.00 0.02 0.00 0.00 177.57 181.02 2ke0 n GLN 75 N -4.84 3.10 0.00 1.57 10.64 -0.57 -3.39 117.38 123.90 2ke0 n GLN 75 Ca -0.04 -1.90 0.00 0.00 -1.83 0.00 0.00 57.00 53.23 2ke0 n GLN 75 Cb 0.11 -2.65 0.00 0.00 -0.86 0.00 0.00 30.24 26.84 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 3.59 0.80 3.77 2.61 0.00 -1.21 -4.96 105.19 109.78 2ke0 n GLY 76 Ca 0.66 -0.06 -0.34 0.00 0.00 0.00 0.00 46.02 46.28 2ke0 n GLY 76 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2ke0 s MET 77 N 0.00 2.95 0.39 1.61 0.23 -0.35 -4.73 119.30 119.40 2ke0 s MET 77 Ca 0.00 1.54 0.07 0.00 -1.03 0.00 0.00 55.69 56.27 2ke0 s MET 77 Cb 0.00 -1.96 -0.08 0.00 -1.53 0.00 0.00 34.83 31.27 2ke0 s MET 77 CO 0.00 -1.16 0.00 0.15 -2.03 0.00 0.00 175.02 171.98 2ke0 s LYS 78 N -3.72 1.91 -0.03 3.16 1.02 -1.26 -1.48 119.74 119.33 2ke0 s LYS 78 Ca 0.71 -2.07 -0.36 0.00 0.02 0.00 0.00 55.97 54.27 2ke0 s LYS 78 Cb -0.23 -1.57 -0.15 0.00 -0.52 0.00 0.00 37.83 35.37 2ke0 s LYS 78 CO 0.36 -0.04 1.63 0.28 -0.92 0.00 0.00 175.35 176.66 2ke0 n VAL 79 N -0.92 0.22 -0.77 3.17 0.31 -0.17 0.21 118.33 120.39 2ke0 n VAL 79 Ca -0.05 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 2ke0 n VAL 79 Cb 0.66 -1.35 0.00 0.00 -0.91 0.00 0.00 33.84 32.24 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 3.63 0.87 3.76 2.92 0.00 0.87 -3.04 105.19 114.20 2ke0 n GLY 80 Ca 0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.84 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 -1.79 2.85 -0.06 -0.02 0.00 0.13 -4.48 107.32 103.96 2ke0 s GLY 81 Ca 0.00 0.31 0.03 0.00 0.00 0.00 0.00 44.72 45.07 2ke0 s GLY 81 CO 0.00 0.97 -0.14 0.14 0.00 0.00 0.00 173.10 174.07 2ke0 s VAL 82 N -0.60 3.09 -0.09 1.40 1.01 0.69 -1.41 120.40 124.49 2ke0 s VAL 82 Ca 0.37 -0.71 -0.04 0.00 0.00 0.00 0.00 61.98 61.60 2ke0 s VAL 82 Cb -0.22 -2.22 0.05 0.00 0.00 0.00 0.00 36.38 33.99 2ke0 s VAL 82 CO 0.24 0.59 0.20 -0.60 0.00 0.00 0.00 175.10 175.53 2ke0 s ARG 83 N -0.66 0.11 -0.32 2.72 3.52 -0.04 -0.06 118.95 124.21 2ke0 s ARG 83 Ca 0.10 0.55 -0.25 0.00 -0.13 0.00 0.00 55.73 56.00 2ke0 s ARG 83 Cb -0.11 -0.16 0.01 0.00 -1.56 0.00 0.00 34.95 33.12 2ke0 s ARG 83 CO 0.01 -0.24 0.86 0.50 -0.81 0.00 0.00 175.30 175.63 2ke0 s ARG 84 N 1.82 3.94 -0.12 5.12 3.52 -0.30 -1.13 118.95 131.80 2ke0 s ARG 84 Ca -0.03 0.65 -0.05 0.00 -0.13 0.00 0.00 55.73 56.17 2ke0 s ARG 84 Cb -0.12 -3.75 -0.04 0.00 -1.56 0.00 0.00 34.95 29.49 2ke0 s ARG 84 CO -0.07 -0.78 0.07 -1.17 -0.81 0.00 0.00 175.30 172.54 2ke0 s LEU 85 N 3.18 3.96 -0.20 -0.88 2.96 0.10 -0.10 118.68 127.70 2ke0 s LEU 85 Ca 0.36 0.26 0.00 0.00 -0.22 0.00 0.00 54.13 54.53 2ke0 s LEU 85 Cb -0.13 -1.95 0.05 0.00 0.50 0.00 0.00 46.19 44.65 2ke0 s LEU 85 