#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ck0 s ILE 2 N 0.00 4.70 -0.23 5.18 1.01 -1.26 -5.02 121.20 125.58 2ck0 s ILE 2 Ca 0.00 1.95 -0.07 0.00 0.00 0.00 0.00 60.65 62.54 2ck0 s ILE 2 Cb 0.00 -4.25 -0.03 0.00 0.01 0.00 0.00 42.46 38.19 2ck0 s ILE 2 CO 0.00 0.08 0.05 -1.58 0.00 0.00 0.00 174.94 173.49 2ck0 s GLN 3 N 1.53 3.66 -0.08 2.79 2.00 -1.26 -4.88 119.66 123.42 2ck0 s GLN 3 Ca 0.52 -0.48 -0.11 0.00 -2.00 0.00 0.00 55.36 53.28 2ck0 s GLN 3 Cb -0.21 -3.24 -0.05 0.00 0.80 0.00 0.00 33.01 30.31 2ck0 s GLN 3 CO 0.24 -0.10 0.28 -0.51 -0.50 0.00 0.00 175.29 174.69 2ck0 s LEU 4 N 1.35 4.40 -0.07 3.68 1.43 -1.26 -1.51 118.68 126.71 2ck0 s LEU 4 Ca 0.05 0.68 0.04 0.00 -1.03 0.00 0.00 54.13 53.87 2ck0 s LEU 4 Cb -0.15 -2.34 0.00 0.00 0.03 0.00 0.00 46.19 43.74 2ck0 s LEU 4 CO 0.03 0.32 -0.18 0.42 0.23 0.00 0.00 176.35 177.16 2ck0 s THR 5 N -0.79 1.57 0.20 5.49 -4.23 -0.09 -4.36 115.64 113.44 2ck0 s THR 5 Ca 0.19 -0.76 0.08 0.00 -1.18 0.00 0.00 61.69 60.02 2ck0 s THR 5 Cb -0.14 -1.37 -0.04 0.00 1.34 0.00 0.00 72.50 72.29 2ck0 s THR 5 CO 0.08 0.45 -0.02 -1.10 -0.54 0.00 0.00 174.62 173.49 2ck0 s GLN 6 N 0.27 2.30 -0.26 3.99 -0.21 -1.26 -0.18 119.66 124.30 2ck0 s GLN 6 Ca -0.11 -1.22 -0.25 0.00 0.02 0.00 0.00 55.36 53.80 2ck0 s GLN 6 Cb -0.15 -2.26 0.07 0.00 1.00 0.00 0.00 33.01 31.67 2ck0 s GLN 6 CO 0.05 0.43 0.72 -1.54 -2.12 0.00 0.00 175.29 172.82 2ck0 s SER 7 N -3.11 -0.75 1.10 5.90 1.04 -0.62 -4.61 113.70 112.65 2ck0 s SER 7 Ca 0.28 1.43 -0.17 0.00 0.48 0.00 0.00 55.95 57.97 2ck0 s SER 7 Cb -0.08 1.45 0.24 0.00 0.10 0.00 0.00 66.02 67.72 2ck0 s SER 7 CO 0.18 -0.26 1.17 -2.84 0.98 0.00 0.00 173.24 172.47 2ck0 s PRO 8 N 0.34 -0.38 0.27 4.02 0.02 -1.26 -0.52 135.00 137.49 2ck0 s PRO 8 Ca -0.00 -0.08 0.18 0.00 0.02 0.00 0.00 61.00 61.12 2ck0 s PRO 8 Cb -0.05 -1.70 0.09 0.00 0.02 0.00 0.00 34.50 32.86 2ck0 s PRO 8 CO 0.01 -3.15 1.32 0.66 -0.33 0.00 0.00 177.00 175.51 2ck0 h SER 9 N -2.18 0.00 -5.03 2.53 4.64 -1.86 -3.42 113.55 108.23 2ck0 h SER 9 Ca -0.46 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 60.75 2ck0 h SER 9 Cb 1.29 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 63.19 2ck0 h SER 9 CO 0.40 0.33 -0.31 -0.55 -0.87 0.00 0.00 176.83 175.83 2ck0 s SER 10 N -6.14 -0.09 0.02 4.97 0.15 -1.26 -1.36 113.70 109.98 2ck0 s SER 10 Ca 0.03 -0.15 -0.05 0.00 0.70 0.00 0.00 55.95 56.48 2ck0 s SER 10 Cb 0.07 0.31 -0.01 0.00 -1.71 0.00 0.00 66.02 64.69 2ck0 s SER 10 CO 0.74 -0.53 0.09 -0.76 1.20 0.00 0.00 173.24 173.99 2ck0 s LEU 11 N -1.78 1.77 -0.13 3.45 1.43 0.12 -4.88 118.68 118.68 2ck0 s LEU 11 Ca -0.09 -0.36 -0.04 0.00 -1.03 0.00 0.00 54.13 52.61 2ck0 s LEU 11 Cb -0.03 0.53 0.06 0.00 0.03 0.00 0.00 46.19 46.78 2ck0 s LEU 11 CO -0.01 -0.39 0.13 0.00 0.23 0.00 0.00 176.35 176.31 2ck0 s ALA 12 N -1.74 0.06 0.17 4.21 0.00 -1.26 0.12 121.76 123.31 2ck0 s ALA 12 Ca -0.12 0.18 0.03 0.00 0.00 0.00 0.00 51.96 52.05 2ck0 s ALA 12 Cb -0.06 -0.95 -0.05 0.00 0.00 0.00 0.00 23.12 22.06 2ck0 s ALA 12 CO -0.01 -0.86 -0.05 0.14 0.00 0.00 0.00 175.76 174.98 2ck0 s VAL 13 N 2.23 1.00 0.40 0.00 -7.23 -0.72 -4.82 120.40 111.26 2ck0 s VAL 13 Ca 0.04 -2.03 -0.07 0.00 -1.81 0.00 0.00 61.98 58.11 2ck0 s VAL 13 Cb -0.14 -2.00 -0.05 0.00 0.56 0.00 0.00 36.38 34.75 2ck0 s VAL 13 CO -0.07 -0.61 0.71 -0.44 -0.31 0.00 0.00 175.10 174.38 2ck0 s SER 14 N -3.19 6.41 0.26 4.85 0.01 -1.26 -0.68 113.70 120.10 2ck0 s SER 14 Ca 0.20 0.94 -0.30 0.00 1.31 0.00 0.00 55.95 58.10 2ck0 s SER 14 Cb 0.04 -2.24 -0.11 0.00 0.21 0.00 0.00 66.02 63.92 2ck0 s SER 14 CO 0.03 -0.40 1.54 0.00 0.41 0.00 0.00 173.24 174.81 2ck0 s ALA 15 N -2.42 3.71 0.00 1.44 0.00 -1.26 -2.09 121.76 121.14 2ck0 s ALA 15 Ca 0.48 1.46 0.00 0.00 0.00 0.00 0.00 51.96 53.89 2ck0 s ALA 15 Cb -0.10 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.40 2ck0 s ALA 15 CO 0.35 -0.86 0.00 0.41 0.00 0.00 0.00 175.76 175.66 2ck0 n GLY 16 N 2.45 3.19 3.80 0.00 0.00 0.04 -4.95 105.19 109.73 2ck0 n GLY 16 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 2ck0 n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ck0 s GLU 17 N -0.49 0.51 0.02 1.61 2.02 -0.89 -3.93 118.70 117.54 2ck0 s GLU 17 Ca 0.00 -0.05 0.06 0.00 0.02 0.00 0.00 54.97 55.00 2ck0 s GLU 17 Cb 0.00 -1.80 -0.03 0.00 0.10 0.00 0.00 34.13 32.40 2ck0 s GLU 17 CO 0.00 -2.56 -0.18 0.21 0.02 0.00 0.00 175.26 172.75 2ck0 s LYS 18 N -5.55 2.16 0.07 1.61 2.20 -1.26 -0.79 119.74 118.17 2ck0 s LYS 18 Ca 0.69 -0.92 0.05 0.00 -0.36 0.00 0.00 55.97 55.43 2ck0 s LYS 18 Cb -0.09 -2.22 -0.03 0.00 -1.51 0.00 0.00 37.83 33.98 2ck0 s LYS 18 CO 0.53 0.56 -0.15 0.54 -0.36 0.00 0.00 175.35 176.47 2ck0 s VAL 19 N -0.87 1.17 -0.07 4.02 0.11 0.79 -4.97 120.40 120.57 2ck0 s VAL 19 Ca 0.14 -1.26 0.00 0.00 -2.93 0.00 0.00 61.98 57.93 2ck0 s VAL 19 Cb -0.10 -1.10 0.02 0.00 -1.53 0.00 0.00 36.38 33.67 2ck0 s VAL 19 CO 0.04 -0.16 -0.05 -0.89 -3.33 0.00 0.00 175.10 170.72 2ck0 s THR 20 N -1.16 0.64 0.18 5.04 2.01 -1.26 -0.66 115.64 120.42 2ck0 s THR 20 Ca -0.00 -0.12 0.10 0.00 0.31 0.00 0.00 61.69 61.97 2ck0 s THR 20 Cb -0.09 -0.69 -0.04 0.00 0.01 0.00 0.00 72.50 71.68 2ck0 s THR 20 CO 0.02 0.27 -0.20 0.00 -0.69 0.00 0.00 174.62 174.02 2ck0 s MET 21 N 1.33 1.36 0.23 4.92 0.23 -0.65 -4.86 119.30 121.86 2ck0 s MET 21 Ca -0.04 -1.45 0.11 0.00 -1.03 0.00 0.00 55.69 53.28 2ck0 s MET 21 Cb -0.14 -1.52 -0.05 0.00 -1.53 0.00 0.00 34.83 31.60 2ck0 s MET 21 CO -0.02 0.32 -0.17 -0.80 -2.03 0.00 0.00 175.02 172.32 2ck0 s ASN 22 N -2.66 3.80 -0.04 -1.18 0.01 0.33 -1.98 114.94 113.22 2ck0 s ASN 22 Ca 0.17 -0.83 -0.01 0.00 -0.71 0.00 0.00 52.86 51.48 2ck0 s ASN 22 Cb -0.07 -0.44 0.03 0.00 0.41 0.00 0.00 41.25 41.19 2ck0 s ASN 22 CO 0.08 0.07 0.07 0.00 -1.51 0.00 0.00 177.10 175.81 2ck0 s LYS 24 N 1.22 2.42 0.28 0.00 2.20 0.74 -1.57 119.74 125.03 2ck0 s LYS 24 Ca -0.08 -0.64 -0.16 0.00 -0.36 0.00 0.00 55.97 54.73 2ck0 s LYS 24 Cb -0.12 -1.97 -0.08 0.00 -1.51 0.00 0.00 37.83 34.14 2ck0 s LYS 24 CO -0.04 0.01 0.70 0.45 -0.36 0.00 0.00 175.35 176.12 2ck0 s SER 25 N 0.76 6.83 0.29 1.43 0.15 0.83 -0.91 113.70 123.08 2ck0 s SER 25 Ca -0.11 1.27 0.18 0.00 0.70 0.00 0.00 55.95 57.98 2ck0 s SER 25 Cb -0.16 -2.36 0.10 0.00 -1.71 0.00 0.00 66.02 61.89 2ck0 s SER 25 CO 0.02 -0.11 1.38 0.77 1.20 0.00 0.00 173.24 176.49 2ck0 h SER 26 N 2.66 0.00 -3.77 5.45 4.64 -1.59 -3.46 113.55 117.48 2ck0 h SER 26 Ca -0.48 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 60.37 2ck0 h SER 26 Cb 1.18 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 63.09 2ck0 h SER 26 CO 0.66 0.36 -0.77 -1.10 -0.87 0.00 0.00 176.83 175.11 2ck0 s GLN 27 N -3.04 1.16 0.03 4.77 -0.21 -1.26 -4.93 119.66 116.18 2ck0 s GLN 27 Ca 0.04 -1.34 -0.30 0.00 0.02 0.00 0.00 55.36 53.77 2ck0 s GLN 27 Cb 0.07 -1.12 -0.06 0.00 1.00 0.00 0.00 33.01 32.90 2ck0 s GLN 27 CO 0.74 0.22 1.38 1.21 -2.12 0.00 0.00 175.29 176.72 2ck0 s ASN 28 N -2.60 6.87 0.00 5.90 3.84 -1.26 -4.72 114.94 122.96 2ck0 s ASN 28 Ca 0.13 2.15 0.25 0.00 0.21 0.00 0.00 52.86 55.60 2ck0 s ASN 28 Cb -0.05 -2.57 0.50 0.00 -0.55 0.00 0.00 41.25 38.58 2ck0 s ASN 28 CO 0.05 -0.68 1.43 0.18 -2.79 0.00 0.00 177.10 175.29 2ck0 n LEU 29 N 4.90 2.58 -4.64 