#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2p0x n SER 2 N 0.00 -0.19 -1.59 1.61 2.88 -1.26 -4.98 113.62 110.09 2p0x n SER 2 Ca 0.00 -0.42 0.03 0.00 -1.33 0.00 0.00 58.87 57.15 2p0x n SER 2 Cb 0.00 0.06 0.02 0.00 -0.75 0.00 0.00 64.21 63.53 2p0x n SER 2 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 2p0x n PHE 3 N 0.00 0.09 0.00 0.66 3.01 -1.26 -4.87 117.46 115.10 2p0x n PHE 3 Ca -0.05 -0.65 0.00 0.00 1.01 0.00 0.00 57.45 57.75 2p0x n PHE 3 Cb 0.31 -0.10 0.00 0.00 -0.01 0.00 0.00 39.48 39.68 2p0x n PHE 3 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2p0x n ARG 4 N 0.35 0.00 -3.95 -1.08 5.12 -1.26 -5.03 116.66 110.81 2p0x n ARG 4 Ca 0.04 0.00 -0.35 0.00 -1.93 0.00 0.00 57.85 55.61 2p0x n ARG 4 Cb 1.09 -0.75 -0.10 0.00 -1.16 0.00 0.00 32.46 31.53 2p0x n ARG 4 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 2p0x s VAL 5 N -1.92 4.73 -0.13 1.55 -7.23 -1.26 -4.67 120.40 111.47 2p0x s VAL 5 Ca 0.00 -0.05 0.07 0.00 -1.81 0.00 0.00 61.98 60.19 2p0x s VAL 5 Cb 0.00 -3.15 -0.23 0.00 0.56 0.00 0.00 36.38 33.56 2p0x s VAL 5 CO 0.00 0.43 0.32 0.29 -0.31 0.00 0.00 175.10 175.82 2p0x n LYS 6 N 3.85 0.68 -0.34 4.82 4.76 -1.26 -4.96 118.16 125.71 2p0x n LYS 6 Ca -0.16 0.20 -0.30 0.00 -2.87 0.00 0.00 58.31 55.18 2p0x n LYS 6 Cb 0.52 -1.67 0.29 0.00 -1.84 0.00 0.00 35.03 32.33 2p0x n LYS 6 CO 0.00 0.00 0.00 -2.14 -1.37 0.00 0.00 177.40 173.89 2p0x s PRO 7 N -2.55 -2.54 0.34 1.97 0.02 -1.26 -4.81 135.00 126.18 2p0x s PRO 7 Ca -0.15 0.40 -0.18 0.00 0.02 0.00 0.00 61.00 61.08 2p0x s PRO 7 Cb 0.07 -1.40 -0.13 0.00 0.02 0.00 0.00 34.50 33.06 2p0x s PRO 7 CO 0.78 -4.68 0.08 0.00 -0.33 0.00 0.00 177.00 172.85 2p0x n VAL 9 N -0.85 0.00 1.45 0.00 3.14 -1.26 -4.50 118.33 116.30 2p0x n VAL 9 Ca 0.10 0.00 0.15 0.00 -2.96 0.00 0.00 64.34 61.62 2p0x n VAL 9 Cb 0.34 0.05 0.69 0.00 -1.06 0.00 0.00 33.84 33.86 2p0x n VAL 9 CO 0.00 0.00 0.00 0.52 -6.46 0.00 0.00 176.83 170.89 2p0x n VAL 10 N 0.00 0.00 0.00 1.55 0.31 -1.26 -4.15 118.33 114.78 2p0x n VAL 10 Ca 0.00 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.30 2p0x n VAL 10 Cb 0.00 -0.28 0.00 0.00 -0.91 0.00 0.00 33.84 32.65 2p0x n VAL 10 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2p0x n LYS 12 N -1.68 -1.77 0.00 0.00 5.02 -1.26 -4.41 118.16 114.07 2p0x n LYS 12 Ca 0.00 0.10 0.04 0.00 -2.02 0.00 0.00 58.31 56.43 2p0x n LYS 12 Cb 0.14 -3.19 -0.04 0.00 -0.02 0.00 0.00 35.03 31.91 2p0x n LYS 12 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 2p0x n VAL 13 N -0.51 0.00 -4.77 -0.18 3.14 -1.26 -4.97 118.33 109.78 2p0x n VAL 13 Ca -0.01 -0.31 -0.33 0.00 -2.96 0.00 0.00 64.34 60.74 2p0x n VAL 13 Cb 0.08 