#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zzp s LYS 5 N 0.00 4.40 0.88 3.44 1.02 -1.26 -5.08 119.74 123.14 2zzp s LYS 5 Ca 0.00 1.16 -0.13 0.00 0.02 0.00 0.00 55.97 57.03 2zzp s LYS 5 Cb 0.00 -2.59 0.15 0.00 -0.52 0.00 0.00 37.83 34.87 2zzp s LYS 5 CO 0.00 0.19 1.23 0.95 -0.92 0.00 0.00 175.35 176.80 2zzp s THR 6 N -1.80 2.04 0.11 2.17 -4.23 -1.26 -4.85 115.64 107.82 2zzp s THR 6 Ca 0.53 -0.09 -0.25 0.00 -1.18 0.00 0.00 61.69 60.70 2zzp s THR 6 Cb -0.15 -2.95 -0.08 0.00 1.34 0.00 0.00 72.50 70.66 2zzp s THR 6 CO 0.20 0.00 1.67 0.15 -0.54 0.00 0.00 174.62 176.09 2zzp h PHE 7 N -1.29 -0.46 -0.05 3.99 3.57 -1.98 -1.98 116.94 118.75 2zzp h PHE 7 Ca -0.44 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.09 2zzp h PHE 7 Cb 1.27 0.20 -0.00 0.00 2.79 0.00 0.00 35.95 40.20 2zzp h PHE 7 CO -0.58 -0.26 0.06 0.87 -2.23 0.00 0.00 178.31 176.18 2zzp h LYS 8 N -0.32 0.00 0.00 1.11 1.57 -1.94 -1.72 116.57 115.28 2zzp h LYS 8 Ca 0.04 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.69 2zzp h LYS 8 Cb 0.36 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.65 2zzp h LYS 8 CO -0.13 0.00 -0.99 1.96 -0.57 0.00 0.00 179.45 179.73 2zzp h GLN 9 N 0.00 0.00 0.00 3.15 4.20 -1.74 -3.35 115.11 117.37 2zzp h GLN 9 Ca 0.02 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.67 2zzp h GLN 9 Cb 0.15 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.92 2zzp h GLN 9 CO -0.00 0.37 -0.84 0.00 -0.67 0.00 0.00 178.83 177.69 2zzp h ARG 10 N 0.00 0.00 -4.64 1.46 3.08 -0.70 -3.46 114.38 110.12 2zzp h ARG 10 Ca -0.08 0.00 -0.46 0.00 0.07 0.00 0.00 59.98 59.50 2zzp h ARG 10 Cb 1.46 0.00 -0.32 0.00 0.08 0.00 0.00 29.97 31.20 2zzp h ARG 10 CO 0.05 0.18 -0.80 1.03 -1.07 0.00 0.00 179.97 179.36 2zzp s ARG 11 N -3.14 1.21 0.94 0.04 0.52 -0.97 -5.12 118.95 112.45 2zzp s ARG 11 Ca 0.01 -0.35 -0.12 0.00 -0.52 0.00 0.00 55.73 54.75 2zzp s ARG 11 Cb 0.08 -1.09 0.16 0.00 0.52 0.00 0.00 34.95 34.62 2zzp s ARG 11 CO 0.77 0.10 1.09 -1.54 0.02 0.00 0.00 175.30 175.73 2zzp s SER 12 N 0.33 3.02 0.10 0.23 1.04 -1.26 -4.66 113.70 112.50 2zzp s SER 12 Ca -0.06 1.46 -0.22 0.00 0.48 0.00 0.00 55.95 57.61 2zzp s SER 12 Cb -0.11 -2.13 -0.11 0.00 0.10 0.00 0.00 66.02 63.77 2zzp s SER 12 CO 0.01 -2.92 1.74 0.15 0.98 0.00 0.00 173.24 173.20 2zzp h PHE 13 N -1.74 0.02 -0.63 5.02 3.57 -1.99 0.33 116.94 121.51 2zzp h PHE 13 Ca -0.51 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 60.97 2zzp h PHE 13 Cb 1.30 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 40.01 2zzp h PHE 13 CO 0.38 0.01 0.30 0.93 -2.23 0.00 0.00 178.31 177.70 2zzp h GLU 14 N 0.04 0.89 -0.47 1.11 3.07 -1.99 -0.81 114.58 116.42 2zzp h GLU 14 Ca 0.04 -0.11 -0.06 0.00 -0.50 0.00 0.00 59.36 58.72 2zzp h GLU 14 Cb 0.03 -0.17 -0.02 0.00 -0.84 0.00 0.00 28.75 27.76 2zzp h GLU 14 CO -0.05 0.69 0.07 0.37 -1.40 0.00 0.00 179.01 178.69 2zzp h GLN 15 N 0.89 0.78 -0.35 2.33 4.15 -1.81 -2.30 115.11 118.80 2zzp h GLN 15 Ca 0.22 -0.21 -0.10 0.00 0.77 0.00 0.00 58.65 59.33 2zzp h GLN 15 Cb 0.09 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 27.68 2zzp h GLN 15 CO -0.03 0.80 -0.18 0.00 -1.93 0.00 0.00 178.83 177.49 2zzp h ARG 16 N 0.65 0.64 -0.77 1.69 3.08 -0.41 -1.44 114.38 117.83 2zzp h ARG 16 Ca 0.14 -0.23 -0.03 0.00 0.07 0.00 0.00 59.98 59.94 2zzp h ARG 16 Cb 0.39 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.36 2zzp h ARG 16 CO 0.01 0.79 0.36 0.28 -1.07 0.00 0.00 179.97 180.33 2zzp h VAL 17 N 0.58 1.24 -0.39 2.04 2.07 -0.98 -2.09 116.25 118.72 2zzp h VAL 17 Ca 0.09 -0.70 -0.15 0.00 0.82 0.00 0.00 66.70 66.77 2zzp h VAL 17 Cb 0.63 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.66 2zzp h VAL 17 CO 0.04 0.30 -0.32 -0.08 0.02 0.00 0.00 177.57 177.52 2zzp h GLU 18 N 1.10 0.91 -0.83 1.57 4.57 -1.04 -1.80 114.58 119.07 2zzp h GLU 18 Ca 0.26 -0.46 0.08 0.00 -1.18 0.00 0.00 59.36 58.07 2zzp h GLU 18 Cb 0.13 0.01 -0.07 0.00 -0.16 0.00 0.00 28.75 28.66 2zzp h GLU 18 CO -0.03 1.11 0.49 -0.44 -1.18 0.00 0.00 179.01 178.95 2zzp h ASP 19 N 0.72 0.73 -0.38 1.04 3.32 -0.85 -1.49 