#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kcx n ASP 2 N 0.00 2.75 -1.01 4.04 2.03 -1.26 -4.71 116.55 118.39 2kcx n ASP 2 Ca 0.00 -2.70 -0.00 0.00 0.52 0.00 0.00 54.79 52.61 2kcx n ASP 2 Cb 0.00 -1.24 0.00 0.00 -0.72 0.00 0.00 41.12 39.16 2kcx n ASP 2 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 2kcx n SER 3 N 8.06 -0.01 -3.97 1.67 7.64 -1.26 -5.01 113.62 120.74 2kcx n SER 3 Ca 0.49 -1.00 -0.25 0.00 1.01 0.00 0.00 58.87 59.12 2kcx n SER 3 Cb 0.41 0.01 -0.17 0.00 -1.01 0.00 0.00 64.21 63.46 2kcx n SER 3 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2kcx s ASP 5 N 1.01 6.43 -1.96 0.00 1.01 -1.26 -4.38 116.67 117.52 2kcx s ASP 5 Ca -0.08 0.01 0.00 0.00 0.71 0.00 0.00 52.55 53.19 2kcx s ASP 5 Cb -0.15 -2.36 0.00 0.00 1.01 0.00 0.00 42.92 41.42 2kcx s ASP 5 CO -0.00 -0.77 0.00 0.61 0.21 0.00 0.00 175.17 175.22 2kcx n GLY 6 N 4.82 1.37 3.32 0.21 0.00 -1.26 -4.95 105.19 108.70 2kcx n GLY 6 Ca 0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.64 2kcx n GLY 6 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2kcx s VAL 7 N -2.69 4.16 -0.50 1.61 1.01 -1.26 -5.07 120.40 117.66 2kcx s VAL 7 Ca 0.00 -1.04 -0.21 0.00 0.00 0.00 0.00 61.98 60.73 2kcx s VAL 7 Cb 0.00 -3.36 0.05 0.00 0.00 0.00 0.00 36.38 33.06 2kcx s VAL 7 CO 0.00 -0.23 0.72 -1.61 0.00 0.00 0.00 175.10 173.97 2kcx s GLU 8 N 1.47 3.21 -0.11 2.72 0.41 -1.26 -4.92 118.70 120.22 2kcx s GLU 8 Ca 0.00 -0.61 -0.10 0.00 -0.41 0.00 0.00 54.97 53.86 2kcx s GLU 8 Cb -0.20 -4.05 0.03 0.00 -1.78 0.00 0.00 34.13 28.13 2kcx s GLU 8 CO 0.04 -1.25 0.30 0.00 -0.49 0.00 0.00 175.26 173.86 2kcx n GLY 10 N 3.13 3.16 3.45 0.00 0.00 -0.00 -4.44 105.19 110.49 2kcx n GLY 10 Ca -0.15 -0.09 -0.48 0.00 0.00 0.00 0.00 46.02 45.30 2kcx n GLY 10 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2kcx n PRO 11 N 0.00 0.92 0.00 1.61 -0.02 -1.26 -1.23 135.00 135.02 2kcx n PRO 11 Ca 0.00 0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 2kcx n PRO 11 Cb 0.00 -2.43 0.00 0.00 -0.02 0.00 0.00 33.50 31.05 2kcx n PRO 11 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2kcx n GLY 12 N 6.53 3.17 2.92 -1.23 0.00 -1.26 -5.04 105.19 110.28 2kcx n GLY 12 Ca 0.44 -0.90 -0.18 0.00 0.00 0.00 0.00 46.02 45.38 2kcx n GLY 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kcx s LYS 13 N 0.00 0.58 -0.09 1.61 1.02 -0.36 -1.69 119.74 