#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ko7 s PRO 2 N 0.00 -0.76 0.00 1.61 0.04 -1.26 -4.91 135.00 129.73 2ko7 s PRO 2 Ca 0.00 0.10 0.00 0.00 0.04 0.00 0.00 61.00 61.14 2ko7 s PRO 2 Cb 0.00 -1.64 0.00 0.00 0.04 0.00 0.00 34.50 32.90 2ko7 s PRO 2 CO 0.00 -3.44 0.00 0.41 0.04 0.00 0.00 177.00 174.01 2ko7 n GLY 3 N -1.00 0.33 3.73 0.56 0.00 -1.26 -5.06 105.19 102.49 2ko7 n GLY 3 Ca 0.11 -1.27 -0.42 0.00 0.00 0.00 0.00 46.02 44.44 2ko7 n GLY 3 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ko7 s SER 4 N -4.00 6.52 -0.92 1.61 0.15 -1.26 -4.96 113.70 110.84 2ko7 s SER 4 Ca 0.00 2.74 -0.02 0.00 0.70 0.00 0.00 55.95 59.36 2ko7 s SER 4 Cb 0.00 -2.61 0.23 0.00 -1.71 0.00 0.00 66.02 61.93 2ko7 s SER 4 CO 0.00 -0.84 0.82 -0.04 1.20 0.00 0.00 173.24 174.38 2ko7 s MET 5 N 0.52 3.38 -0.15 5.44 -1.94 -1.26 -5.05 119.30 120.25 2ko7 s MET 5 Ca 0.67 -3.29 -0.29 0.00 -1.71 0.00 0.00 55.69 51.07 2ko7 s MET 5 Cb -0.45 -4.02 -0.03 0.00 2.01 0.00 0.00 34.83 32.33 2ko7 s MET 5 CO 0.37 -1.26 1.55 0.99 -0.01 0.00 0.00 175.02 176.66 2ko7 s THR 6 N -1.37 3.78 -0.40 2.05 2.01 -1.26 -4.98 115.64 115.47 2ko7 s THR 6 Ca 0.28 0.92 -0.03 0.00 0.31 0.00 0.00 61.69 63.16 2ko7 s THR 6 Cb -0.07 -3.68 0.11 0.00 0.01 0.00 0.00 72.50 68.86 2ko7 s THR 6 CO -0.12 -0.18 0.20 -0.69 -0.69 0.00 0.00 174.62 173.14 2ko7 s VAL 7 N 4.39 3.35 -0.12 3.82 1.01 -1.26 -4.75 120.40 126.84 2ko7 s VAL 7 Ca 0.68 -1.97 -0.29 0.00 0.00 0.00 0.00 61.98 60.40 2ko7 s VAL 7 Cb -0.27 -3.26 -0.02 0.00 0.00 0.00 0.00 36.38 32.83 2ko7 s VAL 7 CO 0.26 -0.65 1.21 -0.69 0.00 0.00 0.00 175.10 175.23 2ko7 s VAL 8 N 1.17 4.33 0.15 2.92 1.01 -1.17 -4.89 120.40 123.92 2ko7 s VAL 8 Ca 0.07 1.63 -0.05 0.00 0.00 0.00 0.00 61.98 63.63 2ko7 s VAL 8 Cb -0.23 -4.05 -0.06 0.00 0.00 0.00 0.00 36.38 32.05 2ko7 s VAL 8 CO -0.04 -0.08 0.39 -0.89 0.00 0.00 0.00 175.10 174.49 2ko7 s THR 9 N 2.88 5.14 0.24 3.92 2.01 -1.26 -1.09 115.64 127.48 2ko7 s THR 9 Ca 0.54 0.07 0.04 0.00 0.31 0.00 0.00 61.69 62.65 2ko7 s THR 9 Cb -0.22 -3.62 0.04 0.00 0.01 0.00 0.00 72.50 68.70 2ko7 s THR 9 CO 0.17 0.03 0.30 0.35 -0.69 0.00 0.00 174.62 174.77 2ko7 n THR 10 N 0.06 0.00 0.17 -0.82 -2.24 0.33 -4.97 114.28 106.80 2ko7 n THR 10 Ca -0.02 -0.84 0.05 0.00 -2.27 0.00 0.00 64.05 60.97 2ko7 n THR 10 Cb 0.52 -0.67 0.13 0.00 -2.10 0.00 0.00 70.33 68.21 2ko7 n THR 10 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 2ko7 h GLU 11 N 0.00 0.00 -0.40 -0.78 4.11 -2.00 -3.07 114.58 112.44 2ko7 h GLU 11 Ca -0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.31 2ko7 h GLU 11 Cb 0.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.78 2ko7 h GLU 11 CO 0.18 0.38 0.00 0.43 0.07 0.00 0.00 179.01 180.07 2ko7 n SER 12 N -3.24 2.10 0.00 3.06 7.64 -1.26 -4.92 113.62 117.00 2ko7 n SER 12 Ca 0.02 -2.03 0.00 0.00 1.01 0.00 0.00 58.87 57.87 2ko7 n SER 12 Cb 0.65 -0.27 0.00 0.00 -1.01 0.00 0.00 64.21 63.57 2ko7 n SER 12 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ko7 n GLY 13 N 1.05 2.13 3.56 0.23 0.00 -1.16 -4.95 105.19 106.05 2ko7 n GLY 13 Ca 0.13 -0.42 -0.40 0.00 0.00 0.00 0.00 46.02 45.32 2ko7 n GLY 13 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2ko7 n LEU 14 N 0.00 2.01 -4.51 0.99 0.00 -1.26 -4.27 117.00 109.95 2ko7 n LEU 14 Ca 0.00 0.94 -0.25 0.00 0.00 0.00 0.00 56.01 56.70 2ko7 n LEU 14 Cb 0.00 -1.29 -0.10 0.00 0.00 0.00 0.00 43.42 42.03 2ko7 n LEU 14 CO 0.00 -2.02 -0.42 -0.54 0.00 0.00 0.00 177.39 174.41 2ko7 s LYS 15 N -2.04 1.74 -0.12 1.96 1.02 -0.56 -0.51 119.74 121.23 2ko7 s LYS 15 Ca 0.66 -1.86 -0.10 0.00 0.02 0.00 0.00 55.97 54.69 2ko7 s LYS 15 Cb -0.53 -1.68 0.03 0.00 -0.52 0.00 0.00 37.83 35.13 2ko7 s LYS 15 CO 0.55 0.20 0.31 1.52 -0.92 0.00 0.00 175.35 177.01 2ko7 s TYR 16 N -2.61 -0.35 -0.18 3.18 1.13 -0.25 0.03 117.35 118.31 