#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xcb h GLU 5 N 0.00 0.00 0.00 -0.52 5.08 -2.08 1.48 114.58 118.54 1xcb h GLU 5 Ca 0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 1xcb h GLU 5 Cb 0.00 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 1xcb h GLU 5 CO 0.00 0.00 -0.81 0.00 -1.00 0.00 0.00 179.01 177.20 1xcb h ALA 6 N 0.59 0.64 -0.32 3.43 0.00 -2.06 -3.35 119.26 118.18 1xcb h ALA 6 Ca 0.00 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.69 1xcb h ALA 6 Cb 1.37 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.18 1xcb h ALA 6 CO 0.00 0.17 -0.08 0.00 0.00 0.00 0.00 179.25 179.34 1xcb h ALA 7 N 1.89 0.45 -0.96 0.00 0.00 0.16 -2.96 119.26 117.85 1xcb h ALA 7 Ca -0.02 -0.29 0.15 0.00 0.00 0.00 0.00 54.91 54.74 1xcb h ALA 7 Cb 1.11 -0.11 -0.09 0.00 0.00 0.00 0.00 17.79 18.69 1xcb h ALA 7 CO 0.01 0.28 0.57 0.82 0.00 0.00 0.00 179.25 180.93 1xcb h ILE 8 N 0.41 0.79 -0.28 0.00 5.03 -1.69 0.53 117.51 122.30 1xcb h ILE 8 Ca 0.08 -0.28 -0.10 0.00 -0.12 0.00 0.00 64.86 64.45 1xcb h ILE 8 Cb 0.58 -0.09 -0.01 0.00 -3.03 0.00 0.00 36.82 34.27 1xcb h ILE 8 CO 0.03 0.15 -0.25 0.77 -0.68 0.00 0.00 178.15 178.17 1xcb h SER 9 N 0.81 0.54 -0.08 1.72 4.64 -1.71 -1.19 113.55 118.28 1xcb h SER 9 Ca 0.51 -0.18 -0.05 0.00 -0.47 0.00 0.00 61.79 61.60 1xcb h SER 9 Cb 0.68 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 1xcb h SER 9 CO -0.33 0.78 -0.15 0.03 -0.87 0.00 0.00 176.83 176.29 1xcb h ARG 10 N 0.47 0.24 -0.84 4.77 3.08 -0.78 -2.58 114.38 118.75 1xcb h ARG 10 Ca 0.07 -0.15 0.16 0.00 0.07 0.00 0.00 59.98 60.13 1xcb h ARG 10 Cb 0.68 0.02 -0.10 0.00 0.08 0.00 0.00 29.97 30.65 1xcb h ARG 10 CO 0.05 0.74 0.40 1.25 -1.07 0.00 0.00 179.97 181.34 1xcb h LEU 11 N -0.22 0.43 -0.97 3.04 5.85 0.14 0.54 115.31 124.13 1xcb h LEU 11 Ca 0.00 0.11 -0.04 0.00 0.84 0.00 0.00 57.88 58.80 1xcb h LEU 11 Cb 0.72 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.78 1xcb h LEU 11 CO 0.03 0.15 0.29 0.40 -0.34 0.00 0.00 178.44 178.97 1xcb h ILE 12 N 0.54 1.24 -0.65 4.05 2.04 -1.14 -1.96 117.51 121.63 1xcb h ILE 12 Ca 0.48 -0.74 -0.06 0.00 1.00 0.00 0.00 64.86 65.54 1xcb h ILE 12 Cb 0.75 0.39 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 1xcb h ILE 12 CO -0.41 0.30 0.17 0.74 0.00 0.00 0.00 178.15 178.95 1xcb h THR 13 N 1.01 1.25 0.16 -0.27 2.02 0.37 -2.82 112.91 114.63 1xcb h THR 13 Ca 0.24 -0.89 -0.01 0.00 0.77 0.00 0.00 66.41 66.52 1xcb h THR 13 Cb 0.18 0.57 0.00 0.00 -1.74 0.00 0.00 