#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kcx s ASP 2 N 0.00 4.63 -0.01 4.04 1.01 -1.26 -4.74 116.67 120.34 2kcx s ASP 2 Ca 0.00 -1.20 -0.04 0.00 0.71 0.00 0.00 52.55 52.03 2kcx s ASP 2 Cb 0.00 0.22 -0.00 0.00 1.01 0.00 0.00 42.92 44.15 2kcx s ASP 2 CO 0.00 -0.99 0.07 -0.44 0.21 0.00 0.00 175.17 174.03 2kcx s SER 3 N -4.21 0.04 0.47 0.27 0.01 -1.26 -3.24 113.70 105.78 2kcx s SER 3 Ca 0.35 -0.13 0.09 0.00 1.31 0.00 0.00 55.95 57.56 2kcx s SER 3 Cb -0.01 0.17 0.04 0.00 0.21 0.00 0.00 66.02 66.42 2kcx s SER 3 CO 0.21 -0.22 0.65 0.00 0.41 0.00 0.00 173.24 174.29 2kcx n ASP 5 N -1.99 2.44 0.00 0.00 -0.08 -1.26 -0.28 116.55 115.39 2kcx n ASP 5 Ca 0.11 0.56 0.00 0.00 -1.51 0.00 0.00 54.79 53.95 2kcx n ASP 5 Cb 0.60 -1.28 0.00 0.00 2.34 0.00 0.00 41.12 42.77 2kcx n ASP 5 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2kcx n GLY 6 N 5.90 0.52 3.46 0.27 0.00 -1.26 -4.92 105.19 109.16 2kcx n GLY 6 Ca 0.36 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.51 4.18 -0.44 1.61 1.01 0.62 -5.08 120.40 119.80 2kcx s VAL 7 Ca 0.00 -0.22 -0.21 0.00 0.00 0.00 0.00 61.98 61.54 2kcx s VAL 7 Cb 0.00 -2.93 0.02 0.00 0.00 0.00 0.00 36.38 33.48 2kcx s VAL 7 CO 0.00 0.38 0.68 -1.83 0.00 0.00 0.00 175.10 174.34 2kcx s GLU 8 N 1.29 3.33 0.38 2.72 -1.05 -1.26 -2.95 118.70 121.15 2kcx s GLU 8 Ca 0.04 -0.29 0.06 0.00 -0.15 0.00 0.00 54.97 54.64 2kcx s GLU 8 Cb -0.15 -3.94 -0.02 0.00 -0.44 0.00 0.00 34.13 29.58 2kcx s GLU 8 CO 0.02 -1.03 0.23 0.00 0.95 0.00 0.00 175.26 175.44 2kcx n GLY 10 N -0.78 1.35 3.56 0.00 0.00 0.30 -4.62 105.19 105.01 2kcx n GLY 10 Ca 0.02 -0.46 -0.14 0.00 0.00 0.00 0.00 46.02 45.45 2kcx n GLY 10 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2kcx s PRO 11 N 0.00 1.57 0.00 1.61 0.02 -1.26 -2.07 135.00 134.87 2kcx s PRO 11 Ca 0.00 0.32 0.00 0.00 0.02 0.00 0.00 61.00 61.34 2kcx s PRO 11 Cb 0.00 -4.83 0.00 0.00 0.02 0.00 0.00 34.50 29.69 2kcx s PRO 11 CO 0.00 -4.57 0.00 0.41 -0.33 0.00 0.00 177.00 172.51 2kcx n GLY 12 N 6.72 0.57 2.89 0.52 0.00 -1.26 -5.01 105.19 109.62 2kcx n GLY 12 Ca 0.46 -0.26 -0.13 0.00 0.00 0.00 0.00 46.02 46.09 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 -0.60 0.04 0.04 1.61 1.02 -0.88 -0.94 119.74 120.02 2kcx s LYS 13 Ca 0.00 0.13 0.06 0.00 0.02 0.00 0.00 55.97 56.17 2kcx s LYS 