116.42 119.51 2zzp h ASP 19 Ca 0.07 0.03 -0.15 0.00 0.02 0.00 0.00 57.03 57.01 2zzp h ASP 19 Cb 0.91 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.34 2zzp h ASP 19 CO 0.08 0.44 -0.33 0.58 -1.72 0.00 0.00 179.24 178.30 2zzp h VAL 20 N 0.85 1.28 -0.33 -1.35 2.07 -1.24 -1.86 116.25 115.67 2zzp h VAL 20 Ca 0.38 -1.50 0.01 0.00 0.82 0.00 0.00 66.70 66.42 2zzp h VAL 20 Cb 0.28 1.37 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 2zzp h VAL 20 CO -0.21 0.50 0.19 -0.09 0.02 0.00 0.00 177.57 177.98 2zzp h ARG 21 N 0.72 0.38 0.16 1.57 2.43 -0.75 -1.40 114.38 117.48 2zzp h ARG 21 Ca 0.07 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.21 2zzp h ARG 21 Cb 0.92 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.38 2zzp h ARG 21 CO 0.08 0.25 -0.08 1.25 -1.51 0.00 0.00 179.97 179.97 2zzp h LEU 22 N 0.39 -0.18 -1.13 3.80 5.85 -1.26 -2.05 115.31 120.73 2zzp h LEU 22 Ca 0.13 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.68 2zzp h LEU 22 Cb 0.00 0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 2zzp h LEU 22 CO -0.06 0.07 0.52 -0.29 -0.34 0.00 0.00 178.44 178.34 2zzp h ILE 23 N -0.44 1.22 0.00 4.05 6.09 -1.26 -0.99 117.51 126.19 2zzp h ILE 23 Ca -0.02 -0.45 -0.09 0.00 -1.37 0.00 0.00 64.86 62.93 2zzp h ILE 23 Cb 0.34 0.03 -0.01 0.00 0.47 0.00 0.00 36.82 37.64 2zzp h ILE 23 CO 0.04 0.23 -0.42 0.03 -3.07 0.00 0.00 178.15 174.96 2zzp h ARG 24 N 1.14 0.00 -0.08 2.19 2.47 -1.26 0.26 114.38 119.09 2zzp h ARG 24 Ca 0.30 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 59.00 2zzp h ARG 24 Cb -0.08 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.23 2zzp h ARG 24 CO -0.06 0.42 -0.05 1.49 0.56 0.00 0.00 179.97 182.32 2zzp h GLU 25 N 0.00 0.18 0.00 0.04 4.81 -0.52 -2.52 114.58 116.57 2zzp h GLU 25 Ca -0.00 -0.08 -0.16 0.00 -0.13 0.00 0.00 59.36 58.99 2zzp h GLU 25 Cb 0.88 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.23 2zzp h GLU 25 CO 0.05 0.57 -0.74 1.96 -0.73 0.00 0.00 179.01 180.12 2zzp h GLN 26 N -0.20 0.00 -2.33 1.92 4.20 -1.06 -3.39 115.11 114.25 2zzp h GLN 26 Ca 0.02 0.00 -0.59 0.00 0.06 0.00 0.00 58.65 58.14 2zzp h GLN 26 Cb 0.52 0.00 -0.39 0.00 0.30 0.00 0.00 27.48 27.90 2zzp h GLN 26 CO 0.01 0.74 -0.93 0.72 -0.67 0.00 0.00 178.83 178.70 2zzp n HIS 27 N -3.51 0.20 0.22 2.96 8.25 0.91 -4.98 115.22 119.28 2zzp n HIS 27 Ca -0.00 -3.59 0.14 0.00 -0.26 0.00 0.00 57.72 54.00 2zzp n HIS 27 Cb 0.76 -0.11 0.71 0.00 1.12 0.00 0.00 29.99 32.47 2zzp n HIS 27 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2zzp h PRO 28 N 4.97 0.00 -0.47 -0.41 0.13 -1.65 -2.05 132.00 132.51 2zzp h PRO 28 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 2zzp h PRO 28 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 2zzp h PRO 28 CO 0.49 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 178.51 2zzp n THR 29 N -2.44 1.37 -4.21 1.56 -2.24 -1.26 -4.98 114.28 102.08 2zzp n THR 29 Ca -0.01 -1.17 -0.29 0.00 -2.27 0.00 0.00 64.05 60.30 2zzp n THR 29 Cb 0.06 0.31 -0.09 0.00 -2.10 0.00 0.00 70.33 68.50 2zzp n THR 29 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2zzp s LYS 30 N -1.46 2.22 -0.21 -0.78 -0.14 -0.77 -0.94 119.74 117.66 2zzp s LYS 30 Ca 0.37 -1.03 -0.04 0.00 -1.36 0.00 0.00 55.97 53.90 2zzp s LYS 30 Cb 0.22 -2.33 -0.01 0.00 -1.68 0.00 0.00 37.83 34.03 2zzp s LYS 30 CO 0.20 0.50 -0.03 0.42 -0.76 0.00 0.00 175.35 175.67 2zzp s ILE 31 N -1.35 3.55 -0.29 2.17 -1.09 0.18 -4.84 121.20 119.52 2zzp s ILE 31 Ca 0.23 -0.44 -0.29 0.00 -2.23 0.00 0.00 60.65 57.92 2zzp s ILE 31 Cb -0.11 -2.60 0.01 0.00 -1.58 0.00 0.00 42.46 38.18 2zzp s ILE 31 CO 0.15 0.43 1.14 -2.16 -1.23 0.00 0.00 174.94 173.27 2zzp s PRO 32 N 1.25 4.07 -0.04 2.79 0.04 -1.26 -0.94 135.00 140.92 2zzp s PRO 32 Ca 0.03 1.19 0.07 0.00 0.04 0.00 0.00 61.00 62.34 2zzp s PRO 32 Cb -0.14 -3.76 -0.01 0.00 0.04 0.00 0.00 34.50 30.62 2zzp s PRO 32 CO -0.01 -0.90 -0.25 0.08 0.04 0.00 0.00 177.00 175.96 2zzp s VAL 33 N 3.74 1.99 -0.27 -0.36 1.01 0.84 -2.44 120.40 124.91 2zzp s VAL 33 Ca 0.48 -1.06 -0.06 0.00 0.00 0.00 0.00 61.98 