2ko7 s TYR 16 Ca 0.31 0.84 -0.06 0.00 -1.41 0.00 0.00 57.07 56.75 2ko7 s TYR 16 Cb -0.00 0.12 0.09 0.00 -1.10 0.00 0.00 41.96 41.06 2ko7 s TYR 16 CO 0.15 -0.17 0.37 -1.83 -2.51 0.00 0.00 175.55 171.56 2ko7 s GLU 17 N 0.30 0.27 0.62 -3.49 -1.05 0.13 -3.06 118.70 112.42 2ko7 s GLU 17 Ca -0.01 0.91 -0.19 0.00 -0.15 0.00 0.00 54.97 55.53 2ko7 s GLU 17 Cb -0.03 0.15 -0.02 0.00 -0.44 0.00 0.00 34.13 33.79 2ko7 s GLU 17 CO -0.01 -0.29 1.30 0.16 0.95 0.00 0.00 175.26 177.37 2ko7 s ASP 18 N 2.55 4.80 -0.06 0.83 -4.77 -1.26 -0.59 116.67 118.17 2ko7 s ASP 18 Ca 0.00 2.64 -0.04 0.00 -3.30 0.00 0.00 52.55 51.85 2ko7 s ASP 18 Cb -0.12 -2.62 -0.03 0.00 -1.09 0.00 0.00 42.92 39.05 2ko7 s ASP 18 CO -0.12 -1.87 -0.11 0.18 0.70 0.00 0.00 175.17 173.95 2ko7 n LEU 19 N -1.67 0.78 -3.69 2.11 7.99 -0.01 -4.72 117.00 117.78 2ko7 n LEU 19 Ca 0.14 0.12 -0.10 0.00 -0.01 0.00 0.00 56.01 56.16 2ko7 n LEU 19 Cb 0.47 -0.30 -0.11 0.00 -0.11 0.00 0.00 43.42 43.38 2ko7 n LEU 19 CO 0.48 -0.02 0.04 -0.89 -1.51 0.00 0.00 177.39 175.49 2ko7 s THR 20 N -2.18 -0.07 1.10 -5.08 2.01 0.69 -4.99 115.64 107.13 2ko7 s THR 20 Ca -0.11 0.10 -0.18 0.00 0.31 0.00 0.00 61.69 61.81 2ko7 s THR 20 Cb 0.04 -0.60 0.09 0.00 0.01 0.00 0.00 72.50 72.03 2ko7 s THR 20 CO 0.14 0.04 0.01 -0.62 -0.69 0.00 0.00 174.62 173.50 2ko7 n GLU 21 N 4.34 -1.41 0.16 4.92 -0.58 -1.26 -1.42 120.64 125.38 2ko7 n GLU 21 Ca -0.22 -0.39 0.00 0.00 -0.42 0.00 0.00 57.16 56.12 2ko7 n GLU 21 Cb 0.55 -1.70 0.00 0.00 -0.57 0.00 0.00 31.44 29.72 2ko7 n GLU 21 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2ko7 n GLY 22 N 2.01 -1.46 2.58 0.62 0.00 -1.24 -4.40 105.19 103.29 2ko7 n GLY 22 Ca 0.01 0.30 -0.03 0.00 0.00 0.00 0.00 46.02 46.30 2ko7 n GLY 22 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2ko7 n SER 23 N -3.19 -7.08 0.00 1.61 7.64 -1.26 -4.78 113.62 106.57 2ko7 n SER 23 Ca 0.00 0.89 0.00 0.00 1.01 0.00 0.00 58.87 60.77 2ko7 n SER 23 Cb 0.00 -4.70 0.00 0.00 -1.01 0.00 0.00 64.21 58.50 2ko7 n SER 23 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ko7 n GLY 24 N 0.20 1.67 2.98 0.23 0.00 -1.09 -4.94 105.19 104.24 2ko7 n GLY 24 Ca 0.04 -0.18 -0.14 0.00 0.00 0.00 0.00 46.02 45.75 2ko7 n GLY 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ko7 s ALA 25 N -1.81 -0.44 0.10 4.61 0.00 -1.25 -4.79 121.76 118.18 2ko7 s ALA 25 Ca 0.00 0.85 -0.31 0.00 0.00 0.00 0.00 51.96 52.50 2ko7 s ALA 25 Cb 0.00 -0.74 -0.07 0.00 0.00 0.00 0.00 23.12 22.31 2ko7 s ALA 25 CO 0.00 -0.37 1.32 -2.00 0.00 0.00 0.00 175.76 174.71 2ko7 s GLU 26 N 1.73 4.37 0.74 0.00 2.12 -1.26 -0.15 118.70 126.25 2ko7 s GLU 26 Ca -0.04 1.97 -0.15 0.00 0.36 0.00 0.00 54.97 57.10 2ko7 s GLU 26 Cb -0.11 -3.28 0.05 0.00 0.26 0.00 0.00 34.13 31.05 2ko7 s GLU 26 CO -0.08 -0.36 1.24 0.00 -0.54 0.00 0.00 175.26 175.53 2ko7 s ALA 27 N 0.99 2.05 -0.01 6.30 0.00 -0.62 -4.96 121.76 125.51 2ko7 s ALA 27 Ca 0.62 0.98 0.03 0.00 0.00 0.00 0.00 51.96 53.59 2ko7 s ALA 27 Cb -0.34 -3.51 -0.00 0.00 0.00 0.00 0.00 23.12 19.26 2ko7 s ALA 27 CO 0.31 -2.02 -0.08 1.03 0.00 0.00 0.00 175.76 174.99 2ko7 s ARG 28 N -3.85 0.72 0.01 0.00 0.52 -1.26 -4.58 118.95 110.51 2ko7 s ARG 28 Ca 0.77 -0.30 -0.31 0.00 -0.52 0.00 0.00 55.73 55.36 2ko7 s ARG 28 Cb -0.32 -0.69 -0.10 0.00 0.52 0.00 0.00 34.95 34.36 2ko7 s ARG 28 CO 0.46 0.17 1.94 0.00 0.02 0.00 0.00 175.30 177.89 2ko7 n ALA 29 N 2.94 1.41 0.00 2.13 0.00 -1.26 -1.80 120.51 123.92 2ko7 n ALA 29 Ca -0.14 0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.54 2ko7 n ALA 29 Cb 0.57 -2.62 0.00 0.00 0.00 0.00 0.00 19.45 17.40 2ko7 n ALA 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ko7 n GLY 30 N 4.48 2.28 3.85 0.00 0.00 0.93 -4.91 105.19 111.81 2ko7 n GLY 30 Ca 0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.89 2ko7 n GLY 30 