13 Cb 0.00 -0.06 -0.02 0.00 -0.52 0.00 0.00 37.83 37.23 2kcx s LYS 13 CO 0.00 -0.06 -0.16 0.00 -0.92 0.00 0.00 175.35 174.21 2kcx s ALA 14 N 0.39 1.36 0.02 5.17 0.00 -0.03 -0.54 121.76 128.14 2kcx s ALA 14 Ca -0.03 -0.88 0.08 0.00 0.00 0.00 0.00 51.96 51.12 2kcx s ALA 14 Cb -0.04 -0.24 -0.02 0.00 0.00 0.00 0.00 23.12 22.81 2kcx s ALA 14 CO -0.01 0.28 -0.23 0.00 0.00 0.00 0.00 175.76 175.80 2kcx s ARG 16 N -0.99 0.42 -0.22 0.00 3.52 -0.34 -4.86 118.95 116.47 2kcx s ARG 16 Ca 0.09 -0.37 -0.28 0.00 -0.13 0.00 0.00 55.73 55.04 2kcx s ARG 16 Cb -0.09 0.17 0.01 0.00 -1.56 0.00 0.00 34.95 33.48 2kcx s ARG 16 CO 0.01 -0.09 1.00 -1.64 -0.81 0.00 0.00 175.30 173.76 2kcx s MET 17 N -1.23 4.26 -0.51 5.12 -1.94 -1.26 -1.03 119.30 122.70 2kcx s MET 17 Ca -0.13 1.28 -0.21 0.00 -1.71 0.00 0.00 55.69 54.92 2kcx s MET 17 Cb -0.07 -3.63 0.05 0.00 2.01 0.00 0.00 34.83 33.18 2kcx s MET 17 CO 0.01 -0.59 0.72 -0.51 -0.01 0.00 0.00 175.02 174.64 2kcx s LEU 18 N 3.04 4.65 0.00 -0.03 2.01 0.13 -4.83 118.68 123.65 2kcx s LEU 18 Ca 0.42 -0.68 0.00 0.00 0.01 0.00 0.00 54.13 53.89 2kcx s LEU 18 Cb -0.15 -2.59 0.00 0.00 0.01 0.00 0.00 46.19 43.45 2kcx s LEU 18 CO 0.07 -0.98 0.00 0.61 1.01 0.00 0.00 176.35 177.06 2kcx n GLY 19 N 5.14 0.57 0.03 -3.19 0.00 -1.26 -1.87 105.19 104.61 2kcx n GLY 19 Ca -0.03 0.55 0.02 0.00 0.00 0.00 0.00 46.02 46.56 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 0.00 0.35 3.23 -0.02 0.00 -1.26 -5.03 105.19 102.46 2kcx n GLY 20 Ca 0.00 -0.10 -0.31 0.00 0.00 0.00 0.00 46.02 45.61 2kcx n GLY 20 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2kcx s ARG 21 N -1.16 2.60 -0.04 1.61 1.70 -0.78 -5.09 118.95 117.78 2kcx s ARG 21 Ca 0.02 -0.84 -0.28 0.00 -0.47 0.00 0.00 55.73 54.16 2kcx s ARG 21 Cb 0.03 -2.11 -0.03 0.00 -0.57 0.00 0.00 34.95 32.27 2kcx s ARG 21 CO 0.13 0.28 0.91 -1.25 -1.08 0.00 0.00 175.30 174.29 2kcx s PRO 22 N 0.07 4.49 0.14 3.89 0.05 -1.26 0.19 135.00 142.57 2kcx s PRO 22 Ca -0.09 1.26 0.07 0.00 0.05 0.00 0.00 61.00 62.29 2kcx s PRO 22 Cb -0.15 -3.48 -0.04 0.00 0.05 0.00 0.00 34.50 30.88 2kcx s PRO 22 CO 0.05 -0.08 -0.05 1.03 0.05 0.00 0.00 177.00 178.00 2kcx s ARG 23 N 1.20 2.27 -0.04 4.56 1.81 -0.20 -4.91 118.95 123.63 2kcx s ARG 23 Ca 0.47 -1.07 0.07 0.00 -1.72 0.00 0.00 55.73 53.47 2kcx s ARG 23 Cb -0.19 -2.33 -0.01 0.00 -0.45 0.00 0.00 34.95 31.96 2kcx s ARG 23 CO 0.23 0.48 -0.25 0.00 -0.68 0.00 0.00 175.30 175.08 2kcx s GLU 25 N -0.34 0.80 -0.49 0.00 0.41 0.03 -4.95 118.70 114.16 2kcx s GLU 25 Ca 0.02 -0.71 -0.26 0.00 -0.41 0.00 0.00 54.97 53.61 2kcx s GLU 25 Cb -0.12 -0.76 -0.07 0.00 -1.78 0.00 0.00 34.13 31.40 2kcx s GLU 25 CO 0.02 0.18 2.41 0.00 -0.49 0.00 0.00 175.26 177.38 2kcx s ALA 27 N 12.17 2.63 -0.29 0.00 0.00 -0.12 -4.82 121.76 131.33 2kcx s ALA 27 Ca 0.98 -1.66 -0.28 0.00 0.00 0.00 0.00 51.96 51.00 2kcx s ALA 27 Cb -0.17 -0.37 -0.06 0.00 0.00 0.00 0.00 23.12 22.52 2kcx s ALA 27 CO 0.26 0.41 2.27 -2.30 0.00 0.00 0.00 175.76 176.40 2kcx n PRO 28 N 0.07 1.73 -2.53 0.00 -0.02 -1.26 -3.49 135.00 129.50 2kcx n PRO 28 Ca -0.11 0.40 -0.41 0.00 -2.02 0.00 0.00 63.50 61.36 2kcx n PRO 28 Cb 0.57 -3.27 -0.02 0.00 -0.02 0.00 0.00 33.50 30.76 2kcx n PRO 28 CO 0.00 0.00 0.00 0.16 1.98 0.00 0.00 175.50 177.64 2kcx s ASP 29 N 9.23 6.56 -1.14 2.55 -4.77 -1.26 -4.93 116.67 122.91 2kcx s ASP 29 Ca 1.01 -1.97 -0.19 0.00 -3.30 0.00 0.00 52.55 48.10 2kcx s ASP 29 Cb -0.31 -2.58 0.10 0.00 -1.09 0.00 0.00 42.92 39.04 2kcx s ASP 29 CO 0.33 -1.45 1.49 0.00 0.70 0.00 0.00 175.17 176.24 2kcx n SER 31 N 7.62 0.00 -4.58 0.00 2.88 -1.26 -4.80 113.62 113.48 2kcx n SER 31 Ca 0.38 0.00 -0.24 0.00 -1.33 0.00 0.00 58.87 57.68 2kcx n SER 31 Cb 0.47 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.85 2kcx n SER 31 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2kcx s GLY 32 N 0.00 -0.27 -0.06 0.46 0.00 -1.26 -4.84 107.32 101.35 2kcx s GLY 32 Ca 0.00 -1.89 -0.23 0.00 0.00 0.00 0.00 44.72 42.60 2kcx s GLY 32 CO 0.00 3.80 0.52 0.48 0.00 0.00 0.00 173.10 177.90 2kcx s LEU 33 N 13.00 -0.00 -0.23 0.66 0.05 -1.26 -5.14 118.68 125.76 2kcx s LEU 33 Ca 0.73 0.53 -0.26 0.00 0.05 0.00 0.00 54.13 55.18 2kcx s LEU 33 Cb -0.03 1.96 0.00 0.00 -2.05 0.00 0.00 46.19 46.07 2kcx s LEU 33 CO 0.14 -0.49 0.91 -2.16 -0.55 0.00 0.00 176.35 174.21 2kcx s PRO 34 N -1.04 4.22 0.00 1.48 0.04 -1.26 -4.94 135.00 133.51 2kcx s PRO 34 Ca -0.10 1.11 0.00 0.00 0.04 0.00 0.00 61.00 62.05 2kcx s PRO 34 Cb -0.03 -3.64 0.00 0.00 0.04 0.00 0.00 34.50 30.88 2kcx s PRO 34 CO 0.06 -0.55 0.55 0.00 0.04 0.00 0.00 177.00 177.11 2kcx n ALA 35 N 6.06 2.27 0.04 8.56 0.00 -1.26 -2.73 