CO 0.14 0.35 -0.08 -0.89 -1.32 0.00 0.00 176.35 174.56 2ke0 s THR 86 N -0.68 1.48 -0.20 3.68 2.01 0.23 0.15 115.64 122.31 2ke0 s THR 86 Ca 0.12 -0.99 -0.01 0.00 0.31 0.00 0.00 61.69 61.12 2ke0 s THR 86 Cb -0.12 -1.64 0.01 0.00 0.01 0.00 0.00 72.50 70.76 2ke0 s THR 86 CO 0.02 0.07 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.28 2ke0 s ILE 87 N 1.45 2.68 1.00 1.82 1.01 -0.49 -1.75 121.20 126.93 2ke0 s ILE 87 Ca -0.02 -0.77 -0.12 0.00 0.00 0.00 0.00 60.65 59.73 2ke0 s ILE 87 Cb -0.17 -2.20 0.19 0.00 0.01 0.00 0.00 42.46 40.29 2ke0 s ILE 87 CO -0.07 0.45 1.09 -2.16 0.00 0.00 0.00 174.94 174.25 2ke0 s PRO 88 N 1.37 0.42 0.11 2.79 0.04 -1.26 -1.43 135.00 137.04 2ke0 s PRO 88 Ca 0.05 0.52 0.18 0.00 0.04 0.00 0.00 61.00 61.79 2ke0 s PRO 88 Cb -0.14 -1.74 0.77 0.00 0.04 0.00 0.00 34.50 33.44 2ke0 s PRO 88 CO -0.08 -2.74 1.57 -0.35 0.04 0.00 0.00 177.00 175.44 2ke0 n PRO 89 N -4.18 0.08 0.02 0.56 -0.04 -1.25 -0.03 135.00 130.17 2ke0 n PRO 89 Ca 0.05 0.33 -0.03 0.00 -0.04 0.00 0.00 63.50 63.81 2ke0 n PRO 89 Cb 0.57 -1.66 -0.10 0.00 -0.04 0.00 0.00 33.50 32.27 2ke0 n PRO 89 CO 0.00 0.00 0.00 -0.56 -0.04 0.00 0.00 175.50 174.90 2ke0 h GLN 90 N 0.00 0.00 0.00 0.54 3.07 -1.92 -1.60 115.11 115.20 2ke0 h GLN 90 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 2ke0 h GLN 90 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.86 2ke0 h GLN 90 CO 0.00 0.39 -0.96 1.28 0.09 0.00 0.00 178.83 179.64 2ke0 n LEU 91 N -2.98 0.49 0.00 0.06 4.32 -1.00 -4.76 117.00 113.14 2ke0 n LEU 91 Ca -0.11 -0.36 0.00 0.00 -0.02 0.00 0.00 56.01 55.52 2ke0 n LEU 91 Cb 0.91 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.71 2ke0 n LEU 91 CO 0.44 0.12 0.00 0.61 -1.22 0.00 0.00 177.39 177.34 2ke0 n GLY 92 N 1.43 0.51 0.17 -0.72 0.00 0.96 -4.90 105.19 102.64 2ke0 n GLY 92 Ca 0.01 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.99 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 -0.13 0.00 1.61 -1.99 -1.80 -3.49 116.97 111.18 2ke0 h TYR 93 Ca 0.00 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.76 2ke0 h TYR 93 Cb 0.00 0.12 0.00 0.00 2.00 0.00 0.00 36.73 38.85 2ke0 h TYR 93 CO 0.00 -0.14 0.00 0.41 -0.00 0.00 0.00 178.16 178.43 2ke0 n GLY 94 N -1.30 0.28 0.13 3.88 0.00 -0.60 -4.69 105.19 102.88 2ke0 n GLY 94 Ca 0.03 -2.00 0.07 0.00 0.00 0.00 0.00 46.02 44.11 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 0.64 0.17 4.61 0.00 -1.94 -3.39 119.26 119.35 2ke0 h ALA 95 Ca 0.00 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 2ke0 h ALA 95 Cb 0.00 0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2ke0 h ALA 95 CO 0.00 0.38 -0.08 -0.09 0.00 0.00 0.00 179.25 179.46 2ke0 h ARG 96 N 0.00 -0.22 0.00 0.00 1.12 -1.93 -3.43 