#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cd0 s PHE 2 N 0.00 -0.04 0.08 1.20 -0.12 -1.26 -4.78 117.98 113.05 2cd0 s PHE 2 Ca 0.00 -0.13 0.06 0.00 -0.05 0.00 0.00 56.93 56.81 2cd0 s PHE 2 Cb 0.00 0.58 -0.03 0.00 -0.63 0.00 0.00 43.02 42.94 2cd0 s PHE 2 CO 0.00 -0.46 -0.16 -1.17 -0.05 0.00 0.00 175.22 173.38 2cd0 s LEU 3 N -3.10 2.27 -0.22 -1.99 2.96 -1.26 -4.97 118.68 112.37 2cd0 s LEU 3 Ca 0.16 -0.62 -0.01 0.00 -0.22 0.00 0.00 54.13 53.44 2cd0 s LEU 3 Cb 0.02 -0.66 0.02 0.00 0.50 0.00 0.00 46.19 46.07 2cd0 s LEU 3 CO -0.01 -0.01 -0.10 -0.76 -1.32 0.00 0.00 176.35 174.14 2cd0 s LEU 4 N -1.70 2.78 -0.20 -0.68 1.43 -1.26 -1.16 118.68 117.89 2cd0 s LEU 4 Ca 0.01 -0.70 -0.08 0.00 -1.03 0.00 0.00 54.13 52.34 2cd0 s LEU 4 Cb -0.10 -1.62 -0.04 0.00 0.03 0.00 0.00 46.19 44.46 2cd0 s LEU 4 CO 0.03 -0.06 0.07 -0.89 0.23 0.00 0.00 176.35 175.73 2cd0 s THR 5 N 1.34 4.76 0.15 5.49 2.01 0.21 -3.15 115.64 126.45 2cd0 s THR 5 Ca 0.03 -0.04 0.06 0.00 0.31 0.00 0.00 61.69 62.05 2cd0 s THR 5 Cb -0.15 -3.16 -0.04 0.00 0.01 0.00 0.00 72.50 69.16 2cd0 s THR 5 CO -0.07 0.43 -0.13 -1.10 -0.69 0.00 0.00 174.62 173.06 2cd0 s GLN 6 N 0.63 1.11 0.62 4.92 -0.21 -1.26 -1.48 119.66 123.99 2cd0 s GLN 6 Ca 0.04 -1.38 -0.18 0.00 0.02 0.00 0.00 55.36 53.86 2cd0 s GLN 6 Cb -0.13 -0.91 -0.02 0.00 1.00 0.00 0.00 33.01 32.95 2cd0 s GLN 6 CO 0.01 0.16 1.22 -1.25 -2.12 0.00 0.00 175.29 173.31 2cd0 s PRO 7 N -3.15 2.81 0.15 2.91 0.04 -1.26 -4.81 135.00 131.69 2cd0 s PRO 7 Ca 0.14 1.84 -0.14 0.00 0.04 0.00 0.00 61.00 62.87 2cd0 s PRO 7 Cb -0.02 -1.91 0.03 0.00 0.04 0.00 0.00 34.50 32.64 2cd0 s PRO 7 CO 0.03 -1.33 1.71 1.25 0.04 0.00 0.00 177.00 178.70 2cd0 h HIS 8 N 0.67 0.71 -3.01 0.56 2.76 -1.97 -3.36 115.15 111.53 2cd0 h HIS 8 Ca -0.50 -0.05 0.04 0.00 -2.20 0.00 0.00 60.37 57.66 2cd0 h HIS 8 Cb 1.30 -0.22 -0.08 0.00 1.55 0.00 0.00 27.41 29.97 2cd0 h HIS 8 CO 0.46 0.59 0.22 -1.54 -1.30 0.00 0.00 177.93 176.36 2cd0 s SER 9 N -5.92 -0.37 -0.14 3.26 1.04 -1.26 -1.47 113.70 108.84 2cd0 s SER 9 Ca -0.13 -0.39 -0.12 0.00 0.48 0.00 0.00 55.95 55.79 2cd0 s SER 9 Cb 0.11 0.68 0.04 0.00 0.10 0.00 0.00 66.02 66.95 2cd0 s SER 9 CO 0.77 -1.21 0.36 -0.69 0.98 0.00 0.00 173.24 173.44 2cd0 s VAL 11 N -3.86 -0.00 -0.10 5.02 1.01 0.40 -4.88 120.40 117.99 2cd0 s VAL 11 Ca 0.07 0.02 -0.02 0.00 0.00 0.00 0.00 61.98 62.05 2cd0 s VAL 11 Cb -0.04 -0.50 0.03 0.00 0.00 0.00 0.00 36.38 35.87 2cd0 s VAL 11 CO -0.00 0.01 0.00 -0.44 0.00 0.00 0.00 175.10 174.67 2cd0 s SER 12 N 0.35 1.89 0.06 3.32 0.01 -1.26 -0.10 113.70 117.97 2cd0 s SER 12 Ca -0.01 -0.25 -0.01 0.00 1.31 0.00 0.00 55.95 56.99 2cd0 s SER 12 Cb -0.03 -0.50 -0.04 0.00 0.21 0.00 0.00 66.02 65.66 2cd0 s SER 12 CO -0.01 -0.21 -0.02 -1.61 0.41 0.00 0.00 173.24 171.80 2cd0 s GLU 13 N 1.93 0.65 0.46 12.44 0.41 -0.84 -4.97 118.70 128.77 2cd0 s GLU 13 Ca 0.04 -1.23 -0.19 0.00 -0.41 0.00 0.00 54.97 53.18 2cd0 s GLU 13 Cb -0.13 0.22 -0.10 0.00 -1.78 0.00 0.00 34.13 32.34 2cd0 s GLU 13 CO -0.06 -0.13 0.95 -1.12 -0.49 0.00 0.00 175.26 174.41 2cd0 s SER 14 N -2.93 6.81 0.68 -0.19 0.01 -1.26 -1.57 113.70 115.25 2cd0 s SER 14 Ca 0.08 1.61 -0.17 0.00 1.31 0.00 0.00 55.95 58.79 2cd0 s SER 14 Cb 0.08 -2.52 -0.01 0.00 0.21 0.00 0.00 66.02 63.78 2cd0 s SER 14 CO -0.09 -0.44 0.96 -2.65 0.41 0.00 0.00 173.24 171.43 2cd0 n PRO 15 N -0.98 0.65 0.00 12.44 -0.02 -1.26 -2.54 135.00 143.28 2cd0 n PRO 15 Ca 0.07 0.27 0.00 0.00 -2.02 0.00 0.00 63.50 61.82 2cd0 n PRO 15 Cb 0.54 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.82 2cd0 n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2cd0 n GLY 16 N 1.18 