120.81 2kcx s LYS 13 Ca 0.00 -0.13 -0.02 0.00 0.02 0.00 0.00 55.97 55.84 2kcx s LYS 13 Cb 0.00 -0.60 -0.03 0.00 -0.52 0.00 0.00 37.83 36.68 2kcx s LYS 13 CO 0.00 0.02 -0.01 0.00 -0.92 0.00 0.00 175.35 174.44 2kcx s ALA 14 N 0.39 3.23 -0.24 5.17 0.00 0.43 -0.82 121.76 129.92 2kcx s ALA 14 Ca -0.05 -0.82 -0.10 0.00 0.00 0.00 0.00 51.96 50.99 2kcx s ALA 14 Cb -0.08 -1.47 -0.05 0.00 0.00 0.00 0.00 23.12 21.52 2kcx s ALA 14 CO -0.00 0.55 0.16 0.00 0.00 0.00 0.00 175.76 176.46 2kcx s ARG 16 N 1.03 0.74 -0.63 0.00 3.52 0.00 -4.68 118.95 118.93 2kcx s ARG 16 Ca 0.07 -1.03 -0.28 0.00 -0.13 0.00 0.00 55.73 54.36 2kcx s ARG 16 Cb -0.13 0.28 0.03 0.00 -1.56 0.00 0.00 34.95 33.57 2kcx s ARG 16 CO 0.04 -0.20 1.29 -1.64 -0.81 0.00 0.00 175.30 173.98 2kcx s MET 17 N -3.77 3.34 -0.03 5.12 -1.94 -1.26 -0.10 119.30 120.66 2kcx s MET 17 Ca 0.05 0.14 0.05 0.00 -1.71 0.00 0.00 55.69 54.21 2kcx s MET 17 Cb 0.05 -4.10 -0.03 0.00 2.01 0.00 0.00 34.83 32.76 2kcx s MET 17 CO -0.10 -1.92 -0.16 -0.51 -0.01 0.00 0.00 175.02 172.32 2kcx s LEU 18 N 5.56 2.65 -1.91 -0.03 2.01 -0.03 -4.58 118.68 122.35 2kcx s LEU 18 Ca 0.43 -0.27 0.00 0.00 0.01 0.00 0.00 54.13 54.30 2kcx s LEU 18 Cb -0.08 -1.54 0.00 0.00 0.01 0.00 0.00 46.19 44.58 2kcx s LEU 18 CO 0.22 0.32 0.00 0.61 1.01 0.00 0.00 176.35 178.51 2kcx n GLY 19 N 2.14 0.43 2.64 -3.19 0.00 -1.26 -1.55 105.19 104.39 2kcx n GLY 19 Ca -0.17 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2kcx n GLY 19 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kcx n GLY 20 N -0.81 1.38 3.01 -0.02 0.00 -1.26 -5.02 105.19 102.47 2kcx n GLY 20 Ca -0.23 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.61 2kcx n GLY 20 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kcx s ARG 21 N -0.12 0.65 -0.10 1.61 0.52 -0.60 -5.06 118.95 115.86 2kcx s ARG 21 Ca 0.00 -0.31 -0.29 0.00 -0.52 0.00 0.00 55.73 54.61 2kcx s ARG 21 Cb 0.00 -0.63 -0.07 0.00 0.52 0.00 0.00 34.95 34.77 2kcx s ARG 21 CO 0.00 0.17 2.03 -1.25 0.02 0.00 0.00 175.30 176.28 2kcx s PRO 22 N -0.24 3.69 0.22 3.54 0.04 -1.26 -0.85 135.00 140.14 2kcx s PRO 22 Ca 0.03 2.27 0.11 0.00 0.04 0.00 0.00 61.00 63.45 2kcx s PRO 22 Cb -0.03 -4.24 -0.05 0.00 0.04 0.00 0.00 34.50 30.22 2kcx s PRO 22 CO -0.00 -1.47 -0.17 1.03 0.04 0.00 0.00 177.00 176.43 2kcx s ARG 23 N 5.27 1.76 -0.18 4.56 1.81 0.86 -4.89 118.95 128.13 2kcx s