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2ko7 s GLN 31 N -0.17 3.26 -0.02 1.61 -2.07 -0.75 -4.77 119.66 116.76 2ko7 s GLN 31 Ca 0.00 -0.38 -0.18 0.00 -1.82 0.00 0.00 55.36 52.97 2ko7 s GLN 31 Cb 0.00 -2.99 -0.05 0.00 -1.09 0.00 0.00 33.01 28.87 2ko7 s GLN 31 CO 0.00 0.67 0.51 0.99 -1.32 0.00 0.00 175.29 176.14 2ko7 s THR 32 N -1.24 4.98 0.09 3.63 2.01 -1.26 -1.50 115.64 122.35 2ko7 s THR 32 Ca 0.24 1.06 -0.10 0.00 0.31 0.00 0.00 61.69 63.20 2ko7 s THR 32 Cb -0.12 -3.84 0.01 0.00 0.01 0.00 0.00 72.50 68.55 2ko7 s THR 32 CO 0.15 0.46 0.24 0.68 -0.69 0.00 0.00 174.62 175.46 2ko7 s VAL 33 N -0.36 0.12 -0.20 3.82 -7.23 -0.41 -4.74 120.40 111.40 2ko7 s VAL 33 Ca 0.27 -1.02 -0.08 0.00 -1.81 0.00 0.00 61.98 59.34 2ko7 s VAL 33 Cb -0.17 -1.27 -0.04 0.00 0.56 0.00 0.00 36.38 35.45 2ko7 s VAL 33 CO 0.15 -0.56 0.09 -0.44 -0.31 0.00 0.00 175.10 174.03 2ko7 s SER 34 N -2.79 5.75 0.07 4.85 0.01 0.26 -1.57 113.70 120.29 2ko7 s SER 34 Ca 0.04 0.07 -0.05 0.00 1.31 0.00 0.00 55.95 57.33 2ko7 s SER 34 Cb 0.04 -2.01 -0.02 0.00 0.21 0.00 0.00 66.02 64.24 2ko7 s SER 34 CO -0.11 0.13 0.08 0.68 0.41 0.00 0.00 173.24 174.43 2ko7 s VAL 35 N 0.66 0.18 -0.14 3.43 -7.23 -0.16 -1.51 120.40 115.63 2ko7 s VAL 35 Ca 0.05 -1.53 -0.03 0.00 -1.81 0.00 0.00 61.98 58.66 2ko7 s VAL 35 Cb -0.13 -1.48 -0.03 0.00 0.56 0.00 0.00 36.38 35.31 2ko7 s VAL 35 CO 0.01 -0.80 -0.04 -1.00 -0.31 0.00 0.00 175.10 172.96 2ko7 s HIS 36 N -3.90 3.02 -0.11 2.82 3.76 -0.01 -0.87 115.29 119.99 2ko7 s HIS 36 Ca 0.07 -0.22 0.02 0.00 -0.15 0.00 0.00 55.06 54.78 2ko7 s HIS 36 Cb 0.06 -1.91 -0.01 0.00 1.11 0.00 0.00 32.58 31.83 2ko7 s HIS 36 CO -0.10 0.05 -0.18 1.52 -0.85 0.00 0.00 174.74 175.18 2ko7 s TYR 37 N 0.12 2.70 -0.28 1.40 1.13 -1.25 -1.12 117.35 120.05 2ko7 s TYR 37 Ca -0.01 -0.78 0.01 0.00 -1.41 0.00 0.00 57.07 54.88 2ko7 s TYR 37 Cb -0.14 -1.77 0.08 0.00 -1.10 0.00 0.00 41.96 39.03 2ko7 s TYR 37 CO 0.03 -0.27 0.00 0.99 -2.51 0.00 0.00 175.55 173.78 2ko7 s THR 38 N 0.28 1.60 -0.37 -3.49 2.01 -0.39 -2.39 115.64 112.90 2ko7 s THR 38 Ca -0.13 -1.55 -0.29 0.00 0.31 0.00 0.00 61.69 60.04 2ko7 s THR 38 Cb -0.16 -2.00 0.00 0.00 0.01 0.00 0.00 72.50 70.34 2ko7 s THR 38 CO 0.07 -0.34 1.49 -0.83 -0.69 0.00 0.00 174.62 174.32 2ko7 s GLY 39 N 1.31 1.09 0.21 4.40 0.00 0.12 -1.02 107.32 113.43 2ko7 s GLY 39 Ca 0.01 0.01 0.11 0.00 0.00 0.00 0.00 44.72 44.85 2ko7 s GLY 39 CO -0.10 2.86 -0.21 -0.98 0.00 0.00 0.00 173.10 174.66 2ko7 s TRP 40 N 5.55 2.18 0.54 1.90 0.51 0.15 -1.52 118.94 128.25 2ko7 s TRP 40 Ca 0.65 -0.38 -0.02 0.00 -2.12 0.00 0.00 56.10 54.23 2ko7 s TRP 40 Cb -0.17 -1.04 0.01 0.00 -0.81 0.00 0.00 33.47 31.47 2ko7 s TRP 40 CO 0.31 0.52 0.79 -0.51 -0.51 0.00 0.00 176.95 177.56 2ko7 s LEU 41 N -2.93 3.37 0.45 2.99 1.02 0.12 -0.96 118.68 122.74 2ko7 s LEU 41 Ca 0.22 0.37 0.31 0.00 0.02 0.00 0.00 54.13 55.05 2ko7 s LEU 41 Cb -0.06 -3.21 1.61 0.00 0.02 0.00 0.00 46.19 44.55 2ko7 s LEU 41 CO 0.11 -0.98 1.94 0.71 0.02 0.00 0.00 176.35 178.15 2ko7 h THR 42 N 0.07 0.00 0.00 5.49 1.35 -1.90 -0.06 112.91 117.86 2ko7 h THR 42 Ca -0.45 -0.07 0.00 0.00 -0.55 0.00 0.00 66.41 65.34 2ko7 h THR 42 Cb 1.27 0.80 0.00 0.00 -1.73 0.00 0.00 68.15 68.49 2ko7 h THR 42 CO 0.57 0.00 -1.18 0.47 -0.25 0.00 0.00 175.52 175.14 2ko7 n ASP 43 N -2.61 0.69 0.00 5.36 9.92 -1.26 -4.95 116.55 123.70 2ko7 n ASP 43 Ca -0.01 0.26 0.00 0.00 -0.53 0.00 0.00 54.79 54.50 2ko7 n ASP 43 Cb 0.09 0.73 0.00 0.00 -0.64 0.00 0.00 41.12 41.30 2ko7 n ASP 43 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2ko7 n GLY 44 N 1.20 1.10 3.79 0.44 0.00 -0.04 -5.11 105.19 106.58 2ko7 n GLY 44 Ca -0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 2ko7 n GLY 44 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2ko7 s GLN 45 N -0.35 3.96 -0.21 1.61 -1.52 -1.26 -4.71 119.66 117.19 2ko7 s GLN 45 Ca 0.00 1.42 -0.08 0.00 -1.95 0.00 0.00 55.36 54.75 2ko7 s GLN 45 Cb 0.00 -2.28 -0.04 0.00 -0.22 0.00 0.00 33.01 30.47 2ko7 s GLN 45 CO 0.00 -0.30 0.07 0.21 -0.25 0.00 0.00 175.29 175.02 2ko7 s LYS 46 N -2.93 3.88 -0.02 2.91 2.20 -1.26 0.12 119.74 124.64 2ko7 s LYS 46 Ca 0.63 -0.38 0.03 0.00 -0.36 0.00 0.00 55.97 55.89 2ko7 s LYS 46 Cb -0.18 -3.28 0.05 0.00 -1.51 0.00 0.00 37.83 32.91 2ko7 s LYS 46 CO 0.23 0.10 1.01 1.97 -0.36 0.00 0.00 175.35 178.30 2ko7 n PHE 47 N 4.08 0.00 -3.52 4.03 -1.74 -0.58 -5.01 117.46 114.72 2ko7 n PHE 47 Ca -0.16 -0.18 0.02 0.00 -0.56 0.00 0.00 57.45 56.56 2ko7 n PHE 47 Cb 0.52 -0.07 -0.06 0.00 1.52 0.00 0.00 39.48 41.40 2ko7 n PHE 47 CO 0.00 0.00 0.00 0.34 -0.56 0.00 0.00 176.76 176.54 2ko7 s ASP 48 N -1.30 -0.17 -0.18 5.98 2.15 -1.07 -4.89 116.67 117.19 2ko7 s ASP 48 Ca 0.06 0.26 -0.08 0.00 0.43 0.00 0.00 52.55 53.22 2ko7 s ASP 48 Cb 0.05 1.11 0.08 0.00 -0.30 0.00 0.00 42.92 43.86 2ko7 s ASP 48 CO 0.01 -0.04 0.40 -0.94 -0.17 0.00 0.00 175.17 174.43 2ko7 s SER 49 N 1.42 -0.29 0.49 -0.34 1.04 -1.26 0.13 113.70 114.89 2ko7 s SER 49 Ca -0.06 0.92 0.33 0.00 0.48 0.00 0.00 55.95 57.62 2ko7 s SER 49 Cb -0.02 1.07 1.72 0.00 0.10 0.00 0.00 66.02 68.89 2ko7 s SER 49 CO -0.13 -0.22 2.01 0.77 0.98 0.00 0.00 173.24 176.66 2ko7 h SER 50 N 7.80 0.00 -0.04 7.02 4.64 -1.85 -1.95 113.55 129.18 2ko7 h SER 50 Ca -0.23 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.10 2ko7 h SER 50 Cb 1.14 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.22 2ko7 h SER 50 CO 0.19 0.00 0.10 0.07 -0.87 0.00 0.00 176.83 176.32 2ko7 h LYS 51 N 0.00 0.00 -0.83 4.77 2.10 -1.87 -2.11 116.57 118.64 2ko7 h LYS 51 Ca 0.00 0.00 0.15 0.00 -2.00 0.00 0.00 60.65 58.80 2ko7 h LYS 51 Cb 0.09 0.00 -0.10 0.00 -0.90 0.00 0.00 32.23 31.33 2ko7 h LYS 51 CO 0.00 0.00 0.40 0.22 -2.00 0.00 0.00 179.45 178.07 2ko7 h ASP 52 N 0.00 0.46 1.18 7.07 3.58 -1.74 0.24 116.42 127.21 2ko7 h ASP 52 Ca 0.02 0.10 0.00 0.00 0.42 0.00 0.00 57.03 57.57 2ko7 h ASP 52 Cb 0.23 0.03 0.00 0.00 1.72 0.00 0.00 39.33 41.31 2ko7 h ASP 52 CO -0.00 0.18 -0.27 -1.14 -2.88 0.00 0.00 179.24 175.13 2ko7 n ARG 53 N -4.91 0.26 -3.05 0.28 0.63 -0.79 -4.96 116.66 104.11 2ko7 n ARG 53 Ca 0.17 0.15 -0.13 0.00 -0.92 0.00 0.00 57.85 57.11 2ko7 n ARG 53 Cb 0.44 -1.74 0.07 0.00 0.45 0.00 0.00 32.46 31.68 2ko7 n ARG 53 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 2ko7 n ASN 54 N -2.15 -3.76 -3.63 6.15 4.13 0.85 -5.02 115.26 111.83 2ko7 n ASN 54 Ca 0.05 -0.54 -0.03 0.00 1.68 0.00 0.00 54.58 55.74 2ko7 n ASN 54 Cb 0.43 -4.28 -0.03 0.00 -1.54 0.00 0.00 39.78 34.36 2ko7 n ASN 54 CO 0.00 0.00 0.00 -1.81 0.28 0.00 0.00 177.26 175.73 2ko7 s ASP 55 N -3.74 -0.07 0.67 6.41 1.11 -1.26 -5.08 116.67 114.71 2ko7 s ASP 55 Ca 0.17 0.04 -0.14 0.00 0.18 0.00 0.00 52.55 52.80 2ko7 s ASP 55 Cb -0.02 0.07 0.01 0.00 1.07 0.00 0.00 42.92 44.04 2ko7 s ASP 55 CO 0.59 -0.09 1.11 -2.16 1.18 0.00 0.00 175.17 175.80 2ko7 s PRO 56 N -1.67 2.72 -0.54 8.23 0.04 -1.26 -4.76 135.00 137.76 2ko7 s PRO 56 Ca 0.09 1.36 -0.17 0.00 0.04 0.00 0.00 61.00 62.32 2ko7 s PRO 56 Cb -0.01 -1.94 0.11 0.00 0.04 0.00 0.00 34.50 32.70 2ko7 s PRO 56 CO -0.05 -1.31 0.56 0.12 0.04 0.00 0.00 177.00 176.36 2ko7 s PHE 57 N -2.42 3.16 -0.23 0.56 5.36 -0.05 -4.85 117.98 119.51 2ko7 s PHE 57 Ca 0.66 -1.08 -0.19 0.00 -0.96 0.00 0.00 56.93 55.36 2ko7 s PHE 57 Cb -0.20 -3.76 -0.03 0.00 -0.34 0.00 0.00 43.02 38.69 2ko7 s PHE 57 CO 0.43 -1.08 0.55 0.00 -1.46 0.00 0.00 175.22 173.67 2ko7 s ALA 58 N 2.02 3.57 0.22 11.12 0.00 -1.26 -0.99 121.76 136.44 2ko7 s ALA 58 Ca 0.07 -0.46 -0.17 0.00 0.00 0.00 0.00 51.96 51.40 2ko7 s ALA 58 Cb -0.27 -2.90 0.02 0.00 0.00 0.00 0.00 23.12 19.97 2ko7 s ALA 58 CO 0.05 -0.62 0.54 -0.59 0.00 0.00 0.00 175.76 