120.51 133.45 2kcx n ALA 35 Ca 0.08 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.55 2kcx n ALA 35 Cb 0.47 -1.00 -0.04 0.00 0.00 0.00 0.00 19.45 18.88 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 -0.10 1.12 -2.73 0.00 1.74 -1.26 -4.71 116.66 110.72 2kcx n ARG 36 Ca 0.00 -0.04 -0.43 0.00 -0.77 0.00 0.00 57.85 56.62 2kcx n ARG 36 Cb 0.14 -1.05 -0.03 0.00 -1.02 0.00 0.00 32.46 30.49 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 -3.15 3.82 0.92 0.55 2.96 -1.11 -4.86 118.68 117.82 2kcx s LEU 37 Ca -0.01 -0.16 -0.10 0.00 -0.22 0.00 0.00 54.13 53.63 2kcx s LEU 37 Cb 0.03 -2.97 0.15 0.00 0.50 0.00 0.00 46.19 43.91 2kcx s LEU 37 CO 0.22 -1.34 1.14 0.00 -1.32 0.00 0.00 176.35 175.04 2kcx n GLN 38 N 7.89 -0.49 -3.62 1.98 6.02 -1.20 -2.95 117.38 125.02 2kcx n GLN 38 Ca 0.05 -0.08 -0.15 0.00 -0.01 0.00 0.00 57.00 56.81 2kcx n GLN 38 Cb 0.48 -2.37 -0.07 0.00 1.02 0.00 0.00 30.24 29.30 2kcx n GLN 38 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2kcx s VAL 39 N -2.63 0.01 -0.21 5.09 0.11 -1.01 -0.40 120.40 121.35 2kcx s VAL 39 Ca 0.67 -0.05 -0.10 0.00 -2.93 0.00 0.00 61.98 59.57 2kcx s VAL 39 Cb -0.23 -0.89 -0.05 0.00 -1.53 0.00 0.00 36.38 33.68 2kcx s VAL 39 CO 0.58 -0.03 0.14 0.00 -3.33 0.00 0.00 175.10 172.46 2kcx s GLY 41 N 0.57 1.76 0.61 0.00 0.00 -0.99 -2.01 107.32 107.26 2kcx s GLY 41 Ca 0.08 -1.65 0.41 0.00 0.00 0.00 0.00 44.72 43.56 2kcx s GLY 41 CO -0.00 -1.06 2.25 1.76 0.00 0.00 0.00 173.10 176.05 2kcx h SER 42 N -0.66 0.00 -0.15 1.64 0.02 -1.33 -1.76 113.55 111.31 2kcx h SER 42 Ca -0.38 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.43 2kcx h SER 42 Cb 1.26 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.81 2kcx h SER 42 CO 0.40 0.00 -0.49 -2.24 -1.14 0.00 0.00 176.83 173.37 2kcx h ASP 43 N 0.00 0.69 0.00 3.07 2.03 -1.91 -3.49 116.42 116.81 2kcx h ASP 43 Ca 0.00 -0.60 0.00 0.00 -0.73 0.00 0.00 57.03 55.70 2kcx h ASP 43 Cb 0.04 -0.20 0.00 0.00 -0.83 0.00 0.00 39.33 38.34 2kcx h ASP 43 CO 0.00 1.17 0.00 0.61 -1.03 0.00 0.00 179.24 179.99 2kcx n GLY 44 N 0.57 0.56 3.90 7.15 0.00 -0.66 -5.13 105.19 111.58 2kcx n GLY 44 Ca -0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.62 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 -1.54 3.94 -0.49 4.61 0.00 -1.26 -4.87 121.76 122.14 2kcx s