ARG 23 Ca 0.92 -1.53 0.00 0.00 -1.72 0.00 0.00 55.73 53.40 2kcx s ARG 23 Cb -0.37 -1.93 0.01 0.00 -0.45 0.00 0.00 34.95 32.22 2kcx s ARG 23 CO 0.38 0.38 -0.17 0.00 -0.68 0.00 0.00 175.30 175.21 2kcx s GLU 25 N 1.23 1.01 0.16 0.00 -1.05 -0.82 -4.87 118.70 114.36 2kcx s GLU 25 Ca 0.03 -1.44 -0.34 0.00 -0.15 0.00 0.00 54.97 53.07 2kcx s GLU 25 Cb -0.14 -0.39 -0.14 0.00 -0.44 0.00 0.00 34.13 33.03 2kcx s GLU 25 CO -0.09 -0.02 1.57 0.00 0.95 0.00 0.00 175.26 177.67 2kcx s ALA 27 N 0.87 2.38 0.49 0.00 0.00 -0.68 -4.75 121.76 120.07 2kcx s ALA 27 Ca 0.78 -1.30 -0.22 0.00 0.00 0.00 0.00 51.96 51.23 2kcx s ALA 27 Cb -0.68 -1.26 -0.07 0.00 0.00 0.00 0.00 23.12 21.12 2kcx s ALA 27 CO 0.38 -0.48 1.17 -1.25 0.00 0.00 0.00 175.76 175.59 2kcx s PRO 28 N 1.27 3.57 0.00 0.00 0.04 -1.26 -4.25 135.00 134.37 2kcx s PRO 28 Ca 0.03 1.76 0.00 0.00 0.04 0.00 0.00 61.00 62.83 2kcx s PRO 28 Cb -0.14 -2.27 0.00 0.00 0.04 0.00 0.00 34.50 32.13 2kcx s PRO 28 CO -0.12 -0.71 0.96 -0.25 0.04 0.00 0.00 177.00 176.93 2kcx n ASP 29 N -0.79 2.79 -0.98 6.66 9.92 -1.26 -4.36 116.55 128.54 2kcx n ASP 29 Ca 0.09 -1.73 0.05 0.00 -0.53 0.00 0.00 54.79 52.67 2kcx n ASP 29 Cb 0.49 -0.50 0.19 0.00 -0.64 0.00 0.00 41.12 40.66 2kcx n ASP 29 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2kcx n SER 31 N 0.46 2.71 0.00 0.00 7.64 -1.26 -1.53 113.62 121.63 2kcx n SER 31 Ca 0.14 -2.67 0.00 0.00 1.01 0.00 0.00 58.87 57.34 2kcx n SER 31 Cb 0.54 -1.45 0.00 0.00 -1.01 0.00 0.00 64.21 62.29 2kcx n SER 31 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2kcx n GLY 32 N 5.30 0.31 3.90 0.23 0.00 -1.26 -5.15 105.19 108.53 2kcx n GLY 32 Ca 0.47 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.18 2kcx n GLY 32 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2kcx s LEU 33 N 0.00 4.22 -0.09 0.99 1.43 -0.58 -5.05 118.68 119.59 2kcx s LEU 33 Ca 0.00 0.64 -0.30 0.00 -1.03 0.00 0.00 54.13 53.45 2kcx s LEU 33 Cb 0.00 -3.39 -0.05 0.00 0.03 0.00 0.00 46.19 42.78 2kcx s LEU 33 CO 0.00 -0.01 1.60 -2.16 0.23 0.00 0.00 176.35 176.01 2kcx s PRO 34 N -2.88 4.13 0.00 1.29 0.04 -1.26 -4.89 135.00 131.43 2kcx s PRO 34 Ca 0.42 2.06 0.26 0.00 0.04 0.00 0.00 61.00 63.78 2kcx s PRO 34 Cb -0.12 -3.97 0.59 0.00 0.04 0.00 0.00 34.50 31.04 2kcx s PRO 34 CO 0.25 -0.89 1.46 0.00 0.04 0.00 0.00 177.00 177.86 2kcx n ALA 35 N 7.26 3.15 0.95 8.56 0.00 -1.26 -3.54 120.51 135.62 2kcx n ALA 35 Ca 0.17 -0.47 0.11 0.00 0.00 0.00 0.00 53.44 53.25 2kcx n ALA 35 Cb 0.43 -1.05 0.07 0.00 0.00 0.00 0.00 19.45 18.91 2kcx n ALA 35 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2kcx n ARG 36 N -0.42 1.97 -4.03 0.00 1.74 -1.26 -4.70 116.66 109.97 2kcx n ARG 36 Ca 0.12 -1.67 -0.34 0.00 -0.77 0.00 0.00 57.85 55.19 2kcx n ARG 36 Cb 0.38 -1.44 -0.15 0.00 -1.02 0.00 0.00 32.46 30.23 2kcx n ARG 36 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2kcx s LEU 37 N -2.00 2.55 0.95 0.55 2.96 -1.25 -5.03 118.68 117.41 2kcx s LEU 37 Ca 0.25 -0.61 -0.11 0.00 -0.22 0.00 0.00 54.13 53.43 2kcx s LEU 37 Cb 0.19 -1.59 0.16 0.00 0.50 0.00 0.00 46.19 45.45 2kcx s LEU 37 CO 0.34 -0.03 1.10 -1.10 -1.32 0.00 0.00 176.35 175.34 2kcx s GLN 38 N 1.35 0.81 -0.09 1.98 -0.21 -1.21 -2.93 119.66 119.36 2kcx s GLN 38 Ca 0.04 1.15 -0.14 0.00 0.02 0.00 0.00 55.36 56.43 2kcx s GLN 38 Cb -0.14 -1.73 0.03 0.00 1.00 0.00 0.00 33.01 32.17 2kcx s GLN 38 CO -0.08 -2.65 0.36 0.54 -2.12 0.00 0.00 175.29 171.34 2kcx s VAL 39 N -2.72 0.02 -0.21 1.09 0.11 -0.98 0.16 120.40 117.88 2kcx s VAL 39 Ca 0.65 -0.17 -0.10 0.00 -2.93 0.00 0.00 61.98 59.43 2kcx s VAL 39 Cb -0.21 -0.58 -0.05 0.00 -1.53 0.00 0.00 36.38 34.01 2kcx s VAL 39 CO 0.59 -0.10 0.13 0.00 -3.33 0.00 0.00 175.10 172.39 2kcx s GLY 41 N 0.53 1.85 0.30 0.00 0.00 -1.01 -2.14 107.32 106.84 2kcx s GLY 41 Ca 0.07 -1.97 0.21 0.00 0.00 0.00 0.00 44.72 43.03 2kcx s GLY 41 CO -0.00 -1.71 1.65 -1.14 0.00 0.00 0.00 173.10 171.90 2kcx n SER 42 N -2.12 0.57 0.17 1.64 3.41 0.10 -1.07 113.62 116.31 2kcx n SER 42 Ca 0.12 0.74 0.14 0.00 -0.26 0.00 0.00 58.87 59.61 2kcx n SER 42 Cb 0.62 -0.82 0.49 0.00 -0.26 0.00 0.00 64.21 64.23 2kcx n SER 42 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 2kcx h ASP 43 N 0.00 0.00 0.00 4.04 3.58 -1.85 -3.47 116.42 118.72 2kcx h ASP 43 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2kcx h ASP 43 Cb 0.07 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.12 2kcx h ASP 43 CO 0.00 0.00 0.00 0.61 -2.88 0.00 0.00 179.24 176.97 2kcx n GLY 44 N 0.42 1.69 3.91 -0.78 0.00 -0.23 -5.06 105.19 105.13 2kcx n GLY 44 Ca 0.03 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.77 2kcx n GLY 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kcx s ALA 45 N -2.41 3.90 0.24 4.61 0.00 -1.26 -4.87 121.76 