175.14 2ko7 s PHE 59 N 2.05 0.01 -0.08 0.00 -0.71 -0.61 -4.94 117.98 113.70 2ko7 s PHE 59 Ca 0.24 -0.38 -0.22 0.00 -1.04 0.00 0.00 56.93 55.54 2ko7 s PHE 59 Cb -0.16 0.39 -0.04 0.00 -1.21 0.00 0.00 43.02 42.00 2ko7 s PHE 59 CO 0.09 -0.99 0.63 0.08 -1.34 0.00 0.00 175.22 173.69 2ko7 s VAL 60 N -3.92 5.08 0.43 -2.49 1.01 -1.26 -1.29 120.40 117.95 2ko7 s VAL 60 Ca 0.13 1.30 -0.24 0.00 0.00 0.00 0.00 61.98 63.17 2ko7 s VAL 60 Cb -0.02 -3.97 -0.08 0.00 0.00 0.00 0.00 36.38 32.31 2ko7 s VAL 60 CO 0.02 0.28 1.11 -0.22 0.00 0.00 0.00 175.10 176.29 2ko7 s LEU 61 N 0.70 4.08 -0.74 3.92 2.96 -0.56 -3.24 118.68 125.80 2ko7 s LEU 61 Ca 0.34 2.18 0.00 0.00 -0.22 0.00 0.00 54.13 56.43 2ko7 s LEU 61 Cb -0.17 -4.20 0.00 0.00 0.50 0.00 0.00 46.19 42.32 2ko7 s LEU 61 CO 0.16 -0.70 0.00 0.61 -1.32 0.00 0.00 176.35 175.10 2ko7 n GLY 62 N 0.40 0.91 0.09 7.98 0.00 -1.26 -0.05 105.19 113.25 2ko7 n GLY 62 Ca 0.06 -0.73 -0.13 0.00 0.00 0.00 0.00 46.02 45.22 2ko7 n GLY 62 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2ko7 h GLY 63 N 0.00 -0.11 0.00 -0.02 0.00 -1.96 -3.46 103.07 97.52 2ko7 h GLY 63 Ca -0.14 0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.23 2ko7 h GLY 63 CO 0.21 -0.04 0.00 0.61 0.00 0.00 0.00 176.54 177.32 2ko7 n GLY 64 N 0.23 2.22 0.24 4.60 0.00 -1.26 -4.95 105.19 106.27 2ko7 n GLY 64 Ca -0.09 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.03 2ko7 n GLY 64 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2ko7 h MET 65 N 0.48 0.00 -6.24 1.61 2.86 -1.95 -3.43 114.93 108.27 2ko7 h MET 65 Ca 0.00 0.00 -0.57 0.00 -2.06 0.00 0.00 59.70 57.07 2ko7 h MET 65 Cb 0.00 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.63 2ko7 h MET 65 CO 0.00 0.16 -0.26 0.14 1.06 0.00 0.00 176.91 178.02 2ko7 s VAL 66 N -4.34 5.10 0.79 -2.22 -7.23 -1.26 -5.06 120.40 106.17 2ko7 s VAL 66 Ca -0.03 0.17 -0.14 0.00 -1.81 0.00 0.00 61.98 60.17 2ko7 s VAL 66 Cb 0.14 -3.62 0.04 0.00 0.56 0.00 0.00 36.38 33.50 2ko7 s VAL 66 CO 0.63 0.02 0.95 2.30 -0.31 0.00 0.00 175.10 178.69 2ko7 n ILE 67 N 0.06 1.90 -0.21 -0.62 -5.35 -1.26 -4.60 119.36 109.28 2ko7 n ILE 67 Ca -0.02 -0.27 -0.01 0.00 -0.27 0.00 0.00 62.75 62.18 2ko7 n ILE 67 Cb 0.52 -1.03 0.05 0.00 -1.74 0.00 0.00 39.64 37.44 2ko7 n ILE 67 CO 0.00 0.00 0.00 0.11 -1.76 0.00 0.00 176.55 174.90 2ko7 h LYS 68 N -0.77 -0.03 -0.96 6.28 1.79 -1.89 0.17 116.57 121.17 2ko7 h LYS 68 Ca -0.46 0.00 0.14 0.00 -2.18 0.00 0.00 60.65 58.16 2ko7 h LYS 68 Cb 1.31 0.01 -0.08 0.00 -1.58 0.00 0.00 32.23 31.89 2ko7 h LYS 68 CO 0.44 -0.02 0.61 0.78 -1.08 0.00 0.00 179.45 180.18 2ko7 h GLY 69 N -0.03 1.48 0.75 3.86 0.00 -1.68 -0.63 103.07 106.81 2ko7 h GLY 69 Ca 0.29 -0.36 -0.02 0.00 0.00 0.00 0.00 47.33 47.25 2ko7 h GLY 69 CO -0.66 0.09 -0.18 1.49 0.00 0.00 0.00 176.54 177.28 2ko7 h TRP 70 N 0.82 -0.48 -0.47 5.60 4.06 -0.98 -1.61 115.95 122.89 2ko7 h TRP 70 Ca 0.49 -0.01 0.08 0.00 2.06 0.00 0.00 58.89 61.51 2ko7 h TRP 70 Cb 0.67 0.16 -0.07 0.00 -1.00 0.00 0.00 29.16 28.92 2ko7 h TRP 70 CO -0.00 -0.17 0.08 -0.44 -3.56 0.00 0.00 178.44 174.35 2ko7 h ASP 71 N -0.77 -0.02 -0.90 -3.49 3.32 -0.88 0.29 116.42 113.97 2ko7 h ASP 71 Ca -0.05 0.08 0.04 0.00 0.02 0.00 0.00 57.03 57.12 2ko7 h ASP 71 Cb 0.52 0.12 -0.05 0.00 0.22 0.00 0.00 39.33 40.14 2ko7 h ASP 71 CO 0.09 0.02 0.58 -0.08 -1.72 0.00 0.00 179.24 178.13 2ko7 h GLU 72 N 0.22 1.09 -0.16 3.56 4.81 -1.12 -0.22 114.58 122.76 2ko7 h GLU 72 Ca 0.23 -0.07 -0.10 0.00 -0.13 0.00 0.00 59.36 59.29 2ko7 h GLU 72 Cb 0.31 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.44 2ko7 h GLU 72 CO -0.31 0.72 -0.29 0.78 -0.73 0.00 0.00 179.01 179.18 2ko7 h GLY 73 N 1.13 0.54 2.00 1.92 0.00 -0.23 -3.11 103.07 105.32 2ko7 h GLY 73 Ca 0.36 -0.62 -0.03 0.00 0.00 0.00 0.00 47.33 47.04 2ko7 h GLY 73 CO -0.12 0.56 -0.15 -2.08 0.00 0.00 0.00 176.54 174.74 2ko7 h VAL 74 N 0.12 0.83 -0.04 4.60 2.07 -0.19 -0.38 116.25 123.26 2ko7 h VAL 74 Ca 0.01 -0.58 0.00 0.00 0.82 0.00 0.00 66.70 66.95 2ko7 h VAL 74 Cb 0.88 1.