#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cu7 s SER 2 N 0.00 4.35 -0.99 1.61 0.01 -1.26 -3.18 113.70 114.24 2cu7 s SER 2 Ca 0.00 -0.92 -0.01 0.00 1.31 0.00 0.00 55.95 56.33 2cu7 s SER 2 Cb 0.00 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.65 2cu7 s SER 2 CO 0.00 -3.67 0.83 -1.20 0.41 0.00 0.00 173.24 169.61 2cu7 n SER 3 N 16.72 -2.62 -3.64 2.44 7.64 -1.26 -5.00 113.62 127.90 2cu7 n SER 3 Ca 0.43 -0.49 -0.06 0.00 1.01 0.00 0.00 58.87 59.77 2cu7 n SER 3 Cb 0.46 -4.21 -0.07 0.00 -1.01 0.00 0.00 64.21 59.38 2cu7 n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2cu7 s GLY 4 N -3.95 -0.02 0.13 0.23 0.00 -1.19 -4.99 107.32 97.52 2cu7 s GLY 4 Ca 0.08 2.98 -0.30 0.00 0.00 0.00 0.00 44.72 47.48 2cu7 s GLY 4 CO 0.59 2.16 1.58 0.23 0.00 0.00 0.00 173.10 177.66 2cu7 h SER 5 N 4.83 -1.32 0.04 1.64 0.87 -1.95 -3.30 113.55 114.36 2cu7 h SER 5 Ca -0.28 0.17 -0.35 0.00 -1.23 0.00 0.00 61.79 60.10 2cu7 h SER 5 Cb 1.18 0.53 -0.04 0.00 -0.44 0.00 0.00 62.40 63.63 2cu7 h SER 5 CO 0.15 -0.44 -1.96 -1.54 -0.53 0.00 0.00 176.83 172.51 2cu7 n SER 6 N -5.44 1.98 0.00 6.23 3.41 -1.26 -4.89 113.62 113.65 2cu7 n SER 6 Ca -0.05 0.24 0.00 0.00 -0.26 0.00 0.00 58.87 58.80 2cu7 n SER 6 Cb 0.37 -0.81 0.00 0.00 -0.26 0.00 0.00 64.21 63.51 2cu7 n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2cu7 n GLY 7 N 1.71 2.23 2.93 5.00 0.00 -1.24 -4.68 105.19 111.14 2cu7 n GLY 7 Ca -0.39 -0.68 -0.15 0.00 0.00 0.00 0.00 46.02 44.80 2cu7 n GLY 7 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2cu7 s TYR 8 N 0.00 0.38 0.14 1.61 -0.85 -1.26 -4.97 117.35 112.41 2cu7 s TYR 8 Ca 0.00 -0.07 -0.30 0.00 -0.52 0.00 0.00 57.07 56.18 2cu7 s TYR 8 Cb 0.00 -0.26 -0.07 0.00 0.38 0.00 0.00 41.96 42.01 2cu7 s TYR 8 CO 0.00 -0.02 0.99 -1.12 -1.52 0.00 0.00 175.55 173.89 2cu7 s SER 9 N -0.01 7.46 -1.16 -0.18 0.01 -1.26 -4.99 113.70 113.57 2cu7 s SER 9 Ca 0.01 1.88 -0.11 0.00 1.31 0.00 0.00 55.95 59.04 2cu7 s SER 9 Cb -0.03 -2.59 0.23 0.00 0.21 0.00 0.00 66.02 63.84 2cu7 s SER 9 CO -0.00 -0.08 1.29 1.33 0.41 0.00 0.00 173.24 176.19 2cu7 n VAL 10 N 2.56 4.46 -1.59 3.43 0.24 -1.26 -5.03 118.33 121.13 2cu7 n VAL 10 Ca 0.02 -5.09 -0.40 0.00 -2.04 0.00 0.00 64.34 56.83 2cu7 n VAL 10 Cb 0.48 -2.51 0.03 0.00 -1.47 0.00 0.00 33.84 30.36 2cu7 n VAL 10 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 