68.15 67.16 1xcb h THR 13 CO -0.02 0.34 -0.08 1.88 0.37 0.00 0.00 175.52 178.01 1xcb h TYR 14 N 0.96 -0.20 -0.96 3.16 0.99 -0.12 -1.50 116.97 119.32 1xcb h TYR 14 Ca 0.21 -0.00 0.13 0.00 2.00 0.00 0.00 58.73 61.07 1xcb h TYR 14 Cb 0.32 0.07 -0.08 0.00 1.00 0.00 0.00 36.73 38.04 1xcb h TYR 14 CO 0.02 -0.11 0.61 1.25 -0.00 0.00 0.00 178.16 179.93 1xcb h LEU 15 N -0.23 0.81 -0.20 3.88 5.85 -1.25 0.23 115.31 124.39 1xcb h LEU 15 Ca -0.02 0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.72 1xcb h LEU 15 Cb 0.18 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 1xcb h LEU 15 CO 0.04 0.42 0.02 -0.09 -0.34 0.00 0.00 178.44 178.48 1xcb h ARG 16 N 0.86 0.34 0.00 1.25 2.43 -1.29 0.31 114.38 118.27 1xcb h ARG 16 Ca 0.48 -0.10 -0.01 0.00 -0.81 0.00 0.00 59.98 59.54 1xcb h ARG 16 Cb 0.60 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.11 1xcb h ARG 16 CO -0.25 0.51 -0.07 0.82 -1.51 0.00 0.00 179.97 179.48 1xcb h ILE 17 N 0.12 0.59 0.00 1.20 1.08 -0.04 -2.53 117.51 117.92 1xcb h ILE 17 Ca 0.06 -0.28 -0.02 0.00 -0.39 0.00 0.00 64.86 64.23 1xcb h ILE 17 Cb 0.34 1.17 -0.00 0.00 -3.07 0.00 0.00 36.82 35.26 1xcb h ILE 17 CO 0.01 0.06 -0.22 -0.07 -0.69 0.00 0.00 178.15 177.24 1xcb h LEU 18 N 0.00 0.00 -1.66 1.44 3.38 -0.02 -2.78 115.31 115.68 1xcb h LEU 18 Ca -0.00 -0.27 0.20 0.00 0.09 0.00 0.00 57.88 57.90 1xcb h LEU 18 Cb 0.17 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 1xcb h LEU 18 CO 0.01 0.76 0.75 -0.33 0.09 0.00 0.00 178.44 179.72 1xcb h GLU 19 N -1.00 0.00 0.08 1.13 5.08 -0.32 0.56 114.58 120.12 1xcb h GLU 19 Ca -0.03 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.01 1xcb h GLU 19 Cb 0.45 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 1xcb h GLU 19 CO -0.02 0.00 -1.67 1.49 -1.00 0.00 0.00 179.01 177.81 1xcb h GLU 20 N 0.00 0.18 -0.19 2.33 4.81 -1.56 -2.92 114.58 117.22 1xcb h GLU 20 Ca 0.32 -0.30 -0.06 0.00 -0.13 0.00 0.00 59.36 59.20 1xcb h GLU 20 Cb 1.82 0.11 -0.01 0.00 0.63 0.00 0.00 28.75 31.30 1xcb h GLU 20 CO -0.00 0.96 -0.13 -0.07 -0.73 0.00 0.00 179.01 179.04 1xcb h LEU 21 N 0.05 0.30 0.29 1.64 4.07 0.33 -2.10 115.31 119.88 1xcb h LEU 21 Ca -0.29 -0.07 -0.01 0.00 0.08 0.00 0.00 57.88 57.59 1xcb h LEU 21 Cb 2.01 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 43.68 1xcb h LEU 21 CO 0.12 0.46 -0.14 -0.08 -1.08 0.00 0.00 178.44 177.73 1xcb h GLU 22 N 0.30 -0.37 -0.97 1.13 4.81 -1.08 -1.09 114.58 117.31 1xcb h GLU 22 Ca 0.06 0.03 0.28 0.00 -0.13 0.00 0.00 59.36 