3.09 3.94 -1.23 0.00 0.74 -4.86 105.19 108.05 2cd0 n GLY 16 Ca 0.13 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.91 2cd0 n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cd0 s LYS 17 N -0.49 2.82 -0.10 1.61 -0.14 -1.05 -3.96 119.74 118.42 2cd0 s LYS 17 Ca 0.00 -0.29 -0.03 0.00 -1.36 0.00 0.00 55.97 54.29 2cd0 s LYS 17 Cb 0.00 -2.38 -0.03 0.00 -1.68 0.00 0.00 37.83 33.74 2cd0 s LYS 17 CO 0.00 -0.64 0.01 0.99 -0.76 0.00 0.00 175.35 174.95 2cd0 s THR 18 N -2.86 4.35 0.05 2.17 2.01 -1.26 -1.01 115.64 119.09 2cd0 s THR 18 Ca 0.53 -0.23 0.07 0.00 0.31 0.00 0.00 61.69 62.37 2cd0 s THR 18 Cb -0.10 -2.85 -0.03 0.00 0.01 0.00 0.00 72.50 69.53 2cd0 s THR 18 CO 0.42 0.58 -0.18 0.54 -0.69 0.00 0.00 174.62 175.29 2cd0 s VAL 19 N -0.62 1.47 -0.34 3.82 0.11 -0.17 -4.98 120.40 119.69 2cd0 s VAL 19 Ca 0.10 -1.18 0.02 0.00 -2.93 0.00 0.00 61.98 58.00 2cd0 s VAL 19 Cb -0.12 -1.30 0.10 0.00 -1.53 0.00 0.00 36.38 33.53 2cd0 s VAL 19 CO 0.02 0.09 0.08 -0.89 -3.33 0.00 0.00 175.10 171.07 2cd0 s THR 20 N -0.88 1.82 -0.27 5.04 2.01 -1.26 -1.04 115.64 121.06 2cd0 s THR 20 Ca 0.05 -2.08 -0.24 0.00 0.31 0.00 0.00 61.69 59.73 2cd0 s THR 20 Cb -0.09 -2.35 -0.01 0.00 0.01 0.00 0.00 72.50 70.07 2cd0 s THR 20 CO 0.02 -0.64 0.79 -0.63 -0.69 0.00 0.00 174.62 173.47 2cd0 s ILE 21 N 1.08 4.84 0.38 1.82 1.01 -0.15 -4.92 121.20 125.26 2cd0 s ILE 21 Ca 0.11 1.38 -0.03 0.00 0.00 0.00 0.00 60.65 62.11 2cd0 s ILE 21 Cb -0.19 -4.10 -0.04 0.00 0.01 0.00 0.00 42.46 38.14 2cd0 s ILE 21 CO -0.13 -0.12 0.64 -0.94 0.00 0.00 0.00 174.94 174.39 2cd0 s SER 22 N 1.45 6.33 -0.38 3.58 1.04 -1.26 -0.79 113.70 123.66 2cd0 s SER 22 Ca 0.33 0.70 0.02 0.00 0.48 0.00 0.00 55.95 57.48 2cd0 s SER 22 Cb -0.15 -2.14 0.16 0.00 0.10 0.00 0.00 66.02 63.99 2cd0 s SER 22 CO 0.09 -0.37 0.32 0.00 0.98 0.00 0.00 173.24 174.26 2cd0 s THR 24 N 0.88 5.12 -0.21 0.00 2.01 -0.55 -1.24 115.64 121.64 2cd0 s THR 24 Ca 0.23 0.99 -0.17 0.00 0.31 0.00 0.00 61.69 63.04 2cd0 s THR 24 Cb -0.12 -3.82 -0.03 0.00 0.01 0.00 0.00 72.50 68.53 2cd0 s THR 24 CO -0.06 0.38 0.48 -0.60 -0.69 0.00 0.00 174.62 174.12 2cd0 s ARG 25 N 0.26 4.15 0.05 4.92 3.52 -1.06 -0.62 118.95 130.17 2cd0 s ARG 25 Ca 0.27 0.32 -0.20 0.00 -0.13 0.00 0.00 55.73 55.98 2cd0 s ARG 25 Cb -0.16 -3.58 -0.09 0.00 -1.56 0.00 0.00 34.95 29.57 2cd0 s ARG 25 CO 0.12 -0.16 1.32 0.66 -0.81 0.00 0.00 175.30 176.42 2cd0 h SER 26 N 7.57 -0.87 -3.72 -2.12 4.64 -1.46 -3.46 113.55 114.13 2cd0 h SER 26 Ca -0.33 0.08 -0.41 0.00 -0.47 0.00 0.00 61.79 60.66 2cd0 h SER 26 Cb 1.15 0.31 -0.14 0.00 -0.31 0.00 0.00 62.40 63.41 2cd0 h SER 26 CO 0.72 -0.34 -0.64 -0.94 -0.87 0.00 0.00 176.83 174.76 2cd0 s SER 27 N -3.60 1.95 0.07 4.97 1.04 -1.26 -5.00 113.70 111.87 2cd0 s SER 27 Ca -0.10 -1.28 0.00 0.00 0.48 0.00 0.00 55.95 55.05 2cd0 s SER 27 Cb 0.03 -0.01 0.00 0.00 0.10 0.00 0.00 66.02 66.14 2cd0 s SER 27 CO 0.34 -0.56 0.00 0.61 0.98 0.00 0.00 173.24 174.62 2cd0 n GLY 27 N -0.51 -3.01 3.68 7.32 0.00 -1.26 -4.81 105.19 106.60 2cd0 n GLY 27 Ca -0.04 -1.21 -0.42 0.00 0.00 0.00 0.00 46.02 44.35 2cd0 n GLY 27 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2cd0 s SER 27 N -2.97 6.72 0.00 1.61 0.15 -1.26 -4.89 113.70 113.06 2cd0 s SER 27 Ca 0.00 2.27 0.15 0.00 0.70 0.00 0.00 55.95 59.07 2cd0 s SER 27 Cb 0.00 -2.56 0.82 0.00 -1.71 0.00 0.00 66.02 62.58 2cd0 s SER 27 CO 0.00 -0.82 1.39 0.00 1.20 0.00 0.00 173.24 175.01 2cd0 n ILE 28 N 4.85 0.36 0.02 6.45 3.06 -1.26 -2.64 119.36 130.20 2cd0 n ILE 28 Ca 0.15 0.09 0.04 0.00 -2.50 0.00 0.00 62.75 60.53 2cd0 n ILE 28 Cb 0.42 -0.84 -0.10 0.00 0.54 0.00 0.00 39.64 39.66 2cd0 n