121.97 2kcx s ALA 45 Ca 0.00 -1.02 -0.18 0.00 0.00 0.00 0.00 51.96 50.76 2kcx s ALA 45 Cb 0.00 -1.72 -0.08 0.00 0.00 0.00 0.00 23.12 21.32 2kcx s ALA 45 CO 0.00 0.60 0.71 0.99 0.00 0.00 0.00 175.76 178.06 2kcx s THR 46 N -1.68 4.62 0.29 0.00 2.01 -1.26 -2.42 115.64 117.21 2kcx s THR 46 Ca 0.34 1.17 0.11 0.00 0.31 0.00 0.00 61.69 63.62 2kcx s THR 46 Cb -0.11 -3.79 -0.05 0.00 0.01 0.00 0.00 72.50 68.55 2kcx s THR 46 CO 0.27 0.13 -0.17 -0.31 -0.69 0.00 0.00 174.62 173.85 2kcx s TYR 47 N -1.62 2.33 0.26 4.92 2.02 0.10 -4.95 117.35 120.42 2kcx s TYR 47 Ca 0.45 -0.35 -0.02 0.00 -0.37 0.00 0.00 57.07 56.78 2kcx s TYR 47 Cb -0.15 -1.07 0.53 0.00 -0.40 0.00 0.00 41.96 40.86 2kcx s TYR 47 CO 0.20 0.69 1.74 -0.09 -1.57 0.00 0.00 175.55 176.52 2kcx h ARG 48 N 2.20 0.51 -3.01 -0.62 1.12 -1.92 -2.60 114.38 110.06 2kcx h ARG 48 Ca -0.41 -0.03 -0.01 0.00 -1.11 0.00 0.00 59.98 58.43 2kcx h ARG 48 Cb 1.26 -0.11 -0.01 0.00 -0.01 0.00 0.00 29.97 31.10 2kcx h ARG 48 CO 0.62 0.34 0.26 0.16 -3.11 0.00 0.00 179.97 178.23 2kcx s ASP 49 N -5.36 -0.03 0.14 -3.80 -4.77 -1.26 -3.31 116.67 98.28 2kcx s ASP 49 Ca -0.12 -1.07 -0.17 0.00 -3.30 0.00 0.00 52.55 47.88 2kcx s ASP 49 Cb 0.22 0.83 0.01 0.00 -1.09 0.00 0.00 42.92 42.89 2kcx s ASP 49 CO 0.77 -1.64 1.76 -0.08 0.70 0.00 0.00 175.17 176.69 2kcx h GLU 50 N 2.00 0.26 -0.61 2.11 4.22 -1.58 -1.83 114.58 119.16 2kcx h GLU 50 Ca -0.30 -0.02 -0.09 0.00 0.08 0.00 0.00 59.36 59.03 2kcx h GLU 50 Cb 1.25 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.42 2kcx h GLU 50 CO 0.38 0.17 0.03 0.00 -2.18 0.00 0.00 179.01 177.41 2kcx h GLU 52 N 0.97 0.72 0.35 0.00 4.57 -1.80 0.21 114.58 119.61 2kcx h GLU 52 Ca 0.18 -0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 58.31 2kcx h GLU 52 Cb 0.52 -0.16 -0.02 0.00 -0.16 0.00 0.00 28.75 28.93 2kcx h GLU 52 CO 0.03 0.48 -0.32 1.25 -1.18 0.00 0.00 179.01 179.26 2kcx h LEU 53 N 0.74 -0.85 -1.60 1.64 6.46 -1.07 0.16 115.31 120.78 2kcx h LEU 53 Ca 0.51 0.07 -0.04 0.00 -0.12 0.00 0.00 57.88 58.30 2kcx h LEU 53 Cb 0.71 0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 40.92 2kcx h LEU 53 CO -0.35 -0.46 -0.21 0.03 -0.62 0.00 0.00 178.44 176.83 2kcx h ARG 54 N -0.69 0.00 -0.25 1.25 3.08 -1.29 -1.00 114.38 115.48 2kcx h ARG 54 Ca -0.02 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.93 2kcx h ARG 54 Cb 0.62 