61.35 2zzp s VAL 33 Cb -0.14 -1.67 -0.00 0.00 0.00 0.00 0.00 36.38 34.57 2zzp s VAL 33 CO 0.16 0.56 0.05 -0.63 0.00 0.00 0.00 175.10 175.24 2zzp s ILE 34 N -0.38 3.92 -0.19 2.22 -1.09 -0.03 -0.49 121.20 125.16 2zzp s ILE 34 Ca 0.03 -0.51 0.01 0.00 -2.23 0.00 0.00 60.65 57.95 2zzp s ILE 34 Cb -0.11 -2.92 0.03 0.00 -1.58 0.00 0.00 42.46 37.88 2zzp s ILE 34 CO 0.01 0.22 -0.14 -0.63 -1.23 0.00 0.00 174.94 173.18 2zzp s ILE 35 N 1.52 1.83 0.19 2.92 1.01 -0.45 -0.51 121.20 127.71 2zzp s ILE 35 Ca 0.04 -1.01 0.06 0.00 0.00 0.00 0.00 60.65 59.74 2zzp s ILE 35 Cb -0.16 -1.80 -0.05 0.00 0.01 0.00 0.00 42.46 40.47 2zzp s ILE 35 CO 0.01 0.30 -0.11 -1.61 0.00 0.00 0.00 174.94 173.54 2zzp s GLU 36 N 1.34 1.25 0.13 2.79 2.02 -0.86 -4.52 118.70 120.86 2zzp s GLU 36 Ca 0.01 -1.56 -0.30 0.00 0.02 0.00 0.00 54.97 53.13 2zzp s GLU 36 Cb -0.15 -0.90 -0.06 0.00 0.10 0.00 0.00 34.13 33.12 2zzp s GLU 36 CO -0.10 0.11 1.03 0.50 0.02 0.00 0.00 175.26 176.82 2zzp s ARG 37 N -3.71 4.64 0.27 1.61 3.52 -1.26 -1.95 118.95 122.07 2zzp s ARG 37 Ca 0.22 1.57 -0.30 0.00 -0.13 0.00 0.00 55.73 57.08 2zzp s ARG 37 Cb 0.01 -3.34 -0.13 0.00 -1.56 0.00 0.00 34.95 29.93 2zzp s ARG 37 CO 0.05 0.13 1.32 0.98 -0.81 0.00 0.00 175.30 176.98 2zzp n TYR 38 N 2.69 2.05 -0.26 5.12 9.36 -0.71 -4.81 117.16 130.61 2zzp n TYR 38 Ca 0.03 0.51 0.20 0.00 3.32 0.00 0.00 57.90 61.96 2zzp n TYR 38 Cb 0.48 -2.42 0.52 0.00 -0.63 0.00 0.00 39.34 37.29 2zzp n TYR 38 CO 0.00 0.00 0.00 1.57 0.22 0.00 0.00 176.86 178.65 2zzp h LYS 39 N 3.51 0.38 0.00 2.98 2.10 -1.93 0.67 116.57 124.28 2zzp h LYS 39 Ca -0.45 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.18 2zzp h LYS 39 Cb 1.29 -0.09 0.00 0.00 -0.90 0.00 0.00 32.23 32.53 2zzp h LYS 39 CO 0.70 0.25 -0.28 0.41 -2.00 0.00 0.00 179.45 178.54 2zzp n GLY 40 N -1.52 -1.37 3.73 0.07 0.00 -1.26 -4.88 105.19 99.97 2zzp n GLY 40 Ca 0.21 -0.24 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 2zzp n GLY 40 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2zzp s GLU 41 N -3.00 4.46 0.00 1.61 2.56 0.23 -4.93 118.70 119.63 2zzp s GLU 41 Ca 0.12 1.87 0.00 0.00 0.00 0.00 0.00 54.97 56.96 2zzp s GLU 41 Cb 0.18 -3.27 0.00 0.00 2.00 0.00 0.00 34.13 33.04 2zzp s GLU 41 CO 0.63 -0.16 0.00 1.63 -0.56 0.00 0.00 175.26 176.80 2zzp n LYS 42 N 2.97 2.19 -0.02 4.30 4.76 -1.26 -4.86 118.16 126.24 2zzp n LYS 42 Ca 0.06 0.00 -0.22 0.00 -2.87 0.00 0.00 58.31 55.28 2zzp n LYS 42 Cb 0.45 -0.78 -0.13 0.00 -1.84 0.00 0.00 35.03 32.72 2zzp n LYS 42 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 2zzp n GLN 43 N -1.05 0.72 -2.39 1.97 3.00 -1.26 -4.92 117.38 113.44 2zzp n GLN 43 Ca 0.00 0.32 -0.39 0.00 -0.01 0.00 0.00 57.00 56.92 2zzp n GLN 43 Cb 0.00 -1.71 -0.03 0.00 0.00 0.00 0.00 30.24 28.49 2zzp n GLN 43 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 2zzp s LEU 44 N -7.20 4.31 0.97 1.08 1.43 -1.26 -5.02 118.68 112.99 2zzp s LEU 44 Ca -0.24 2.28 -0.12 0.00 -1.03 0.00 0.00 54.13 55.02 2zzp s LEU 44 Cb 0.07 -3.90 0.17 0.00 0.03 0.00 0.00 46.19 42.56 2zzp s LEU 44 CO 0.73 -0.45 1.08 -2.16 0.23 0.00 0.00 176.35 175.78 2zzp s PRO 45 N -2.03 0.64 -0.09 1.29 0.04 -1.26 -5.04 135.00 128.55 2zzp s PRO 45 Ca 0.53 0.85 -0.10 0.00 0.04 0.00 0.00 61.00 62.32 2zzp s PRO 45 Cb -0.30 -1.73 -0.05 0.00 0.04 0.00 0.00 34.50 32.46 2zzp s PRO 45 CO 0.38 -2.68 0.22 0.08 0.04 0.00 0.00 177.00 175.05 2zzp s VAL 46 N -2.81 5.36 0.55 -0.36 1.01 -1.26 -4.94 120.40 117.95 2zzp s VAL 46 Ca 0.65 0.41 -0.13 0.00 0.00 0.00 0.00 61.98 62.91 2zzp s VAL 46 Cb -0.20 -3.50 -0.06 0.00 0.00 0.00 0.00 36.38 32.62 2zzp s VAL 46 CO 0.59 0.60 0.98 -0.76 0.00 0.00 0.00 175.10 176.50 2zzp s LEU 47 N -0.96 3.48 0.09 3.92 1.43 -1.26 -4.99 118.68 120.40 2zzp s LEU 47 Ca 0.17 1.45 -0.17 0.00 -1.03 0.00 0.00 54.13 54.55 2zzp s LEU 47 Cb -0.13 -4.43 -0.07 0.00 0.03 0.00 0.00 46.19 41.59 2zzp s LEU 47 CO 0.07 -0.69 1.52 -0.78 0.23 0.00 0.00 176.35 176.70 2zzp h ASP 48 N 0.41 0.51 -3.56 2.29 -0.00 -1.98 -3.44 116.42 110.64 2zzp h ASP 48 Ca -0.46 -0.32 -0.63 0.00 -0.00 0.00 0.00 57.03 