59.59 1xcb h GLU 22 Cb 0.42 0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.85 1xcb h GLU 22 CO 0.02 -0.06 0.69 0.00 -0.73 0.00 0.00 179.01 178.94 1xcb h ALA 23 N -0.64 2.90 -0.00 2.92 0.00 -1.40 1.11 119.26 124.15 1xcb h ALA 23 Ca -0.04 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1xcb h ALA 23 Cb 0.49 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1xcb h ALA 23 CO 0.06 -1.17 -0.15 1.04 0.00 0.00 0.00 179.25 179.03 1xcb n GLN 24 N -4.25 0.32 -0.00 0.00 6.02 -0.80 -4.93 117.38 113.73 1xcb n GLN 24 Ca 0.20 -0.10 0.00 0.00 -0.01 0.00 0.00 57.00 57.10 1xcb n GLN 24 Cb 1.02 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.79 1xcb n GLN 24 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1xcb n GLY 25 N 1.39 0.80 3.73 1.08 0.00 0.38 -5.03 105.19 107.54 1xcb n GLY 25 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 1xcb n GLY 25 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1xcb n VAL 26 N -2.00 0.35 -0.09 1.61 0.24 -0.43 -4.90 118.33 113.11 1xcb n VAL 26 Ca 0.00 -0.09 -0.19 0.00 -2.04 0.00 0.00 64.34 62.02 1xcb n VAL 26 Cb 0.00 -1.97 -0.12 0.00 -1.47 0.00 0.00 33.84 30.28 1xcb n VAL 26 CO 0.00 0.00 0.00 -0.74 -2.14 0.00 0.00 176.83 173.95 1xcb h HIS 27 N 6.08 0.02 -3.76 6.34 -0.00 -1.95 -3.40 115.15 118.48 1xcb h HIS 27 Ca -0.44 -0.01 -0.59 0.00 -0.00 0.00 0.00 60.37 59.32 1xcb h HIS 27 Cb 1.21 -0.00 -0.21 0.00 -0.00 0.00 0.00 27.41 28.41 1xcb h HIS 27 CO 0.62 1.32 -0.83 1.03 -0.00 0.00 0.00 177.93 180.07 1xcb s ARG 28 N -2.32 1.25 0.29 5.26 0.52 -1.26 -1.94 118.95 120.74 1xcb s ARG 28 Ca -0.25 -1.28 0.03 0.00 -0.52 0.00 0.00 55.73 53.71 1xcb s ARG 28 Cb 0.03 -1.55 -0.04 0.00 0.52 0.00 0.00 34.95 33.91 1xcb s ARG 28 CO 0.63 0.35 0.17 -0.08 0.02 0.00 0.00 175.30 176.40 1xcb s THR 29 N -1.32 0.20 0.30 0.02 -1.32 0.49 -4.87 115.64 109.13 1xcb s THR 29 Ca 0.11 -2.00 0.04 0.00 -1.21 0.00 0.00 61.69 58.63 1xcb s THR 29 Cb -0.09 -2.51 -0.03 0.00 -1.51 0.00 0.00 72.50 68.36 1xcb s THR 29 CO 0.06 0.00 0.21 -0.94 -2.21 0.00 0.00 174.62 171.74 1xcb s SER 30 N -3.33 1.33 0.43 8.08 1.04 -1.26 0.78 113.70 120.78 1xcb s SER 30 Ca 0.37 -1.63 0.16 0.00 0.48 0.00 0.00 55.95 55.33 1xcb s SER 30 Cb 0.05 0.48 0.97 0.00 0.10 0.00 0.00 66.02 67.62 1xcb s SER 30 CO 0.18 -0.97 1.95 -1.28 0.98 0.00 0.00 173.24 174.10 1xcb h SER 31 N 2.25 0.00 -0.26 7.02 0.87 -1.97 0.14 113.55 121.60 1xcb h SER 31 Ca -0.30 0.00 -0.19 0.00 -1.23 0.00 0.00 61.79 60.07 1xcb h SER 31 Cb 1.24 