3.21 4.77 0.82 -4.91 117.00 123.73 2ck0 n LEU 29 Ca 0.12 -0.93 -0.43 0.00 -0.03 0.00 0.00 56.01 54.75 2ck0 n LEU 29 Cb 0.44 -0.05 -0.02 0.00 -2.33 0.00 0.00 43.42 41.45 2ck0 n LEU 29 CO 0.58 0.46 0.90 -0.22 -1.33 0.00 0.00 177.39 177.78 2ck0 s LEU 30 N -1.88 4.01 -0.19 2.23 2.96 -1.26 -1.97 118.68 122.59 2ck0 s LEU 30 Ca 0.33 1.13 -0.29 0.00 -0.22 0.00 0.00 54.13 55.07 2ck0 s LEU 30 Cb 0.20 -3.48 0.00 0.00 0.50 0.00 0.00 46.19 43.41 2ck0 s LEU 30 CO 0.31 -0.77 1.09 -2.28 -1.32 0.00 0.00 176.35 173.38 2ck0 s HIS 31 N 3.39 3.26 0.24 5.38 5.65 0.07 -4.95 115.29 128.33 2ck0 s HIS 31 Ca 0.43 1.39 -0.04 0.00 0.25 0.00 0.00 55.06 57.08 2ck0 s HIS 31 Cb -0.13 -3.31 0.45 0.00 -1.18 0.00 0.00 32.58 28.41 2ck0 s HIS 31 CO 0.11 -0.72 1.72 0.66 -0.65 0.00 0.00 174.74 175.87 2ck0 h SER 31 N 7.55 0.22 0.27 9.88 4.64 -1.95 0.24 113.55 134.40 2ck0 h SER 31 Ca -0.23 0.12 -0.01 0.00 -0.47 0.00 0.00 61.79 61.19 2ck0 h SER 31 Cb 1.09 0.11 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 2ck0 h SER 31 CO 0.96 0.07 -0.13 0.40 -0.87 0.00 0.00 176.83 177.26 2ck0 h ILE 31 N 0.40 0.00 0.00 0.95 5.03 -1.97 -3.34 117.51 118.58 2ck0 h ILE 31 Ca 0.41 -0.36 0.00 0.00 -0.12 0.00 0.00 64.86 64.79 2ck0 h ILE 31 Cb 0.64 0.00 0.00 0.00 -3.03 0.00 0.00 36.82 34.43 2ck0 h ILE 31 CO -0.42 0.00 0.00 0.71 -0.68 0.00 0.00 178.15 177.76 2ck0 h THR 31 N -0.73 0.00 -0.38 -0.27 1.35 -2.00 -3.46 112.91 107.43 2ck0 h THR 31 Ca -0.04 -0.42 -0.16 0.00 -0.55 0.00 0.00 66.41 65.24 2ck0 h THR 31 Cb 0.28 1.33 -0.06 0.00 -1.73 0.00 0.00 68.15 67.96 2ck0 h THR 31 CO 0.06 0.00 -0.15 0.54 -0.25 0.00 0.00 175.52 175.72 2ck0 n ARG 31 N -2.34 -1.16 -3.35 4.72 5.12 0.84 -4.98 116.66 115.52 2ck0 n ARG 31 Ca 0.04 0.71 -0.36 0.00 -1.93 0.00 0.00 57.85 56.31 2ck0 n ARG 31 Cb 0.36 -4.77 -0.06 0.00 -1.16 0.00 0.00 32.46 26.83 2ck0 n ARG 31 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2ck0 s LYS 31 N -2.38 4.02 -0.36 5.56 1.02 -1.24 -4.79 119.74 121.56 2ck0 s LYS 31 Ca 0.00 0.54 -0.14 0.00 0.02 0.00 0.00 55.97 56.39 2ck0 s LYS 31 Cb 0.00 -3.01 -0.00 0.00 -0.52 0.00 0.00 37.83 34.30 2ck0 s LYS 31 CO 0.00 0.52 0.29 -0.80 -0.92 0.00 0.00 175.35 174.44 2ck0 s ASN 31 N -1.57 6.10 -1.40 2.83 0.01 -1.26 -0.75 114.94 118.90 2ck0 s ASN 31 Ca 0.35 -0.54 -0.15 0.00 -0.71 0.00 0.00 52.86 51.81 2ck0 s ASN 31 Cb -0.16 -2.16 0.05 0.00 0.41 0.00 0.00 41.25 39.39 2ck0 s ASN 31 CO 0.19 -0.33 2.05 -1.22 -1.51 0.00 0.00 177.10 176.28 2ck0 n TYR 32 N 5.19 3.94 -3.86 2.20 4.02 -0.83 -3.19 117.16 124.63 2ck0 n TYR 32 Ca -0.11 -2.93 -0.16 0.00 -0.01 0.00 0.00 57.90 54.69 2ck0 n TYR 32 Cb 0.49 -2.58 -0.16 0.00 -0.02 0.00 0.00 39.34 37.07 2ck0 n TYR 32 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 2ck0 s LEU 33 N 2.89 1.21 0.27 7.72 2.96 -1.26 -2.17 118.68 130.31 2ck0 s LEU 33 Ca 0.49 0.00 0.10 0.00 -0.22 0.00 0.00 54.13 54.50 2ck0 s LEU 33 Cb 0.10 -0.14 -0.05 0.00 0.50 0.00 0.00 46.19 46.60 2ck0 s LEU 33 CO -0.03 -0.10 -0.15 0.00 -1.32 0.00 0.00 176.35 174.75 2ck0 s ALA 34 N 0.93 2.53 -0.04 5.97 0.00 0.10 -0.25 121.76 131.01 2ck0 s ALA 34 Ca -0.09 -1.86 0.05 0.00 0.00 0.00 0.00 51.96 50.06 2ck0 s ALA 34 Cb -0.12 -0.11 -0.01 0.00 0.00 0.00 0.00 23.12 22.88 2ck0 s ALA 34 CO -0.02 0.14 -0.19 -1.58 0.00 0.00 0.00 175.76 174.11 2ck0 s TRP 35 N -2.72 1.82 0.18 0.00 0.52 0.10 -0.52 118.94 118.32 2ck0 s TRP 35 Ca 0.28 -0.49 0.02 0.00 0.02 0.00 0.00 56.10 55.94 2ck0 s TRP 35 Cb -0.01 -1.21 -0.05 0.00 -1.15 0.00 0.00 33.47 31.05 2ck0 s TRP 35 CO 0.13 -0.14 0.00 0.71 0.02 0.00 0.00 176.95 177.66 2ck0 s TYR 36 N -0.10 1.26 -0.00 -1.98 1.51 0.88 -0.22 117.35 118.70 2ck0 s TYR 36 Ca -0.01 -1.00 -0.06 0.00 -1.01 0.00 0.00 57.07 54.99 2ck0 s TYR 36 Cb -0.11 -0.72 -0.00 0.00 -0.11 0.00 0.00 41.96 41.02 2ck0 s TYR 36 CO 0.02 -0.19 0.11 -0.98 -1.11 0.00 0.00 175.55 173.40 2ck0 s ARG 37 N -3.91 0.42 -0.17 -0.62 1.70 -0.74 -0.49 118.95 115.14 2ck0 s ARG 37 Ca 0.25 -0.37 -0.00 0.00 -0.47 0.00 0.00 55.73 55.13 2ck0 s ARG 37 Cb 0.06 0.17 0.04 0.00 -0.57 0.00 0.00 34.95 34.65 2ck0 s ARG 37 CO 0.05 -0.09 -0.06 -1.14 -1.08 0.00 0.00 175.30 172.98 2ck0 s GLN 38 N -1.24 1.48 0.53 3.89 0.74 0.18 -0.57 119.66 124.68 2ck0 s GLN 38 Ca -0.13 -0.57 -0.17 0.00 0.05 0.00 0.00 55.36 54.54 2ck0 s GLN 38 Cb -0.07 -2.08 -0.07 0.00 1.10 0.00 0.00 33.01 31.89 2ck0 s GLN 38 CO 0.01 -0.44 1.00 0.15 -0.55 0.00 0.00 175.29 175.46 2ck0 s LYS 39 N 1.60 3.80 -0.31 1.67 1.02 -1.26 -1.96 119.74 124.31 2ck0 s LYS 39 Ca 0.00 1.04 -0.39 0.00 0.02 0.00 0.00 55.97 56.64 2ck0 s LYS 39 Cb -0.16 -2.11 -0.15 0.00 -0.52 0.00 0.00 37.83 34.90 2ck0 s LYS 39 CO -0.08 -0.40 1.90 -2.30 -0.92 0.00 0.00 175.35 173.56 2ck0 n PRO 40 N -1.62 1.09 -2.60 -1.68 -0.02 -1.26 -1.40 135.00 127.50 2ck0 n PRO 40 Ca 0.07 0.37 -0.13 0.00 -2.02 0.00 0.00 63.50 61.80 2ck0 n PRO 40 Cb 0.54 -2.17 0.02 0.00 -0.02 0.00 0.00 33.50 31.86 2ck0 n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ck0 n GLY 41 N 5.10 -0.03 3.19 -1.23 0.00 -1.26 -5.03 105.19 105.92 2ck0 n GLY 41 Ca 0.33 -0.28 -0.11 0.00 0.00 0.00 0.00 46.02 45.95 2ck0 n GLY 41 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2ck0 s GLN 42 N -5.08 0.96 0.68 1.61 -0.21 -0.49 -5.15 119.66 111.97 2ck0 s GLN 42 Ca 0.14 -1.44 -0.12 0.00 0.02 0.00 0.00 55.36 53.96 2ck0 s GLN 42 Cb -0.06 -0.06 0.01 0.00 1.00 0.00 0.00 33.01 33.89 2ck0 s GLN 42 CO 0.17 -0.15 1.07 -1.12 -2.12 0.00 0.00 175.29 173.15 2ck0 s SER 43 N -3.09 5.27 0.63 5.90 0.01 -1.26 -4.54 113.70 116.62 2ck0 s SER 43 Ca 0.20 1.74 -0.17 0.00 1.31 0.00 0.00 55.95 59.03 2ck0 s SER 43 Cb 0.07 -2.51 -0.02 0.00 0.21 0.00 0.00 66.02 63.77 2ck0 s SER 43 CO 0.00 -1.52 1.15 -2.84 0.41 0.00 0.00 173.24 170.45 2ck0 s PRO 44 N -4.71 2.87 -0.01 12.44 0.02 -1.26 -4.53 135.00 139.81 2ck0 s PRO 44 Ca 0.61 1.60 0.05 0.00 0.02 0.00 0.00 61.00 63.28 2ck0 s PRO 44 Cb -0.16 -1.94 -0.01 0.00 0.02 0.00 0.00 34.50 32.41 2ck0 s PRO 44 CO 0.50 -1.23 -0.17 0.21 -0.33 0.00 0.00 177.00 175.98 2ck0 s LYS 45 N -3.69 1.39 0.05 5.54 2.20 0.27 -4.95 119.74 120.56 2ck0 s LYS 45 Ca 0.72 -0.60 -0.30 0.00 -0.36 0.00 0.00 55.97 55.42 2ck0 s LYS 45 Cb -0.25 -1.33 -0.05 0.00 -1.51 0.00 0.00 37.83 34.69 2ck0 s LYS 45 CO 0.36 0.36 1.13 -1.17 -0.36 0.00 0.00 175.35 175.68 2ck0 s LEU 46 N -0.37 4.38 -0.14 5.43 1.98 -1.26 -1.79 118.68 126.90 2ck0 s LEU 46 Ca 0.06 1.93 -0.01 0.00 -2.89 0.00 0.00 54.13 53.22 2ck0 s LEU 46 Cb -0.07 -3.58 -0.09 0.00 0.66 0.00 0.00 46.19 43.12 2ck0 s LEU 46 CO -0.01 -0.40 -0.14 0.18 -1.89 0.00 0.00 176.35 174.10 2ck0 n LEU 47 N 3.82 2.56 -3.73 -0.68 4.77 0.69 -4.78 117.00 119.65 2ck0 n LEU 47 Ca 0.08 -0.02 -0.14 0.00 -0.03 0.00 0.00 56.01 55.90 2ck0 n LEU 47 Cb 0.48 -0.49 -0.09 0.00 -2.33 0.00 0.00 43.42 40.99 2ck0 n LEU 47 CO 0.54 0.65 0.08 -0.63 -1.33 0.00 0.00 177.39 176.70 2ck0 s ILE 48 N -2.28 0.03 0.13 -0.08 1.01 -0.98 -1.53 121.20 117.49 2ck0 s ILE 48 Ca -0.20 -0.24 0.00 0.00 0.00 0.00 0.00 60.65 60.21 2ck0 s ILE 48 Cb 0.06 -0.63 -0.04 0.00 0.01 0.00 0.00 42.46 41.85 2ck0 s ILE 48 CO 0.31 -0.13 0.00 -0.72 0.00 0.00 0.00 174.94 174.40 2ck0 s TYR 49 N -0.72 0.93 -1.60 3.97 1.13 -0.39 0.00 117.35 120.68 2ck0 s TYR 49 Ca -0.08 -1.08 0.00 0.00 -1.41 0.00 0.00 57.07 