ILE 28 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2cd0 n ALA 29 N -1.18 2.24 0.62 1.51 0.00 -1.26 -4.18 120.51 118.26 2cd0 n ALA 29 Ca 0.09 -0.58 0.06 0.00 0.00 0.00 0.00 53.44 53.01 2cd0 n ALA 29 Cb 0.10 -0.83 0.31 0.00 0.00 0.00 0.00 19.45 19.03 2cd0 n ALA 29 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2cd0 n ASN 30 N -2.65 0.00 -3.80 0.00 5.03 -1.08 -4.68 115.26 108.08 2cd0 n ASN 30 Ca -0.09 -0.09 -0.12 0.00 0.87 0.00 0.00 54.58 55.15 2cd0 n ASN 30 Cb 0.75 -0.16 -0.09 0.00 -1.02 0.00 0.00 39.78 39.26 2cd0 n ASN 30 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.26 175.63 2cd0 s ASN 31 N -2.32 -0.10 0.57 6.41 0.01 -1.26 -5.06 114.94 113.19 2cd0 s ASN 31 Ca 0.14 -0.10 -0.18 0.00 -0.71 0.00 0.00 52.86 52.01 2cd0 s ASN 31 Cb 0.08 0.29 -0.05 0.00 0.41 0.00 0.00 41.25 41.99 2cd0 s ASN 31 CO 0.16 -0.48 1.11 -0.31 -1.51 0.00 0.00 177.10 176.07 2cd0 s TYR 32 N -1.76 2.72 -0.10 2.20 2.02 -1.26 -4.88 117.35 116.29 2cd0 s TYR 32 Ca -0.11 1.55 0.04 0.00 -0.37 0.00 0.00 57.07 58.17 2cd0 s TYR 32 Cb -0.04 -3.21 0.00 0.00 -0.40 0.00 0.00 41.96 38.31 2cd0 s TYR 32 CO 0.01 -1.48 -0.22 0.08 -1.57 0.00 0.00 175.55 172.37 2cd0 s VAL 33 N -1.99 1.89 0.22 0.71 1.01 -1.26 -4.06 120.40 116.92 2cd0 s VAL 33 Ca 0.70 -0.92 0.10 0.00 0.00 0.00 0.00 61.98 61.86 2cd0 s VAL 33 Cb -0.22 -1.65 -0.04 0.00 0.00 0.00 0.00 36.38 34.47 2cd0 s VAL 33 CO 0.30 0.52 -0.12 -1.00 0.00 0.00 0.00 175.10 174.80 2cd0 s HIS 34 N 0.45 2.52 -0.04 5.22 3.76 -0.21 0.11 115.29 127.10 2cd0 s HIS 34 Ca -0.17 -0.27 0.02 0.00 -0.15 0.00 0.00 55.06 54.49 2cd0 s HIS 34 Cb -0.17 -1.19 0.01 0.00 1.11 0.00 0.00 32.58 32.34 2cd0 s HIS 34 CO 0.07 0.56 -0.09 -1.58 -0.85 0.00 0.00 174.74 172.86 2cd0 s TRP 35 N -1.95 1.05 0.13 1.40 0.52 -0.07 -0.15 118.94 119.86 2cd0 s TRP 35 Ca 0.26 -0.32 0.06 0.00 0.02 0.00 0.00 56.10 56.13 2cd0 s TRP 35 Cb -0.08 -0.79 -0.04 0.00 -1.15 0.00 0.00 33.47 31.41 2cd0 s TRP 35 CO 0.15 -0.18 -0.15 1.52 0.02 0.00 0.00 176.95 178.31 2cd0 s TYR 36 N 0.55 1.47 -0.11 -1.98 -0.85 -0.39 -0.68 117.35 115.36 2cd0 s TYR 36 Ca -0.09 -0.54 -0.01 0.00 -0.52 0.00 0.00 57.07 55.90 2cd0 s TYR 36 Cb -0.13 -0.76 -0.03 0.00 0.38 0.00 0.00 41.96 41.42 2cd0 s TYR 36 CO 0.01 0.18 -0.05 -1.14 -1.52 0.00 0.00 175.55 173.03 2cd0 s GLN 37 N -2.72 3.17 -0.24 -3.49 0.74 0.13 -1.73 119.66 115.53 2cd0 s GLN 37 Ca 0.10 -0.53 -0.02 0.00 0.05 0.00 0.00 55.36 54.97 2cd0 s GLN 37 Cb -0.05 -2.74 0.07 0.00 1.10 0.00 0.00 33.01 31.40 2cd0 s GLN 37 CO 0.04 0.48 0.05 -1.14 -0.55 0.00 0.00 175.29 174.16 2cd0 s GLN 38 N -0.29 0.81 1.20 1.67 0.74 -0.19 -0.85 119.66 122.75 2cd0 s GLN 38 Ca 0.04 -0.74 -0.15 0.00 0.05 0.00 0.00 55.36 54.57 2cd0 s GLN 38 Cb -0.13 -2.12 0.27 0.00 1.10 0.00 0.00 33.01 32.13 2cd0 s GLN 38 CO 0.02 -0.77 0.78 0.54 -0.55 0.00 0.00 175.29 175.32 2cd0 n ARG 39 N 4.92 -2.54 0.00 1.67 5.12 -1.26 -1.53 116.66 123.04 2cd0 n ARG 39 Ca -0.07 -0.72 0.00 0.00 -1.93 0.00 0.00 57.85 55.13 2cd0 n ARG 39 Cb 0.45 -2.04 0.00 0.00 -1.16 0.00 0.00 32.46 29.71 2cd0 n ARG 39 CO 0.00 0.00 0.00 -0.35 -1.93 0.00 0.00 177.63 175.35 2cd0 n PRO 40 N -4.42 0.00 -3.37 5.56 -0.04 -1.26 -2.94 135.00 128.53 2cd0 n PRO 40 Ca 0.02 0.64 -0.36 0.00 -0.04 0.00 0.00 63.50 63.76 2cd0 n PRO 40 Cb 0.56 -1.17 -0.04 0.00 -0.04 0.00 0.00 33.50 32.81 2cd0 n PRO 40 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2cd0 n GLY 41 N -0.98 4.67 3.55 0.55 0.00 -1.26 -5.01 105.19 106.70 2cd0 n GLY 41 Ca 0.00 -2.67 -0.09 0.00 0.00 0.00 0.00 46.02 43.25 2cd0 n GLY 41 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cd0 s SER 42 N -1.32 -0.07 0.23 1.61 1.04 -1.15 -5.16 113.70 108.88 2cd0 s SER 42 Ca 0.32 -0.94 -0.10 0.00 0.48 0.00 0.00 55.95 55.71 2cd0 s SER 42 Cb 0.03 0.56 -0.07 0.00 0.10 0.00 0.00 66.02 66.64 2cd0 s SER 42 CO -0.02 -1.10 0.56 -0.94 0.98 0.00 0.00 173.24 172.72 2cd0 s SER 43 N -3.02 6.65 0.63 7.02 1.04 -1.26 -4.56 113.70 120.19 2cd0 s SER 43 Ca 0.23 0.96 -0.18 0.00 0.48 0.00 0.00 55.95 57.43 2cd0 s SER 43 Cb 0.00 -2.24 -0.02 0.00 0.10 0.00 0.00 66.02 63.86 2cd0 s SER 43 CO 0.08 -0.08 1.25 -2.84 0.98 0.00 0.00 173.24 172.63 2cd0 s PRO 44 N -2.80 2.73 -0.02 4.02 0.02 -1.26 -4.59 135.00 133.10 2cd0 s PRO 44 Ca 0.48 1.93 -0.03 0.00 0.02 0.00 0.00 61.00 63.39 2cd0 s PRO 44 Cb -0.11 -1.89 0.00 0.00 0.02 0.00 0.00 34.50 32.52 2cd0 s PRO 44 CO 0.21 -1.42 0.07 -0.08 -0.33 0.00 0.00 177.00 175.45 2cd0 s THR 45 N -1.53 0.03 0.15 0.99 -1.32 -0.03 -4.96 115.64 108.97 2cd0 s THR 45 Ca 0.80 -0.28 -0.30 0.00 -1.21 0.00 0.00 61.69 60.69 2cd0 s THR 45 Cb -0.33 -0.20 -0.07 0.00 -1.51 0.00 0.00 72.50 70.38 2cd0 s THR 45 CO 0.37 -0.16 1.06 -0.89 -2.21 0.00 0.00 174.62 172.79 2cd0 s THR 46 N -0.47 4.07 -0.05 5.08 2.01 -1.26 0.23 115.64 125.25 2cd0 s THR 46 Ca -0.05 1.76 0.09 0.00 0.31 0.00 0.00 61.69 63.79 2cd0 s THR 46 Cb -0.03 -4.12 -0.13 0.00 0.01 0.00 0.00 72.50 68.22 2cd0 s THR 46 CO 0.00 0.29 0.14 1.33 -0.69 0.00 0.00 174.62 175.69 2cd0 n VAL 47 N 2.55 0.26 -3.74 3.82 0.24 0.15 -4.83 118.33 116.77 2cd0 n VAL 47 Ca 0.03 -0.29 -0.15 0.00 -2.04 0.00 0.00 64.34 61.89 2cd0 n VAL 47 Cb 0.47 -0.16 -0.15 0.00 -1.47 0.00 0.00 33.84 32.53 2cd0 n VAL 47 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2cd0 s ILE 48 N -2.48 -0.08 -0.02 1.34 1.01 -1.04 -4.25 121.20 115.67 2cd0 s ILE 48 Ca -0.04 0.22 0.06 0.00 0.00 0.00 0.00 60.65 60.90 2cd0 s ILE 48 Cb 0.05 -0.20 -0.02 0.00 0.01 0.00 0.00 42.46 42.30 2cd0 s ILE 48 CO 0.39 0.09 -0.21 0.12 0.00 0.00 0.00 174.94 175.34 2cd0 s PHE 49 N 1.32 2.49 -1.03 3.97 5.36 0.12 -0.89 117.98 129.33 2cd0 s PHE 49 Ca -0.07 -0.31 -0.15 0.00 -0.96 0.00 0.00 56.93 55.44 2cd0 s PHE 49 Cb -0.12 -1.54 -0.01 0.00 -0.34 0.00 0.00 43.02 41.02 2cd0 s PHE 49 CO -0.05 0.09 0.76 0.39 -1.46 0.00 0.00 175.22 174.94 2cd0 n GLU 50 N 2.25 -1.29 0.00 10.12 1.02 -1.23 -0.64 120.64 130.87 2cd0 n GLU 50 Ca -0.16 0.66 0.00 0.00 -0.02 0.00 0.00 57.16 57.64 2cd0 n GLU 50 Cb 0.52 -4.11 0.00 0.00 -0.02 0.00 0.00 31.44 27.83 2cd0 n GLU 50 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2cd0 n ASP 51 N -2.54 0.00 -0.40 1.62 8.00 0.12 -3.94 116.55 119.41 2cd0 n ASP 51 Ca -0.11 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.39 2cd0 n ASP 51 Cb 0.59 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.69 2cd0 n ASP 51 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 2cd0 n ASP 52 N 1.97 0.00 -4.79 -2.24 5.68 -1.22 -3.67 116.55 112.28 2cd0 n ASP 52 Ca 0.00 -1.51 -0.38 0.00 -0.50 0.00 0.00 54.79 52.40 2cd0 n ASP 52 Cb 0.00 -0.10 -0.06 0.00 -1.14 0.00 0.00 41.12 39.82 2cd0 n ASP 52 CO 0.00 0.00 0.00 -1.00 -1.33 0.00 0.00 177.20 174.87 2cd0 s HIS 53 N 0.00 3.69 -0.33 2.11 3.76 0.18 -4.63 115.29 120.07 2cd0 s HIS 53 Ca 0.00 1.06 -0.09 0.00 -0.15 0.00 0.00 55.06 55.88 2cd0 s HIS 53 Cb 0.00 -2.45 0.02 0.00 1.11 0.00 0.00 32.58 31.26 2cd0 s HIS 53 CO 0.00 0.47 0.15 0.50 -0.85 0.00 0.00 174.74 175.01 2cd0 s ARG 54 N -0.53 2.96 0.57 1.40 3.52 -1.26 0.16 118.95 125.76 2cd0 s ARG 54 Ca 0.26 -0.97 -0.21 0.00 -0.13 0.00 0.00 55.73 54.69 2cd0 s ARG 54 Cb -0.17 -3.56 -0.04 0.00 -1.56 0.00 0.00 34.95 29.62 2cd0 s ARG 54 CO 0.14 -0.57 1.30 -0.35 -0.81 0.00 0.00 175.30 175.01 2cd0 n PRO 55 N 4.93 1.50 -1.59 5.12 -0.04 -1.26 -4.87 135.00 138.79 2cd0 n