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.20 1xcb h SER 31 CO 0.44 0.24 -0.58 -0.33 -0.53 0.00 0.00 176.83 176.06 1xcb h GLU 32 N 0.00 0.86 0.03 2.24 3.07 -1.96 -2.76 114.58 116.06 1xcb h GLU 32 Ca -0.00 -0.57 -0.09 0.00 -0.50 0.00 0.00 59.36 58.19 1xcb h GLU 32 Cb 0.44 0.08 0.01 0.00 -0.84 0.00 0.00 28.75 28.43 1xcb h GLU 32 CO 0.03 1.20 -0.38 0.37 -1.40 0.00 0.00 179.01 178.84 1xcb h GLN 33 N 0.63 0.21 -0.21 2.33 4.15 -1.87 -1.75 115.11 118.61 1xcb h GLN 33 Ca 0.00 -0.26 0.05 0.00 0.77 0.00 0.00 58.65 59.21 1xcb h GLN 33 Cb 1.20 0.08 -0.05 0.00 0.21 0.00 0.00 27.48 28.92 1xcb h GLN 33 CO 0.13 1.02 -0.09 -0.07 -1.93 0.00 0.00 178.83 177.89 1xcb h LEU 34 N -0.49 -0.30 0.06 -2.39 3.38 -1.09 -0.28 115.31 114.20 1xcb h LEU 34 Ca -0.05 0.08 0.02 0.00 0.09 0.00 0.00 57.88 58.02 1xcb h LEU 34 Cb 1.17 0.17 -0.04 0.00 0.09 0.00 0.00 40.66 42.06 1xcb h LEU 34 CO 0.07 -0.12 -0.25 1.23 0.09 0.00 0.00 178.44 179.47 1xcb h GLY 35 N -0.06 -0.42 -0.34 0.83 0.00 -1.56 0.51 103.07 102.03 1xcb h GLY 35 Ca 0.11 0.30 0.11 0.00 0.00 0.00 0.00 47.33 47.85 1xcb h GLY 35 CO -0.25 -0.21 -0.26 -2.09 0.00 0.00 0.00 176.54 173.73 1xcb h GLU 36 N -0.42 -0.10 0.00 4.80 4.81 -0.69 0.34 114.58 123.32 1xcb h GLU 36 Ca 0.05 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.27 1xcb h GLU 36 Cb 0.48 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.88 1xcb h GLU 36 CO -0.18 -0.07 -0.04 -0.07 -0.73 0.00 0.00 179.01 177.92 1xcb h LEU 37 N -0.11 0.00 -2.64 1.64 3.38 -0.67 -2.94 115.31 113.97 1xcb h LEU 37 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.23 1xcb h LEU 37 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1xcb h LEU 37 CO -0.66 0.04 0.00 0.00 0.09 0.00 0.00 178.44 177.91 1xcb n ALA 38 N -2.12 2.33 -3.87 1.53 0.00 0.32 -4.97 120.51 113.74 1xcb n ALA 38 Ca 0.01 -1.16 -0.25 0.00 0.00 0.00 0.00 53.44 52.04 1xcb n ALA 38 Cb 0.33 -0.75 0.00 0.00 0.00 0.00 0.00 19.45 19.04 1xcb n ALA 38 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1xcb n GLN 39 N 1.25 -4.16 -3.82 0.00 6.02 0.94 -4.99 117.38 112.62 1xcb n GLN 39 Ca 0.19 0.51 -0.12 0.00 -0.01 0.00 0.00 57.00 57.57 1xcb n GLN 39 Cb 0.55 -4.92 -0.09 0.00 1.02 0.00 0.00 30.24 26.80 1xcb n GLN 39 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 1xcb s VAL 40 N -3.74 0.07 0.67 5.09 -7.23 -0.63 -5.03 120.40 109.60 1xcb s VAL 40 Ca 0.11 -0.61 -0.17 0.00 -1.81 0.00 0.00 61.98 59.50 1xcb s VAL 40 Cb -0.06 -0.56 -0.01 0.00 0.56 0.00 0.00 36.38 36.31 1xcb s