1.01 -0.13 0.00 -1.06 0.00 0.00 33.84 33.74 2p0x n VAL 13 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2p0x s ALA 14 N -1.77 2.77 -0.22 1.55 0.00 -1.26 -4.99 121.76 117.84 2p0x s ALA 14 Ca 0.04 -0.93 0.00 0.00 0.00 0.00 0.00 51.96 51.07 2p0x s ALA 14 Cb 0.07 -1.11 0.00 0.00 0.00 0.00 0.00 23.12 22.07 2p0x s ALA 14 CO 0.34 0.50 0.44 -0.35 0.00 0.00 0.00 175.76 176.69 2p0x n PRO 15 N 2.53 0.49 -2.28 0.00 -0.04 -1.26 -4.80 135.00 129.64 2p0x n PRO 15 Ca -0.18 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.25 2p0x n PRO 15 Cb 0.52 -1.25 -0.03 0.00 -0.04 0.00 0.00 33.50 32.71 2p0x n PRO 15 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2p0x n ARG 16 N 0.64 -3.86 -0.69 0.54 1.74 -1.26 -4.77 116.66 108.99 2p0x n ARG 16 Ca 0.00 2.97 -0.25 0.00 -0.77 0.00 0.00 57.85 59.80 2p0x n ARG 16 Cb 0.22 -4.16 -0.02 0.00 -1.02 0.00 0.00 32.46 27.48 2p0x n ARG 16 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2p0x n ASP 17 N 1.40 -0.36 -4.09 0.55 9.92 -1.26 -4.12 116.55 118.59 2p0x n ASP 17 Ca -0.24 0.55 -0.07 0.00 -0.53 0.00 0.00 54.79 54.50 2p0x n ASP 17 Cb 0.37 -0.45 -0.10 0.00 -0.64 0.00 0.00 41.12 40.30 2p0x n ASP 17 CO 0.00 0.00 0.00 -1.66 0.13 0.00 0.00 177.20 175.67 2p0x s TRP 18 N -0.29 0.56 0.05 1.24 -2.14 -1.26 0.88 118.94 117.98 2p0x s TRP 18 Ca 0.36 -1.08 -0.01 0.00 2.66 0.00 0.00 56.10 58.04 2p0x s TRP 18 Cb -0.51 -0.39 -0.04 0.00 -3.10 0.00 0.00 33.47 29.43 2p0x s TRP 18 CO 0.27 -0.40 -0.03 0.50 -2.66 0.00 0.00 176.95 174.62 2p0x s ARG 19 N -3.94 0.63 -0.31 3.25 3.52 0.51 -4.97 118.95 117.65 2p0x s ARG 19 Ca 0.09 -1.22 -0.07 0.00 -0.13 0.00 0.00 55.73 54.41 2p0x s ARG 19 Cb 0.08 0.17 0.02 0.00 -1.56 0.00 0.00 34.95 33.65 2p0x s ARG 19 CO -0.08 -0.10 0.08 0.08 -0.81 0.00 0.00 175.30 174.47 2p0x s VAL 20 N -3.83 3.88 -0.24 7.11 1.01 -1.26 0.85 120.40 127.91 2p0x s VAL 20 Ca 0.07 -0.83 -0.06 0.00 0.00 0.00 0.00 61.98 61.16 2p0x s VAL 20 Cb 0.07 -3.06 -0.01 0.00 0.00 0.00 0.00 36.38 33.38 2p0x s VAL 20 CO -0.09 0.01 0.02 -0.75 0.00 0.00 0.00 175.10 174.29 2p0x s LYS 21 N 1.47 3.42 0.29 2.72 2.47 0.90 -4.96 119.74 126.04 2p0x s LYS 21 Ca 0.01 -0.62 0.00 0.00 -1.56 0.00 0.00 55.97 53.81 2p0x s LYS 21 Cb -0.18 -3.19 0.00 0.00 -1.46 0.00 0.00 37.83 33.00 2p0x s LYS 21 CO 0.02 -0.24 0.00 0.09 0.16 0.00 0.00 175.35 175.38 2p0x n ASN 22 N 4.85 0.00 0.00 1.43 3.02 -1.26 0.20 115.26 123.50 2p0x n ASN 22 Ca -0.17 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.38 2p0x n ASN 22 Cb 0.50 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.67 2p0x n ASN 22 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2p0x n ARG 23 N 0.00 -0.47 -4.21 3.52 1.74 -1.26 -5.05 116.66 110.93 2p0x n ARG 23 Ca 0.00 -0.50 -0.23 0.00 -0.77 0.00 0.00 57.85 56.35 2p0x n ARG 23 Cb 0.00 -0.91 -0.06 0.00 -1.02 0.00 0.00 32.46 30.47 2p0x n ARG 23 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 2p0x s HIS 24 N -0.08 2.89 -0.16 -1.55 3.76 0.53 -4.00 115.29 116.69 2p0x s HIS 24 Ca 0.00 -0.16 -0.04 0.00 -0.15 0.00 0.00 55.06 54.71 2p0x s HIS 24 Cb 0.00 -1.31 -0.03 0.00 1.11 0.00 0.00 32.58 32.35 2p0x s HIS 24 CO 0.00 0.57 -0.04 -0.51 -0.85 0.00 0.00 174.74 173.91 2p0x s LEU 25 N -3.62 3.24 -0.16 0.89 1.02 0.58 -0.07 118.68 120.56 2p0x s LEU 25 Ca 0.31 -0.13 -0.04 0.00 0.02 0.00 0.00 54.13 54.29 2p0x s LEU 25 Cb -0.07 -1.78 -0.03 0.00 0.02 0.00 0.00 46.19 44.33 2p0x s LEU 25 CO 0.22 0.17 -0.03 -0.60 0.02 0.00 0.00 176.35 176.12 2p0x s ARG 26 N 0.38 3.65 0.26 1.70 3.52 0.25 -0.31 118.95 128.40 2p0x s ARG 26 Ca -0.04 -0.53 0.08 0.00 -0.13 0.00 0.00 55.73 55.12 2p0x s ARG 26 Cb -0.14 -2.94 -0.04 0.00 -1.56 0.00 0.00 34.95 30.27 2p0x s ARG 26 CO 0.03 0.19 0.11 0.42 -0.81 0.00 0.00 175.30 175.24 2p0x s ILE 27 N 0.50 3.91 -0.15 4.11 1.01 0.40 0.19 121.20 131.18 2p0x s ILE 27 Ca -0.03 -1.65 0.01 0.00 0.00 0.00 0.00 60.65 58.98 2p0x s ILE 27 Cb -0.14 -3.13 0.02 0.00 0.01 0.00 0.00 42.46 39.22 2p0x s ILE 27 CO 0.03 -0.35 -0.16 -0.31 0.00 0.00 0.00 174.94 174.14 2p0x s TYR 28 N -2.24 2.35 -0.51 3.97 2.02 88.31 -1.74 117.35 209.52 2p0x s TYR 28 Ca 0.33 -1.31 0.00 0.00 -0.37 0.00 0.00 57.07 55.71 2p0x s TYR 28 Cb -0.07 -1.68 0.00 0.00 -0.40 0.00 0.00 41.96 39.81 2p0x s TYR 28 CO 0.23 -0.68 0.66 0.09 -1.57 0.00 0.00 175.55 174.27 2p0x n ASN 29 N 4.61 0.00 -3.68 2.29 3.02 0.27 -4.07 115.26 117.70 2p0x n ASN 29 Ca -0.18 0.19 -0.13 0.00 -0.03 0.00 0.00 54.58 54.43 2p0x n ASN 29 Cb 0.50 -0.19 -0.09 0.00 -0.61 0.00 0.00 39.78 39.39 2p0x n ASN 29 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 2p0x s MET 30 N -2.32 0.64 1.20 3.52 -1.94 -1.26 -0.43 119.30 118.71 2p0x s MET 30 Ca 0.00 0.80 -0.15 0.00 -1.71 0.00 0.00 55.69 54.63 2p0x s MET 30 Cb 0.00 0.29 0.29 0.00 2.01 0.00 0.00 34.83 37.42 2p0x s MET 30 CO 0.00 -0.09 1.03 0.00 -0.01 0.00 0.00 175.02 175.95 2p0x h LYS 32 N -2.67 0.66 0.00 0.00 3.11 -1.96 1.32 116.57 117.04 2p0x h LYS 32 Ca -0.56 -0.04 0.00 0.00 -2.81 0.00 0.00 60.65 57.24 2p0x h LYS 32 Cb 1.33 -0.15 0.00 0.00 -1.00 0.00 0.00 32.23 32.41 2p0x h LYS 32 CO 0.47 0.44 0.00 2.41 -2.81 0.00 0.00 179.45 179.96 2p0x n THR 33 N -4.82 0.00 0.12 1.00 -1.04 -1.26 -2.85 114.28 105.43 2p0x n THR 33 Ca 0.14 1.21 0.18 0.00 -2.04 0.00 0.00 64.05 63.54 2p0x n THR 33 Cb 0.32 -2.21 0.76 0.00 -1.82 0.00 0.00 70.33 67.38 2p0x n THR 33 