PRO 55 Ca -0.13 0.56 -0.48 0.00 -0.04 0.00 0.00 63.50 63.41 2cd0 n PRO 55 Cb 0.47 -2.51 -0.04 0.00 -0.04 0.00 0.00 33.50 31.38 2cd0 n PRO 55 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2cd0 n SER 56 N -1.10 1.53 0.00 3.54 2.88 -1.26 -1.80 113.62 117.40 2cd0 n SER 56 Ca 0.12 1.14 0.00 0.00 -1.33 0.00 0.00 58.87 58.80 2cd0 n SER 56 Cb 0.45 -1.25 0.00 0.00 -0.75 0.00 0.00 64.21 62.66 2cd0 n SER 56 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2cd0 n GLY 57 N 1.99 2.84 3.68 0.46 0.00 -1.26 -5.04 105.19 107.86 2cd0 n GLY 57 Ca 0.14 -0.01 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 2cd0 n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2cd0 s VAL 58 N -2.86 4.64 0.36 1.61 1.01 -0.75 -5.00 120.40 119.41 2cd0 s VAL 58 Ca 0.00 1.92 -0.27 0.00 0.00 0.00 0.00 61.98 63.63 2cd0 s VAL 58 Cb 0.00 -4.24 -0.12 0.00 0.00 0.00 0.00 36.38 32.02 2cd0 s VAL 58 CO 0.00 -0.03 1.26 -0.81 0.00 0.00 0.00 175.10 175.52 2cd0 n PRO 59 N 5.28 2.02 0.00 2.72 -0.04 -1.26 -4.88 135.00 138.84 2cd0 n PRO 59 Ca 0.10 0.71 0.05 0.00 -0.04 0.00 0.00 63.50 64.32 2cd0 n PRO 59 Cb 0.48 -2.30 0.29 0.00 -0.04 0.00 0.00 33.50 31.93 2cd0 n PRO 59 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2cd0 n ASP 60 N 0.67 0.00 0.20 3.54 5.68 -1.26 -1.96 116.55 123.42 2cd0 n ASP 60 Ca 0.05 -0.43 0.14 0.00 -0.50 0.00 0.00 54.79 54.06 2cd0 n ASP 60 Cb 0.37 0.00 0.56 0.00 -1.14 0.00 0.00 41.12 40.91 2cd0 n ASP 60 CO 0.00 0.00 0.00 0.08 -1.33 0.00 0.00 177.20 175.95 2cd0 h ARG 61 N 0.00 0.00 -5.62 0.11 0.11 -1.90 -3.42 114.38 103.67 2cd0 h ARG 61 Ca 0.00 0.00 -0.58 0.00 0.10 0.00 0.00 59.98 59.50 2cd0 h ARG 61 Cb 0.00 0.00 -0.09 0.00 1.11 0.00 0.00 29.97 30.99 2cd0 h ARG 61 CO 0.00 0.00 -0.22 -0.06 0.10 0.00 0.00 179.97 179.79 2cd0 s PHE 62 N -3.46 3.48 -0.03 4.08 0.40 -0.83 -0.58 117.98 121.04 2cd0 s PHE 62 Ca 0.03 0.75 -0.06 0.00 -0.60 0.00 0.00 56.93 57.06 2cd0 s PHE 62 Cb 0.09 -2.46 0.01 0.00 0.51 0.00 0.00 43.02 41.16 2cd0 s PHE 62 CO 0.49 0.19 0.13 -1.54 0.70 0.00 0.00 175.22 175.18 2cd0 s SER 63 N 0.59 -0.05 0.08 1.36 1.04 0.08 -4.98 113.70 111.82 2cd0 s SER 63 Ca 0.22 0.03 0.08 0.00 0.48 0.00 0.00 55.95 56.75 2cd0 s SER 63 Cb -0.14 0.24 -0.04 0.00 0.10 0.00 0.00 66.02 66.18 2cd0 s SER 63 CO 0.07 -0.20 -0.15 -0.83 0.98 0.00 0.00 173.24 173.11 2cd0 s GLY 64 N -0.64 1.68 0.09 7.32 0.00 -1.26 -0.48 107.32 114.03 2cd0 s GLY 64 Ca -0.07 -1.25 -0.07 0.00 0.00 0.00 0.00 44.72 43.32 2cd0 s GLY 64 CO 0.01 -1.20 0.15 -1.35 0.00 0.00 0.00 173.10 170.71 2cd0 s SER 65 N -1.89 0.18 -0.09 1.64 1.04 -0.23 -4.45 113.70 109.91 2cd0 s SER 65 Ca 0.18 -0.75 0.01 0.00 0.48 0.00 0.00 55.95 55.87 2cd0 s SER 65 Cb -0.11 0.32 0.02 0.00 0.10 0.00 0.00 66.02 66.35 2cd0 s SER 65 CO 0.09 -0.72 -0.09 -0.69 0.98 0.00 0.00 173.24 172.81 2cd0 s VAL 66 N -3.88 1.03 -0.38 5.02 1.01 -1.26 -0.26 120.40 121.67 2cd0 s VAL 66 Ca 0.07 -0.36 -0.06 0.00 0.00 0.00 0.00 61.98 61.63 2cd0 s VAL 66 Cb 0.05 -1.00 0.07 0.00 0.00 0.00 0.00 36.38 35.50 2cd0 s VAL 66 CO -0.10 0.35 0.17 -0.62 0.00 0.00 0.00 175.10 174.90 2cd0 s ASP 66 N 1.18 5.38 0.12 3.32 -1.08 0.29 -4.99 116.67 120.88 2cd0 s ASP 66 Ca -0.05 -1.46 -0.21 0.00 -0.52 0.00 0.00 52.55 50.30 2cd0 s ASP 66 Cb -0.14 -1.89 -0.07 0.00 -1.46 0.00 0.00 42.92 39.36 2cd0 s ASP 66 CO -0.02 -0.44 1.71 0.74 0.52 0.00 0.00 175.17 177.68 2cd0 h THR 66 N 6.20 0.83 -0.68 1.71 2.02 -1.97 -1.61 112.91 119.41 2cd0 h THR 66 Ca -0.21 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.05 2cd0 h THR 66 Cb 1.07 0.83 -0.04 0.00 -1.74 0.00 0.00 68.15 68.27 2cd0 h THR 66 CO 0.67 0.00 0.45 0.77 0.37 0.00 0.00 175.52 177.78 