VAL 40 CO 0.85 -0.34 1.07 0.35 -0.31 0.00 0.00 175.10 176.73 1xcb n THR 41 N 1.29 3.73 -0.13 5.32 -2.24 -1.26 -4.01 114.28 116.98 1xcb n THR 41 Ca -0.22 -0.44 -0.10 0.00 -2.27 0.00 0.00 64.05 61.02 1xcb n THR 41 Cb 0.56 -1.23 -0.02 0.00 -2.10 0.00 0.00 70.33 67.54 1xcb n THR 41 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xcb h ALA 42 N 0.16 0.49 -0.73 6.98 0.00 -1.90 -1.81 119.26 122.45 1xcb h ALA 42 Ca -0.49 -0.19 0.14 0.00 0.00 0.00 0.00 54.91 54.37 1xcb h ALA 42 Cb 1.34 -0.14 -0.14 0.00 0.00 0.00 0.00 17.79 18.86 1xcb h ALA 42 CO 0.50 0.17 -0.22 0.35 0.00 0.00 0.00 179.25 180.04 1xcb h PHE 43 N 0.45 -0.52 0.79 0.00 3.57 -1.90 0.20 116.94 119.54 1xcb h PHE 43 Ca 0.12 0.07 -0.04 0.00 3.53 0.00 0.00 57.97 61.65 1xcb h PHE 43 Cb 0.32 0.34 0.01 0.00 2.79 0.00 0.00 35.95 39.40 1xcb h PHE 43 CO 0.02 -0.34 -0.38 0.37 -2.23 0.00 0.00 178.31 175.75 1xcb h GLN 44 N -0.03 -1.03 -0.62 1.11 5.75 -1.80 -0.94 115.11 117.55 1xcb h GLN 44 Ca 0.34 0.07 0.13 0.00 -0.15 0.00 0.00 58.65 59.04 1xcb h GLN 44 Cb 0.55 0.23 -0.11 0.00 1.07 0.00 0.00 27.48 29.22 1xcb h GLN 44 CO -0.76 -0.68 -0.04 -0.24 -2.65 0.00 0.00 178.83 174.46 1xcb h VAL 45 N -1.27 0.45 -0.21 2.39 3.04 -0.95 0.85 116.25 120.56 1xcb h VAL 45 Ca -0.11 -0.03 0.03 0.00 -1.01 0.00 0.00 66.70 65.58 1xcb h VAL 45 Cb 0.82 0.36 -0.01 0.00 -2.01 0.00 0.00 31.29 30.46 1xcb h VAL 45 CO 0.18 0.01 0.14 -0.09 -1.01 0.00 0.00 177.57 176.81 1xcb h ARG 46 N 0.08 0.16 0.05 4.17 2.43 -0.57 -1.97 114.38 118.73 1xcb h ARG 46 Ca 0.32 -0.01 -0.24 0.00 -0.81 0.00 0.00 59.98 59.24 1xcb h ARG 46 Cb 0.52 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.03 1xcb h ARG 46 CO -0.57 0.11 -1.05 -0.22 -1.51 0.00 0.00 179.97 176.73 1xcb h LYS 47 N 0.17 0.27 0.15 0.20 3.64 0.20 -3.12 116.57 118.07 1xcb h LYS 47 Ca 0.09 -0.37 -0.01 0.00 -1.27 0.00 0.00 60.65 59.10 1xcb h LYS 47 Cb 0.15 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 1xcb h LYS 47 CO -0.01 1.10 -0.07 -0.44 -2.27 0.00 0.00 179.45 177.76 1xcb h ASP 48 N 0.12 -0.16 0.09 4.20 3.32 0.22 -2.05 116.42 122.16 1xcb h ASP 48 Ca -0.09 -0.20 0.00 0.00 0.02 0.00 0.00 57.03 56.76 1xcb h ASP 48 Cb 1.73 0.04 0.00 0.00 0.22 0.00 0.00 39.33 41.32 1xcb h ASP 48 CO 0.17 0.11 0.00 0.18 -1.72 0.00 0.00 179.24 177.98 1xcb n LEU 49 N -5.06 0.16 0.03 1.55 4.77 -0.92 -1.59 117.00 115.94 1xcb n LEU 49 Ca -0.09 0.57 -0.20 0.00 -0.03 0.00 0.00 56.01 56.26 1xcb n LEU 49 Cb 0.19 -0.58 -0.11 0.00 -2.33 0.00 0.00 43.42 40.59 1xcb