114.38 109.91 2ke0 h ARG 96 Ca -0.05 0.02 0.00 0.00 -1.11 0.00 0.00 59.98 58.83 2ke0 h ARG 96 Cb 1.24 0.05 0.00 0.00 -0.01 0.00 0.00 29.97 31.25 2ke0 h ARG 96 CO 0.02 -0.15 0.00 0.41 -3.11 0.00 0.00 179.97 177.15 2ke0 n GLY 97 N -0.05 -2.44 0.00 2.80 0.00 -1.26 -4.43 105.19 99.80 2ke0 n GLY 97 Ca -0.03 -2.11 0.00 0.00 0.00 0.00 0.00 46.02 43.88 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 0.26 0.00 -0.29 4.61 0.00 0.83 -4.99 120.51 120.94 2ke0 n ALA 98 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.54 2ke0 n ALA 98 Cb 0.00 0.00 0.33 0.00 0.00 0.00 0.00 19.45 19.78 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 0.00 1.30 0.00 0.00 0.00 -1.97 -3.44 103.07 98.96 2ke0 h GLY 99 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 46.99 2ke0 h GLY 99 CO 0.00 0.13 0.00 0.61 0.00 0.00 0.00 176.54 177.28 2ke0 n GLY 100 N -1.41 0.09 0.31 4.60 0.00 -1.26 -4.99 105.19 102.53 2ke0 n GLY 100 Ca 0.17 -0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.11 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 1.26 -2.80 1.61 2.07 -2.02 -3.31 116.25 113.06 2ke0 h VAL 101 Ca 0.00 -0.99 -0.66 0.00 0.82 0.00 0.00 66.70 65.87 2ke0 h VAL 101 Cb 0.00 0.62 -0.38 0.00 -1.52 0.00 0.00 31.29 30.01 2ke0 h VAL 101 CO 0.00 0.37 -0.26 -0.38 0.02 0.00 0.00 177.57 177.33 2ke0 n ILE 102 N -4.26 2.81 -1.18 4.57 5.41 -1.26 -5.04 119.36 120.41 2ke0 n ILE 102 Ca 0.04 -5.22 -0.29 0.00 1.00 0.00 0.00 62.75 58.28 2ke0 n ILE 102 Cb 0.27 -2.20 0.16 0.00 -0.71 0.00 0.00 39.64 37.17 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 -2.01 0.72 0.79 0.38 0.04 -1.25 -0.12 135.00 133.56 2ke0 s PRO 103 Ca 0.32 0.62 -0.11 0.00 0.04 0.00 0.00 61.00 61.88 2ke0 s PRO 103 Cb 0.03 -1.76 0.07 0.00 0.04 0.00 0.00 34.50 32.88 2ke0 s PRO 103 CO -0.06 -2.56 1.09 -1.25 0.04 0.00 0.00 177.00 174.26 2ke0 s PRO 104 N -4.95 2.10 -1.91 0.56 0.04 -1.26 -3.49 135.00 126.08 2ke0 s PRO 104 Ca 0.65 1.11 0.00 0.00 0.04 0.00 0.00 61.00 62.80 2ke0 s PRO 104 Cb -0.18 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.47 2ke0 s PRO 104 CO 0.57 -1.74 0.00 0.09 0.04 0.00 0.00 177.00 175.96 2ke0 n ASN 105 N -3.58 -5.68 -3.98 6.66 3.02 -1.26 -4.96 115.26 105.48 2ke0 n ASN 105 Ca 0.09 0.18 -0.29 0.00 -0.03 0.00 0.00 54.58 54.53 2ke0 n ASN 105 Cb 0.53 -4.83 -0.17 0.00 -0.61 0.00 0.00 39.78 34.70 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 -2.92 1.64 0.28 5.41 0.00 -1.23 -4.95 121.76 119.99 2ke0 s ALA 106 Ca 0.00 -0.75 -0.29 0.00 0.00 0.00 0.00 51.96 50.92 2ke0 s ALA 106 Cb 0.00 -0.97 -0.09 0.00 0.00 0.00 0.00 23.12 22.05 2ke0 s ALA 106 CO 0.00 -0.36 1.02 0.99 0.00 0.00 0.00 175.76 177.41 2ke0 s THR 107 N 1.51 3.79 -0.07 0.00 2.01 -1.26 -3.76 115.64 117.86 