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.66 2kcx h ARG 54 CO -0.04 0.21 -0.23 0.00 -1.07 0.00 0.00 179.97 178.84 2kcx h ALA 55 N 1.79 0.36 -0.76 0.04 0.00 -0.25 -2.63 119.26 117.82 2kcx h ALA 55 Ca -0.00 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.51 2kcx h ALA 55 Cb 0.38 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 2kcx h ALA 55 CO 0.03 0.32 0.37 0.00 0.00 0.00 0.00 179.25 179.97 2kcx h ALA 56 N 0.68 1.23 -0.22 0.00 0.00 -0.16 -2.41 119.26 118.37 2kcx h ALA 56 Ca 0.04 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 54.85 2kcx h ALA 56 Cb 0.78 -0.30 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 2kcx h ALA 56 CO 0.06 0.60 -0.07 -0.09 0.00 0.00 0.00 179.25 179.74 2kcx h ARG 57 N 1.08 -0.03 -0.02 0.00 2.43 -1.12 -1.66 114.38 115.06 2kcx h ARG 57 Ca 0.26 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.44 2kcx h ARG 57 Cb 0.09 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 2kcx h ARG 57 CO -0.04 -0.02 0.00 0.00 -1.51 0.00 0.00 179.97 178.41 2kcx n ARG 59 N -0.57 3.27 -0.42 0.00 1.74 -0.62 -4.83 116.66 115.22 2kcx n ARG 59 Ca 0.09 -3.99 0.00 0.00 -0.77 0.00 0.00 57.85 53.19 2kcx n ARG 59 Cb 0.07 -2.29 0.00 0.00 -1.02 0.00 0.00 32.46 29.22 2kcx n ARG 59 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2kcx n GLY 60 N -0.45 0.73 2.32 -0.13 0.00 -1.25 -4.99 105.19 101.42 2kcx n GLY 60 Ca 0.48 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.25 2kcx n GLY 60 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2kcx n HIS 61 N -2.13 0.39 0.58 1.61 -0.00 -0.91 -4.94 115.22 109.83 2kcx n HIS 61 Ca 0.00 -3.65 0.07 0.00 -0.00 0.00 0.00 57.72 54.14 2kcx n HIS 61 Cb 0.00 -0.26 0.32 0.00 -0.00 0.00 0.00 29.99 30.05 2kcx n HIS 61 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.34 174.04 2kcx n PRO 62 N 1.68 0.12 0.00 1.57 -0.02 -0.97 -2.89 135.00 134.48 2kcx n PRO 62 Ca 0.24 0.20 0.07 0.00 -2.02 0.00 0.00 63.50 61.99 2kcx n PRO 62 Cb 0.49 -1.50 0.31 0.00 -0.02 0.00 0.00 33.50 32.78 2kcx n PRO 62 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2kcx n ASP 63 N -1.37 0.00 -4.71 2.55 9.92 -1.26 -4.79 116.55 116.89 2kcx n ASP 63 Ca 0.05 0.42 -0.40 0.00 -0.53 0.00 0.00 54.79 54.33 2kcx n ASP 63 Cb 0.13 -0.46 -0.04 0.00 -0.64 0.00 0.00 41.12 40.11 2kcx n ASP 63 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 2kcx s LEU 64 N -2.92 