54.50 2ck0 s TYR 49 Cb -0.04 -0.55 0.00 0.00 -1.10 0.00 0.00 41.96 40.28 2ck0 s TYR 49 CO 0.03 -0.32 0.00 0.91 -2.51 0.00 0.00 175.55 173.66 2ck0 n TRP 50 N -0.10 -1.07 0.00 -3.49 8.01 -1.06 -1.63 117.44 118.09 2ck0 n TRP 50 Ca -0.08 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.11 2ck0 n TRP 50 Cb 0.63 -3.61 0.00 0.00 -2.01 0.00 0.00 31.31 26.31 2ck0 n TRP 50 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2ck0 n ALA 51 N -1.92 0.00 0.00 6.99 0.00 0.66 -4.31 120.51 121.93 2ck0 n ALA 51 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.22 2ck0 n ALA 51 Cb 0.66 -0.06 0.00 0.00 0.00 0.00 0.00 19.45 20.05 2ck0 n ALA 51 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2ck0 n SER 52 N 0.00 0.00 -4.65 0.00 7.64 -1.07 -2.64 113.62 112.90 2ck0 n SER 52 Ca 0.00 0.00 -0.43 0.00 1.01 0.00 0.00 58.87 59.45 2ck0 n SER 52 Cb 0.00 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 2ck0 n SER 52 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2ck0 s THR 53 N -0.67 3.76 0.50 0.44 2.01 -0.65 -4.47 115.64 116.56 2ck0 s THR 53 Ca 0.00 0.90 -0.22 0.00 0.31 0.00 0.00 61.69 62.68 2ck0 s THR 53 Cb 0.00 -3.64 -0.06 0.00 0.01 0.00 0.00 72.50 68.80 2ck0 s THR 53 CO 0.00 -0.15 1.18 -0.13 -0.69 0.00 0.00 174.62 174.83 2ck0 s ARG 54 N 4.13 3.55 0.87 4.92 0.52 -1.26 -1.27 118.95 130.41 2ck0 s ARG 54 Ca 0.69 1.78 -0.12 0.00 -0.52 0.00 0.00 55.73 57.56 2ck0 s ARG 54 Cb -0.28 -2.26 0.11 0.00 0.52 0.00 0.00 34.95 33.04 2ck0 s ARG 54 CO 0.26 -0.73 1.15 0.20 0.02 0.00 0.00 175.30 176.20 2ck0 s GLY 55 N -1.44 1.58 0.21 -3.53 0.00 -0.58 -4.84 107.32 98.72 2ck0 s GLY 55 Ca 0.68 -0.57 -0.32 0.00 0.00 0.00 0.00 44.72 44.51 2ck0 s GLY 55 CO 0.34 -0.04 1.73 -0.45 0.00 0.00 0.00 173.10 174.68 2ck0 s SER 56 N -4.23 6.37 0.00 1.64 0.15 -1.26 -2.07 113.70 114.29 2ck0 s SER 56 Ca 0.63 2.88 0.00 0.00 0.70 0.00 0.00 55.95 60.16 2ck0 s SER 56 Cb -0.13 -2.60 0.00 0.00 -1.71 0.00 0.00 66.02 61.58 2ck0 s SER 56 CO 0.52 -0.98 0.00 0.61 1.20 0.00 0.00 173.24 174.59 2ck0 n GLY 57 N 3.99 2.90 3.66 9.45 0.00 -1.26 -4.99 105.19 118.94 2ck0 n GLY 57 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 2ck0 n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ck0 s VAL 58 N -1.83 3.87 0.87 1.61 1.01 -0.88 -4.98 120.40 120.06 2ck0 s VAL 58 Ca 0.00 1.09 -0.12 0.00 0.00 0.00 0.00 61.98 62.95 2ck0 s VAL 58 Cb 0.00 -3.70 0.10 0.00 0.00 0.00 0.00 36.38 32.78 2ck0 s VAL 58 CO 0.00 -0.08 1.07 -0.81 0.00 0.00 0.00 175.10 175.28 2ck0 n PRO 59 N 6.63 -0.16 0.00 2.72 -0.04 -1.26 -4.79 135.00 138.11 2ck0 n PRO 59 Ca 0.15 0.02 0.06 0.00 -0.04 0.00 0.00 63.50 63.70 2ck0 n PRO 59 Cb 0.44 -2.33 0.38 0.00 -0.04 0.00 0.00 33.50 31.95 2ck0 n PRO 59 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2ck0 n ASP 60 N -3.40 0.00 0.17 3.54 5.75 -1.26 -2.69 116.55 118.66 2ck0 n ASP 60 Ca 0.12 -0.46 0.02 0.00 -0.01 0.00 0.00 54.79 54.46 2ck0 n ASP 60 Cb 0.51 0.00 0.31 0.00 -1.03 0.00 0.00 41.12 40.91 2ck0 n ASP 60 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 2ck0 h ARG 61 N 0.00 0.00 -5.79 0.11 3.08 -1.90 -3.41 114.38 106.47 2ck0 h ARG 61 Ca 0.00 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.44 2ck0 h ARG 61 Cb 0.00 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 29.94 2ck0 h ARG 61 CO 0.00 0.45 0.38 -0.06 -1.07 0.00 0.00 179.97 179.67 2ck0 s PHE 62 N -3.88 3.13 -0.16 3.04 0.40 -1.10 -3.00 117.98 116.41 2ck0 s PHE 62 Ca -0.02 0.60 0.01 0.00 -0.60 0.00 0.00 56.93 56.93 2ck0 s PHE 62 Cb 0.13 -3.37 0.02 0.00 0.51 0.00 0.00 43.02 40.30 2ck0 s PHE 62 CO 0.72 -0.71 -0.19 0.99 0.70 0.00 0.00 175.22 176.74 2ck0 s THR 63 N 3.08 1.95 -0.06 0.64 2.01 -0.74 -4.90 115.64 117.62 2ck0 s THR 63 Ca 0.32 -0.88 -0.02 0.00 0.31 0.00 0.00 61.69 61.42 2ck0 s THR 63 Cb -0.13 -1.76 -0.04 0.00 0.01 0.00 0.00 72.50 70.58 2ck0 s THR 63 CO 0.16 0.52 0.04 -0.83 -0.69 0.00 0.00 174.62 173.82 2ck0 s GLY 64 N 1.20 1.93 0.24 4.40 0.00 -1.26 -1.17 107.32 112.65 2ck0 s GLY 64 Ca 0.02 -0.82 -0.01 0.00 0.00 0.00 0.00 44.72 43.91 2ck0 s GLY 64 CO -0.10 -0.61 0.32 -1.14 0.00 0.00 0.00 173.10 171.58 2ck0 n SER 65 N 1.83 -0.90 0.00 1.64 3.41 -0.39 -4.20 113.62 115.01 2ck0 n SER 65 Ca -0.17 -2.29 0.00 0.00 -0.26 0.00 0.00 58.87 56.15 2ck0 n SER 65 Cb 0.53 1.69 0.00 0.00 -0.26 0.00 0.00 64.21 66.18 2ck0 n SER 65 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ck0 n GLY 66 N -0.39 1.08 3.50 5.00 0.00 -1.26 -1.56 105.19 111.56 2ck0 n GLY 66 Ca 0.01 -1.99 -0.13 0.00 0.00 0.00 0.00 46.02 43.91 2ck0 n GLY 66 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ck0 s SER 67 N -0.24 -0.53 0.00 1.61 0.15 -0.48 -4.89 113.70 109.32 2ck0 s SER 67 Ca 0.00 0.32 0.00 0.00 0.70 0.00 0.00 55.95 56.97 2ck0 s SER 67 Cb 0.00 0.49 0.00 0.00 -1.71 0.00 0.00 66.02 64.80 2ck0 s SER 67 CO 0.00 -0.67 0.00 0.61 1.20 0.00 0.00 173.24 174.38 2ck0 n GLY 68 N 0.29 1.93 0.00 9.45 0.00 -1.26 -3.29 105.19 112.31 2ck0 n GLY 68 Ca -0.15 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.70 2ck0 n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2ck0 n THR 69 N 0.00 0.00 -4.56 2.61 -2.24 -1.26 -0.13 114.28 108.71 2ck0 n THR 69 Ca 0.00 -0.17 -0.32 0.00 -2.27 0.00 0.00 64.05 61.30 2ck0 n THR 69 Cb 0.00 1.16 -0.16 0.00 -2.10 0.00 0.00 70.33 69.23 2ck0 n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2ck0 s ASP 70 N -0.25 2.97 0.18 3.42 -0.00 -1.21 -0.12 116.67 121.66 2ck0 s ASP 70 Ca 0.00 -0.57 0.02 0.00 -0.00 0.00 0.00 52.55 52.00 2ck0 s ASP 70 Cb 0.00 -1.37 -0.05 0.00 -0.00 0.00 0.00 42.92 41.50 2ck0 s ASP 70 CO 0.00 0.06 -0.01 -0.36 -0.00 0.00 0.00 175.17 174.86 2ck0 s PHE 71 N 0.92 1.28 0.00 4.23 0.40 -0.61 -1.38 117.98 122.81 2ck0 s PHE 71 Ca -0.05 -0.98 -0.12 0.00 -0.60 0.00 0.00 56.93 55.18 2ck0 s PHE 71 Cb -0.15 -0.73 0.01 0.00 0.51 0.00 0.00 43.02 42.67 2ck0 s PHE 71 CO -0.03 -0.16 0.24 0.99 0.70 0.00 0.00 175.22 176.96 2ck0 s THR 72 N -3.59 0.07 -0.08 0.64 2.01 -0.60 -2.01 115.64 112.08 2ck0 s THR 72 Ca 0.24 -0.60 0.03 0.00 0.31 0.00 0.00 61.69 61.68 2ck0 s THR 72 Cb 0.06 -0.60 0.01 0.00 0.01 0.00 0.00 72.50 71.97 2ck0 s THR 72 CO 0.05 -0.33 -0.19 -0.22 -0.69 0.00 0.00 174.62 173.24 2ck0 s LEU 73 N -1.46 1.89 -0.10 4.42 2.96 -0.84 -1.26 118.68 124.30 2ck0 s LEU 73 Ca -0.13 -0.44 0.04 0.00 -0.22 0.00 0.00 54.13 53.38 2ck0 s LEU 73 Cb -0.05 -1.14 0.00 0.00 0.50 0.00 0.00 46.19 45.50 2ck0 s LEU 73 CO 0.02 0.11 -0.22 -0.89 -1.32 0.00 0.00 176.35 174.05 2ck0 s THR 74 N 0.45 1.93 -0.10 3.68 2.01 -0.32 -1.63 115.64 121.66 2ck0 s THR 74 Ca -0.16 -0.94 0.03 0.00 0.31 0.00 0.00 61.69 60.93 2ck0 s THR 74 Cb -0.17 -1.68 -0.00 0.00 0.01 0.00 0.00 72.50 70.66 2ck0 s THR 74 CO 0.06 0.53 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.67 2ck0 s ILE 75 N 0.39 2.24 0.04 1.82 1.01 0.16 -1.79 121.20 125.06 2ck0 s ILE 75 Ca -0.18 -0.96 0.06 0.00 0.00 0.00 0.00 60.65 59.57 2ck0 s ILE 75 Cb -0.18 -1.87 -0.03 0.00 0.01 0.00 0.00 42.46 40.39 2ck0 s ILE 75 CO 0.08 0.55 -0.13 -0.44 0.00 0.00 0.00 174.94 175.01 2ck0 s SER 76 N 0.30 4.17 -1.09 3.58 0.01 -1.16 -0.15 113.70 119.35 2ck0 s SER 76 Ca -0.16 -0.33 -0.01 0.00 1.31 0.00 0.00 55.95 56.75 2ck0 s SER 76 Cb -0.17 -0.80 0.00 0.00 0.21 0.00 0.00 66.02 65.26 2ck0 s SER 