2cu7 n LYS 11 N 3.96 1.12 -0.90 7.34 3.00 -1.26 -4.95 118.16 126.46 2cu7 n LYS 11 Ca 0.30 0.41 -0.28 0.00 -0.00 0.00 0.00 58.31 58.74 2cu7 n LYS 11 Cb 0.40 -2.04 0.21 0.00 0.00 0.00 0.00 35.03 33.60 2cu7 n LYS 11 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.40 175.82 2cu7 s TRP 12 N -1.40 1.76 0.13 5.64 0.52 -1.26 -5.06 118.94 119.27 2cu7 s TRP 12 Ca 0.68 1.06 0.10 0.00 0.02 0.00 0.00 56.10 57.96 2cu7 s TRP 12 Cb -0.50 -3.19 -0.04 0.00 -1.15 0.00 0.00 33.47 28.59 2cu7 s TRP 12 CO 0.54 -3.35 -0.22 0.95 0.02 0.00 0.00 176.95 174.89 2cu7 s THR 13 N -2.75 2.60 0.19 2.01 -4.23 -1.26 -5.02 115.64 107.19 2cu7 s THR 13 Ca 0.67 -1.64 -0.22 0.00 -1.18 0.00 0.00 61.69 59.31 2cu7 s THR 13 Cb -0.21 -2.18 0.12 0.00 1.34 0.00 0.00 72.50 71.56 2cu7 s THR 13 CO 0.61 0.07 1.56 0.40 -0.54 0.00 0.00 174.62 176.72 2cu7 h ILE 14 N 3.63 0.06 -0.45 2.99 2.04 -1.99 -0.18 117.51 123.61 2cu7 h ILE 14 Ca -0.50 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.41 2cu7 h ILE 14 Cb 1.17 0.06 -0.08 0.00 -0.74 0.00 0.00 36.82 37.24 2cu7 h ILE 14 CO 0.44 0.00 -0.49 -0.08 0.00 0.00 0.00 178.15 178.02 2cu7 h GLU 15 N -0.10 -0.27 -0.17 2.37 4.81 -2.00 -1.31 114.58 117.91 2cu7 h GLU 15 Ca 0.25 0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.55 2cu7 h GLU 15 Cb 0.56 0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.94 2cu7 h GLU 15 CO -0.83 -0.18 -0.26 0.93 -0.73 0.00 0.00 179.01 177.94 2cu7 h GLU 16 N -0.28 -0.29 -1.00 1.92 3.07 -1.65 -0.83 114.58 115.52 2cu7 h GLU 16 Ca 0.08 0.02 0.34 0.00 -0.50 0.00 0.00 59.36 59.30 2cu7 h GLU 16 Cb 0.48 0.07 -0.16 0.00 -0.84 0.00 0.00 28.75 28.30 2cu7 h GLU 16 CO -0.58 -0.20 0.54 0.87 -1.40 0.00 0.00 179.01 178.25 2cu7 h LYS 17 N -0.30 0.23 0.69 2.33 1.57 -0.08 0.75 116.57 121.75 2cu7 h LYS 17 Ca 0.11 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.84 2cu7 h LYS 17 Cb 0.47 -0.05 0.01 0.00 0.08 0.00 0.00 32.23 32.74 2cu7 h LYS 17 CO -0.34 0.15 -0.33 0.93 -0.57 0.00 0.00 179.45 179.29 2cu7 h GLU 18 N 0.24 -0.89 -0.43 3.15 5.08 -0.10 -2.92 114.58 118.72 2cu7 h GLU 18 Ca 0.75 0.06 0.09 0.00 -1.00 0.00 0.00 59.36 59.26 2cu7 h GLU 18 Cb 1.79 0.20 -0.09 0.00 0.50 0.00 0.00 28.75 31.14 2cu7 h GLU 18 CO -0.65 -0.59 -0.26 -0.07 -1.00 0.00 0.00 179.01 176.44 2cu7 h LEU 19 N -1.22 -0.87 -0.74 1.33 3.38 -0.70 -0.91 115.31 115.58 2cu7 