4.30 0.14 0.64 2.96 -1.14 -4.75 118.68 117.92 2kcx s LEU 64 Ca 0.08 1.24 0.07 0.00 -0.22 0.00 0.00 54.13 55.30 2kcx s LEU 64 Cb 0.09 -3.16 -0.04 0.00 0.50 0.00 0.00 46.19 43.58 2kcx s LEU 64 CO 0.25 -0.17 -0.15 -0.44 -1.32 0.00 0.00 176.35 174.51 2kcx s SER 65 N 0.88 2.27 -0.17 3.68 0.01 -1.26 -4.92 113.70 114.18 2kcx s SER 65 Ca 0.39 -0.85 -0.26 0.00 1.31 0.00 0.00 55.95 56.55 2kcx s SER 65 Cb -0.18 -0.10 -0.01 0.00 0.21 0.00 0.00 66.02 65.94 2kcx s SER 65 CO 0.19 -0.12 0.85 0.54 0.41 0.00 0.00 173.24 175.11 2kcx s VAL 66 N -2.22 4.86 -0.18 3.43 0.11 -1.26 0.01 120.40 125.15 2kcx s VAL 66 Ca 0.13 1.68 -0.17 0.00 -2.93 0.00 0.00 61.98 60.68 2kcx s VAL 66 Cb -0.05 -4.16 -0.06 0.00 -1.53 0.00 0.00 36.38 30.59 2kcx s VAL 66 CO 0.04 0.01 -0.34 0.23 -3.33 0.00 0.00 175.10 171.71 2kcx n MET 67 N 5.31 0.52 -3.67 1.54 2.81 -0.91 -4.89 117.12 117.83 2kcx n MET 67 Ca 0.05 0.21 -0.15 0.00 -1.81 0.00 0.00 57.70 56.00 2kcx n MET 67 Cb 0.49 -1.41 -0.08 0.00 -0.71 0.00 0.00 33.22 31.50 2kcx n MET 67 CO 0.00 0.00 0.00 1.52 1.51 0.00 0.00 175.97 179.00 2kcx s TYR 68 N -2.87 -0.48 -0.45 2.03 1.13 -1.16 -5.05 117.35 110.50 2kcx s TYR 68 Ca -0.29 1.00 -0.27 0.00 -1.41 0.00 0.00 57.07 56.10 2kcx s TYR 68 Cb 0.05 0.22 0.03 0.00 -1.10 0.00 0.00 41.96 41.15 2kcx s TYR 68 CO 0.42 -0.39 1.01 1.03 -2.51 0.00 0.00 175.55 175.10 2kcx s ARG 69 N -0.57 3.65 0.00 -3.49 0.52 -1.26 -1.46 118.95 116.34 2kcx s ARG 69 Ca -0.07 0.38 0.00 0.00 -0.52 0.00 0.00 55.73 55.52 2kcx s ARG 69 Cb -0.03 -3.90 0.00 0.00 0.52 0.00 0.00 34.95 31.54 2kcx s ARG 69 CO 0.04 -1.24 0.00 0.41 0.02 0.00 0.00 175.30 174.53 2kcx n GLY 70 N 4.81 0.06 3.78 -3.53 0.00 0.12 -4.91 105.19 105.52 2kcx n GLY 70 Ca 0.08 -1.57 -0.39 0.00 0.00 0.00 0.00 46.02 44.15 2kcx n GLY 70 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kcx s ARG 71 N -1.62 4.59 -0.38 1.61 0.52 -1.26 -2.95 118.95 119.46 2kcx s ARG 71 Ca 0.00 1.20 -0.27 0.00 -0.52 0.00 0.00 55.73 56.14 2kcx s ARG 71 Cb 0.00 -3.19 -0.05 0.00 0.52 0.00 0.00 34.95 32.23 2kcx s ARG 71 CO 0.00 0.52 2.23 0.00 0.02 0.00 0.00 175.30 178.07 2kcx s ARG 73 N 7.16 4.31 0.00 0.00 0.52 -1.26 -5.06 118.95 124.62 2kcx s ARG 73 Ca 0.94 0.52 0.11 0.00 -0.52 0.00 0.00 55.73 56.78 2kcx s ARG 73 Cb -0.23 -3.41 0.09 0.00 0.52 0.00 0.00 34.95 31.91 2kcx s ARG 73 CO 0.30 0.22 0.84 0.36 0.02 0.00 0.00 175.30 177.04