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.99 2ko7 h VAL 74 CO 0.07 0.15 0.00 0.00 0.02 0.00 0.00 177.57 177.80 2ko7 n GLN 75 N -3.95 1.17 0.00 1.57 6.02 -0.12 -3.70 117.38 118.37 2ko7 n GLN 75 Ca -0.02 -0.26 0.00 0.00 -0.01 0.00 0.00 57.00 56.71 2ko7 n GLN 75 Cb 0.24 -1.31 0.00 0.00 1.02 0.00 0.00 30.24 30.19 2ko7 n GLN 75 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2ko7 n GLY 76 N 0.86 0.00 3.74 1.08 0.00 -0.34 -4.68 105.19 105.84 2ko7 n GLY 76 Ca 0.14 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.80 2ko7 n GLY 76 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2ko7 s MET 77 N -1.77 2.57 0.10 1.61 -1.94 -0.30 -4.75 119.30 114.82 2ko7 s MET 77 Ca 0.00 1.90 0.10 0.00 -1.71 0.00 0.00 55.69 55.98 2ko7 s MET 77 Cb 0.00 -1.87 -0.04 0.00 2.01 0.00 0.00 34.83 34.93 2ko7 s MET 77 CO 0.00 -1.54 -0.24 0.15 -0.01 0.00 0.00 175.02 173.38 2ko7 s LYS 78 N -3.51 1.65 0.01 2.03 1.02 -1.26 -1.59 119.74 118.08 2ko7 s LYS 78 Ca 0.79 -1.22 -0.36 0.00 0.02 0.00 0.00 55.97 55.20 2ko7 s LYS 78 Cb -0.33 -1.99 -0.15 0.00 -0.52 0.00 0.00 37.83 34.84 2ko7 s LYS 78 CO 0.39 0.48 1.57 0.28 -0.92 0.00 0.00 175.35 177.15 2ko7 n VAL 79 N 1.18 0.15 -0.81 3.17 0.31 0.79 0.16 118.33 123.28 2ko7 n VAL 79 Ca -0.17 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.13 2ko7 n VAL 79 Cb 0.53 -1.27 0.00 0.00 -0.91 0.00 0.00 33.84 32.18 2ko7 n VAL 79 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2ko7 n GLY 80 N 3.40 0.89 3.83 2.92 0.00 -0.08 -2.68 105.19 113.48 2ko7 n GLY 80 Ca 0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.86 2ko7 n GLY 80 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ko7 s GLY 81 N -1.82 2.09 -0.12 -0.02 0.00 0.12 -3.66 107.32 103.90 2ko7 s GLY 81 Ca 0.00 -0.68 0.01 0.00 0.00 0.00 0.00 44.72 44.05 2ko7 s GLY 81 CO 0.00 -0.41 -0.13 0.14 0.00 0.00 0.00 173.10 172.70 2ko7 s VAL 82 N -0.97 1.40 -0.08 1.40 1.01 -0.51 -1.22 120.40 121.43 2ko7 s VAL 82 Ca 0.14 -0.54 -0.12 0.00 0.00 0.00 0.00 61.98 61.46 2ko7 s VAL 82 Cb -0.12 -1.32 0.03 0.00 0.00 0.00 0.00 36.38 34.97 2ko7 s VAL 82 CO 0.04 0.43 0.31 -0.60 0.00 0.00 0.00 175.10 175.27 2ko7 s ARG 83 N 1.34 0.48 -0.15 2.72 3.52 -0.53 -0.22 118.95 126.12 2ko7 s ARG 83 Ca 0.00 0.19 -0.06 0.00 -0.13 0.00 0.00 55.73 55.74 2ko7 s ARG 83 Cb -0.14 0.22 -0.04 0.00 -1.56 0.00 0.00 34.95 33.44 2ko7 s ARG 83 CO -0.07 -0.09 0.06 0.50 -0.81 0.00 0.00 175.30 174.89 2ko7 s ARG 84 N -0.41 3.62 -0.02 5.12 3.52 0.24 -1.48 118.95 129.54 2ko7 s ARG 84 Ca -0.05 -0.32 0.03 0.00 -0.13 0.00 0.00 55.73 55.26 2ko7 s ARG 84 Cb -0.03 -3.10 -0.00 0.00 -1.56 0.00 0.00 34.95 30.26 2ko7 s ARG 84 CO 0.02 0.48 -0.12 -0.51 -0.81 0.00 0.00 175.30 174.35 2ko7 s LEU 85 N -0.21 1.93 -0.43 -0.88 1.02 -0.63 0.18 118.68 119.67 2ko7 s LEU 85 Ca 0.08 -0.23 -0.19 0.00 0.02 0.00 0.00 54.13 53.80 2ko7 s LEU 85 Cb -0.12 -0.66 0.02 0.00 0.02 0.00 0.00 46.19 45.45 2ko7 s LEU 85 CO 0.01 0.12 0.54 -0.89 0.02 0.00 0.00 176.35 176.16 2ko7 s THR 86 N -0.08 4.96 -0.23 5.49 2.01 0.11 -1.74 115.64 126.14 2ko7 s THR 86 Ca 0.01 -0.14 -0.14 0.00 0.31 0.00 0.00 61.69 61.73 2ko7 s THR 86 Cb -0.07 -4.13 -0.04 0.00 0.01 0.00 0.00 72.50 68.27 2ko7 s THR 86 CO 0.00 -0.52 0.34 -0.63 -0.69 0.00 0.00 174.62 173.12 2ko7 s ILE 87 N 2.48 5.23 1.05 1.82 1.01 0.95 -1.49 121.20 132.25 2ko7 s ILE 87 Ca 0.17 0.55 -0.14 0.00 0.00 0.00 0.00 60.65 61.23 2ko7 s ILE 87 Cb -0.16 -3.67 0.21 0.00 0.01 0.00 0.00 42.46 38.86 2ko7 s ILE 87 CO 0.16 0.24 1.10 -2.16 0.00 0.00 0.00 174.94 174.28 2ko7 s PRO 88 N 1.49 0.00 0.24 2.79 0.04 -1.26 -1.38 135.00 136.92 2ko7 s PRO 88 Ca 0.15 0.37 