76 CO 0.08 0.25 0.91 -0.24 0.41 0.00 0.00 173.24 174.65 2ck0 n SER 77 N 1.40 -2.60 -4.66 2.44 2.88 -1.00 -4.83 113.62 107.24 2ck0 n SER 77 Ca -0.15 -0.54 -0.44 0.00 -1.33 0.00 0.00 58.87 56.40 2ck0 n SER 77 Cb 0.52 -4.60 -0.04 0.00 -0.75 0.00 0.00 64.21 59.35 2ck0 n SER 77 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2ck0 n VAL 78 N -3.92 0.66 -4.07 2.46 0.31 0.03 -4.62 118.33 109.18 2ck0 n VAL 78 Ca -0.22 -0.17 -0.24 0.00 -0.01 0.00 0.00 64.34 63.71 2ck0 n VAL 78 Cb 0.64 -2.20 -0.07 0.00 -0.91 0.00 0.00 33.84 31.30 2ck0 n VAL 78 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2ck0 s GLN 79 N 4.61 2.30 0.39 5.55 -2.07 -1.26 -0.78 119.66 128.40 2ck0 s GLN 79 Ca 0.92 -1.70 0.18 0.00 -1.82 0.00 0.00 55.36 52.94 2ck0 s GLN 79 Cb -0.51 -2.09 1.09 0.00 -1.09 0.00 0.00 33.01 30.41 2ck0 s GLN 79 CO 0.44 -0.03 1.76 0.00 -1.32 0.00 0.00 175.29 176.15 2ck0 h ALA 80 N 1.45 2.20 0.00 2.60 0.00 -1.93 0.15 119.26 123.73 2ck0 h ALA 80 Ca -0.43 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.55 2ck0 h ALA 80 Cb 1.25 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2ck0 h ALA 80 CO 0.66 -0.63 0.00 0.39 0.00 0.00 0.00 179.25 179.67 2ck0 n GLU 81 N -4.66 0.34 0.00 0.00 4.71 -1.26 -3.14 120.64 116.64 2ck0 n GLU 81 Ca 0.26 0.09 0.12 0.00 -0.01 0.00 0.00 57.16 57.62 2ck0 n GLU 81 Cb 0.89 -1.50 0.23 0.00 -1.01 0.00 0.00 31.44 30.05 2ck0 n GLU 81 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 2ck0 n ASP 82 N -1.21 1.15 -4.68 1.62 10.43 0.51 -4.91 116.55 119.47 2ck0 n ASP 82 Ca 0.10 -0.93 -0.42 0.00 2.57 0.00 0.00 54.79 56.11 2ck0 n ASP 82 Cb 0.12 0.30 -0.03 0.00 1.84 0.00 0.00 41.12 43.35 2ck0 n ASP 82 CO 0.00 0.00 0.00 -1.48 -1.07 0.00 0.00 177.20 174.65 2ck0 s LEU 83 N -2.62 4.37 0.00 0.64 0.05 -1.19 -4.86 118.68 115.08 2ck0 s LEU 83 Ca 0.20 2.50 -0.01 0.00 0.05 0.00 0.00 54.13 56.87 2ck0 s LEU 83 Cb 0.18 -3.56 0.00 0.00 -2.05 0.00 0.00 46.19 40.77 2ck0 s LEU 83 CO 0.59 -0.92 0.03 0.00 -0.55 0.00 0.00 176.35 175.50 2ck0 n ALA 84 N 5.95 -0.09 -2.86 1.48 0.00 -1.24 -4.57 120.51 119.18 2ck0 n ALA 84 Ca 0.17 -0.02 -0.33 0.00 0.00 0.00 0.00 53.44 53.26 2ck0 n ALA 84 Cb 0.41 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.73 2ck0 n ALA 84 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2ck0 s VAL 85 N -2.04 3.46 -0.23 0.00 1.01 -0.83 -1.55 120.40 120.23 2ck0 s VAL 85 Ca 0.01 -0.53 -0.06 0.00 0.00 0.00 0.00 61.98 61.39 2ck0 s VAL 85 Cb -0.00 -2.46 -0.03 0.00 0.00 0.00 0.00 36.38 33.90 2ck0 s VAL 85 CO -0.00 0.54 0.04 -0.31 0.00 0.00 0.00 175.10 175.37 2ck0 s TYR 86 N -0.02 3.07 -0.04 5.22 2.02 0.55 -0.64 117.35 127.51 2ck0 s TYR 86 Ca -0.01 -0.44 0.04 0.00 -0.37 0.00 0.00 57.07 56.29 2ck0 s TYR 86 Cb -0.14 -2.17 -0.03 0.00 -0.40 0.00 0.00 41.96 39.23 2ck0 s TYR 86 CO 0.03 -0.30 -0.15 0.71 -1.57 0.00 0.00 175.55 174.27 2ck0 s TYR 87 N 1.32 2.67 -0.02 2.71 2.02 0.36 -1.52 117.35 124.89 2ck0 s TYR 87 Ca 0.05 -0.18 -0.01 0.00 -0.37 0.00 0.00 57.07 56.55 2ck0 s TYR 87 Cb -0.15 -1.60 -0.04 0.00 -0.40 0.00 0.00 41.96 39.77 2ck0 s TYR 87 CO 0.02 0.18 0.08 0.00 -1.57 0.00 0.00 175.55 174.26 2ck0 s LYS 89 N -1.62 0.81 0.03 0.00 2.20 0.33 -0.95 119.74 120.54 2ck0 s LYS 89 Ca 0.22 -1.00 0.06 0.00 -0.36 0.00 0.00 55.97 54.89 2ck0 s LYS 89 Cb -0.12 -0.73 -0.03 0.00 -1.51 0.00 0.00 37.83 35.44 2ck0 s LYS 89 CO 0.12 0.15 -0.14 1.14 -0.36 0.00 0.00 175.35 176.27 2ck0 s GLN 90 N -1.99 2.23 0.00 4.03 1.03 0.33 -0.73 119.66 124.56 2ck0 s GLN 90 Ca -0.00 -0.90 0.00 0.00 0.04 0.00 0.00 55.36 54.50 2ck0 s GLN 90 Cb -0.08 -2.30 0.00 0.00 0.03 0.00 0.00 33.01 30.66 2ck0 s GLN 90 CO 0.02 0.56 0.81 0.43 -2.54 0.00 0.00 175.29 174.56 2ck0 n SER 91 N 1.50 1.49 -0.37 12.60 7.64 -0.92 -2.87 113.62 132.70 2ck0 n SER 91 Ca -0.16 -1.65 0.01 0.00 1.01 0.00 0.00 58.87 58.08 2ck0 n SER 91 Cb 0.52 0.00 0.15 0.00 -1.01 0.00 0.00 64.21 63.87 2ck0 n SER 91 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 2ck0 h TYR 92 N 0.00 1.20 -2.10 1.43 5.03 -1.91 -3.40 116.97 117.22 2ck0 h TYR 92 Ca 0.00 0.03 -0.15 0.00 2.58 0.00 0.00 58.73 61.19 2ck0 h TYR 92 Cb 0.46 -0.40 -0.30 0.00 1.55 0.00 0.00 36.73 38.05 2ck0 h TYR 92 CO 0.00 0.67 -0.47 1.21 -1.32 0.00 0.00 178.16 178.25 2ck0 s ASN 93 N -5.96 0.19 0.96 -2.11 3.04 -1.26 -5.10 114.94 104.69 2ck0 s ASN 93 Ca -0.13 0.39 0.00 0.00 0.04 0.00 0.00 52.86 53.16 2ck0 s ASN 93 Cb 0.19 1.11 0.00 0.00 -1.54 0.00 0.00 41.25 41.02 2ck0 s ASN 93 CO 0.81 -0.28 0.00 0.18 -3.04 0.00 0.00 177.10 174.77 2ck0 n LEU 94 N 5.37 0.00 -4.35 3.21 4.77 -1.26 -4.78 117.00 119.95 2ck0 n LEU 94 Ca -0.05 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 55.71 2ck0 n LEU 94 Cb 0.50 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.48 2ck0 n LEU 94 CO 0.05 -0.45 -0.48 -0.31 -1.33 0.00 0.00 177.39 174.86 2ck0 s TYR 95 N 0.00 1.88 -0.29 -1.77 2.02 -1.26 -4.29 117.35 113.64 2ck0 s TYR 95 Ca 0.00 -0.46 -0.12 0.00 -0.37 0.00 0.00 57.07 56.13 2ck0 s TYR 95 Cb 0.00 -0.93 0.12 0.00 -0.40 0.00 0.00 41.96 40.75 2ck0 s TYR 95 CO 0.00 0.37 0.68 0.99 -1.57 0.00 0.00 175.55 176.01 2ck0 s THR 96 N -2.08 -0.72 0.40 -0.71 2.01 -1.14 -4.97 115.64 108.43 2ck0 s THR 96 Ca 0.17 0.00 0.05 0.00 0.31 0.00 0.00 61.69 62.23 2ck0 s THR 96 Cb -0.06 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.45 2ck0 s THR 96 CO 0.07 0.00 0.56 -0.36 -0.69 0.00 0.00 174.62 174.20 2ck0 s PHE 97 N 2.55 3.03 0.51 4.92 0.40 -1.26 -0.52 117.98 127.62 2ck0 s PHE 97 Ca -0.07 -0.17 0.07 0.00 -0.60 0.00 0.00 56.93 56.16 2ck0 s PHE 97 Cb -0.10 -2.21 0.05 0.00 0.51 0.00 0.00 43.02 41.26 2ck0 s PHE 97 CO -0.19 -0.25 0.71 0.20 0.70 0.00 0.00 175.22 176.38 2ck0 s GLY 98 N -4.25 1.85 0.56 4.36 0.00 -0.12 -4.54 107.32 105.18 2ck0 s GLY 98 Ca 0.49 -1.78 0.38 0.00 0.00 0.00 0.00 44.72 43.81 2ck0 s GLY 98 CO 0.33 -1.46 2.15 -1.33 0.00 0.00 0.00 173.10 172.79 2ck0 h GLY 99 N 0.31 0.00 0.00 0.20 0.00 -1.91 -3.44 103.07 98.22 2ck0 h GLY 99 Ca -0.37 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.96 2ck0 h GLY 99 CO 0.44 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.59 2ck0 n GLY 100 N -0.99 0.15 2.95 4.60 0.00 -1.26 -5.02 105.19 105.62 2ck0 n GLY 100 Ca -0.02 -1.65 -0.23 0.00 0.00 0.00 0.00 46.02 44.12 2ck0 n GLY 100 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ck0 s THR 101 N -2.94 0.89 -0.07 2.61 2.01 -0.58 -4.77 115.64 112.79 2ck0 s THR 101 Ca 0.00 -0.30 -0.14 0.00 0.31 0.00 0.00 61.69 61.56 2ck0 s THR 101 Cb 0.00 -0.86 -0.05 0.00 0.01 0.00 0.00 72.50 71.60 2ck0 s THR 101 CO 0.00 0.31 0.35 -0.75 -0.69 0.00 0.00 174.62 173.84 2ck0 s LYS 102 N 0.98 4.01 -0.14 4.92 2.20 -0.47 -0.33 119.74 130.92 2ck0 s LYS 102 Ca -0.09 0.26 -0.02 0.00 -0.36 0.00 0.00 55.97 55.76 2ck0 s LYS 102 Cb -0.15 -3.30 -0.02 0.00 -1.51 0.00 0.00 37.83 32.85 2ck0 s LYS 102 CO 0.00 0.51 -0.06 -1.17 -0.36 0.00 0.00 175.35 174.26 2ck0 s LEU 103 N -0.42 3.11 0.08 5.43 2.96 -0.60 0.15 118.68 129.39 2ck0 s LEU 103 Ca 0.21 -0.16 0.09 0.00 -0.22 0.00 0.00 54.13 54.04 2ck0 s LEU 103 Cb -0.15 -1.73 -0.03 0.00 0.50 0.00 0.00 46.19 44.78 2ck0 s LEU 103 CO 0.09 0.20 -0.23 -1.61 -1.32 0.00 0.00 176.35 173.48 2ck0 s GLU 104 N 0.19 1.34 -0.30 1.98 2.02 0.12 -3.67 118.70 120.38 2ck0 s GLU 104 Ca -0.04 -1.13 -0.14 0.00 0.02 0.00 0.00 54.97 53.68 2ck0 s GLU 104 Cb -0.14 -1.60 -0.03 0.00 0.10 0.00 0.00 34.13 32.45 2ck0 s GLU 104 CO 0.03 0.39 0.30 0.42 0.02 0.00 0.00 175.26 176.43 2ck0 s ILE 105 N -0.99 5.22 -0.28 -1.63 -1.09 -1.26 -1.75 121.20 119.42 2ck0 s ILE 105 Ca 0.09 0.20 -0.29 0.00 -2.23 0.00 0.00 60.65 58.42 2ck0 s ILE 105 Cb -0.10 -3.69 -0.00 0.00 -1.58 0.00 0.00 42.46 37.09 2ck0 s ILE 105 CO 0.04 0.08 1.30 -0.54 -1.23 0.00 0.00 174.94 174.58 2ck0 s LYS 106 N 1.93 3.96 0.21 2.79 1.02 0.14 -4.92 119.74 124.87 2ck0 s LYS 106 Ca 0.11 1.31 0.02 0.00 0.02 0.00 0.00 55.97 57.42 2ck0 s LYS 106 Cb -0.16 -3.86 -0.01 0.00 -0.52 0.00 0.00 37.83 33.28 2ck0 s LYS 106 CO 0.11 -1.06 0.06 2.89 -0.92 0.00 0.00 175.35 176.43 2ck0 n ARG 107 N 7.21 0.88 -2.36 1.68 1.85 -1.26 -4.37 116.66 120.29 2ck0 n ARG 107 Ca 0.15 -1.68 -0.37 0.00 -1.00 0.00 0.00 57.85 54.94 2ck0 n ARG 107 Cb 0.46 0.83 -0.02 0.00 -1.05 0.00 0.00 32.46 32.68 2ck0 n ARG 107 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2ck0 s ALA 108 N -2.51 3.09 0.59 2.89 0.00 -1.26 -4.98 121.76 119.57 2ck0 s ALA 108 Ca 0.08 0.88 -0.20 0.00 0.00 0.00 0.00 51.96 52.72 2ck0 s ALA 108 Cb 0.00 -3.35 -0.04 0.00 0.00 0.00 0.00 23.12 19.74 2ck0 s ALA 108 CO 0.06 -0.46 1.26 -0.25 0.00 0.00 0.00 175.76 176.37 2ck0 n ASP 109 N -0.11 2.12 -3.70 0.00 8.00 -1.26 -4.77 116.55 116.84 2ck0 n ASP 109 Ca 0.05 0.90 -0.12 0.00 0.71 0.00 0.00 54.79 56.34 2ck0 n ASP 109 Cb 0.48 -1.53 -0.12 0.00 -0.02 0.00 0.00 41.12 39.92 2ck0 n ASP 109 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2ck0 s ALA 110 N -1.36 -0.76 0.47 2.24 0.00 0.21 -4.90 121.76 117.66 2ck0 s ALA 110 Ca 0.76 1.19 -0.21 0.00 0.00 0.00 0.00 51.96 53.71 2ck0 s ALA 110 Cb -0.41 -0.88 -0.09 0.00 0.00 0.00 0.00 23.12 21.74 2ck0 s ALA 110 CO 0.46 -0.38 1.02 0.00 0.00 0.00 0.00 175.76 176.86 2ck0 s ALA 111 N 1.71 2.92 0.66 0.00 0.00 -1.26 -1.67 121.76 124.10 2ck0 s ALA 111 Ca -0.06 0.56 -0.11 0.00 0.00 0.00 0.00 51.96 52.35 2ck0 s ALA 111 Cb -0.10 -3.23 -0.02 0.00 0.00 0.00 0.00 23.12 19.77 2ck0 s ALA 111 CO -0.10 -0.21 1.04 -1.25 0.00 0.00 0.00 175.76 175.25 2ck0 s PRO 112 N -3.20 3.28 -0.54 0.00 0.04 -1.26 -4.51 135.00 128.82 2ck0 s PRO 112 Ca 0.66 0.85 -0.08 0.00 0.04 0.00 0.00 61.00 62.47 2ck0 s PRO 112 Cb -0.15 -2.04 0.14 0.00 0.04 0.00 0.00 34.50 32.49 2ck0 s PRO 112 CO 0.18 -0.82 0.40 0.99 0.04 0.00 0.00 177.00 177.79 2ck0 s THR 113 N -3.12 4.14 0.43 1.26 2.01 -0.59 -4.89 115.64 114.89 2ck0 s THR 113 Ca 0.56 -2.15 -0.22 0.00 0.31 0.00 0.00 61.69 60.19 2ck0 s THR 113 Cb -0.12 -3.71 -0.09 0.00 0.01 0.00 0.00 72.50 68.58 2ck0 s THR 113 CO 0.54 -0.82 1.03 -0.69 -0.69 0.00 0.00 174.62 174.00 2ck0 s VAL 114 N 0.90 3.83 -0.21 3.82 1.01 -1.26 -2.94 120.40 125.55 2ck0 s VAL 114 Ca 0.10 1.28 -0.08 0.00 0.00 0.00 0.00 61.98 63.28 2ck0 s VAL 114 Cb -0.23 -3.60 0.09 0.00 0.00 0.00 0.00 36.38 32.65 2ck0 s VAL 114 CO -0.03 -0.11 0.46 -0.44 0.00 0.00 0.00 175.10 174.98 2ck0 s SER 115 N -1.78 -0.41 -0.11 3.32 0.01 -0.45 -4.97 113.70 109.31 2ck0 s SER 115 Ca 0.61 1.07 -0.03 0.00 1.31 0.00 0.00 55.95 58.92 2ck0 s SER 115 Cb -0.19 1.43 -0.03 0.00 0.21 0.00 0.00 66.02 67.44 2ck0 s SER 115 CO 0.23 -0.23 0.00 -0.51 0.41 0.00 0.00 173.24 173.14 2ck0 s ILE 116 N 2.52 4.28 -0.12 1.44 2.07 -1.26 -0.46 121.20 129.67 2ck0 s ILE 116 Ca -0.03 -0.25 0.03 0.00 -1.41 0.00 0.00 60.65 58.99 2ck0 s ILE 116 Cb -0.11 -2.83 0.01 0.00 0.13 0.00 0.00 42.46 39.66 2ck0 s ILE 116 CO -0.14 0.57 -0.20 -0.36 -1.91 0.00 0.00 174.94 172.91 2ck0 s PHE 117 N -0.53 2.38 0.69 3.50 0.08 0.11 -5.00 117.98 119.21 2ck0 s PHE 117 Ca 0.09 -1.13 -0.13 0.00 0.12 0.00 0.00 56.93 55.89 2ck0 s PHE 117 Cb -0.12 -1.64 0.01 0.00 -0.57 0.00 0.00 43.02 40.70 2ck0 s PHE 117 CO 0.02 -0.52 1.08 -2.14 -0.10 0.00 0.00 175.22 173.56 2ck0 s PRO 118 N 0.78 2.79 0.44 0.24 0.02 -1.26 -2.26 135.00 135.75 2ck0 s PRO 118 Ca -0.09 1.18 -0.26 0.00 0.02 0.00 0.00 61.00 61.85 2ck0 s PRO 118 Cb -0.16 -1.96 -0.09 0.00 0.02 0.00 0.00 34.50 32.31 2ck0 s PRO 118 CO 0.00 -1.23 1.44 -2.30 -0.33 0.00 0.00 177.00 174.58 2ck0 n PRO 119 N -2.83 2.30 -2.35 5.54 -0.02 -1.25 -4.86 135.00 131.53 2ck0 n PRO 119 Ca 0.09 0.82 -0.34 0.00 -2.02 0.00 0.00 63.50 62.05 2ck0 n PRO 119 Cb 0.53 -2.64 -0.02 0.00 -0.02 0.00 0.00 33.50 31.35 2ck0 n PRO 119 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2ck0 s SER 120 N -0.43 6.07 0.43 2.55 1.04 -1.26 -4.90 113.70 117.19 2ck0 s SER 120 Ca 0.60 1.94 0.09 0.00 0.48 0.00 0.00 55.95 59.07 2ck0 s SER 120 Cb -0.45 -2.56 0.93 0.00 0.10 0.00 0.00 66.02 64.04 2ck0 s SER 120 CO 0.58 -0.97 2.06 0.77 0.98 0.00 0.00 173.24 176.66 2ck0 h SER 121 N 1.18 0.35 -0.32 7.02 4.64 -2.00 -1.15 113.55 123.27 2ck0 h SER 121 Ca -0.49 -0.02 -0.10 0.00 -0.47 0.00 0.00 61.79 60.72 2ck0 h SER 121 Cb 1.23 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 63.21 2ck0 h SER 121 CO 0.58 0.28 -0.14 -0.33 -0.87 0.00 0.00 176.83 176.35 2ck0 h GLU 122 N 0.40 0.77 -0.16 4.77 5.08 -1.99 -2.23 114.58 121.22 2ck0 h GLU 122 Ca 0.11 -0.27 -0.18 0.00 -1.00 0.00 0.00 59.36 58.01 2ck0 h GLU 122 Cb 0.01 -0.06 0.01 0.00 0.50 0.00 0.00 28.75 29.21 2ck0 h GLU 122 CO -0.02 0.87 -0.61 0.37 -1.00 0.00 0.00 179.01 178.62 2ck0 h GLN 123 N 0.69 0.70 -0.52 2.33 4.15 -1.63 -3.14 115.11 117.68 2ck0 h GLN 123 Ca 0.11 -0.54 0.09 0.00 0.77 0.00 0.00 58.65 59.09 2ck0 h GLN 123 Cb 0.63 0.10 -0.07 0.00 0.21 0.00 0.00 27.48 28.34 2ck0 h GLN 123 CO 0.04 1.16 0.10 -0.07 -1.93 0.00 0.00 178.83 178.13 2ck0 h LEU 124 N 0.39 -0.01 -0.10 -2.39 3.38 -1.09 0.29 115.31 115.79 2ck0 h LEU 124 Ca -0.03 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2ck0 h LEU 124 Cb 1.24 0.13 0.00 0.00 0.09 0.00 0.00 40.66 42.13 2ck0 h LEU 124 CO 0.13 0.02 0.00 0.41 0.09 0.00 0.00 178.44 179.09 2ck0 n THR 125 N -5.12 1.89 1.05 0.22 -1.04 -0.85 -0.23 114.28 110.19 2ck0 n THR 125 Ca 0.06 0.50 0.11 0.00 -2.04 0.00 0.00 64.05 62.69 2ck0 n THR 125 Cb 0.26 -1.49 0.11 0.00 -1.82 0.00 0.00 70.33 67.39 2ck0 n THR 125 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 2ck0 n SER 126 N -1.55 1.03 0.00 8.00 7.64 0.10 -4.95 113.62 123.90 2ck0 n SER 126 Ca 0.00 -0.84 0.00 0.00 1.01 0.00 0.00 58.87 59.04 2ck0 n SER 126 Cb 0.01 0.51 0.00 0.00 -1.01 0.00 0.00 64.21 63.72 2ck0 n SER 126 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ck0 n GLY 127 N 1.46 0.49 3.53 0.23 0.00 0.68 -5.07 105.19 106.52 2ck0 n GLY 127 Ca 0.07 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.84 2ck0 n GLY 127 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ck0 s GLY 128 N -1.30 2.19 -0.11 -0.02 0.00 -1.20 -1.76 107.32 105.12 2ck0 s GLY 128 Ca 0.00 -2.10 -0.04 0.00 0.00 0.00 0.00 44.72 42.57 2ck0 s GLY 128 CO 0.00 -2.00 0.23 0.00 0.00 0.00 0.00 173.10 171.33 2ck0 s ALA 129 N -2.75 -0.45 -0.19 3.20 0.00 -0.66 -3.14 121.76 117.77 2ck0 s ALA 129 Ca 0.33 0.84 0.01 0.00 0.00 0.00 0.00 51.96 53.14 2ck0 s ALA 129 Cb 0.05 -0.88 0.04 0.00 0.00 0.00 0.00 23.12 22.33 2ck0 s ALA 129 CO 0.16 -0.52 -0.13 -1.12 0.00 0.00 0.00 175.76 174.14 2ck0 s SER 130 N 2.13 3.33 -0.17 0.00 0.01 -1.26 -0.16 113.70 117.58 2ck0 s SER 130 Ca -0.01 -0.82 -0.17 0.00 1.31 0.00 0.00 55.95 56.27 2ck0 s SER 130 Cb -0.12 -1.32 -0.04 0.00 0.21 0.00 0.00 66.02 64.75 2ck0 s SER 130 CO -0.08 -0.10 0.42 -0.69 0.41 0.00 0.00 173.24 173.20 2ck0 s VAL 131 N 1.35 5.20 -0.07 3.43 1.01 0.16 -3.86 120.40 127.61 2ck0 s VAL 131 Ca 0.00 0.79 0.03 0.00 0.00 0.00 0.00 61.98 62.80 2ck0 s VAL 131 Cb -0.15 -3.75 -0.02 0.00 0.00 0.00 0.00 36.38 32.45 2ck0 s VAL 131 CO -0.09 0.29 -0.15 -0.69 0.00 0.00 0.00 175.10 174.46 2ck0 s VAL 132 N 1.01 2.99 -0.09 2.92 1.01 -0.96 -0.42 120.40 126.86 2ck0 s VAL 132 Ca 0.21 -0.73 0.03 0.00 0.00 0.00 0.00 61.98 61.49 2ck0 s VAL 132 Cb -0.15 -2.19 0.01 0.00 0.00 0.00 0.00 36.38 34.05 2ck0 s VAL 132 CO 0.08 0.57 -0.17 0.00 0.00 0.00 0.00 175.10 175.59 2ck0 s PHE 134 N 0.70 2.99 -0.37 0.00 2.99 0.39 -0.46 117.98 124.23 2ck0 s PHE 134 Ca -0.13 -0.72 -0.00 0.00 0.00 0.00 0.00 56.93 56.08 2ck0 s PHE 134 Cb -0.16 -2.11 0.10 0.00 0.00 0.00 0.00 43.02 40.84 2ck0 s PHE 134 CO 0.03 -0.42 0.11 -0.51 -0.00 0.00 0.00 175.22 174.43 2ck0 s LEU 135 N 1.33 4.83 0.17 -0.37 1.02 0.65 -1.34 118.68 124.97 2ck0 s LEU 135 Ca 0.04 -1.93 0.08 0.00 0.02 0.00 0.00 54.13 52.34 2ck0 s LEU 135 Cb -0.14 -1.74 -0.04 0.00 0.02 0.00 0.00 46.19 44.28 2ck0 s LEU 135 CO -0.00 -0.44 -0.07 0.20 0.02 0.00 0.00 176.35 176.05 2ck0 s ASN 136 N 1.43 4.40 -1.07 2.29 0.02 -1.15 -0.24 114.94 120.62 2ck0 s ASN 136 Ca 0.06 -0.51 -0.01 0.00 -1.02 0.00 0.00 52.86 51.39 2ck0 s ASN 136 Cb -0.21 -0.81 0.00 0.00 0.02 0.00 0.00 41.25 40.25 2ck0 s ASN 136 CO -0.05 0.11 0.90 0.59 0.02 0.00 0.00 177.10 178.67 2ck0 n ASN 137 N 0.10 -2.38 -4.55 -1.22 3.02 -0.63 -1.54 115.26 108.06 2ck0 n ASN 137 Ca -0.11 -0.54 -0.25 0.00 -0.03 0.00 0.00 54.58 53.65 2ck0 n ASN 137 Cb 0.55 -4.59 -0.10 0.00 -0.61 0.00 0.00 39.78 35.03 2ck0 n ASN 137 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 2ck0 s PHE 138 N -3.32 2.42 -0.25 3.10 -0.12 -0.23 -4.63 117.98 114.96 2ck0 s PHE 138 Ca 0.05 -0.45 -0.18 0.00 -0.05 0.00 0.00 56.93 56.30 2ck0 s PHE 138 Cb -0.02 -1.33 0.07 0.00 -0.63 0.00 0.00 43.02 41.11 2ck0 s PHE 138 CO 0.65 0.59 0.64 -0.47 -0.05 0.00 0.00 175.22 176.57 2ck0 s TYR 139 N -2.56 -0.85 1.24 3.49 6.14 -0.67 -0.01 117.35 124.13 2ck0 s TYR 139 Ca 0.33 1.85 -0.19 0.00 0.64 0.00 0.00 57.07 59.69 2ck0 s TYR 139 Cb 0.00 0.41 0.30 0.00 0.42 0.00 0.00 41.96 43.09 2ck0 s TYR 139 CO 0.17 -0.42 1.06 -1.25 0.64 0.00 0.00 175.55 175.75 2ck0 s PRO 140 N 1.01 -1.51 0.28 4.97 0.04 -1.26 -0.62 135.00 137.91 2ck0 s PRO 140 Ca -0.05 0.10 0.01 0.00 0.04 0.00 0.00 61.00 61.09 2ck0 s PRO 140 Cb -0.05 -1.55 0.42 0.00 0.04 0.00 0.00 34.50 33.36 2ck0 s PRO 140 CO -0.09 -3.93 1.79 -0.22 0.04 0.00 0.00 177.00 174.58 2ck0 h LYS 141 N -2.74 0.66 -6.39 4.56 3.64 -1.99 -3.44 116.57 110.86 2ck0 h LYS 141 Ca -0.47 -0.18 -0.54 0.00 -1.27 0.00 0.00 60.65 58.20 2ck0 h LYS 141 Cb 1.31 -0.08 0.01 0.00 -0.41 0.00 0.00 32.23 33.06 2ck0 h LYS 141 CO 0.36 0.71 0.97 -0.51 -2.27 0.00 0.00 179.45 178.71 2ck0 s ASP 142 N -6.70 6.68 -0.12 4.20 -0.00 -1.26 -4.99 116.67 114.48 2ck0 s ASP 142 Ca -0.08 2.34 -0.19 0.00 -0.00 0.00 0.00 52.55 54.61 2ck0 s ASP 142 Cb 0.15 -2.56 0.05 0.00 -0.00 0.00 0.00 42.92 40.56 2ck0 s ASP 142 CO 0.79 -0.85 0.49 -0.51 -0.00 0.00 0.00 175.17 175.09 2ck0 s ILE 143 N 2.84 0.01 -0.11 0.77 2.07 -1.26 -4.74 121.20 120.78 2ck0 s ILE 143 Ca 0.71 -0.12 -0.01 0.00 -1.41 0.00 0.00 60.65 59.82 2ck0 s ILE 143 Cb -0.36 -0.74 -0.03 0.00 0.13 0.00 0.00 42.46 41.46 2ck0 s ILE 143 CO 0.30 -0.06 -0.06 0.21 -1.91 0.00 0.00 174.94 173.42 2ck0 s ASN 144 N -0.39 4.69 -0.14 4.50 2.47 -0.05 -4.97 114.94 121.06 2ck0 s ASN 144 Ca -0.05 -0.09 0.01 0.00 0.42 0.00 0.00 52.86 53.15 2ck0 s ASN 144 Cb -0.03 -1.50 0.02 0.00 -1.45 0.00 0.00 41.25 38.29 2ck0 s ASN 144 CO 0.03 0.26 -0.14 0.54 -3.72 0.00 0.00 177.10 174.07 2ck0 s VAL 145 N -0.19 1.54 -0.05 -5.21 0.11 -1.26 -0.65 120.40 114.69 2ck0 s VAL 145 Ca 0.03 -0.63 0.02 0.00 -2.93 0.00 0.00 61.98 58.47 2ck0 s VAL 145 Cb -0.13 -1.44 -0.03 0.00 -1.53 0.00 0.00 36.38 33.25 2ck0 s VAL 145 CO 0.03 0.45 -0.08 -0.54 -3.33 0.00 0.00 175.10 171.63 2ck0 s LYS 146 N 1.36 2.66 -0.22 1.54 1.02 0.18 -4.96 119.74 121.32 2ck0 s LYS 146 Ca 0.02 -0.61 -0.06 0.00 0.02 0.00 0.00 55.97 55.34 2ck0 s LYS 146 Cb -0.13 -2.54 -0.03 0.00 -0.52 0.00 0.00 37.83 34.61 2ck0 s LYS 146 CO -0.08 0.64 0.04 -1.58 -0.92 0.00 0.00 175.35 173.45 2ck0 s TRP 147 N -0.84 3.07 -0.17 3.18 0.52 -1.26 -0.15 118.94 123.30 2ck0 s TRP 147 Ca 0.13 -0.41 0.01 0.00 0.02 0.00 0.00 56.10 55.85 2ck0 s TRP 147 Cb -0.11 -2.15 0.02 0.00 -1.15 0.00 0.00 33.47 30.08 2ck0 s TRP 147 CO 0.03 -0.27 -0.18 0.15 0.02 0.00 0.00 176.95 176.69 2ck0 s LYS 148 N 1.24 2.77 -0.41 4.98 1.02 -0.61 -0.02 119.74 128.71 2ck0 s LYS 148 Ca 0.04 -0.74 -0.11 0.00 0.02 0.00 0.00 55.97 55.17 2ck0 s LYS 148 Cb -0.15 -2.40 0.06 0.00 -0.52 0.00 0.00 37.83 34.82 2ck0 s LYS 148 CO 0.02 -0.20 0.27 0.42 -0.92 0.00 0.00 175.35 174.95 2ck0 s ILE 149 N 1.30 4.62 0.00 2.17 1.01 0.14 -1.60 121.20 128.83 2ck0 s ILE 149 Ca 0.04 -1.10 0.00 0.00 0.00 0.00 0.00 60.65 59.58 2ck0 s ILE 149 Cb -0.13 -3.71 0.00 0.00 0.01 0.00 0.00 42.46 38.62 2ck0 s ILE 149 CO -0.11 -0.42 0.00 0.47 0.00 0.00 0.00 174.94 174.88 2ck0 n ASP 150 N 5.02 0.00 0.00 3.58 8.00 -0.06 -2.14 116.55 130.95 2ck0 n ASP 150 Ca -0.11 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.39 2ck0 n ASP 150 Cb 0.44 -0.97 0.00 0.00 -0.02 0.00 0.00 41.12 40.57 2ck0 n ASP 150 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ck0 n GLY 151 N -2.00 1.01 3.71 0.44 0.00 -1.26 -5.01 105.19 102.07 2ck0 n GLY 151 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 2ck0 n GLY 151 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ck0 s SER 152 N -0.36 5.33 -0.27 1.61 0.15 -0.91 -5.06 113.70 114.20 2ck0 s SER 152 Ca 0.00 0.12 -0.26 0.00 0.70 0.00 0.00 55.95 56.51 2ck0 s SER 152 Cb 0.00 -1.49 0.00 0.00 -1.71 0.00 0.00 66.02 62.82 2ck0 s SER 152 CO 0.00 0.34 0.91 -0.70 1.20 0.00 0.00 173.24 174.98 2ck0 s GLU 153 N -1.22 4.13 -0.42 5.44 2.12 -1.26 0.25 118.70 127.74 2ck0 s GLU 153 Ca 0.17 0.97 -0.16 0.00 0.36 0.00 0.00 54.97 56.31 2ck0 s GLU 153 Cb -0.12 -3.68 0.03 0.00 0.26 0.00 0.00 34.13 30.62 2ck0 s GLU 153 CO 0.06 -0.65 0.34 0.50 -0.54 0.00 0.00 175.26 174.98 2ck0 s ARG 154 N 3.09 3.00 -0.05 4.30 6.06 0.98 -4.93 118.95 131.39 2ck0 s ARG 154 Ca 0.38 -0.99 0.19 0.00 -2.50 0.00 0.00 55.73 52.81 2ck0 s ARG 154 Cb -0.14 -3.99 -0.29 0.00 0.06 0.00 0.00 34.95 30.59 2ck0 s ARG 154 CO 0.10 -0.81 0.36 1.04 -2.50 0.00 0.00 175.30 173.49 2ck0 n GLN 155 N 5.28 0.67 -3.24 5.12 6.02 -1.26 -4.22 117.38 125.75 2ck0 n GLN 155 Ca -0.10 -0.15 -0.39 0.00 -0.01 0.00 0.00 57.00 56.35 2ck0 n GLN 155 Cb 0.47 -1.46 -0.06 0.00 1.02 0.00 0.00 30.24 30.21 2ck0 n GLN 155 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 2ck0 s ASN 156 N -4.42 7.03 0.00 1.08 -0.87 -1.26 -4.15 114.94 112.35 2ck0 s ASN 156 Ca -0.07 1.22 0.00 0.00 -1.57 0.00 0.00 52.86 52.43 2ck0 s ASN 156 Cb 0.11 -2.36 0.00 0.00 -0.02 0.00 0.00 41.25 38.98 2ck0 s ASN 156 CO 0.80 0.19 0.00 0.61 -2.57 0.00 0.00 177.10 176.13 2ck0 n GLY 157 N 2.06 0.93 3.53 0.66 0.00 -1.26 -4.88 105.19 106.23 2ck0 n GLY 157 Ca -0.09 -0.51 -0.34 0.00 0.00 0.00 0.00 46.02 45.09 2ck0 n GLY 157 