2cd0 h SER 67 N -0.04 0.54 -0.11 4.18 4.64 -1.95 -1.53 113.55 119.28 2cd0 h SER 67 Ca 0.06 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 2cd0 h SER 67 Cb 0.13 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 2cd0 h SER 67 CO -0.14 0.34 0.00 -1.54 -0.87 0.00 0.00 176.83 174.62 2cd0 n SER 68 N -4.48 2.77 -4.05 4.97 3.41 -1.14 -4.96 113.62 110.14 2cd0 n SER 68 Ca 0.11 -1.90 -0.33 0.00 -0.26 0.00 0.00 58.87 56.49 2cd0 n SER 68 Cb 0.30 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 64.19 2cd0 n SER 68 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2cd0 n ASN 69 N 1.13 -4.13 -4.36 4.04 5.15 -0.58 -4.82 115.26 111.68 2cd0 n ASN 69 Ca 0.16 -0.88 -0.19 0.00 -0.60 0.00 0.00 54.58 53.07 2cd0 n ASN 69 Cb 0.54 -3.38 -0.10 0.00 -0.53 0.00 0.00 39.78 36.31 2cd0 n ASN 69 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 2cd0 s SER 70 N -3.31 1.71 0.12 1.20 1.04 -1.02 -2.57 113.70 110.87 2cd0 s SER 70 Ca 0.70 -1.39 0.06 0.00 0.48 0.00 0.00 55.95 55.79 2cd0 s SER 70 Cb -0.36 0.07 -0.04 0.00 0.10 0.00 0.00 66.02 65.79 2cd0 s SER 70 CO 0.87 -0.69 -0.14 0.00 0.98 0.00 0.00 173.24 174.27 2cd0 s ALA 71 N -3.56 1.44 0.01 5.32 0.00 -0.38 -0.55 121.76 124.05 2cd0 s ALA 71 Ca 0.37 -1.27 0.01 0.00 0.00 0.00 0.00 51.96 51.06 2cd0 s ALA 71 Cb 0.08 -0.06 -0.01 0.00 0.00 0.00 0.00 23.12 23.13 2cd0 s ALA 71 CO 0.15 0.09 -0.04 -1.12 0.00 0.00 0.00 175.76 174.84 2cd0 s SER 72 N -2.44 0.38 -0.29 0.00 0.01 0.64 -0.18 113.70 111.82 2cd0 s SER 72 Ca 0.08 -0.27 -0.06 0.00 1.31 0.00 0.00 55.95 57.02 2cd0 s SER 72 Cb -0.05 0.02 0.02 0.00 0.21 0.00 0.00 66.02 66.22 2cd0 s SER 72 CO 0.03 -0.11 0.06 -0.22 0.41 0.00 0.00 173.24 173.40 2cd0 s LEU 73 N -0.75 3.81 -0.08 2.44 2.96 0.03 -1.06 118.68 126.03 2cd0 s LEU 73 Ca -0.06 -0.83 -0.00 0.00 -0.22 0.00 0.00 54.13 53.02 2cd0 s LEU 73 Cb -0.05 -1.83 -0.03 0.00 0.50 0.00 0.00 46.19 44.77 2cd0 s LEU 73 CO -0.00 -0.21 -0.05 -0.89 -1.32 0.00 0.00 176.35 173.88 2cd0 s THR 74 N 1.44 3.85 -0.20 3.68 2.01 0.37 -0.97 115.64 125.82 2cd0 s THR 74 Ca 0.01 -0.42 0.01 0.00 0.31 0.00 0.00 61.69 61.60 2cd0 s THR 74 Cb -0.18 -2.59 0.04 0.00 0.01 0.00 0.00 72.50 69.78 2cd0 s THR 74 CO 0.01 0.59 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.80 2cd0 s ILE 75 N -0.73 1.64 -0.17 1.82 1.01 -0.21 -0.74 121.20 123.82 2cd0 s ILE 75 Ca 0.11 -0.99 -0.12 0.00 0.00 0.00 0.00 60.65 59.66 2cd0 s ILE 75 Cb -0.11 -1.71 -0.05 0.00 0.01 0.00 0.00 42.46 40.60 2cd0 s ILE 75 CO 0.02 0.19 0.21 -0.44 0.00 0.00 0.00 174.94 174.92 2cd0 s SER 76 N 1.40 6.34 -0.79 3.58 0.01 0.25 -1.00 113.70 123.49 2cd0 s SER 76 Ca -0.01 0.39 -0.02 0.00 1.31 0.00 0.00 55.95 57.62 2cd0 s SER 76 Cb -0.16 -2.13 -0.03 0.00 0.21 0.00 0.00 66.02 63.91 2cd0 s SER 76 CO -0.08 0.17 0.67 0.61 0.41 0.00 0.00 173.24 175.02 2cd0 n GLY 77 N 3.28 -0.35 3.38 3.44 0.00 -1.05 -4.69 105.19 109.20 2cd0 n GLY 77 Ca -0.14 0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2cd0 n GLY 77 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2cd0 n LEU 78 N -2.94 -1.25 -4.28 0.99 4.77 -0.18 -4.35 117.00 109.75 2cd0 n LEU 78 Ca -0.12 0.85 -0.19 0.00 -0.03 0.00 0.00 56.01 56.51 2cd0 n LEU 78 Cb 0.60 -1.01 -0.11 0.00 -2.33 0.00 0.00 43.42 40.57 2cd0 n LEU 78 CO 0.42 -3.50 -0.46 -0.54 -1.33 0.00 0.00 177.39 171.98 2cd0 s LYS 79 N -1.36 1.14 0.39 3.23 1.02 -1.26 -0.19 119.74 122.71 2cd0 s LYS 79 Ca 0.62 -1.33 0.08 0.00 0.02 0.00 0.00 55.97 55.35 2cd0 s LYS 79 Cb -0.60 -1.07 0.84 0.00 -0.52 0.00 0.00 37.83 36.47 2cd0 s LYS 79 CO 0.60 0.21 2.00 1.79 -0.92 0.00 0.00 175.35 179.03 2cd0 h THR 80 N 3.33 1.03 0.00 2.17 1.35 -1.95 -1.14 112.91 117.69 2cd0 h THR 80 Ca -0.41 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.24 2cd0 h THR 80 Cb 1.20 0.35 0.00 0.00 -1.73 0.00 0.00 68.15 67.97 2cd0 h THR 80 CO 0.52 0.11 0.14 1.05 -0.25 0.00 0.00 175.52 177.10 2cd0 h GLU 81 N 0.62 0.00 -0.00 4.72 4.11 -1.99 -1.70 114.58 120.34 2cd0 h GLU 81 Ca 0.25 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.68 2cd0 h GLU 81 Cb 0.