h LEU 19 Ca -0.09 0.18 0.15 0.00 0.09 0.00 0.00 57.88 58.20 2cu7 h LEU 19 Cb 0.71 0.44 -0.14 0.00 0.09 0.00 0.00 40.66 41.76 2cu7 h LEU 19 CO 0.15 -0.27 -0.20 0.15 0.09 0.00 0.00 178.44 178.36 2cu7 h PHE 20 N -0.18 -0.45 0.56 1.13 3.04 -0.98 -1.20 116.94 118.87 2cu7 h PHE 20 Ca 0.20 0.07 -0.03 0.00 3.98 0.00 0.00 57.97 62.19 2cu7 h PHE 20 Cb 0.49 0.31 0.00 0.00 2.56 0.00 0.00 35.95 39.32 2cu7 h PHE 20 CO -0.50 -0.33 -0.28 0.93 -2.02 0.00 0.00 178.31 176.12 2cu7 h GLU 21 N -0.01 -0.74 -0.91 1.11 5.08 -1.00 -0.91 114.58 117.20 2cu7 h GLU 21 Ca 0.35 0.05 0.09 0.00 -1.00 0.00 0.00 59.36 58.85 2cu7 h GLU 21 Cb 0.55 0.17 -0.12 0.00 0.50 0.00 0.00 28.75 29.85 2cu7 h GLU 21 CO -0.77 -0.49 -0.50 0.94 -1.00 0.00 0.00 179.01 177.19 2cu7 n GLN 22 N -5.42 -0.36 0.23 2.33 7.27 -0.50 0.21 117.38 121.14 2cu7 n GLN 22 Ca -0.12 1.37 0.16 0.00 0.07 0.00 0.00 57.00 58.47 2cu7 n GLN 22 Cb 0.32 -2.02 0.62 0.00 2.41 0.00 0.00 30.24 31.57 2cu7 n GLN 22 CO 0.00 0.00 0.00 0.78 0.07 0.00 0.00 177.06 177.91 2cu7 h GLY 23 N 0.00 0.00 2.00 1.69 0.00 -1.37 -2.60 103.07 102.80 2cu7 h GLY 23 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.51 2cu7 h GLY 23 CO -0.86 0.00 0.00 -2.00 0.00 0.00 0.00 176.54 173.68 2cu7 h LEU 24 N 0.00 0.00 0.00 3.11 5.85 0.39 0.20 115.31 124.86 2cu7 h LEU 24 Ca 0.00 0.00 -0.20 0.00 0.84 0.00 0.00 57.88 58.52 2cu7 h LEU 24 Cb 0.48 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.48 2cu7 h LEU 24 CO 0.00 0.00 -1.39 0.00 -0.34 0.00 0.00 178.44 176.71 2cu7 n ALA 25 N -1.94 0.84 -0.15 1.25 0.00 -0.81 -1.91 120.51 117.80 2cu7 n ALA 25 Ca 0.01 -0.71 -0.09 0.00 0.00 0.00 0.00 53.44 52.65 2cu7 n ALA 25 Cb 0.27 -0.12 -0.00 0.00 0.00 0.00 0.00 19.45 19.59 2cu7 n ALA 25 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 2cu7 h LYS 26 N -1.00 0.69 0.00 0.00 2.10 -1.59 -3.15 116.57 113.61 2cu7 h LYS 26 Ca -0.30 -0.16 -0.16 0.00 -2.00 0.00 0.00 60.65 58.03 2cu7 h LYS 26 Cb 1.15 -0.09 -0.03 0.00 -0.90 0.00 0.00 32.23 32.36 2cu7 h LYS 26 CO -0.18 0.69 -1.47 1.19 -2.00 0.00 0.00 179.45 177.68 2cu7 n PHE 27 N -4.54 0.87 -0.41 0.07 3.72 0.04 -5.07 117.46 112.15 2cu7 n PHE 27 Ca 0.00 0.29 0.00 0.00 -0.05 0.00 0.00 57.45 57.69 2cu7 n PHE 27 Cb 0.21 -1.04 0.00 0.00 -0.94 0.00 0.00 39.48 37.70 2cu7 n PHE 27 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2cu7 n GLY 28 