55.62 2zzp h ASP 48 Cb 1.19 -0.14 -0.20 0.00 -0.00 0.00 0.00 39.33 40.18 2zzp h ASP 48 CO 0.62 0.71 -0.83 -0.54 -0.00 0.00 0.00 179.24 179.20 2zzp s LYS 49 N -4.93 1.39 0.00 0.28 1.02 -1.26 -5.04 119.74 111.21 2zzp s LYS 49 Ca -0.13 -1.41 0.00 0.00 0.02 0.00 0.00 55.97 54.44 2zzp s LYS 49 Cb 0.08 -1.71 0.00 0.00 -0.52 0.00 0.00 37.83 35.68 2zzp s LYS 49 CO 0.76 0.38 0.36 0.25 -0.92 0.00 0.00 175.35 176.18 2zzp n THR 50 N 0.54 0.00 -3.92 2.17 -2.24 -1.26 -4.97 114.28 104.60 2zzp n THR 50 Ca -0.15 -0.44 -0.35 0.00 -2.27 0.00 0.00 64.05 60.84 2zzp n THR 50 Cb 0.55 1.11 -0.13 0.00 -2.10 0.00 0.00 70.33 69.76 2zzp n THR 50 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2zzp s LYS 51 N -0.15 3.55 0.01 -0.78 1.02 -1.26 -1.34 119.74 120.78 2zzp s LYS 51 Ca 0.00 -0.54 0.07 0.00 0.02 0.00 0.00 55.97 55.52 2zzp s LYS 51 Cb 0.00 -3.14 -0.02 0.00 -0.52 0.00 0.00 37.83 34.15 2zzp s LYS 51 CO 0.00 -0.12 -0.21 -0.06 -0.92 0.00 0.00 175.35 174.03 2zzp s PHE 52 N 1.36 1.91 -0.36 3.18 0.40 0.36 -5.00 117.98 119.82 2zzp s PHE 52 Ca 0.04 -0.37 -0.03 0.00 -0.60 0.00 0.00 56.93 55.98 2zzp s PHE 52 Cb -0.15 -1.20 0.08 0.00 0.51 0.00 0.00 43.02 42.27 2zzp s PHE 52 CO 0.01 0.02 0.12 -1.17 0.70 0.00 0.00 175.22 174.90 2zzp s LEU 53 N -0.76 4.67 -0.21 -0.37 2.96 -1.26 -0.11 118.68 123.60 2zzp s LEU 53 Ca 0.08 -1.66 -0.08 0.00 -0.22 0.00 0.00 54.13 52.26 2zzp s LEU 53 Cb -0.08 -1.79 -0.04 0.00 0.50 0.00 0.00 46.19 44.77 2zzp s LEU 53 CO 0.00 -0.42 0.08 -0.69 -1.32 0.00 0.00 176.35 174.00 2zzp s VAL 54 N 1.21 4.71 0.19 1.68 1.01 -0.11 -4.85 120.40 124.24 2zzp s VAL 54 Ca 0.02 -0.05 -0.33 0.00 0.00 0.00 0.00 61.98 61.62 2zzp s VAL 54 Cb -0.21 -3.15 -0.14 0.00 0.00 0.00 0.00 36.38 32.88 2zzp s VAL 54 CO -0.02 0.41 1.46 -2.65 0.00 0.00 0.00 175.10 174.30 2zzp n PRO 55 N 4.03 1.98 0.00 2.72 -0.02 -1.26 0.48 135.00 142.92 2zzp n PRO 55 Ca -0.16 0.71 0.01 0.00 -2.02 0.00 0.00 63.50 62.04 2zzp n PRO 55 Cb 0.52 -2.41 0.06 0.00 -0.02 0.00 0.00 33.50 31.65 2zzp n PRO 55 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2zzp n ASP 56 N 2.71 0.00 0.11 2.55 5.68 -0.12 -1.86 116.55 125.62 2zzp n ASP 56 Ca 0.15 0.50 0.12 0.00 -0.50 0.00 0.00 54.79 55.05 2zzp n ASP 56 Cb 0.29 -0.50 0.02 0.00 -1.14 0.00 0.00 41.12 39.79 2zzp n ASP 56 CO 0.00 0.00 0.00 1.12 -1.33 0.00 0.00 177.20 176.99 2zzp h HIS 57 N 0.00 0.00 -2.40 2.11 2.07 -1.87 -3.03 115.15 112.03 2zzp h HIS 57 Ca 0.00 0.00 -0.56 0.00 -2.85 0.00 0.00 60.37 56.96 2zzp h HIS 57 Cb 0.05 0.00 0.05 0.00 2.57 0.00 0.00 27.41 30.08 2zzp h HIS 57 CO 0.00 0.00 0.92 0.28 -3.07 0.00 0.00 177.93 176.06 2zzp n VAL 58 N -2.67 0.08 -2.63 6.12 0.31 -0.78 -4.64 118.33 114.12 2zzp n VAL 58 Ca 0.00 -0.01 -0.22 0.00 -0.01 0.00 0.00 64.34 64.10 2zzp n VAL 58 Cb 0.54 -1.76 0.07 0.00 -0.91 0.00 0.00 33.84 31.78 2zzp n VAL 58 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2zzp s ASN 59 N 1.39 4.90 0.42 4.52 2.20 -1.26 -0.76 114.94 126.34 2zzp s ASN 59 Ca 0.79 -0.18 0.11 0.00 -0.94 0.00 0.00 52.86 52.64 2zzp s ASN 59 Cb -0.60 -0.49 0.89 0.00 -2.00 0.00 0.00 41.25 39.04 2zzp s ASN 59 CO 0.37 -1.44 1.96 0.24 -2.94 0.00 0.00 177.10 175.29 2zzp h MET 60 N -0.17 0.15 -0.32 3.55 2.86 -1.15 -1.64 114.93 118.22 2zzp h MET 60 Ca -0.39 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.20 2zzp h MET 60 Cb 1.29 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.91 2zzp h MET 60 CO 0.47 0.29 0.15 1.03 1.06 0.00 0.00 176.91 179.91 2zzp h SER 61 N 0.15 0.42 -0.36 1.22 0.87 -1.58 -0.96 113.55 113.32 2zzp h SER 61 Ca 0.03 -0.13 -0.11 0.00 -1.23 0.00 0.00 61.79 60.36 2zzp h SER 61 Cb 0.32 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.16 2zzp h SER 61 CO 0.02 0.43 -0.21 -0.33 -0.53 0.00 0.00 176.83 176.21 2zzp h GLU 62 N 0.38 0.77 -0.01 2.24 5.08 -1.77 -2.49 114.58 118.77 2zzp h GLU 62 Ca 0.11 -0.35 0.00 0.00 -1.00 0.00 0.00 59.36 58.12 2zzp h GLU 62 Cb 0.12 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.35 2zzp h GLU 62 CO -0.01 0.97 0.01 1.25 -1.00 0.00 0.00 179.01 180.22 2zzp h LEU 63 N 0.55 0.01 -0.42 