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2p0x h PHE 35 N 0.00 -0.05 -0.44 0.00 3.57 0.18 5.31 116.94 125.51 2p0x h PHE 35 Ca 0.16 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.59 2p0x h PHE 35 Cb 0.77 0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.54 2p0x h PHE 35 CO 0.00 -0.05 -0.03 -0.91 -2.23 0.00 0.00 178.31 175.09 2p0x h ASN 36 N 0.03 0.79 -0.12 0.41 2.35 -1.04 -2.78 115.58 115.21 2p0x h ASN 36 Ca 0.08 -0.33 -0.09 0.00 -0.55 0.00 0.00 56.30 55.41 2p0x h ASN 36 Cb 0.11 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.26 2p0x h ASN 36 CO -0.16 0.92 -0.22 -1.13 -1.65 0.00 0.00 177.43 175.20 2p0x h ASN 37 N 0.63 0.55 -0.28 5.81 -0.00 -0.47 -2.06 115.58 119.76 2p0x h ASN 37 Ca 0.12 -0.18 0.08 0.00 -0.00 0.00 0.00 56.30 56.32 2p0x h ASN 37 Cb 0.54 -0.15 -0.01 0.00 -0.00 0.00 0.00 38.32 38.70 2p0x h ASN 37 CO 0.03 0.77 0.22 0.77 -0.00 0.00 0.00 177.43 179.21 2p0x h SER 38 N 0.49 0.00 0.05 1.15 4.64 1.10 1.71 113.55 122.69 2p0x h SER 38 Ca 0.07 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.33 2p0x h SER 38 Cb 0.65 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.73 2p0x h SER 38 CO 0.05 0.00 -0.19 0.40 -0.87 0.00 0.00 176.83 176.22 2p0x h ILE 39 N 0.00 1.21 0.01 0.95 2.04 -1.22 3.86 117.51 124.36 2p0x h ILE 39 Ca 0.13 -0.97 -0.00 0.00 1.00 0.00 0.00 64.86 65.03 2p0x h ILE 39 Cb 0.56 1.30 0.00 0.00 -0.74 0.00 0.00 36.82 37.94 2p0x h ILE 39 CO -0.00 0.30 -0.00 0.11 0.00 0.00 0.00 178.15 178.55 2p0x h LYS 40 N 0.25 -0.01 0.11 2.37 6.56 0.21 -2.48 116.57 123.58 2p0x h LYS 40 Ca 0.05 0.00 -0.01 0.00 -1.06 0.00 0.00 60.65 59.63 2p0x h LYS 40 Cb 0.48 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.14 2p0x h LYS 40 CO 0.03 -0.00 -0.05 0.77 -2.06 0.00 0.00 179.45 178.13 2p0x h SER 41 N -0.16 -0.13 -0.03 0.86 0.02 0.81 -3.27 113.55 111.65 2p0x h SER 41 Ca -0.00 -0.31 -0.00 0.00 -0.84 0.00 0.00 61.79 60.64 2p0x h SER 41 Cb 0.01 0.03 -0.00 0.00 0.14 0.00 0.00 62.40 62.58 2p0x h SER 41 CO 0.00 0.25 0.01 1.23 -1.14 0.00 0.00 176.83 177.19 2p0x h GLY 42 N -0.53 0.05 0.00 -3.77 0.00 0.63 -3.43 103.07 96.01 2p0x h GLY 42 Ca -0.02 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.29 2p0x h GLY 42 CO 0.03 0.03 0.00 1.34 0.00 0.00 0.00 176.54 177.93 2p0x n ASP 43 N -4.97 0.00 0.00 0.19 2.03 0.63 -4.28 116.55 110.14 2p0x n ASP 43 Ca -0.07 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.24 2p0x n ASP 43 Cb 0.12 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.52 2p0x n ASP 43 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2p0x n ASP 44 N 0.00 0.00 0.00 1.67 2.03 -1.26 -3.96 116.55 115.03 2p0x n ASP 44 Ca 0.00 0.04 0.00 0.00 0.52 0.00 0.00 