0.02 0.00 0.04 0.00 0.00 61.00 61.58 2ko7 s PRO 88 Cb -0.15 -1.70 0.28 0.00 0.04 0.00 0.00 34.50 32.98 2ko7 s PRO 88 CO 0.08 -2.99 1.61 -1.00 0.04 0.00 0.00 177.00 174.75 2ko7 h PRO 89 N -2.07 0.42 0.00 0.56 0.13 -1.91 -1.55 132.00 127.58 2ko7 h PRO 89 Ca -0.53 -0.22 0.00 0.00 -0.87 0.00 0.00 66.00 64.37 2ko7 h PRO 89 Cb 1.33 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.46 2ko7 h PRO 89 CO 0.53 0.79 0.00 0.00 -0.23 0.00 0.00 178.00 179.09 2ko7 n GLN 90 N -4.00 0.06 0.00 0.86 10.64 -1.26 -0.00 117.38 123.67 2ko7 n GLN 90 Ca -0.02 0.37 0.00 0.00 -1.83 0.00 0.00 57.00 55.52 2ko7 n GLN 90 Cb 0.52 -1.63 0.00 0.00 -0.86 0.00 0.00 30.24 28.27 2ko7 n GLN 90 CO 0.00 0.00 0.00 1.28 -1.83 0.00 0.00 177.06 176.51 2ko7 n LEU 91 N -1.75 1.40 0.00 2.61 7.99 -1.03 -4.97 117.00 121.26 2ko7 n LEU 91 Ca 0.02 -1.40 0.00 0.00 -0.01 0.00 0.00 56.01 54.62 2ko7 n LEU 91 Cb 0.14 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.45 2ko7 n LEU 91 CO 0.12 0.35 0.00 0.61 -1.51 0.00 0.00 177.39 176.96 2ko7 n GLY 92 N -0.28 1.64 0.12 -0.72 0.00 -0.61 -1.75 105.19 103.59 2ko7 n GLY 92 Ca 0.00 -0.17 -0.04 0.00 0.00 0.00 0.00 46.02 45.81 2ko7 n GLY 92 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2ko7 h TYR 93 N 0.00 -0.27 0.00 1.61 -1.99 -1.74 -3.47 116.97 111.11 2ko7 h TYR 93 Ca 0.00 -0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.72 2ko7 h TYR 93 Cb 0.00 0.09 0.00 0.00 2.00 0.00 0.00 36.73 38.82 2ko7 h TYR 93 CO 0.00 -0.17 0.00 0.41 -0.00 0.00 0.00 178.16 178.40 2ko7 n GLY 94 N -0.37 0.77 0.04 3.88 0.00 1.00 -4.64 105.19 105.88 2ko7 n GLY 94 Ca -0.04 -2.24 0.08 0.00 0.00 0.00 0.00 46.02 43.82 2ko7 n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ko7 n ALA 95 N -0.21 1.56 -0.18 4.61 0.00 -1.24 -2.96 120.51 122.10 2ko7 n ALA 95 Ca 0.00 0.01 0.27 0.00 0.00 0.00 0.00 53.44 53.72 2ko7 n ALA 95 Cb 0.00 -1.26 0.70 0.00 0.00 0.00 0.00 19.45 18.89 2ko7 n ALA 95 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2ko7 h ARG 96 N 0.00 0.04 -1.27 0.00 9.65 -1.87 -3.39 114.38 117.55 2ko7 h ARG 96 Ca 0.00 -0.00 0.05 0.00 -1.10 0.00 0.00 59.98 58.93 2ko7 h ARG 96 Cb 0.24 -0.01 -0.03 0.00 -1.39 0.00 0.00 29.97 28.78 2ko7 h ARG 96 CO 0.00 0.03 -0.39 0.41 2.80 0.00 0.00 179.97 182.82 2ko7 n GLY 97 N -1.69 -3.08 0.00 2.80 0.00 -1.16 -4.96 105.19 97.10 2ko7 n GLY 97 Ca 0.18 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.98 2ko7 n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ko7 n ALA 98 N -2.31 1.98 -3.00 4.61 0.00 -1.25 -5.05 120.51 115.50 2ko7 n ALA 98 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2ko7 n ALA 98 Cb 0.20 0.29 0.00 0.00 0.00 0.00 0.00 19.45 19.94 2ko7 n ALA 98 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ko7 n GLY 99 N 3.05 3.24 0.09 0.00 0.00 -1.26 -5.02 105.19 105.29 2ko7 n GLY 99 Ca 0.00 -0.92 -0.15 0.00 0.00 0.00 0.00 46.02 44.95 2ko7 n GLY 99 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2ko7 h GLY 100 N 0.00 0.14 1.59 -0.02 0.00 -2.01 -3.24 103.07 99.52 2ko7 h GLY 100 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.05 2ko7 h GLY 100 CO 0.00 0.25 0.00 3.33 0.00 0.00 0.00 176.54 180.12 2ko7 n VAL 101 N -4.51 0.26 -3.59 4.60 0.24 -1.26 -4.37 118.33 109.70 2ko7 n VAL 101 Ca -0.10 0.06 -0.40 0.00 -2.04 0.00 0.00 64.34 61.86 2ko7 n VAL 101 Cb 0.52 -0.67 -0.07 0.00 -1.47 0.00 0.00 33.84 32.15 2ko7 n VAL 101 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2ko7 s ILE 102 N -2.59 4.35 0.96 1.34 1.01 -1.22 -5.05 121.20 120.00 2ko7 s ILE 102 Ca 0.22 -2.78 -0.12 0.00 0.00 0.00 0.00 60.65 57.97 2ko7 s ILE 102 Cb 0.16 -3.77 0.17 0.00 0.01 0.00 0.00 42.46 39.02 2ko7 s ILE 102 CO 0.36 -0.93 1.09 -2.16 0.00 0.00 0.00 174.94 173.31 2ko7 s PRO 103 N 0.03 0.73 0.00 2.79 0.04 -1.26 -3.87 135.00 133.46 2ko7 s PRO 103 Ca 0.17 0.63 