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ck0 s VAL 158 N -2.00 4.12 -0.30 1.61 1.01 -1.26 -1.81 120.40 121.77 2ck0 s VAL 158 Ca 0.00 -0.28 0.02 0.00 0.00 0.00 0.00 61.98 61.73 2ck0 s VAL 158 Cb 0.00 -2.82 0.08 0.00 0.00 0.00 0.00 36.38 33.64 2ck0 s VAL 158 CO 0.00 0.48 -0.02 -0.22 0.00 0.00 0.00 175.10 175.35 2ck0 s LEU 159 N 0.37 4.08 0.05 3.92 0.20 0.04 -4.94 118.68 122.41 2ck0 s LEU 159 Ca -0.02 -1.68 -0.03 0.00 0.69 0.00 0.00 54.13 53.08 2ck0 s LEU 159 Cb -0.14 -1.62 -0.05 0.00 -0.43 0.00 0.00 46.19 43.96 2ck0 s LEU 159 CO 0.02 -0.29 0.26 0.20 -0.29 0.00 0.00 176.35 176.25 2ck0 s ASN 160 N 1.11 6.43 -0.29 3.68 0.01 -1.26 -1.40 114.94 123.22 2ck0 s ASN 160 Ca -0.01 0.43 -0.00 0.00 -0.71 0.00 0.00 52.86 52.57 2ck0 s ASN 160 Cb -0.20 -2.03 0.18 0.00 0.41 0.00 0.00 41.25 39.61 2ck0 s ASN 160 CO -0.05 0.18 0.54 -0.55 -1.51 0.00 0.00 177.10 175.70 2ck0 s SER 161 N -2.18 -0.96 0.69 -1.22 0.15 -0.68 -5.00 113.70 104.50 2ck0 s SER 161 Ca 0.33 0.59 -0.09 0.00 0.70 0.00 0.00 55.95 57.49 2ck0 s SER 161 Cb -0.13 1.86 0.03 0.00 -1.71 0.00 0.00 66.02 66.08 2ck0 s SER 161 CO 0.23 -0.28 1.04 0.26 1.20 0.00 0.00 173.24 175.68 2ck0 s TRP 162 N 2.77 3.15 0.42 3.44 0.51 -1.26 -2.44 118.94 125.53 2ck0 s TRP 162 Ca 0.17 0.74 0.07 0.00 -2.12 0.00 0.00 56.10 54.97 2ck0 s TRP 162 Cb -0.14 -3.08 -0.03 0.00 -0.81 0.00 0.00 33.47 29.41 2ck0 s TRP 162 CO -0.21 -1.23 0.33 0.95 -0.51 0.00 0.00 176.95 176.28 2ck0 s THR 163 N -3.26 2.49 0.73 2.01 -4.23 -0.01 -4.96 115.64 108.41 2ck0 s THR 163 Ca 0.58 -1.45 -0.11 0.00 -1.18 0.00 0.00 61.69 59.53 2ck0 s THR 163 Cb -0.11 -2.94 0.03 0.00 1.34 0.00 0.00 72.50 70.82 2ck0 s THR 163 CO 0.48 0.00 1.08 -1.81 -0.54 0.00 0.00 174.62 173.83 2ck0 s ASP 164 N -4.08 5.17 0.32 3.99 1.01 -1.26 -4.60 116.67 117.22 2ck0 s ASP 164 Ca 0.45 1.31 -0.29 0.00 0.71 0.00 0.00 52.55 54.74 2ck0 s ASP 164 Cb -0.01 -2.13 -0.11 0.00 1.01 0.00 0.00 42.92 41.68 2ck0 s ASP 164 CO 0.26 -1.54 1.44 -1.58 0.21 0.00 0.00 175.17 173.96 2ck0 s GLN 165 N -5.21 4.22 0.00 8.23 0.74 -1.26 -4.72 119.66 121.66 2ck0 s GLN 165 Ca 0.59 2.41 -0.30 0.00 0.05 0.00 0.00 55.36 58.10 2ck0 s GLN 165 Cb -0.13 -3.04 -0.05 0.00 1.10 0.00 0.00 33.01 30.89 2ck0 s GLN 165 CO 0.53 -0.43 1.32 0.34 -0.55 0.00 0.00 175.29 176.51 2ck0 s ASP 166 N -0.00 6.93 0.65 6.67 3.68 -1.02 -4.91 116.67 128.68 2ck0 s ASP 166 Ca 0.55 2.03 0.40 0.00 2.13 0.00 0.00 52.55 57.66 2ck0 s ASP 166 Cb -0.44 -2.56 2.21 0.00 -1.45 0.00 0.00 42.92 40.68 2ck0 s ASP 166 CO 0.53 -0.65 2.30 0.28 0.13 0.00 0.00 175.17 177.76 2ck0 h SER 167 N 7.53 0.00 0.00 -0.34 0.02 -1.91 0.11 113.55 118.96 2ck0 h SER 167 Ca -0.38 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.57 2ck0 h SER 167 Cb 1.18 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.72 2ck0 h SER 167 CO 0.88 0.00 -0.32 2.29 -1.14 0.00 0.00 176.83 178.54 2ck0 n LYS 168 N -3.26 0.21 0.11 3.45 2.85 -1.26 -3.98 118.16 116.28 2ck0 n LYS 168 Ca -0.03 0.23 0.12 0.00 -1.05 0.00 0.00 58.31 57.59 2ck0 n LYS 168 Cb 0.11 -1.03 0.27 0.00 -0.65 0.00 0.00 35.03 33.74 2ck0 n LYS 168 CO 0.00 0.00 0.00 0.38 -0.05 0.00 0.00 177.40 177.73 2ck0 h ASP 169 N -0.43 0.00 -0.76 -5.58 3.04 -1.99 -3.48 116.42 107.22 2ck0 h ASP 169 Ca 0.00 -0.06 -0.19 0.00 -3.24 0.00 0.00 57.03 53.54 2ck0 h ASP 169 Cb 0.32 0.00 -0.05 0.00 -1.04 0.00 0.00 39.33 38.56 2ck0 h ASP 169 CO 0.00 0.03 -0.20 -1.20 -2.04 0.00 0.00 179.24 175.83 2ck0 n SER 170 N -2.37 -3.81 -4.66 4.15 7.64 0.37 -4.98 113.62 109.96 2ck0 n SER 170 Ca 0.04 0.15 -0.26 0.00 1.01 0.00 0.00 58.87 59.81 2ck0 n SER 170 Cb 0.46 -2.46 -0.08 0.00 -1.01 0.00 0.00 64.21 61.11 2ck0 n SER 170 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2ck0 s THR 171 N -2.39 3.68 0.37 0.44 -4.23 -1.26 -4.68 115.64 107.57 2ck0 s THR 171 Ca 0.00 -1.47 0.05 0.00 -1.18 0.00 0.00 61.69 59.09 2ck0 s THR 171 Cb 0.00 -2.86 -0.01 0.00 1.34 0.00 0.00 72.50 70.98 2ck0 s THR 171 CO 0.00 -0.13 0.54 -0.31 -0.54 0.00 0.00 174.62 174.17 2ck0 s TYR 172 N -1.77 3.12 0.04 3.99 2.02 0.99 -2.43 117.35 123.31 2ck0 s TYR 172 Ca 0.28 -0.10 -0.00 0.00 -0.37 0.00 0.00 57.07 56.87 2ck0 s TYR 172 Cb -0.09 -2.12 -0.03 0.00 -0.40 0.00 0.00 41.96 39.32 2ck0 s TYR 172 CO 0.19 -0.15 -0.03 -1.12 -1.57 0.00 0.00 175.55 172.87 2ck0 s SER 173 N -4.20 0.40 -0.07 2.29 0.01 -1.26 -1.07 113.70 109.79 2ck0 s SER 173 Ca 0.47 -0.75 -0.11 0.00 1.31 0.00 0.00 55.95 56.86 2ck0 s SER 173 Cb -0.10 0.15 0.02 0.00 0.21 0.00 0.00 66.02 66.30 2ck0 s SER 173 CO 0.33 -0.44 0.29 -0.32 0.41 0.00 0.00 173.24 173.50 2ck0 s MET 174 N -2.70 0.45 -0.06 12.44 1.75 0.67 -0.83 119.30 131.03 2ck0 s MET 174 Ca -0.04 0.17 0.04 0.00 -1.25 0.00 0.00 55.69 54.61 2ck0 s MET 174 Cb -0.01 0.21 -0.00 0.00 2.84 0.00 0.00 34.83 37.86 2ck0 s MET 174 CO -0.05 -0.09 -0.19 -1.54 -0.65 0.00 0.00 175.02 172.49 2ck0 s SER 175 N -0.40 2.47 -0.11 1.11 1.04 -1.02 -0.26 113.70 116.53 2ck0 s SER 175 Ca -0.05 -0.41 0.03 0.00 0.48 0.00 0.00 55.95 56.00 2ck0 s SER 175 Cb -0.03 -0.79 -0.00 0.00 0.10 0.00 0.00 66.02 65.29 2ck0 s SER 175 CO 0.02 0.16 -0.22 -0.55 0.98 0.00 0.00 173.24 173.63 2ck0 s SER 176 N 0.09 3.25 -0.18 7.02 0.15 0.39 -1.69 113.70 122.74 2ck0 s SER 176 Ca -0.07 -0.53 0.01 0.00 0.70 0.00 0.00 55.95 56.06 2ck0 s SER 176 Cb -0.13 -1.45 0.03 0.00 -1.71 0.00 0.00 66.02 62.76 2ck0 s SER 176 CO 0.04 0.15 -0.15 -0.89 1.20 0.00 0.00 173.24 173.59 2ck0 s THR 177 N 0.42 1.77 -0.26 6.45 2.01 -0.50 -0.26 115.64 125.28 2ck0 s THR 177 Ca -0.16 -0.87 -0.09 0.00 0.31 0.00 0.00 61.69 60.88 2ck0 s THR 177 Cb -0.17 -1.69 -0.04 0.00 0.01 0.00 0.00 72.50 70.60 2ck0 s THR 177 CO 0.07 0.39 0.13 -0.22 -0.69 0.00 0.00 174.62 174.30 2ck0 s LEU 178 N 1.38 3.80 -0.21 4.42 2.96 0.44 -0.78 118.68 130.69 2ck0 s LEU 178 Ca 0.03 -0.06 -0.00 0.00 -0.22 0.00 0.00 54.13 53.87 2ck0 s LEU 178 Cb -0.14 -2.03 0.02 0.00 0.50 0.00 0.00 46.19 44.53 2ck0 s LEU 178 CO -0.10 -0.02 -0.13 -0.89 -1.32 0.00 0.00 176.35 173.89 2ck0 s THR 179 N 1.54 2.51 0.13 3.68 2.01 -0.75 0.36 115.64 125.11 2ck0 s THR 179 Ca 0.06 -0.93 0.00 0.00 0.31 0.00 0.00 61.69 61.14 2ck0 s THR 179 Cb -0.15 -2.16 -0.00 0.00 0.01 0.00 0.00 72.50 70.20 2ck0 s THR 179 CO 0.07 0.40 0.01 0.18 -0.69 0.00 0.00 174.62 174.58 2ck0 n LEU 180 N 4.65 0.00 -4.99 4.42 4.32 0.77 -4.83 117.00 121.34 2ck0 n LEU 180 Ca -0.19 -0.81 -0.18 0.00 -0.02 0.00 0.00 56.01 54.81 2ck0 n LEU 180 Cb 0.49 0.12 0.00 0.00 -1.62 0.00 0.00 43.42 42.41 2ck0 n LEU 180 CO 0.26 -0.12 0.11 0.42 -1.22 0.00 0.00 177.39 176.84 2ck0 s THR 181 N -1.54 3.23 0.24 -5.08 -4.23 -1.26 -1.66 115.64 105.34 2ck0 s THR 181 Ca 0.01 -1.04 -0.05 0.00 -1.18 0.00 0.00 61.69 59.42 2ck0 s THR 181 Cb 0.00 -3.10 0.22 0.00 1.34 0.00 0.00 72.50 70.96 2ck0 s THR 181 CO 0.01 -0.04 1.87 0.50 -0.54 0.00 0.00 174.62 176.41 2ck0 h LYS 182 N 0.76 1.01 0.00 3.99 3.64 -1.58 -0.97 116.57 123.42 2ck0 h LYS 182 Ca -0.42 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 2ck0 h LYS 182 Cb 1.27 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.86 2ck0 h LYS 182 CO 0.48 0.67 0.00 -0.25 -2.27 0.00 0.00 179.45 178.08 2ck0 n ASP 183 N -4.58 0.00 -0.30 4.20 8.00 -1.26 -0.61 116.55 122.00 2ck0 n ASP 183 Ca 0.12 0.98 0.18 0.00 0.71 0.00 0.00 