54.79 55.35 2p0x n ASP 44 Cb 0.00 -0.02 0.00 0.00 -0.72 0.00 0.00 41.12 40.38 2p0x n ASP 44 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 2p0x n THR 45 N -1.66 0.00 -1.40 5.18 -2.24 -1.26 -4.99 114.28 107.90 2p0x n THR 45 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2p0x n THR 45 Cb 0.00 0.72 0.00 0.00 -2.10 0.00 0.00 70.33 68.95 2p0x n THR 45 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2p0x n TYR 46 N 0.00 -1.10 -4.35 4.78 0.18 -1.25 -4.80 117.16 110.61 2p0x n TYR 46 Ca 0.00 0.00 -0.26 0.00 1.88 0.00 0.00 57.90 59.52 2p0x n TYR 46 Cb 0.03 -0.68 -0.12 0.00 -0.38 0.00 0.00 39.34 38.18 2p0x n TYR 46 CO 0.00 0.00 0.00 -3.38 -2.08 0.00 0.00 176.86 171.40 2p0x s HIS 47 N -1.10 2.06 0.00 -3.48 -3.43 -1.26 -4.83 115.29 103.25 2p0x s HIS 47 Ca 0.00 -0.40 0.00 0.00 -0.80 0.00 0.00 55.06 53.86 2p0x s HIS 47 Cb 0.00 -1.09 0.00 0.00 -1.43 0.00 0.00 32.58 30.06 2p0x s HIS 47 CO 0.00 0.32 0.00 0.41 -2.00 0.00 0.00 174.74 173.47 2p0x n GLY 48 N 0.78 3.43 3.12 -1.38 0.00 -1.26 -4.94 105.19 104.94 2p0x n GLY 48 Ca -0.17 -0.22 -0.08 0.00 0.00 0.00 0.00 46.02 45.55 2p0x n GLY 48 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2p0x s HIS 49 N 0.00 0.48 -0.06 1.61 -3.43 -1.03 -0.30 115.29 112.56 2p0x s HIS 49 Ca 0.00 -0.99 0.06 0.00 -0.80 0.00 0.00 55.06 53.33 2p0x s HIS 49 Cb 0.00 -0.33 -0.01 0.00 -1.43 0.00 0.00 32.58 30.81 2p0x s HIS 49 CO 0.00 -0.43 -0.25 0.08 -2.00 0.00 0.00 174.74 172.15 2p0x s VAL 50 N -3.92 2.09 -0.10 -5.38 1.01 -0.71 -1.72 120.40 111.67 2p0x s VAL 50 Ca 0.08 -1.06 0.03 0.00 0.00 0.00 0.00 61.98 61.03 2p0x s VAL 50 Cb 0.07 -1.75 0.01 0.00 0.00 0.00 0.00 36.38 34.71 2p0x s VAL 50 CO -0.09 0.57 -0.18 -1.81 0.00 0.00 0.00 175.10 173.59 2p0x s ASP 51 N -0.18 2.54 -0.15 3.32 1.01 -0.20 0.15 116.67 123.16 2p0x s ASP 51 Ca -0.03 -0.45 -0.03 0.00 0.71 0.00 0.00 52.55 52.74 2p0x s ASP 51 Cb -0.14 -1.16 -0.03 0.00 1.01 0.00 0.00 42.92 42.61 2p0x s ASP 51 CO 0.04 0.07 -0.05 0.26 0.21 0.00 0.00 175.17 175.69 2p0x s TRP 52 N 0.70 2.99 0.27 4.23 0.52 0.58 0.19 118.94 128.42 2p0x s TRP 52 Ca -0.12 -0.35 0.08 0.00 0.02 0.00 0.00 56.10 55.73 2p0x s TRP 52 Cb -0.16 -1.94 -0.04 0.00 -1.15 0.00 0.00 33.47 30.18 2p0x s TRP 52 CO 0.03 -0.06 0.15 -0.51 0.02 0.00 0.00 176.95 176.58 2p0x s LEU 53 N 0.34 3.61 0.00 2.99 1.02 0.42 -0.31 118.68 126.75 2p0x s LEU 53 Ca -0.05 -0.40 0.00 0.00 0.02 0.00 0.00 54.13 53.70 2p0x s LEU 53 Cb -0.14 -2.15 0.00 0.00 0.02 0.00 0.00 46.19 43.92 2p0x s LEU 53 CO 0.03 -0.07 0.39 1.15 0.02 0.00 0.00 176.35 177.87 2p0x n MET 54 N -1.12 0.60 0.00 1.70 0.00 -1.26 -3.17 117.12 113.87 2p0x n MET 54 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.63 