ALA 45 Ca 0.00 -0.77 -0.24 0.00 0.00 0.00 0.00 51.96 50.94 2kcx s ALA 45 Cb 0.00 -1.86 0.03 0.00 0.00 0.00 0.00 23.12 21.29 2kcx s ALA 45 CO 0.00 0.75 0.90 0.99 0.00 0.00 0.00 175.76 178.40 2kcx s THR 46 N -1.32 4.48 0.64 0.00 2.01 -1.26 -2.36 115.64 117.83 2kcx s THR 46 Ca 0.27 0.49 -0.11 0.00 0.31 0.00 0.00 61.69 62.65 2kcx s THR 46 Cb -0.13 -4.45 -0.03 0.00 0.01 0.00 0.00 72.50 67.90 2kcx s THR 46 CO 0.19 -0.92 1.04 -0.31 -0.69 0.00 0.00 174.62 173.92 2kcx s TYR 47 N 3.73 3.49 0.40 4.92 1.51 0.12 -4.86 117.35 126.65 2kcx s TYR 47 Ca 0.33 1.32 0.09 0.00 -1.01 0.00 0.00 57.07 57.80 2kcx s TYR 47 Cb -0.11 -2.77 0.88 0.00 -0.11 0.00 0.00 41.96 39.84 2kcx s TYR 47 CO 0.23 -0.85 1.98 0.00 -1.11 0.00 0.00 175.55 175.80 2kcx h ARG 48 N -0.43 0.56 -2.42 -0.62 2.47 -1.92 -2.68 114.38 109.34 2kcx h ARG 48 Ca -0.44 -0.03 0.17 0.00 -1.26 0.00 0.00 59.98 58.42 2kcx h ARG 48 Cb 1.20 -0.13 -0.06 0.00 -1.65 0.00 0.00 29.97 29.33 2kcx h ARG 48 CO 0.61 0.37 0.54 0.16 0.56 0.00 0.00 179.97 182.21 2kcx s ASP 49 N -6.30 -0.07 0.24 7.04 1.47 -1.26 -3.21 116.67 114.58 2kcx s ASP 49 Ca -0.09 -0.55 -0.07 0.00 1.18 0.00 0.00 52.55 53.02 2kcx s ASP 49 Cb 0.19 0.49 0.43 0.00 -0.34 0.00 0.00 42.92 43.69 2kcx s ASP 49 CO 0.76 -0.95 1.64 -0.08 0.68 0.00 0.00 175.17 177.22 2kcx h GLU 50 N 2.00 0.12 -0.35 2.11 4.57 -1.76 -2.27 114.58 119.00 2kcx h GLU 50 Ca -0.26 -0.01 -0.17 0.00 -1.18 0.00 0.00 59.36 57.74 2kcx h GLU 50 Cb 1.22 -0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 29.78 2kcx h GLU 50 CO 0.31 0.08 -0.43 0.00 -1.18 0.00 0.00 179.01 177.80 2kcx h GLU 52 N 0.71 0.88 -0.28 0.00 4.57 -1.82 -0.64 114.58 118.01 2kcx h GLU 52 Ca 0.05 -0.05 -0.03 0.00 -1.18 0.00 0.00 59.36 58.14 2kcx h GLU 52 Cb 1.03 -0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 29.41 2kcx h GLU 52 CO 0.10 0.59 0.06 1.25 -1.18 0.00 0.00 179.01 179.82 2kcx h LEU 53 N 0.91 0.44 -2.24 1.64 6.46 -1.23 -2.16 115.31 119.13 2kcx h LEU 53 Ca 0.48 -0.25 0.01 0.00 -0.12 0.00 0.00 57.88 58.00 2kcx h LEU 53 Cb 0.51 -0.12 -0.00 0.00 -0.73 0.00 0.00 40.66 40.33 2kcx h LEU 53 CO -0.28 0.57 0.02 0.03 -0.62 0.00 0.00 178.44 178.16 2kcx h ARG 54 N 0.28 0.00 0.21 1.25 3.08 -0.84 -1.06 114.38 117.29 2kcx h ARG 54 Ca 0.09 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.13 2kcx h ARG 54 