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.46 2cd0 h GLU 81 CO -0.07 0.00 -0.02 -0.25 0.07 0.00 0.00 179.01 178.74 2cd0 n ASP 82 N -2.88 0.37 -4.68 3.06 8.00 -0.43 -4.85 116.55 115.14 2cd0 n ASP 82 Ca -0.02 -0.95 -0.42 0.00 0.71 0.00 0.00 54.79 54.11 2cd0 n ASP 82 Cb 0.20 -0.04 -0.03 0.00 -0.02 0.00 0.00 41.12 41.23 2cd0 n ASP 82 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 2cd0 s GLU 83 N -2.13 4.19 0.00 -1.24 2.12 -0.64 -4.90 118.70 116.09 2cd0 s GLU 83 Ca 0.41 2.35 0.00 0.00 0.36 0.00 0.00 54.97 58.09 2cd0 s GLU 83 Cb 0.21 -3.73 0.00 0.00 0.26 0.00 0.00 34.13 30.88 2cd0 s GLU 83 CO 0.39 -0.78 0.00 0.00 -0.54 0.00 0.00 175.26 174.32 2cd0 n ALA 84 N 6.08 0.00 -2.72 6.30 0.00 -0.84 -4.67 120.51 124.66 2cd0 n ALA 84 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.23 2cd0 n ALA 84 Cb 0.41 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.80 2cd0 n ALA 84 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2cd0 s ASP 85 N -0.27 6.54 -0.06 0.00 1.01 -0.58 -0.67 116.67 122.64 2cd0 s ASP 85 Ca 0.00 0.64 0.04 0.00 0.71 0.00 0.00 52.55 53.95 2cd0 s ASP 85 Cb 0.00 -2.15 -0.00 0.00 1.01 0.00 0.00 42.92 41.78 2cd0 s ASP 85 CO 0.00 0.34 -0.19 -0.31 0.21 0.00 0.00 175.17 175.22 2cd0 s TYR 86 N -0.86 1.98 -0.05 4.23 1.51 0.04 -1.02 117.35 123.18 2cd0 s TYR 86 Ca 0.18 -0.64 0.03 0.00 -1.01 0.00 0.00 57.07 55.63 2cd0 s TYR 86 Cb -0.14 -1.33 0.00 0.00 -0.11 0.00 0.00 41.96 40.38 2cd0 s TYR 86 CO 0.07 -0.23 -0.14 0.71 -1.11 0.00 0.00 175.55 174.85 2cd0 s TYR 87 N 0.12 1.51 0.31 2.71 1.51 -0.70 -0.59 117.35 122.22 2cd0 s TYR 87 Ca -0.08 -0.48 -0.03 0.00 -1.01 0.00 0.00 57.07 55.48 2cd0 s TYR 87 Cb -0.14 -1.05 -0.04 0.00 -0.11 0.00 0.00 41.96 40.62 2cd0 s TYR 87 CO 0.04 -0.20 0.55 0.00 -1.11 0.00 0.00 175.55 174.83 2cd0 s GLN 89 N -3.83 0.10 0.16 0.00 -0.21 0.78 -0.66 119.66 116.00 2cd0 s GLN 89 Ca 0.42 -0.12 0.01 0.00 0.02 0.00 0.00 55.36 55.69 2cd0 s GLN 89 Cb -0.10 0.04 -0.00 0.00 1.00 0.00 0.00 33.01 33.95 2cd0 s GLN 89 CO 0.33 -0.02 0.19 0.45 -2.12 0.00 0.00 175.29 174.12 2cd0 n SER 90 N 2.70 -0.52 -4.11 5.90 2.88 0.02 -1.04 113.62 119.45 2cd0 n SER 90 Ca -0.15 -1.89 -0.16 0.00 -1.33 0.00 0.00 58.87 55.33 2cd0 n SER 90 Cb 0.59 1.02 -0.10 0.00 -0.75 0.00 0.00 64.21 64.97 2cd0 n SER 90 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 2cd0 s TYR 91 N -3.60 1.47 0.25 0.66 2.02 -1.26 -0.99 117.35 115.90 2cd0 s TYR 91 Ca 0.15 -1.33 -0.08 0.00 -0.37 0.00 0.00 57.07 55.43 2cd0 s TYR 91 Cb -0.00 -0.78 -0.01 0.00 -0.40 0.00 0.00 41.96 40.77 2cd0 s TYR 91 CO 0.10 -0.52 0.39 0.34 -1.57 0.00 0.00 175.55 174.30 2cd0 s ASP 92 N -3.29 0.13 0.00 2.29 2.15 -0.52 -4.83 116.67 112.60 2cd0 s ASP 92 Ca 0.38 -1.13 0.00 0.00 0.43 0.00 0.00 52.55 52.22 2cd0 s ASP 92 Cb 0.06 0.55 0.00 0.00 -0.30 0.00 0.00 42.92 43.23 2cd0 s ASP 92 CO 0.15 -1.09 0.57 0.00 -0.17 0.00 0.00 175.17 174.63 2cd0 n HIS 93 N -0.38 0.00 -2.11 -5.34 1.44 -1.26 -2.77 115.22 104.79 2cd0 n HIS 93 Ca -0.00 0.00 -0.27 0.00 -2.01 0.00 0.00 57.72 55.43 2cd0 n HIS 93 Cb 0.63 -0.27 0.02 0.00 0.12 0.00 0.00 29.99 30.49 2cd0 n HIS 93 CO 0.00 0.00 0.00 0.09 -2.81 0.00 0.00 176.34 173.62 2cd0 n ASN 94 N -2.44 5.30 -3.62 4.39 5.03 -1.26 -5.05 115.26 