1.33 5.85 -1.19 -1.02 115.31 120.43 2zzp h LEU 63 Ca 0.07 -0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.85 2zzp h LEU 63 Cb 0.76 -0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.73 2zzp h LEU 63 CO 0.06 0.02 0.09 0.40 -0.34 0.00 0.00 178.44 178.66 2zzp h ILE 64 N 0.01 0.78 -0.27 4.05 2.04 -1.18 -1.41 117.51 121.53 2zzp h ILE 64 Ca 0.00 -0.08 -0.01 0.00 1.00 0.00 0.00 64.86 65.78 2zzp h ILE 64 Cb 0.00 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 36.62 2zzp h ILE 64 CO -0.00 0.04 0.12 0.11 0.00 0.00 0.00 178.15 178.42 2zzp h LYS 65 N 0.22 0.39 -0.13 2.37 1.57 -1.13 -0.17 116.57 119.69 2zzp h LYS 65 Ca 0.20 -0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 58.83 2zzp h LYS 65 Cb 0.25 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 2zzp h LYS 65 CO -0.26 0.39 -0.32 0.97 -0.57 0.00 0.00 179.45 179.66 2zzp h ILE 66 N 0.29 1.27 -0.21 1.86 2.10 -1.03 -0.54 117.51 121.26 2zzp h ILE 66 Ca 0.09 -1.29 -0.16 0.00 1.08 0.00 0.00 64.86 64.58 2zzp h ILE 66 Cb 0.14 1.52 -0.01 0.00 -1.09 0.00 0.00 36.82 37.38 2zzp h ILE 66 CO -0.01 0.39 -0.54 0.40 -1.08 0.00 0.00 178.15 177.31 2zzp h ILE 67 N 0.23 1.31 -0.88 2.19 1.08 -1.09 0.12 117.51 120.48 2zzp h ILE 67 Ca 0.03 -1.77 0.01 0.00 -0.39 0.00 0.00 64.86 62.74 2zzp h ILE 67 Cb 0.68 1.73 -0.04 0.00 -3.07 0.00 0.00 36.82 36.11 2zzp h ILE 67 CO 0.05 0.56 0.58 0.03 -0.69 0.00 0.00 178.15 178.67 2zzp h ARG 68 N 0.48 1.16 -0.42 2.37 3.08 -0.49 -0.62 114.38 119.93 2zzp h ARG 68 Ca 0.01 -0.07 -0.06 0.00 0.07 0.00 0.00 59.98 59.93 2zzp h ARG 68 Cb 1.09 -0.26 -0.02 0.00 0.08 0.00 0.00 29.97 30.86 2zzp h ARG 68 CO 0.10 0.77 0.03 0.00 -1.07 0.00 0.00 179.97 179.81 2zzp h ARG 69 N 1.19 0.73 -0.61 0.04 3.08 -0.69 -0.58 114.38 117.53 2zzp h ARG 69 Ca 0.32 -0.22 0.04 0.00 0.07 0.00 0.00 59.98 60.20 2zzp h ARG 69 Cb -0.13 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 29.81 2zzp h ARG 69 CO -0.07 0.78 0.41 0.00 -1.07 0.00 0.00 179.97 180.02 2zzp h ARG 70 N 0.57 0.65 -0.01 0.04 2.47 -0.15 0.14 114.38 118.08 2zzp h ARG 70 Ca 0.12 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.80 2zzp h ARG 70 Cb 0.44 -0.15 0.00 0.00 -1.65 0.00 0.00 29.97 28.61 2zzp h ARG 70 CO 0.02 0.43 -0.07 1.28 0.56 0.00 0.00 179.97 182.19 2zzp n LEU 71 N -4.47 0.85 -3.08 3.04 4.77 -0.30 -4.93 117.00 112.88 2zzp n LEU 71 Ca 0.08 -0.23 -0.23 0.00 -0.03 0.00 0.00 56.01 55.61 2zzp n LEU 71 Cb 0.18 -0.07 0.04 0.00 -2.33 0.00 0.00 43.42 41.23 2zzp n LEU 71 CO 0.34 0.15 0.02 0.00 -1.33 0.00 0.00 177.39 176.57 2zzp n GLN 72 N -0.49 -5.18 -3.18 3.23 6.02 0.47 -4.91 117.38 113.34 2zzp n GLN 72 Ca 0.18 0.90 -0.30 0.00 -0.01 0.00 0.00 57.00 57.76 2zzp n GLN 72 Cb 0.29 -5.78 -0.04 0.00 1.02 0.00 0.00 30.24 25.72 2zzp n GLN 72 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2zzp s LEU 73 N -6.76 4.01 0.30 1.08 1.43 -0.48 -5.02 118.68 113.24 2zzp s LEU 73 Ca 0.33 0.94 -0.11 0.00 -1.03 0.00 0.00 54.13 54.27 2zzp s LEU 73 Cb -0.15 -3.76 -0.07 0.00 0.03 0.00 0.00 46.19 42.24 2zzp s LEU 73 CO 0.41 -0.23 0.65 0.20 0.23 0.00 0.00 176.35 177.61 2zzp s ASN 74 N -2.91 6.62 0.59 2.29 0.01 -1.26 -4.73 114.94 115.55 2zzp s ASN 74 Ca 0.48 1.03 0.29 0.00 -0.71 0.00 0.00 52.86 53.95 2zzp s ASN 74 Cb -0.11 -2.27 1.57 0.00 0.41 0.00 0.00 41.25 40.85 2zzp s ASN 74 CO 0.27 -0.20 1.99 0.00 -1.51 0.00 0.00 177.10 177.66 2zzp h ALA 75 N 2.06 1.95 0.00 0.60 0.00 -1.99 0.11 119.26 122.00 2zzp h ALA 75 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2zzp h ALA 75 Cb 1.18 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2zzp h ALA 75 CO 0.66 -0.50 0.00 -0.91 0.00 0.00 0.00 179.25 178.51 2zzp h ASN 76 N 0.00 0.00 -3.16 0.00 4.21 -2.04 -3.45 115.58 111.13 2zzp h ASN 76 Ca 0.14 0.00 -0.59 0.00 1.21 0.00 0.00 56.30 57.07 2zzp h ASN 76 Cb 0.83 0.00 -0.05 0.00 -1.12 0.00 0.00 38.32 37.98 2zzp h ASN 76 CO -0.00 0.00 -0.09 -1.10 -1.29 0.00 0.00 177.43 174.95 2zzp s GLN 77 N -3.42 4.10 0.08 0.81 -0.21 0.02 -5.02 119.66 116.02 2zzp s GLN 77 Ca 0.04 0.62 -0.31 0.00 0.02 0.00 0.00 55.36 55.74 2zzp s GLN 77 Cb 