N 1.39 0.75 1.40 1.37 0.00 -0.80 -3.96 105.19 105.35 2cu7 n GLY 28 Ca -0.10 -1.20 0.02 0.00 0.00 0.00 0.00 46.02 44.75 2cu7 n GLY 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cu7 n ARG 29 N 4.52 3.22 -2.46 1.61 1.74 -1.26 -4.14 116.66 119.89 2cu7 n ARG 29 Ca 0.00 -1.92 -0.43 0.00 -0.77 0.00 0.00 57.85 54.73 2cu7 n ARG 29 Cb 0.00 -1.95 -0.02 0.00 -1.02 0.00 0.00 32.46 29.47 2cu7 n ARG 29 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2cu7 s ARG 30 N -2.08 3.85 -0.07 5.56 1.81 -1.25 -4.90 118.95 121.87 2cu7 s ARG 30 Ca 0.34 1.07 -0.23 0.00 -1.72 0.00 0.00 55.73 55.18 2cu7 s ARG 30 Cb 0.26 -3.89 -0.30 0.00 -0.45 0.00 0.00 34.95 30.57 2cu7 s ARG 30 CO 0.09 -1.21 0.88 -1.49 -0.68 0.00 0.00 175.30 172.89 2cu7 h TRP 31 N 9.38 0.42 -0.63 -0.53 -0.00 -1.95 -3.02 115.95 119.63 2cu7 h TRP 31 Ca -0.25 -0.30 0.10 0.00 -0.00 0.00 0.00 58.89 58.44 2cu7 h TRP 31 Cb 1.09 -0.02 -0.08 0.00 -0.00 0.00 0.00 29.16 30.15 2cu7 h TRP 31 CO 0.91 1.23 0.22 1.79 -0.00 0.00 0.00 178.44 182.59 2cu7 h THR 32 N -0.50 0.74 0.53 1.49 1.35 -1.90 -0.62 112.91 113.98 2cu7 h THR 32 Ca -0.11 -0.13 -0.03 0.00 -0.55 0.00 0.00 66.41 65.59 2cu7 h THR 32 Cb 1.48 0.31 0.01 0.00 -1.73 0.00 0.00 68.15 68.22 2cu7 h THR 32 CO 0.12 0.07 -0.25 0.11 -0.25 0.00 0.00 175.52 175.32 2cu7 h LYS 33 N 0.39 -0.68 -0.69 4.72 1.57 -1.98 -3.19 116.57 116.71 2cu7 h LYS 33 Ca 0.32 0.05 0.07 0.00 -1.87 0.00 0.00 60.65 59.22 2cu7 h LYS 33 Cb 0.42 0.15 -0.10 0.00 0.08 0.00 0.00 32.23 32.78 2cu7 h LYS 33 CO -0.33 -0.45 -0.57 0.82 -0.57 0.00 0.00 179.45 178.35 2cu7 h ILE 34 N -0.83 0.00 -0.73 1.86 2.04 -1.38 -0.44 117.51 118.03 2cu7 h ILE 34 Ca -0.07 0.00 0.12 0.00 1.00 0.00 0.00 64.86 65.90 2cu7 h ILE 34 Cb 0.54 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.50 2cu7 h ILE 34 CO 0.12 0.00 -0.27 -1.20 0.00 0.00 0.00 178.15 176.80 2cu7 n SER 35 N -5.32 -0.45 -0.29 1.72 7.64 -0.25 0.21 113.62 116.88 2cu7 n SER 35 Ca -0.01 1.27 0.11 0.00 1.01 0.00 0.00 58.87 61.25 2cu7 n SER 35 Cb 0.31 -0.30 0.27 0.00 -1.01 0.00 0.00 64.21 63.47 2cu7 n SER 35 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 2cu7 h LYS 36 N 0.00 0.29 0.00 1.43 1.63 -1.06 0.22 116.57 119.08 2cu7 h LYS 36 Ca 0.26 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 60.05 2cu7 h LYS 36 Cb 0.45 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 