117.62 2cd0 n ASN 94 Ca 0.00 -3.75 -0.04 0.00 0.87 0.00 0.00 54.58 51.66 2cd0 n ASN 94 Cb 0.00 -0.50 -0.03 0.00 -1.02 0.00 0.00 39.78 38.23 2cd0 n ASN 94 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 2cd0 s ASN 95 N -3.23 -0.12 -0.19 6.41 2.47 -1.11 -5.14 114.94 114.02 2cd0 s ASN 95 Ca 0.51 0.09 -0.09 0.00 0.42 0.00 0.00 52.86 53.79 2cd0 s ASN 95 Cb 0.42 0.11 -0.05 0.00 -1.45 0.00 0.00 41.25 40.28 2cd0 s ASN 95 CO -0.08 -0.15 0.11 -1.58 -3.72 0.00 0.00 177.10 171.68 2cd0 s GLN 96 N -1.56 4.10 -0.10 0.43 0.74 -1.26 -1.44 119.66 120.57 2cd0 s GLN 96 Ca 0.07 -0.25 0.02 0.00 0.05 0.00 0.00 55.36 55.26 2cd0 s GLN 96 Cb -0.01 -3.36 -0.02 0.00 1.10 0.00 0.00 33.01 30.73 2cd0 s GLN 96 CO -0.05 0.32 -0.16 0.08 -0.55 0.00 0.00 175.29 174.94 2cd0 s VAL 97 N 0.29 2.88 0.09 1.34 1.01 -0.16 -4.99 120.40 120.86 2cd0 s VAL 97 Ca 0.07 -0.75 0.05 0.00 0.00 0.00 0.00 61.98 61.35 2cd0 s VAL 97 Cb -0.11 -2.16 -0.04 0.00 0.00 0.00 0.00 36.38 34.07 2cd0 s VAL 97 CO -0.01 0.55 -0.00 -0.36 0.00 0.00 0.00 175.10 175.28 2cd0 s PHE 98 N -0.03 2.98 0.80 5.22 0.40 -1.26 -0.80 117.98 125.29 2cd0 s PHE 98 Ca -0.04 -0.03 -0.12 0.00 -0.60 0.00 0.00 56.93 56.14 2cd0 s PHE 98 Cb -0.14 -1.53 0.07 0.00 0.51 0.00 0.00 43.02 41.93 2cd0 s PHE 98 CO 0.04 0.48 1.13 0.20 0.70 0.00 0.00 175.22 177.78 2cd0 s GLY 99 N -2.33 1.60 0.56 4.36 0.00 0.16 -4.44 107.32 107.24 2cd0 s GLY 99 Ca 0.26 -0.46 0.34 0.00 0.00 0.00 0.00 44.72 44.85 2cd0 s GLY 99 CO 0.18 -0.00 2.05 -1.33 0.00 0.00 0.00 173.10 174.00 2cd0 h GLY 100 N -1.06 0.00 0.00 0.20 0.00 -1.87 -3.43 103.07 96.91 2cd0 h GLY 100 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.86 2cd0 h GLY 100 CO 0.63 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.78 2cd0 n GLY 101 N -0.26 2.33 2.89 4.60 0.00 -1.26 -5.04 105.19 108.46 2cd0 n GLY 101 Ca -0.00 -1.68 -0.26 0.00 0.00 0.00 0.00 46.02 44.08 2cd0 n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2cd0 s THR 102 N -1.65 0.93 -0.37 2.61 2.01 0.25 -4.45 115.64 114.96 2cd0 s THR 102 Ca 0.00 -0.23 -0.24 0.00 0.31 0.00 0.00 61.69 61.53 2cd0 s THR 102 Cb 0.00 -0.96 0.01 0.00 0.01 0.00 0.00 72.50 71.56 2cd0 s THR 102 CO 0.00 0.35 0.81 -0.75 -0.69 0.00 0.00 174.62 174.34 2cd0 s LYS 103 N 1.70 3.74 -0.25 4.92 2.20 -0.54 -0.78 119.74 130.72 2cd0 s LYS 103 Ca 0.04 0.33 -0.08 0.00 -0.36 0.00 0.00 55.97 55.89 2cd0 s LYS 103 Cb -0.13 -3.82 -0.04 0.00 -1.51 0.00 0.00 37.83 32.34 2cd0 s LYS 103 CO -0.07 -0.90 0.10 -1.17 -0.36 0.00 0.00 175.35 172.95 2cd0 s LEU 104 N 3.21 3.65 -0.12 5.43 2.96 0.15 -0.45 118.68 133.51 2cd0 s LEU 104 Ca 0.33 -0.11 -0.02 0.00 -0.22 0.00 0.00 54.13 54.10 2cd0 s LEU 104 Cb -0.13 -1.98 -0.03 0.00 0.50 0.00 0.00 46.19 44.55 2cd0 s LEU 104 CO 0.18 -0.01 -0.04 -0.89 -1.32 0.00 0.00 176.35 174.27 2cd0 s THR 105 N 1.50 3.94 -0.26 3.68 2.01 0.85 -1.99 115.64 125.37 2cd0 s THR 105 Ca 0.06 -0.36 -0.10 0.00 0.31 0.00 0.00 61.69 61.60 2cd0 s THR 105 Cb -0.15 -2.68 -0.05 0.00 0.01 0.00 0.00 72.50 69.63 2cd0 s THR 105 CO 0.05 0.54 0.16 -0.69 -0.69 0.00 0.00 174.62 174.00 2cd0 s VAL 106 N -0.20 5.14 -1.26 3.82 1.01 -1.26 -1.99 120.40 125.65 2cd0 s VAL 106 Ca 0.04 0.11 -0.06 0.00 0.00 0.00 0.00 61.98 62.07 2cd0 s VAL 106 Cb -0.13 -3.43 0.17 0.00 0.00 0.00 0.00 36.38 33.00 2cd0 s VAL 106 CO 0.02 0.29 2.11 0.18 0.00 0.00 0.00 175.10 177.71 2cd0 n LEU 107 N 4.80 7.47 0.00 3.92 4.77 -0.61 -4.98 117.00 132.38 2cd0 n LEU 107 Ca -0.15 -4.90 0.00 0.00 -0.03 0.00 0.00 56.01 50.93 2cd0 n LEU 107 Cb 0.52 -1.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.24 2cd0 n LEU 107 CO 0.33 1.85 0.16 0.61 -1.33 0.00 0.00 177.39 179.01