0.09 -3.23 -0.09 0.00 1.00 0.00 0.00 33.01 30.78 2zzp s GLN 77 CO 0.52 0.66 1.65 0.00 -2.12 0.00 0.00 175.29 176.00 2zzp s ALA 78 N -1.10 3.70 -0.10 6.09 0.00 -1.26 -4.89 121.76 124.20 2zzp s ALA 78 Ca 0.27 1.23 -0.06 0.00 0.00 0.00 0.00 51.96 53.41 2zzp s ALA 78 Cb -0.19 -3.69 0.04 0.00 0.00 0.00 0.00 23.12 19.28 2zzp s ALA 78 CO 0.17 -1.08 0.24 0.12 0.00 0.00 0.00 175.76 175.21 2zzp s PHE 79 N 2.50 -0.31 -0.01 0.00 5.36 -1.26 -4.50 117.98 119.77 2zzp s PHE 79 Ca 0.74 0.74 0.00 0.00 -0.96 0.00 0.00 56.93 57.45 2zzp s PHE 79 Cb -0.40 0.06 0.00 0.00 -0.34 0.00 0.00 43.02 42.34 2zzp s PHE 79 CO 0.32 -0.20 -0.01 -0.06 -1.46 0.00 0.00 175.22 173.81 2zzp s PHE 80 N 0.95 0.15 -0.29 10.12 0.40 0.30 -4.99 117.98 124.62 2zzp s PHE 80 Ca -0.07 -0.01 -0.03 0.00 -0.60 0.00 0.00 56.93 56.21 2zzp s PHE 80 Cb -0.08 -0.13 0.03 0.00 0.51 0.00 0.00 43.02 43.35 2zzp s PHE 80 CO -0.06 -0.02 0.01 -1.17 0.70 0.00 0.00 175.22 174.68 2zzp s LEU 81 N 0.14 3.69 -0.09 -0.37 2.96 -1.26 -1.13 118.68 122.61 2zzp s LEU 81 Ca -0.01 -0.99 -0.02 0.00 -0.22 0.00 0.00 54.13 52.90 2zzp s LEU 81 Cb -0.03 -1.75 -0.03 0.00 0.50 0.00 0.00 46.19 44.88 2zzp s LEU 81 CO -0.00 -0.21 -0.02 -0.76 -1.32 0.00 0.00 176.35 174.04 2zzp s LEU 82 N 1.35 3.45 -0.15 -0.68 1.02 0.83 -0.96 118.68 123.54 2zzp s LEU 82 Ca -0.01 0.07 0.02 0.00 0.02 0.00 0.00 54.13 54.23 2zzp s LEU 82 Cb -0.18 -1.79 0.01 0.00 0.02 0.00 0.00 46.19 44.25 2zzp s LEU 82 CO -0.01 0.34 -0.21 -0.69 0.02 0.00 0.00 176.35 175.80 2zzp s VAL 83 N -0.65 2.09 -1.48 -1.59 1.01 0.30 -1.81 120.40 118.27 2zzp s VAL 83 Ca 0.10 -0.96 -0.13 0.00 0.00 0.00 0.00 61.98 60.99 2zzp s VAL 83 Cb -0.12 -1.84 0.10 0.00 0.00 0.00 0.00 36.38 34.52 2zzp s VAL 83 CO 0.02 0.55 0.71 0.59 0.00 0.00 0.00 175.10 176.96 2zzp n ASN 84 N 4.18 -3.90 0.00 3.32 3.02 -1.26 -1.69 115.26 118.92 2zzp n ASN 84 Ca -0.20 -0.68 0.00 0.00 -0.03 0.00 0.00 54.58 53.67 2zzp n ASN 84 Cb 0.51 -3.18 0.00 0.00 -0.61 0.00 0.00 39.78 36.50 2zzp n ASN 84 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2zzp n GLY 85 N -1.37 0.96 3.31 7.41 0.00 -1.26 -5.06 105.19 109.17 2zzp n GLY 85 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 2zzp n GLY 85 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2zzp s HIS 86 N -2.42 2.16 0.49 1.61 -3.43 -0.68 -5.04 115.29 107.97 2zzp s HIS 86 Ca 0.00 -0.40 -0.22 0.00 -0.80 0.00 0.00 55.06 53.64 2zzp s HIS 86 Cb 0.00 -1.31 -0.07 0.00 -1.43 0.00 0.00 32.58 29.77 2zzp s HIS 86 CO 0.00 0.08 1.15 -1.12 -2.00 0.00 0.00 174.74 172.85 2zzp s SER 87 N -1.06 6.01 -0.16 7.38 0.01 -1.26 -0.54 113.70 124.08 2zzp s SER 87 Ca 0.10 2.26 -0.15 0.00 1.31 0.00 0.00 55.95 59.47 2zzp s SER 87 Cb -0.10 -2.60 -0.04 0.00 0.21 0.00 0.00 66.02 63.50 2zzp s SER 87 CO 0.01 -1.02 0.35 -0.04 0.41 0.00 0.00 173.24 172.94 2zzp s MET 88 N -2.90 4.26 0.19 12.44 -1.94 -0.14 -4.89 119.30 126.32 2zzp s MET 88 Ca 0.67 0.18 -0.26 0.00 -1.71 0.00 0.00 55.69 54.57 2zzp s MET 88 Cb -0.27 -3.45 -0.08 0.00 2.01 0.00 0.00 34.83 33.04 2zzp s MET 88 CO 0.32 0.16 0.81 0.14 -0.01 0.00 0.00 175.02 176.44 2zzp s VAL 89 N 0.68 4.33 -1.08 -6.03 -7.23 -1.26 -4.75 120.40 105.05 2zzp s VAL 89 Ca 0.19 1.74 -0.24 0.00 -1.81 0.00 0.00 61.98 61.85 2zzp s VAL 89 Cb -0.14 -4.14 -0.12 0.00 0.56 0.00 0.00 36.38 32.54 2zzp s VAL 89 CO 0.06 0.48 2.02 -0.55 -0.31 0.00 0.00 175.10 176.79 2zzp s SER 90 N -1.22 4.56 0.38 4.85 0.15 -1.26 -4.53 113.70 116.64 2zzp s SER 90 Ca 0.38 -1.20 0.06 0.00 0.70 0.00 0.00 55.95 55.89 2zzp s SER 90 Cb -0.23 -2.58 -0.02 0.00 -1.71 0.00 0.00 66.02 61.48 2zzp s SER 90 CO 0.27 -3.50 0.22 1.33 1.20 0.00 0.00 173.24 172.75 2zzp n VAL 91 N 8.20 0.00 1.92 4.45 0.24 -1.26 -4.71 118.33 127.17 2zzp n VAL 91 Ca 0.43 -2.49 0.03 0.00 -2.04 0.00 0.00 64.34 60.27 2zzp n VAL 91 Cb 0.46 1.07 0.17 0.00 -1.47 0.00 0.00 33.84 34.07 2zzp n VAL 91 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2zzp n SER 92 N -1.57 0.00 -4.70 -1.34 3.41 -1.26 -1.75 113.62 106.40 2zzp n SER 92 Ca 0.01 -1.74 -0.42 0.00 -0.26 0.00 0.00 58.87 56.45 2zzp n SER 92 Cb 0.63 