54.79 56.78 2ck0 n ASP 183 Cb 0.15 -0.48 0.45 0.00 -0.02 0.00 0.00 41.12 41.21 2ck0 n ASP 183 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2ck0 h GLU 184 N 0.00 0.52 -0.47 -1.24 4.39 -1.92 0.13 114.58 115.98 2ck0 h GLU 184 Ca 0.00 -0.03 -0.06 0.00 0.34 0.00 0.00 59.36 59.61 2ck0 h GLU 184 Cb 0.00 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.52 2ck0 h GLU 184 CO 0.00 0.34 0.08 -0.92 -1.16 0.00 0.00 179.01 177.35 2ck0 h TYR 185 N 0.53 0.84 -0.17 4.33 5.03 -0.85 -2.48 116.97 124.20 2ck0 h TYR 185 Ca 0.53 -0.12 -0.02 0.00 2.58 0.00 0.00 58.73 61.70 2ck0 h TYR 185 Cb 1.13 -0.23 -0.01 0.00 1.55 0.00 0.00 36.73 39.17 2ck0 h TYR 185 CO -0.00 0.78 0.00 0.93 -1.32 0.00 0.00 178.16 178.55 2ck0 h GLU 186 N 0.66 0.24 0.00 1.82 5.08 0.16 -2.58 114.58 119.97 2ck0 h GLU 186 Ca 0.14 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 2ck0 h GLU 186 Cb 0.39 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.60 2ck0 h GLU 186 CO 0.01 0.27 0.00 0.54 -1.00 0.00 0.00 179.01 178.83 2ck0 n ARG 187 N -4.39 0.24 -4.37 2.33 1.74 -0.45 -4.89 116.66 106.87 2ck0 n ARG 187 Ca -0.00 0.08 -0.19 0.00 -0.77 0.00 0.00 57.85 56.97 2ck0 n ARG 187 Cb 0.17 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 30.01 2ck0 n ARG 187 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 2ck0 s HIS 188 N -2.70 1.72 0.00 -1.55 3.76 -0.97 -5.09 115.29 110.46 2ck0 s HIS 188 Ca 0.19 -0.80 0.00 0.00 -0.15 0.00 0.00 55.06 54.30 2ck0 s HIS 188 Cb 0.15 -0.98 0.00 0.00 1.11 0.00 0.00 32.58 32.87 2ck0 s HIS 188 CO 0.37 0.13 0.00 0.09 -0.85 0.00 0.00 174.74 174.48 2ck0 n ASN 189 N -0.47 0.00 -4.73 1.40 3.02 -1.26 -4.74 115.26 108.47 2ck0 n ASN 189 Ca -0.06 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.10 2ck0 n ASN 189 Cb 0.63 -0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.75 2ck0 n ASN 189 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2ck0 s SER 190 N -0.36 7.10 -0.03 6.41 0.15 -1.26 0.19 113.70 125.90 2ck0 s SER 190 Ca 0.00 1.32 0.06 0.00 0.70 0.00 0.00 55.95 58.04 2ck0 s SER 190 Cb 0.00 -2.44 -0.02 0.00 -1.71 0.00 0.00 66.02 61.85 2ck0 s SER 190 CO 0.00 -0.04 -0.22 -0.31 1.20 0.00 0.00 173.24 173.87 2ck0 s TYR 191 N 0.33 2.46 0.00 3.44 2.02 0.30 -0.88 117.35 125.02 2ck0 s TYR 191 Ca 0.38 -0.37 0.00 0.00 -0.37 0.00 0.00 57.07 56.71 2ck0 s TYR 191 Cb -0.19 -1.55 -0.00 0.00 -0.40 0.00 0.00 41.96 39.81 2ck0 s TYR 191 CO 0.21 0.02 -0.02 0.99 -1.57 0.00 0.00 175.55 175.18 2ck0 s THR 192 N -0.60 0.11 -0.31 -0.71 2.01 -0.63 -1.18 115.64 114.33 2ck0 s THR 192 Ca 0.09 -0.14 -0.05 0.00 0.31 0.00 0.00 61.69 61.90 2ck0 s THR 192 Cb -0.11 -0.12 0.03 0.00 0.01 0.00 0.00 72.50 72.32 2ck0 s THR 192 CO -0.00 -0.02 0.06 0.00 -0.69 0.00 0.00 174.62 173.97 2ck0 s GLU 194 N 1.39 3.70 -0.15 0.00 2.12 0.79 -1.07 118.70 125.48 2ck0 s GLU 194 Ca -0.01 -0.48 0.01 0.00 0.36 0.00 0.00 54.97 54.85 2ck0 s GLU 194 Cb -0.19 -3.16 0.00 0.00 0.26 0.00 0.00 34.13 31.04 2ck0 s GLU 194 CO 0.01 0.02 -0.18 0.00 -0.54 0.00 0.00 175.26 174.57 2ck0 s ALA 195 N 1.01 2.39 -0.17 6.30 0.00 0.16 0.48 121.76 131.93 2ck0 s ALA 195 Ca 0.03 -1.06 -0.02 0.00 0.00 0.00 0.00 51.96 50.90 2ck0 s ALA 195 Cb -0.14 -1.12 -0.02 0.00 0.00 0.00 0.00 23.12 21.84 2ck0 s ALA 195 CO 0.02 -0.01 -0.07 0.99 0.00 0.00 0.00 175.76 176.69 2ck0 s THR 196 N 0.79 3.43 -0.06 0.00 2.01 0.17 -0.02 115.64 121.96 2ck0 s THR 196 Ca -0.07 -0.51 -0.18 0.00 0.31 0.00 0.00 61.69 61.25 2ck0 s THR 196 Cb -0.15 -2.50 0.04 0.00 0.01 0.00 0.00 72.50 69.89 2ck0 s THR 196 CO -0.00 0.48 0.41 -2.28 -0.69 0.00 0.00 174.62 172.54 2ck0 s HIS 197 N 0.72 -0.34 -0.31 4.92 2.46 -1.26 -0.87 115.29 120.61 2ck0 s HIS 197 Ca -0.03 0.64 0.16 0.00 0.47 0.00 0.00 55.06 56.30 2ck0 s HIS 197 Cb -0.15 0.17 0.87 0.00 -0.13 0.00 0.00 32.58 33.34 2ck0 s HIS 197 CO 0.02 -0.39 1.47 0.36 -2.47 0.00 0.00 174.74 173.72 2ck0 n LYS 198 N 1.58 0.10 0.00 2.88 2.85 -1.26 -2.04 118.16 122.27 2ck0 n LYS 198 Ca -0.19 0.59 0.14 0.00 -1.05 0.00 0.00 58.31 57.81 2ck0 n LYS 198 Cb 0.56 -1.90 0.82 0.00 -0.65 0.00 0.00 35.03 33.87 2ck0 n LYS 198 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 2ck0 n THR 199 N -2.07 0.03 -3.97 0.58 -2.24 -1.26 -4.80 114.28 100.55 2ck0 n THR 199 Ca -0.01 0.01 -0.09 0.00 -2.27 0.00 0.00 64.05 61.69 2ck0 n THR 199 Cb 0.08 -0.55 -0.10 0.00 -2.10 0.00 0.00 70.33 67.66 2ck0 n THR 199 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2ck0 s SER 200 N -2.17 0.23 0.05 3.42 0.15 -0.87 -4.89 113.70 109.64 2ck0 s SER 200 Ca 0.39 -0.56 -0.11 0.00 0.70 0.00 0.00 55.95 56.37 2ck0 s SER 200 Cb 0.20 0.17 -0.31 0.00 -1.71 0.00 0.00 66.02 64.37 2ck0 s SER 200 CO 0.36 -0.43 1.08 0.74 1.20 0.00 0.00 173.24 176.19 2ck0 h THR 201 N 4.00 1.36 -3.75 6.45 2.02 -1.87 -3.44 112.91 117.69 2ck0 h THR 201 Ca -0.32 -2.78 -0.68 0.00 0.77 0.00 0.00 66.41 63.40 2ck0 h THR 201 Cb 1.19 2.93 -0.19 0.00 -1.74 0.00 0.00 68.15 70.34 2ck0 h THR 201 CO 0.48 0.83 -0.79 -0.44 0.37 0.00 0.00 175.52 175.97 2ck0 s SER 202 N -7.39 3.95 0.96 4.18 0.01 -1.26 -5.10 113.70 109.05 2ck0 s SER 202 Ca -0.07 -0.50 -0.11 0.00 1.31 0.00 0.00 55.95 56.57 2ck0 s SER 202 Cb 0.06 -0.60 0.13 0.00 0.21 0.00 0.00 66.02 65.81 2ck0 s SER 202 CO 0.92 0.19 0.89 -2.65 0.41 0.00 0.00 173.24 173.00 2ck0 n PRO 203 N 0.94 -0.61 -3.68 12.44 -0.02 -1.26 -4.93 135.00 137.87 2ck0 n PRO 203 Ca -0.15 -0.12 -0.36 0.00 -2.02 0.00 0.00 63.50 60.84 2ck0 n PRO 203 Cb 0.52 -2.19 -0.09 0.00 -0.02 0.00 0.00 33.50 31.73 2ck0 n PRO 203 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2ck0 s ILE 204 N -2.54 5.38 -0.12 4.25 -1.09 0.97 -4.89 121.20 123.16 2ck0 s ILE 204 Ca 0.64 0.20 0.03 0.00 -2.23 0.00 0.00 60.65 59.28 2ck0 s ILE 204 Cb -0.22 -3.49 0.00 0.00 -1.58 0.00 0.00 42.46 37.17 2ck0 s ILE 204 CO 0.62 0.38 -0.22 0.68 -1.23 0.00 0.00 174.94 175.17 2ck0 s VAL 205 N 0.76 2.21 -0.19 2.92 -7.23 -1.26 0.36 120.40 117.97 2ck0 s VAL 205 Ca 0.08 -0.96 0.01 0.00 -1.81 0.00 0.00 61.98 59.30 2ck0 s VAL 205 Cb -0.12 -1.87 0.04 0.00 0.56 0.00 0.00 36.38 34.99 2ck0 s VAL 205 CO 0.02 0.55 -0.10 -0.75 -0.31 0.00 0.00 175.10 174.51 2ck0 s LYS 206 N 0.48 1.98 0.30 4.82 2.47 -0.23 -4.97 119.74 124.58 2ck0 s LYS 206 Ca -0.15 -0.76 0.05 0.00 -1.56 0.00 0.00 55.97 53.56 2ck0 s LYS 206 Cb -0.17 -2.32 -0.06 0.00 -1.46 0.00 0.00 37.83 33.82 2ck0 s LYS 206 CO 0.06 -0.40 -0.01 -1.12 0.16 0.00 0.00 175.35 174.03 2ck0 s SER 207 N 1.44 2.61 -0.27 1.43 0.01 -1.26 -0.88 113.70 116.78 2ck0 s SER 207 Ca -0.00 -1.26 -0.17 0.00 1.31 0.00 0.00 55.95 55.82 2ck0 s SER 207 Cb -0.16 -0.14 0.08 0.00 0.21 0.00 0.00 66.02 66.01 2ck0 s SER 207 CO -0.08 -0.45 0.68 0.72 0.41 0.00 0.00 173.24 174.51 2ck0 s PHE 208 N -3.13 -1.00 -0.10 2.43 -0.12 -0.33 -4.99 117.98 110.75 2ck0 s PHE 208 Ca 0.32 2.06 -0.11 0.00 -0.05 0.00 0.00 56.93 59.15 2ck0 s PHE 208 Cb 0.06 0.56 -0.05 0.00 -0.63 0.00 0.00 43.02 42.96 2ck0 s PHE 208 CO 0.13 -0.50 0.26 1.21 -0.05 0.00 0.00 175.22 176.28 2ck0 s ASN 209 N 1.42 6.52 0.00 1.98 2.47 -1.26 -0.54 114.94 125.53 2ck0 s ASN 209 Ca -0.08 0.62 0.00 0.00 0.42 0.00 0.00 52.86 53.82 2ck0 s ASN 209 Cb -0.05 -2.16 0.00 0.00 -1.45 0.00 0.00 41.25 37.59 2ck0 s ASN 209 CO -0.16 0.29 0.46 -1.14 -3.72 0.00 0.00 177.10 172.83