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.37 2kcx h ARG 54 CO 0.00 0.00 -0.10 0.00 -1.07 0.00 0.00 179.97 178.80 2kcx h ALA 55 N 1.98 -0.28 -0.77 0.04 0.00 -0.91 -3.30 119.26 116.02 2kcx h ALA 55 Ca 0.01 -0.20 0.18 0.00 0.00 0.00 0.00 54.91 54.90 2kcx h ALA 55 Cb 0.04 0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.89 2kcx h ALA 55 CO -0.00 -0.33 0.53 0.00 0.00 0.00 0.00 179.25 179.45 2kcx h ALA 56 N -0.52 2.30 -0.54 0.00 0.00 -1.01 0.10 119.26 119.59 2kcx h ALA 56 Ca -0.03 -0.00 0.11 0.00 0.00 0.00 0.00 54.91 54.99 2kcx h ALA 56 Cb 0.48 -0.02 -0.10 0.00 0.00 0.00 0.00 17.79 18.15 2kcx h ALA 56 CO 0.05 -0.52 -0.15 -0.09 0.00 0.00 0.00 179.25 178.54 2kcx h ARG 57 N 0.29 -0.02 0.00 0.00 2.43 -1.28 -1.52 114.38 114.28 2kcx h ARG 57 Ca 0.38 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.49 2kcx h ARG 57 Cb 1.07 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.62 2kcx h ARG 57 CO -0.10 -0.01 -0.32 0.00 -1.51 0.00 0.00 179.97 178.03 2kcx n ARG 59 N -3.23 0.90 -0.67 0.00 5.12 -0.59 -4.62 116.66 113.57 2kcx n ARG 59 Ca 0.02 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.94 2kcx n ARG 59 Cb 0.61 -1.05 0.00 0.00 -1.16 0.00 0.00 32.46 30.87 2kcx n ARG 59 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2kcx n GLY 60 N 1.03 1.05 2.42 -0.13 0.00 -1.24 -4.99 105.19 103.34 2kcx n GLY 60 Ca 0.00 -0.42 -0.26 0.00 0.00 0.00 0.00 46.02 45.34 2kcx n GLY 60 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2kcx n HIS 61 N -2.35 1.08 0.20 1.61 8.25 -0.82 -4.95 115.22 118.24 2kcx n HIS 61 Ca 0.00 -3.77 0.04 0.00 -0.26 0.00 0.00 57.72 53.73 2kcx n HIS 61 Cb 0.12 -0.29 0.40 0.00 1.12 0.00 0.00 29.99 31.34 2kcx n HIS 61 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 2kcx h PRO 62 N 4.71 0.00 0.00 -0.41 0.11 -1.87 -2.59 132.00 131.95 2kcx h PRO 62 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 2kcx h PRO 62 Cb 0.81 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.92 2kcx h PRO 62 CO 0.57 0.33 0.00 -0.25 -0.21 0.00 0.00 178.00 178.44 2kcx n ASP 63 N -4.06 0.51 -4.61 -2.05 9.92 -1.26 -4.84 116.55 110.17 2kcx n ASP 63 Ca -0.02 0.58 -0.43 0.00 -0.53 0.00 0.00 54.79 54.39 2kcx n ASP 63 Cb 0.38 -0.71 -0.03 0.00 -0.64 0.00 0.00 41.12 40.13 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 -4.03 