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.55 2zzp n SER 92 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2zzp s THR 93 N -2.00 2.94 0.40 6.66 2.01 -1.26 -4.81 115.64 119.58 2zzp s THR 93 Ca 0.09 0.57 -0.24 0.00 0.31 0.00 0.00 61.69 62.41 2zzp s THR 93 Cb 0.04 -3.37 -0.09 0.00 0.01 0.00 0.00 72.50 69.09 2zzp s THR 93 CO 0.07 0.02 1.04 -2.84 -0.69 0.00 0.00 174.62 172.22 2zzp s PRO 94 N 1.77 4.19 0.58 4.92 0.02 -1.26 -1.52 135.00 143.70 2zzp s PRO 94 Ca 0.70 1.48 0.27 0.00 0.02 0.00 0.00 61.00 63.47 2zzp s PRO 94 Cb -0.41 -2.54 1.64 0.00 0.02 0.00 0.00 34.50 33.21 2zzp s PRO 94 CO 0.31 -0.11 2.15 0.97 -0.33 0.00 0.00 177.00 179.99 2zzp h ILE 95 N 2.20 0.58 -0.35 2.83 6.09 -1.05 -1.38 117.51 126.44 2zzp h ILE 95 Ca -0.48 0.00 -0.02 0.00 -1.37 0.00 0.00 64.86 62.98 2zzp h ILE 95 Cb 1.21 0.91 -0.02 0.00 0.47 0.00 0.00 36.82 39.39 2zzp h ILE 95 CO 0.62 0.00 0.11 0.77 -3.07 0.00 0.00 178.15 176.58 2zzp h SER 96 N 0.00 0.45 0.14 2.19 4.64 -1.79 0.20 113.55 119.38 2zzp h SER 96 Ca 0.06 -0.05 -0.27 0.00 -0.47 0.00 0.00 61.79 61.06 2zzp h SER 96 Cb 0.29 -0.12 0.02 0.00 -0.31 0.00 0.00 62.40 62.29 2zzp h SER 96 CO -0.00 0.44 -1.09 -0.33 -0.87 0.00 0.00 176.83 174.98 2zzp h GLU 97 N 0.49 0.60 -0.71 4.77 5.08 -1.57 -2.49 114.58 120.76 2zzp h GLU 97 Ca 0.12 -0.70 -0.04 0.00 -1.00 0.00 0.00 59.36 57.74 2zzp h GLU 97 Cb 0.15 0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.58 2zzp h GLU 97 CO -0.01 1.29 0.30 0.28 -1.00 0.00 0.00 179.01 179.87 2zzp h VAL 98 N 0.31 1.24 -0.52 3.13 2.07 -1.39 -2.36 116.25 118.74 2zzp h VAL 98 Ca -0.14 -0.74 0.00 0.00 0.82 0.00 0.00 66.70 66.65 2zzp h VAL 98 Cb 1.75 0.41 -0.03 0.00 -1.52 0.00 0.00 31.29 31.90 2zzp h VAL 98 CO 0.21 0.30 0.33 0.22 0.02 0.00 0.00 177.57 178.65 2zzp h TYR 99 N 1.00 0.68 -0.57 1.57 3.20 -0.96 0.46 116.97 122.35 2zzp h TYR 99 Ca 0.24 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.11 2zzp h TYR 99 Cb 0.18 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.20 2zzp h TYR 99 CO 0.01 0.45 0.32 1.49 -1.64 0.00 0.00 178.16 178.79 2zzp h GLU 100 N 0.71 0.78 0.00 1.82 4.57 -1.14 -2.27 114.58 119.04 2zzp h GLU 100 Ca 0.19 -0.08 0.00 0.00 -1.18 0.00 0.00 59.36 58.29 2zzp h GLU 100 Cb -0.04 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 28.38 2zzp h GLU 100 CO -0.04 0.57 -1.52 -1.13 -1.18 0.00 0.00 179.01 175.72 2zzp n SER 101 N -4.40 0.73 0.00 1.04 3.41 -0.91 -4.68 113.62 108.80 2zzp n SER 101 Ca 0.05 -0.33 0.00 0.00 -0.26 0.00 0.00 58.87 58.33 2zzp n SER 101 Cb 0.09 1.56 0.00 0.00 -0.26 0.00 0.00 64.21 65.60 2zzp n SER 101 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2zzp n GLU 102 N -1.90 0.45 -1.47 4.33 -0.58 0.16 -5.08 120.64 116.54 2zzp n GLU 102 Ca -0.01 -0.35 -0.35 0.00 -0.42 0.00 0.00 57.16 56.03 2zzp n GLU 102 Cb 0.42 -0.84 0.09 0.00 -0.57 0.00 0.00 31.44 30.55 2zzp n GLU 102 CO 0.00 0.00 0.00 -0.98 -0.48 0.00 0.00 177.13 175.67 2zzp s ARG 103 N -0.16 2.18 0.75 3.49 1.70 -0.86 -4.69 118.95 121.37 2zzp s ARG 103 Ca 0.00 1.81 -0.12 0.00 -0.47 0.00 0.00 55.73 56.96 2zzp s ARG 103 Cb 0.00 -1.83 0.04 0.00 -0.57 0.00 0.00 34.95 32.59 2zzp s ARG 103 CO 0.00 -1.81 1.11 0.34 -1.08 0.00 0.00 175.30 173.86 2zzp s ASP 104 N -1.92 4.98 0.56 -2.89 -1.08 0.73 -4.95 116.67 112.10 2zzp s ASP 104 Ca 0.76 1.11 0.33 0.00 -0.52 0.00 0.00 52.55 54.23 2zzp s ASP 104 Cb -0.31 -1.84 1.61 0.00 -1.46 0.00 0.00 42.92 40.93 2zzp s ASP 104 CO 0.44 -1.63 2.10 -0.33 0.52 0.00 0.00 175.17 176.26 2zzp h GLU 105 N -0.86 0.00 -0.00 4.34 5.08 -1.95 -2.03 114.58 119.16 2zzp h GLU 105 Ca -0.46 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 2zzp h GLU 105 Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 2zzp h GLU 105 CO 0.63 0.06 -0.03 -0.40 -1.00 0.00 0.00 179.01 178.28 2zzp n ASP 106 N -3.33 0.13 0.00 1.42 5.68 -1.26 -4.92 116.55 114.27 2zzp n ASP 106 Ca -0.01 -0.39 0.00 0.00 -0.50 0.00 0.00 54.79 53.88 2zzp n ASP 106 Cb 0.24 -0.19 0.00 0.00 -1.14 0.00 0.00 41.12 40.03 2zzp n ASP 106 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2zzp n GLY 