0.14 0.00 0.04 0.00 0.00 61.00 61.98 2ko7 s PRO 103 Cb -0.17 -1.76 0.63 0.00 0.04 0.00 0.00 34.50 33.23 2ko7 s PRO 103 CO -0.05 -2.55 1.44 -0.35 0.04 0.00 0.00 177.00 175.53 2ko7 n PRO 104 N -4.07 0.04 -0.11 0.56 -0.04 -1.26 -2.08 135.00 128.04 2ko7 n PRO 104 Ca 0.06 0.24 0.05 0.00 -0.04 0.00 0.00 63.50 63.80 2ko7 n PRO 104 Cb 0.56 -1.50 0.10 0.00 -0.04 0.00 0.00 33.50 32.62 2ko7 n PRO 104 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2ko7 n ASN 105 N -1.46 2.50 -4.79 3.54 2.85 -1.26 -3.61 115.26 113.03 2ko7 n ASN 105 Ca 0.04 -2.40 -0.36 0.00 -0.11 0.00 0.00 54.58 51.75 2ko7 n ASN 105 Cb 0.16 -0.22 -0.05 0.00 1.24 0.00 0.00 39.78 40.91 2ko7 n ASN 105 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2ko7 s ALA 106 N -1.70 3.09 0.02 5.20 0.00 -0.88 -4.90 121.76 122.59 2ko7 s ALA 106 Ca 0.18 0.62 0.00 0.00 0.00 0.00 0.00 51.96 52.76 2ko7 s ALA 106 Cb 0.14 -3.24 -0.04 0.00 0.00 0.00 0.00 23.12 19.98 2ko7 s ALA 106 CO 0.05 -0.11 0.10 0.99 0.00 0.00 0.00 175.76 176.79 2ko7 s THR 107 N -1.74 4.78 -0.11 0.00 2.01 -1.26 -3.70 115.64 115.62 2ko7 s THR 107 Ca 0.58 -0.49 0.02 0.00 0.31 0.00 0.00 61.69 62.11 2ko7 s THR 107 Cb -0.19 -3.23 -0.01 0.00 0.01 0.00 0.00 72.50 69.07 2ko7 s THR 107 CO 0.24 0.27 -0.18 -0.76 -0.69 0.00 0.00 174.62 173.51 2ko7 s LEU 108 N -1.99 2.47 -0.01 4.42 1.43 -0.48 -4.30 118.68 120.21 2ko7 s LEU 108 Ca 0.26 -0.41 -0.01 0.00 -1.03 0.00 0.00 54.13 52.94 2ko7 s LEU 108 Cb -0.12 -1.52 -0.04 0.00 0.03 0.00 0.00 46.19 44.54 2ko7 s LEU 108 CO 0.18 0.18 0.11 -0.69 0.23 0.00 0.00 176.35 176.36 2ko7 s VAL 109 N 0.24 4.94 -0.09 -1.59 1.01 -0.14 -0.03 120.40 124.75 2ko7 s VAL 109 Ca -0.12 -0.31 -0.06 0.00 0.00 0.00 0.00 61.98 61.50 2ko7 s VAL 109 Cb -0.16 -3.26 0.03 0.00 0.00 0.00 0.00 36.38 32.99 2ko7 s VAL 109 CO 0.06 0.36 0.22 -0.36 0.00 0.00 0.00 175.10 175.38 2ko7 s PHE 110 N -1.21 -0.26 -0.24 5.22 0.40 -0.71 0.29 117.98 121.46 2ko7 s PHE 110 Ca 0.23 0.65 -0.10 0.00 -0.60 0.00 0.00 56.93 57.11 2ko7 s PHE 110 Cb -0.12 0.04 -0.05 0.00 0.51 0.00 0.00 43.02 43.41 2ko7 s PHE 110 CO 0.14 -0.17 0.15 -2.00 0.70 0.00 0.00 175.22 174.04 2ko7 s GLU 111 N 0.73 4.02 -0.16 0.44 2.12 -0.19 -1.60 118.70 124.06 2ko7 s GLU 111 Ca -0.05 -0.30 -0.05 0.00 0.36 0.00 0.00 54.97 54.93 2ko7 s GLU 111 Cb -0.07 -3.52 -0.03 0.00 0.26 0.00 0.00 34.13 30.77 2ko7 s GLU 111 CO -0.04 0.02 -0.00 0.08 -0.54 0.00 0.00 175.26 174.77 2ko7 s VAL 112 N 1.16 4.20 -0.28 3.70 1.01 -0.55 -1.26 120.40 128.38 2ko7 s VAL 112 Ca 0.07 -0.25 -0.01 0.00 0.00 0.00 0.00 61.98 61.79 2ko7 s VAL 112 Cb -0.14 -2.86 0.09 0.00 0.00 0.00 0.00 36.38 33.47 2ko7 s VAL 112 CO 0.05 0.49 0.07 -0.70 0.00 0.00 0.00 175.10 175.00 2ko7 s GLU 113 N 0.33 0.83 0.09 2.72 2.12 -0.27 -1.45 118.70 123.06 2ko7 s GLU 113 Ca -0.01 -0.95 -0.31 0.00 0.36 0.00 0.00 54.97 54.05 2ko7 s GLU 113 Cb -0.13 -2.12 -0.07 0.00 0.26 0.00 0.00 34.13 32.06 2ko7 s GLU 113 CO 0.02 -0.87 1.37 -1.17 -0.54 0.00 0.00 175.26 174.07 2ko7 s LEU 114 N 1.62 4.36 -0.22 2.70 1.98 -0.36 -0.83 118.68 127.93 2ko7 s LEU 114 Ca 0.06 2.25 -0.04 0.00 -2.89 0.00 0.00 54.13 53.51 2ko7 s LEU 114 Cb -0.17 -3.58 -0.12 0.00 0.66 0.00 0.00 46.19 42.98 2ko7 s LEU 114 CO -0.19 -0.65 -0.23 0.18 -1.89 0.00 0.00 176.35 173.57 2ko7 n LEU 115 N 4.23 2.36 -3.61 -0.68 4.32 -0.57 -0.90 117.00 122.16 2ko7 n LEU 115 Ca 0.12 0.06 0.02 0.00 -0.02 0.00 0.00 56.01 56.18 2ko7 n LEU 115 Cb 0.43 -0.70 -0.00 0.00 -1.62 0.00 0.00 43.42 41.52 2ko7 n LEU 115 CO 0.58 0.68 1.08 -0.62 -1.22 0.00 0.00 177.39 177.89 2ko7 s ASP 116 N -6.48 -0.05 0.00 -1.43 2.15 -1.14 -4.32 116.67 105.39 2ko7 s ASP 116 Ca -0.30 -0.12 0.12 0.00 0.43 0.00 0.00 52.55 52.68 2ko7 s ASP 116 Cb 0.09 0.14 0.09 0.00 -0.30 0.00 0.00 42.92 42.95 2ko7 s ASP 116 CO 0.45 -0.27 0.87 1.33 -0.17 0.00 0.00 175.17 177.38