32.01 2cu7 h LYS 36 CO -0.73 0.19 0.00 -0.11 -3.45 0.00 0.00 179.45 175.36 2cu7 n LEU 37 N -5.14 0.00 -0.20 5.20 7.94 0.57 -3.07 117.00 122.29 2cu7 n LEU 37 Ca 0.20 0.97 0.01 0.00 -1.11 0.00 0.00 56.01 56.07 2cu7 n LEU 37 Cb 0.61 -0.47 0.10 0.00 0.53 0.00 0.00 43.42 44.18 2cu7 n LEU 37 CO 0.10 -0.47 0.83 0.40 -1.11 0.00 0.00 177.39 177.14 2cu7 h ILE 38 N 0.00 0.50 0.00 1.96 2.04 -1.31 -3.45 117.51 117.26 2cu7 h ILE 38 Ca 0.00 -0.04 0.00 0.00 1.00 0.00 0.00 64.86 65.82 2cu7 h ILE 38 Cb 0.00 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 36.46 2cu7 h ILE 38 CO 0.00 0.02 0.00 0.61 0.00 0.00 0.00 178.15 178.78 2cu7 n GLY 39 N -1.36 1.12 0.19 5.37 0.00 0.75 -4.65 105.19 106.60 2cu7 n GLY 39 Ca 0.09 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.01 2cu7 n GLY 39 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2cu7 h SER 40 N 0.00 0.54 -3.55 1.61 0.02 -1.87 -3.44 113.55 106.86 2cu7 h SER 40 Ca 0.00 -0.20 -0.46 0.00 -0.84 0.00 0.00 61.79 60.29 2cu7 h SER 40 Cb 0.00 -0.14 0.09 0.00 0.14 0.00 0.00 62.40 62.49 2cu7 h SER 40 CO 0.00 0.60 0.24 -0.13 -1.14 0.00 0.00 176.83 176.40 2cu7 s ARG 41 N -5.41 1.86 0.10 3.45 1.81 -1.26 -5.11 118.95 114.38 2cu7 s ARG 41 Ca -0.13 -0.42 0.05 0.00 -1.72 0.00 0.00 55.73 53.51 2cu7 s ARG 41 Cb 0.10 -2.14 -0.03 0.00 -0.45 0.00 0.00 34.95 32.42 2cu7 s ARG 41 CO 0.75 -1.46 -0.14 0.95 -0.68 0.00 0.00 175.30 174.72 2cu7 s THR 42 N -3.33 1.22 0.23 0.02 -4.23 -1.26 -4.84 115.64 103.44 2cu7 s THR 42 Ca 0.63 -1.56 0.04 0.00 -1.18 0.00 0.00 61.69 59.63 2cu7 s THR 42 Cb -0.09 -1.35 0.29 0.00 1.34 0.00 0.00 72.50 72.69 2cu7 s THR 42 CO 0.46 -0.35 1.10 0.52 -0.54 0.00 0.00 174.62 175.80 2cu7 n VAL 43 N 0.82 -0.29 0.16 2.29 0.31 -1.26 -0.48 118.33 119.87 2cu7 n VAL 43 Ca -0.18 1.52 -0.06 0.00 -0.01 0.00 0.00 64.34 65.61 2cu7 n VAL 43 Cb 0.56 -2.26 -0.03 0.00 -0.91 0.00 0.00 33.84 31.20 2cu7 n VAL 43 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2cu7 h LEU 44 N 0.00 -0.35 -0.67 7.52 3.38 -1.96 0.23 115.31 123.46 2cu7 h LEU 44 Ca 0.46 0.01 0.12 0.00 0.09 0.00 0.00 57.88 58.56 2cu7 h LEU 44 Cb 1.01 0.09 -0.13 0.00 0.09 0.00 0.00 40.66 41.73 2cu7 h LEU 44 CO -0.64 -0.24 -0.29 1.56 0.09 0.00 0.00 178.44 178.93 2cu7 h GLN 45 N -0.44 -0.09 -0.73 1.13 4.20 -1.18 0.18 115.11 118.18 2cu7 h GLN 45 Ca -0.04 0.01 0.07 0.00 0.06 0.00 