107 N 1.24 3.15 3.88 6.12 0.00 -0.76 -3.87 105.19 114.95 2zzp n GLY 107 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 2zzp n GLY 107 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2zzp s PHE 108 N -2.79 3.51 -0.25 1.61 0.40 -1.26 -4.75 117.98 114.44 2zzp s PHE 108 Ca 0.00 1.07 -0.08 0.00 -0.60 0.00 0.00 56.93 57.32 2zzp s PHE 108 Cb 0.00 -2.48 -0.03 0.00 0.51 0.00 0.00 43.02 41.01 2zzp s PHE 108 CO 0.00 -0.26 0.09 -1.17 0.70 0.00 0.00 175.22 174.59 2zzp s LEU 109 N -4.27 3.55 -0.12 -0.37 2.96 -1.02 -0.20 118.68 119.21 2zzp s LEU 109 Ca 0.52 -0.17 -0.07 0.00 -0.22 0.00 0.00 54.13 54.19 2zzp s LEU 109 Cb -0.10 -1.96 -0.04 0.00 0.50 0.00 0.00 46.19 44.59 2zzp s LEU 109 CO 0.38 -0.03 0.13 -0.31 -1.32 0.00 0.00 176.35 175.19 2zzp s TYR 110 N 1.62 3.56 0.02 5.38 1.51 -1.26 -0.85 117.35 127.33 2zzp s TYR 110 Ca 0.06 0.50 -0.02 0.00 -1.01 0.00 0.00 57.07 56.60 2zzp s TYR 110 Cb -0.15 -1.93 -0.02 0.00 -0.11 0.00 0.00 41.96 39.75 2zzp s TYR 110 CO 0.05 0.71 0.01 -1.64 -1.11 0.00 0.00 175.55 173.57 2zzp s MET 111 N -1.00 0.39 0.07 -0.62 -1.94 0.33 -4.43 119.30 112.10 2zzp s MET 111 Ca 0.15 -0.63 0.03 0.00 -1.71 0.00 0.00 55.69 53.53 2zzp s MET 111 Cb -0.12 0.15 -0.03 0.00 2.01 0.00 0.00 34.83 36.84 2zzp s MET 111 CO 0.04 -0.08 -0.10 0.14 -0.01 0.00 0.00 175.02 175.01 2zzp s VAL 112 N -1.73 0.83 0.12 -6.03 -7.23 -0.75 -2.03 120.40 103.58 2zzp s VAL 112 Ca -0.13 -1.33 0.10 0.00 -1.81 0.00 0.00 61.98 58.81 2zzp s VAL 112 Cb -0.07 -0.99 -0.04 0.00 0.56 0.00 0.00 36.38 35.84 2zzp s VAL 112 CO -0.01 -0.40 -0.25 -0.72 -0.31 0.00 0.00 175.10 173.40 2zzp s TYR 113 N -1.71 2.15 0.25 2.82 -0.85 -0.82 -0.12 117.35 119.07 2zzp s TYR 113 Ca -0.03 -0.39 -0.15 0.00 -0.52 0.00 0.00 57.07 55.98 2zzp s TYR 113 Cb -0.08 -1.17 0.00 0.00 0.38 0.00 0.00 41.96 41.09 2zzp s TYR 113 CO 0.01 0.30 0.53 0.00 -1.52 0.00 0.00 175.55 174.86 2zzp s ALA 114 N -1.08 -0.49 0.00 9.51 0.00 -0.28 -1.73 121.76 127.69 2zzp s ALA 114 Ca 0.12 -0.71 0.00 0.00 0.00 0.00 0.00 51.96 51.37 2zzp s ALA 114 Cb -0.10 1.00 0.00 0.00 0.00 0.00 0.00 23.12 24.02 2zzp s ALA 114 CO 0.05 -0.88 0.00 -1.13 0.00 0.00 0.00 175.76 173.80 2zzp n SER 115 N -0.39 0.00 -4.18 0.00 3.41 -1.26 -0.54 113.62 110.66 2zzp n SER 115 Ca -0.03 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.43 2zzp n SER 115 Cb 0.61 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.45 2zzp n SER 115 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2zzp s GLN 116 N 3.80 0.86 0.72 4.33 -0.21 -1.26 -4.84 119.66 123.06 2zzp s GLN 116 Ca 0.00 -1.16 -0.11 0.00 0.02 0.00 0.00 55.36 54.11 2zzp s GLN 116 Cb 0.00 -0.58 0.02 0.00 1.00 0.00 0.00 33.01 33.45 2zzp s GLN 116 CO 0.00 0.09 1.07 -2.00 -2.12 0.00 0.00 175.29 172.33 2zzp s GLU 117 N -2.74 2.72 0.21 2.91 2.12 -1.26 -4.99 118.70 117.68 2zzp s GLU 117 Ca 0.05 0.84 0.07 0.00 0.36 0.00 0.00 54.97 56.30 2zzp s GLU 117 Cb -0.03 -1.97 -0.04 0.00 0.26 0.00 0.00 34.13 32.34 2zzp s GLU 117 CO 0.00 -1.22 0.08 0.95 -0.54 0.00 0.00 175.26 174.53 2zzp s THR 118 N -3.09 4.01 0.07 -1.70 -4.23 -1.26 -5.13 115.64 104.31 2zzp s THR 118 Ca 0.59 -1.45 0.07 0.00 -1.18 0.00 0.00 61.69 59.71 2zzp s THR 118 Cb -0.14 -3.09 -0.03 0.00 1.34 0.00 0.00 72.50 70.58 2zzp s THR 118 CO 0.55 -0.23 -0.19 -0.36 -0.54 0.00 0.00 174.62 173.85 2zzp s PHE 119 N -1.96 1.61 0.02 3.99 0.40 -1.26 -5.13 117.98 115.65 2zzp s PHE 119 Ca 0.30 -0.40 -0.29 0.00 -0.60 0.00 0.00 56.93 55.94 2zzp s PHE 119 Cb -0.08 -0.92 0.11 0.00 0.51 0.00 0.00 43.02 42.63 2zzp s PHE 119 CO 0.21 0.12 1.20 0.20 0.70 0.00 0.00 175.22 177.65 2zzp s GLY 120 N -1.54 -0.37 0.39 4.36 0.00 -1.26 -5.19 107.32 103.72 2zzp s GLY 120 Ca 0.05 0.60 0.06 0.00 0.00 0.00 0.00 44.72 45.43 2zzp s GLY 120 CO 0.03 0.11 0.02 -1.08 0.00 0.00 0.00 173.10 172.18 2zzp s THR 121 N -2.65 1.77 -2.00 0.90 -1.32 -1.26 -5.35 115.64 105.73 2zzp s THR 121 Ca 0.13 -2.00 0.06 0.00 -1.21 0.00 0.00 61.69 58.67 2zzp s THR 121 Cb 0.03 -2.92 0.17 0.00 -1.51 0.00 0.00 72.50 68.27 2zzp s THR 121 CO -0.02 0.00 0.83 0.00 -2.21 0.00 0.00 174.62 173.21