3.67 0.10 0.64 0.20 -0.98 -4.76 118.68 113.51 2kcx s LEU 64 Ca 0.09 1.64 0.03 0.00 0.69 0.00 0.00 54.13 56.57 2kcx s LEU 64 Cb 0.12 -3.52 -0.04 0.00 -0.43 0.00 0.00 46.19 42.32 2kcx s LEU 64 CO 0.48 -1.60 -0.08 -0.44 -0.29 0.00 0.00 176.35 174.42 2kcx s SER 65 N 5.98 1.27 0.03 3.68 0.01 -1.26 -4.88 113.70 118.53 2kcx s SER 65 Ca 0.83 -0.90 -0.30 0.00 1.31 0.00 0.00 55.95 56.89 2kcx s SER 65 Cb -0.27 0.05 -0.06 0.00 0.21 0.00 0.00 66.02 65.95 2kcx s SER 65 CO 0.34 -0.36 1.32 -0.69 0.41 0.00 0.00 173.24 174.25 2kcx s VAL 66 N -3.01 3.79 -0.21 3.43 1.01 -1.26 -0.93 120.40 123.22 2kcx s VAL 66 Ca 0.08 1.23 -0.16 0.00 0.00 0.00 0.00 61.98 63.13 2kcx s VAL 66 Cb 0.01 -3.79 -0.12 0.00 0.00 0.00 0.00 36.38 32.49 2kcx s VAL 66 CO -0.02 0.04 -0.14 0.23 0.00 0.00 0.00 175.10 175.21 2kcx n MET 67 N 4.68 0.54 -3.71 2.72 2.81 -0.85 -4.93 117.12 118.38 2kcx n MET 67 Ca 0.11 0.41 -0.05 0.00 -1.81 0.00 0.00 57.70 56.36 2kcx n MET 67 Cb 0.44 -1.60 -0.02 0.00 -0.71 0.00 0.00 33.22 31.33 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 -2.48 -0.20 0.73 2.03 1.13 -1.24 -5.05 117.35 112.27 2kcx s TYR 68 Ca -0.29 -0.09 -0.07 0.00 -1.41 0.00 0.00 57.07 55.21 2kcx s TYR 68 Cb 0.08 0.63 0.09 0.00 -1.10 0.00 0.00 41.96 41.65 2kcx s TYR 68 CO 0.46 -0.84 1.04 1.03 -2.51 0.00 0.00 175.55 174.73 2kcx s ARG 69 N -3.39 1.94 3.16 -3.49 1.81 -1.26 -0.91 118.95 116.81 2kcx s ARG 69 Ca 0.10 -0.40 0.00 0.00 -1.72 0.00 0.00 55.73 53.71 2kcx s ARG 69 Cb -0.02 -2.16 0.00 0.00 -0.45 0.00 0.00 34.95 32.32 2kcx s ARG 69 CO 0.00 -1.40 0.00 0.41 -0.68 0.00 0.00 175.30 173.63 2kcx n GLY 70 N -3.00 0.22 3.76 -3.53 0.00 0.46 -4.68 105.19 98.41 2kcx n GLY 70 Ca 0.10 -0.91 -0.41 0.00 0.00 0.00 0.00 46.02 44.80 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 0.00 4.47 -1.11 1.61 1.81 -1.26 -3.70 118.95 120.76 2kcx s ARG 71 Ca 0.00 2.03 -0.22 0.00 -1.72 0.00 0.00 55.73 55.82 2kcx s ARG 71 Cb 0.00 -3.14 0.01 0.00 -0.45 0.00 0.00 34.95 31.36 2kcx s ARG 71 CO 0.00 -0.06 1.74 0.00 -0.68 0.00 0.00 175.30 176.31 2kcx s ARG 73 N 5.51 4.30 0.00 0.00 0.52 -1.26 -5.01 118.95 123.01 2kcx s ARG 73 Ca 0.58 0.75 0.22 0.00 -0.52 0.00 0.00 55.73 56.77 2kcx s ARG 73 Cb -0.00 -3.31 0.18 0.00 0.52 0.00 0.00 34.95 32.33 2kcx s ARG 73 CO 0.02 0.44 1.21 1.17 0.02 0.00 0.00 175.30 178.17