0.00 58.65 58.75 2cu7 h GLN 45 Cb 0.32 0.02 -0.06 0.00 0.30 0.00 0.00 27.48 28.06 2cu7 h GLN 45 CO 0.07 -0.06 0.41 0.28 -0.67 0.00 0.00 178.83 178.86 2cu7 h VAL 46 N -0.09 0.94 -0.93 -0.54 2.07 -0.97 0.65 116.25 117.37 2cu7 h VAL 46 Ca 0.28 -0.25 0.09 0.00 0.82 0.00 0.00 66.70 67.64 2cu7 h VAL 46 Cb 0.55 0.15 -0.07 0.00 -1.52 0.00 0.00 31.29 30.41 2cu7 h VAL 46 CO -0.73 0.13 0.60 0.11 0.02 0.00 0.00 177.57 177.70 2cu7 h LYS 47 N 0.72 0.96 0.00 1.57 1.57 0.15 0.22 116.57 121.76 2cu7 h LYS 47 Ca 0.34 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 59.06 2cu7 h LYS 47 Cb 0.26 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.35 2cu7 h LYS 47 CO -0.21 0.63 -0.00 0.66 -0.57 0.00 0.00 179.45 179.96 2cu7 h SER 48 N 0.98 -0.01 -0.08 0.86 4.64 -0.29 -3.34 113.55 116.32 2cu7 h SER 48 Ca 0.43 -0.76 0.03 0.00 -0.47 0.00 0.00 61.79 61.02 2cu7 h SER 48 Cb 0.34 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.39 2cu7 h SER 48 CO -0.18 0.76 -0.10 0.22 -0.87 0.00 0.00 176.83 176.65 2cu7 h TYR 49 N -0.78 -0.26 -1.11 4.77 5.03 -0.61 -1.97 116.97 122.04 2cu7 h TYR 49 Ca -0.00 0.01 0.36 0.00 2.58 0.00 0.00 58.73 61.68 2cu7 h TYR 49 Cb 0.76 0.13 -0.09 0.00 1.55 0.00 0.00 36.73 39.08 2cu7 h TYR 49 CO 0.19 -0.16 0.75 0.00 -1.32 0.00 0.00 178.16 177.62 2cu7 n ALA 50 N -2.42 1.08 -0.08 1.82 0.00 0.75 0.13 120.51 121.79 2cu7 n ALA 50 Ca -0.04 0.57 -0.19 0.00 0.00 0.00 0.00 53.44 53.77 2cu7 n ALA 50 Cb 0.16 -0.77 -0.12 0.00 0.00 0.00 0.00 19.45 18.72 2cu7 n ALA 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2cu7 h ARG 51 N 0.00 0.03 -1.00 0.00 3.08 -1.52 -3.33 114.38 111.64 2cu7 h ARG 51 Ca 0.64 -0.06 0.21 0.00 0.07 0.00 0.00 59.98 60.84 2cu7 h ARG 51 Cb 2.22 0.02 -0.11 0.00 0.08 0.00 0.00 29.97 32.18 2cu7 h ARG 51 CO -0.23 1.03 0.61 0.37 -1.07 0.00 0.00 179.97 180.68 2cu7 h GLN 52 N -0.90 0.67 0.70 0.04 4.15 0.14 -2.04 115.11 117.86 2cu7 h GLN 52 Ca -0.22 -0.04 -0.03 0.00 0.77 0.00 0.00 58.65 59.13 2cu7 h GLN 52 Cb 1.26 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 28.80 2cu7 h GLN 52 CO -0.10 0.44 -0.45 -0.92 -1.93 0.00 0.00 178.83 175.87 2cu7 h TYR 53 N 0.69 -1.21 -0.85 3.99 3.20 -1.11 -2.75 116.97 118.92 2cu7 h TYR 53 Ca 0.60 -0.01 0.21 0.00 3.14 0.00 0.00 58.73 62.67 2cu7 h TYR 53 Cb 1.03 0.44 -0.12 0.00 1.54 0.00 0.00 36.73 39.62 2cu7 h TYR 53 CO -0.00 -0.67 0.30 0.74 -1.64 0.00 0.00 178.16 176.89 2cu7 h PHE 54 N -1.08 0.49 -0.92 -3.82 0.04 -1.50 0.18 116.94 110.33 2cu7 h PHE 54 Ca -0.09 0.04 0.24 0.00 2.80 0.00 0.00 57.97 60.96 2cu7 h PHE 54 Cb 0.88 -0.08 -0.13 0.00 2.20 0.00 0.00 35.95 38.81 2cu7 h PHE 54 CO -0.10 -0.09 0.40 -0.22 -0.60 0.00 0.00 178.31 177.70 2cu7 h LYS 55 N 0.33 0.35 0.02 1.51 1.63 -1.10 -0.78 116.57 118.53 2cu7 h LYS 55 Ca 0.52 -0.02 -0.12 0.00 -0.85 0.00 0.00 60.65 60.18 2cu7 h LYS 55 Cb 0.97 -0.08 0.01 0.00 -0.60 0.00 0.00 32.23 32.54 2cu7 h LYS 55 CO -0.55 0.23 -0.48 -0.91 -3.45 0.00 0.00 179.45 174.30 2cu7 h ASN 56 N 0.36 0.39 -0.66 4.20 2.35 -0.59 -3.35 115.58 118.28 2cu7 h ASN 56 Ca 0.59 -0.81 0.06 0.00 -0.55 0.00 0.00 56.30 55.59 2cu7 h ASN 56 Cb 1.17 -0.12 -0.08 0.00 0.05 0.00 0.00 38.32 39.35 2cu7 h ASN 56 CO -0.56 1.15 -0.39 0.29 -1.65 0.00 0.00 177.43 176.26 2cu7 n LYS 57 N -4.33 -0.29 -3.21 0.81 4.76 -0.32 -3.83 118.16 111.75 2cu7 n LYS 57 Ca -0.11 1.08 -0.40 0.00 -2.87 0.00 0.00 58.31 56.01 2cu7 n LYS 57 Cb 0.63 -1.58 -0.07 0.00 -1.84 0.00 0.00 35.03 32.16 2cu7 n LYS 57 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2cu7 s VAL 58 N -5.12 5.04 0.59 -0.18 0.11 -1.10 -5.03 120.40 114.71 2cu7 s VAL 58 Ca -0.08 0.82 -0.16 0.00 -2.93 0.00 0.00 61.98 59.64 2cu7 s VAL 58 Cb 0.07 -3.87 -0.13 0.00 -1.53 0.00 0.00 36.38 30.92 2cu7 s VAL 58 CO 0.41 0.02 -0.32 0.29 -3.33 0.00 0.00 175.10 172.17 2cu7 n LYS 59 N 5.62 0.00 -3.97 1.54 5.02 -1.25 -4.89 118.16 120.23 2cu7 n LYS 59 Ca -0.04 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.13 2cu7 n LYS 59 Cb 0.49 -0.88 -0.13 0.00 -0.02 0.00 0.00 35.03 34.49 2cu7 n LYS 59 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2cu7 n GLY 61 N 2.64 1.53 3.04 0.00 0.00 -1.26 -2.63 105.19 108.52 2cu7 n GLY 61 Ca -0.15 0.56 -0.34 0.00 0.00 0.00 0.00 46.02 46.08 2cu7 n GLY 61 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2cu7 s LEU 62 N 0.00 5.00 0.45 0.99 2.01 -1.26 -5.09 118.68 120.79 2cu7 s LEU 62 Ca 0.00 -3.08 -0.19 0.00 0.01 0.00 0.00 54.13 50.86 2cu7 s LEU 62 Cb 0.00 -1.79 -0.10 0.00 0.01 0.00 0.00 46.19 44.31 2cu7 s LEU 62 CO 0.00 -0.29 0.96 -0.62 1.01 0.00 0.00 176.35 177.41 2cu7 s ASP 63 N 0.15 6.84 0.01 2.29 -1.08 -1.08 -5.00 116.67 118.80 2cu7 s ASP 63 Ca 0.19 1.64 0.00 0.00 -0.52 0.00 0.00 52.55 53.86 2cu7 s ASP 63 Cb -0.19 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 38.74 2cu7 s ASP 63 CO -0.04 -0.43 0.00 1.17 0.52 0.00 0.00 175.17 176.39 2cu7 n LYS 64 N -0.93 0.00 -3.43 4.34 3.00 -1.26 -5.06 118.16 114.82 2cu7 n LYS 64 Ca 0.07 0.00 -0.33 0.00 -0.00 0.00 0.00 58.31 58.04 2cu7 n LYS 64 Cb 0.54 -0.45 -0.05 0.00 0.00 0.00 0.00 35.03 35.06 2cu7 n LYS 64 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.40 175.57 2cu7 s GLU 65 N -2.00 3.85 0.02 1.64 -1.05 -1.26 -5.10 118.70 114.81 2cu7 s GLU 65 Ca 0.00 0.32 0.02 0.00 -0.15 0.00 0.00 54.97 55.17 2cu7 s GLU 65 Cb 0.00 -2.80 -0.02 0.00 -0.44 0.00 0.00 34.13 30.87 2cu7 s GLU 65 CO 0.00 0.41 -0.08 0.95 0.95 0.00 0.00 175.26 177.49 2cu7 s THR 66 N -1.63 0.60 1.03 1.83 -4.23 -1.26 -5.11 115.64 106.87 2cu7 s THR 66 Ca 0.42 -0.74 -0.17 0.00 -1.18 0.00 0.00 61.69 60.02 2cu7 s THR 66 Cb -0.13 -0.58 0.26 0.00 1.34 0.00 0.00 72.50 73.38 2cu7 s THR 66 CO 0.20 -0.12 0.92 -0.81 -0.54 0.00 0.00 174.62 174.27 2cu7 n PRO 67 N 2.12 -2.80 -1.24 3.99 -0.04 -1.26 -4.94 135.00 130.83 2cu7 n PRO 67 Ca -0.18 -1.47 -0.31 0.00 -0.04 0.00 0.00 63.50 61.51 2cu7 n PRO 67 Cb 0.56 -1.37 0.08 0.00 -0.04 0.00 0.00 33.50 32.73 2cu7 n PRO 67 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2cu7 n ASN 68 N -4.57 7.02 -3.93 3.54 3.02 -1.26 -4.82 115.26 114.25 2cu7 n ASN 68 Ca 0.13 -3.64 -0.31 0.00 -0.03 0.00 0.00 54.58 50.73 2cu7 n ASN 68 Cb 0.49 -0.97 -0.15 0.00 -0.61 0.00 0.00 39.78 38.54 2cu7 n ASN 68 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2cu7 s GLN 69 N -3.43 1.29 0.21 3.52 -0.21 -1.26 -5.11 119.66 114.67 2cu7 s GLN 69 Ca 0.58 -1.70 0.08 0.00 0.02 0.00 0.00 55.36 54.35 2cu7 s GLN 69 Cb 0.46 -2.87 -0.04 0.00 1.00 0.00 0.00 33.01 31.56 2cu7 s GLN 69 CO 0.01 -0.96 -0.02 -1.59 -2.12 0.00 0.00 175.29 170.60 2cu7 s LYS 70 N 1.04 2.29 -0.50 2.91 0.00 -1.26 -5.07 119.74 119.15 2cu7 s LYS 70 Ca 0.11 -1.26 -0.28 0.00 0.00 0.00 0.00 55.97 54.55 2cu7 s LYS 70 Cb -0.19 -2.24 -0.00 0.00 0.00 0.00 0.00 37.83 35.40 2cu7 s LYS 70 CO -0.12 0.42 1.60 0.99 0.00 0.00 0.00 175.35 178.23 2cu7 s THR 71 N -1.94 3.64 -2.00 3.79 2.01 -1.26 -5.28 115.64 114.60 2cu7 s THR 71 Ca 0.28 0.56 0.23 0.00 0.31 0.00 0.00 61.69 63.08 2cu7 s THR 71 Cb -0.08 -4.11 0.66 0.00 0.01 0.00 0.00 72.50 68.98 2cu7 s THR 71 CO 0.18 -0.88 1.76 0.61 -0.69 0.00 0.00 174.62 175.61