2ke0 s THR 107 Ca 0.04 1.75 0.05 0.00 0.31 0.00 0.00 61.69 63.83 2ke0 s THR 107 Cb -0.13 -4.09 -0.01 0.00 0.01 0.00 0.00 72.50 68.28 2ke0 s THR 107 CO -0.09 0.37 -0.21 -1.48 -0.69 0.00 0.00 174.62 172.53 2ke0 s LEU 108 N -1.47 2.33 -0.23 4.42 0.05 -0.51 -3.93 118.68 119.34 2ke0 s LEU 108 Ca 0.44 -0.41 -0.07 0.00 0.05 0.00 0.00 54.13 54.14 2ke0 s LEU 108 Cb -0.28 -1.45 -0.03 0.00 -2.05 0.00 0.00 46.19 42.38 2ke0 s LEU 108 CO 0.35 0.26 0.06 -0.69 -0.55 0.00 0.00 176.35 175.78 2ke0 s VAL 109 N -0.21 4.42 -0.12 1.48 1.01 -0.59 -1.39 120.40 125.00 2ke0 s VAL 109 Ca -0.01 -0.14 0.01 0.00 0.00 0.00 0.00 61.98 61.83 2ke0 s VAL 109 Cb -0.13 -3.04 -0.02 0.00 0.00 0.00 0.00 36.38 33.19 2ke0 s VAL 109 CO 0.03 0.38 -0.14 -0.36 0.00 0.00 0.00 175.10 175.01 2ke0 s PHE 110 N 1.21 2.78 -0.37 5.22 0.08 0.12 0.19 117.98 127.21 2ke0 s PHE 110 Ca 0.04 -0.61 -0.16 0.00 0.12 0.00 0.00 56.93 56.32 2ke0 s PHE 110 Cb -0.14 -1.81 0.00 0.00 -0.57 0.00 0.00 43.02 40.50 2ke0 s PHE 110 CO 0.03 -0.18 0.41 -2.00 -0.10 0.00 0.00 175.22 173.38 2ke0 s GLU 111 N 0.21 3.38 -0.33 0.44 -6.30 0.59 0.00 118.70 116.68 2ke0 s GLU 111 Ca -0.09 -0.53 -0.13 0.00 -2.50 0.00 0.00 54.97 51.72 2ke0 s GLU 111 Cb -0.15 -3.87 -0.02 0.00 0.00 0.00 0.00 34.13 30.08 2ke0 s GLU 111 CO 0.05 -0.67 0.25 0.08 0.02 0.00 0.00 175.26 175.00 2ke0 s VAL 112 N 2.10 5.27 -0.17 3.70 1.01 -0.28 -0.98 120.40 131.05 2ke0 s VAL 112 Ca 0.12 -0.12 0.00 0.00 0.00 0.00 0.00 61.98 61.99 2ke0 s VAL 112 Cb -0.17 -3.71 0.03 0.00 0.00 0.00 0.00 36.38 32.54 2ke0 s VAL 112 CO 0.13 0.01 -0.11 -1.83 0.00 0.00 0.00 175.10 173.30 2ke0 s GLU 113 N 1.77 2.05 0.09 2.72 -1.05 -0.40 -0.87 118.70 123.01 2ke0 s GLU 113 Ca 0.07 -0.63 -0.30 0.00 -0.15 0.00 0.00 54.97 53.96 2ke0 s GLU 113 Cb -0.17 -2.17 -0.06 0.00 -0.44 0.00 0.00 34.13 31.30 2ke0 s GLU 113 CO 0.11 -0.33 1.10 -1.17 0.95 0.00 0.00 175.26 175.92 2ke0 s LEU 114 N 1.49 4.41 -0.16 1.83 2.96 -0.50 -0.90 118.68 127.82 2ke0 s LEU 114 Ca 0.02 1.94 -0.05 0.00 -0.22 0.00 0.00 54.13 55.83 2ke0 s LEU 114 Cb -0.14 -3.58 -0.08 0.00 0.50 0.00 0.00 46.19 42.88 2ke0 s LEU 114 CO -0.09 -0.32 -0.18 0.18 -1.32 0.00 0.00 176.35 174.62 2ke0 n LEU 115 N 3.38 1.81 -3.95 -0.68 4.77 -0.49 -0.09 117.00 121.74 2ke0 n LEU 115 Ca 0.06 0.09 -0.10 0.00 -0.03 0.00 0.00 56.01 56.04 2ke0 n LEU 115 Cb 0.48 -0.49 -0.11 0.00 -2.33 0.00 0.00 43.42 40.97 2ke0 n LEU 115 CO 0.54 0.49 -0.31 -0.62 -1.33 0.00 0.00 177.39 176.16 2ke0 s ASP 116 N -6.08 0.18 0.00 -1.43 2.15 -1.15 -4.36 116.67 105.98 2ke0 s ASP 116 Ca -0.22 -0.42 0.29 0.00 0.43 0.00 0.00 52.55 52.63 2ke0 s ASP 116 Cb 0.07 0.13 1.29 0.00 -0.30 0.00 0.00 42.92 44.11 2ke0 s ASP 116 CO 0.31 -0.32 1.88 1.33 -0.17 0.00 0.00 175.17 178.19