2p0x n MET 54 Cb 0.58 -1.27 0.00 0.00 0.00 0.00 0.00 33.22 32.53 2p0x n MET 54 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 2p0x n TYR 55 N 0.35 0.00 -4.15 3.17 4.01 -1.26 -5.15 117.16 114.12 2p0x n TYR 55 Ca 0.00 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.64 2p0x n TYR 55 Cb 0.19 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.12 2p0x n TYR 55 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 2p0x s THR 56 N -0.36 0.53 -0.11 -0.72 -4.23 -1.19 -5.15 115.64 104.41 2p0x s THR 56 Ca 0.00 -1.91 0.02 0.00 -1.18 0.00 0.00 61.69 58.62 2p0x s THR 56 Cb 0.00 -1.71 -0.01 0.00 1.34 0.00 0.00 72.50 72.12 2p0x s THR 56 CO 0.00 -0.84 -0.17 1.51 -0.54 0.00 0.00 174.62 174.59 2p0x s ASP 57 N -3.03 3.74 -0.00 3.99 1.47 -1.26 0.16 116.67 121.74 2p0x s ASP 57 Ca 0.13 -0.37 0.06 0.00 1.18 0.00 0.00 52.55 53.54 2p0x s ASP 57 Cb 0.06 -1.38 -0.03 0.00 -0.34 0.00 0.00 42.92 41.23 2p0x s ASP 57 CO -0.05 0.20 -0.18 0.00 0.68 0.00 0.00 175.17 175.82 2p0x s ALA 58 N 0.14 2.53 -0.02 2.11 0.00 0.52 -4.97 121.76 122.07 2p0x s ALA 58 Ca -0.09 -1.11 -0.01 0.00 0.00 0.00 0.00 51.96 50.76 2p0x s ALA 58 Cb -0.15 -0.78 0.01 0.00 0.00 0.00 0.00 23.12 22.20 2p0x s ALA 58 CO 0.05 0.56 0.03 0.15 0.00 0.00 0.00 175.76 176.55 2p0x s LYS 59 N -1.03 0.01 -0.42 0.00 1.02 -1.26 -1.03 119.74 117.02 2p0x s LYS 59 Ca 0.13 0.10 0.05 0.00 0.02 0.00 0.00 55.97 56.26 2p0x s LYS 59 Cb -0.10 -0.08 0.19 0.00 -0.52 0.00 0.00 37.83 37.31 2p0x s LYS 59 CO 0.02 -0.07 0.38 -1.91 -0.92 0.00 0.00 175.35 172.86 2p0x n GLU 60 N 3.49 0.38 -0.74 1.68 2.13 -0.70 -4.89 120.64 122.00 2p0x n GLU 60 Ca -0.18 -3.26 0.00 0.00 0.66 0.00 0.00 57.16 54.38 2p0x n GLU 60 Cb 0.56 -1.62 0.00 0.00 0.27 0.00 0.00 31.44 30.65 2p0x n GLU 60 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 2p0x n PHE 61 N 2.51 0.00 0.00 4.31 7.35 -1.26 -2.45 117.46 127.92 2p0x n PHE 61 Ca 0.28 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.97 2p0x n PHE 61 Cb 0.48 -1.15 0.00 0.00 0.35 0.00 0.00 39.48 39.16 2p0x n PHE 61 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 2p0x n SER 62 N -0.68 0.95 -4.59 -2.13 2.88 -1.26 -4.65 113.62 104.14 2p0x n SER 62 Ca 0.00 -0.03 -0.64 0.00 -1.33 0.00 0.00 58.87 56.88 2p0x n SER 62 Cb 0.24 0.25 -0.10 0.00 -0.75 0.00 0.00 64.21 63.84 2p0x n SER 62 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2p0x n SER 63 N -0.34 1.28 0.00 -3.46 2.88 -1.26 -4.68 113.62 108.04 2p0x n SER 63 Ca 0.00 1.00 0.00 0.00 -1.33 0.00 0.00 58.87 58.54 2p0x n SER 63 Cb 0.00 -0.94 0.00 0.00 -0.75 0.00 0.00 64.21 62.52 2p0x n SER 63 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16