n LEU 49 CO 0.33 -0.58 0.11 -1.28 -1.33 0.00 0.00 177.39 174.64 1xcb h SER 50 N 0.00 0.80 -0.34 -1.43 0.87 -1.30 -3.08 113.55 109.07 1xcb h SER 50 Ca 0.00 -0.75 0.10 0.00 -1.23 0.00 0.00 61.79 59.90 1xcb h SER 50 Cb 0.04 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 61.74 1xcb h SER 50 CO 0.00 1.46 0.37 1.88 -0.53 0.00 0.00 176.83 180.01 1xcb h TYR 51 N 0.24 0.00 0.00 2.24 -1.99 -1.26 -3.42 116.97 112.78 1xcb h TYR 51 Ca -0.12 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.61 1xcb h TYR 51 Cb 1.61 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.34 1xcb h TYR 51 CO 0.12 0.00 0.00 1.19 -0.00 0.00 0.00 178.16 179.47 1xcb n PHE 52 N -3.71 0.00 -4.16 4.88 3.01 -1.17 -5.13 117.46 111.18 1xcb n PHE 52 Ca 0.05 0.00 -0.35 0.00 1.01 0.00 0.00 57.45 58.17 1xcb n PHE 52 Cb 0.53 0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 39.91 1xcb n PHE 52 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1xcb s GLY 53 N 0.00 1.88 0.38 1.37 0.00 -1.19 -5.03 107.32 104.73 1xcb s GLY 53 Ca 0.00 -0.76 0.02 0.00 0.00 0.00 0.00 44.72 43.98 1xcb s GLY 53 CO 0.00 -0.17 0.52 -1.14 0.00 0.00 0.00 173.10 172.31 1xcb n SER 54 N 3.03 0.94 -2.69 1.64 3.41 -1.25 -4.81 113.62 113.89 1xcb n SER 54 Ca -0.18 -1.74 0.00 0.00 -0.26 0.00 0.00 58.87 56.70 1xcb n SER 54 Cb 0.53 -0.31 0.00 0.00 -0.26 0.00 0.00 64.21 64.17 1xcb n SER 54 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xcb n GLY 61 N 0.82 -1.31 3.79 5.00 0.00 -1.26 -5.08 105.19 107.15 1xcb n GLY 61 Ca 0.09 -0.44 -0.24 0.00 0.00 0.00 0.00 46.02 45.43 1xcb n GLY 61 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xcb s TYR 62 N 0.00 2.52 -0.27 1.61 1.51 0.23 -4.96 117.35 117.99 1xcb s TYR 62 Ca 0.00 -0.60 -0.07 0.00 -1.01 0.00 0.00 57.07 55.39 1xcb s TYR 62 Cb 0.00 -2.00 -0.01 0.00 -0.11 0.00 0.00 41.96 39.84 1xcb s TYR 62 CO 0.00 0.05 0.07 0.95 -1.11 0.00 0.00 175.55 175.51 1xcb s THR 63 N -2.60 4.18 0.30 -0.71 -4.23 -1.26 -0.38 115.64 110.94 1xcb s THR 63 Ca 0.41 -0.37 0.04 0.00 -1.18 0.00 0.00 61.69 60.60 1xcb s THR 63 Cb 0.02 -3.02 0.38 0.00 1.34 0.00 0.00 72.50 71.21 1xcb s THR 63 CO 0.23 0.24 1.46 0.52 -0.54 0.00 0.00 174.62 176.53 1xcb n VAL 64 N 4.91 -0.39 -0.15 2.29 0.31 -0.82 -0.78 118.33 123.70 1xcb n VAL 64 Ca -0.16 2.02 -0.10 0.00 -0.01 0.00 0.00 64.34 66.10 1xcb n VAL 64 Cb 0.50 -3.00 -0.01 0.00 -0.91 0.00 0.00 33.84 30.43 1xcb n VAL 64 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1xcb h PRO 65 N 0.00 0.72 -0.04 5.55 0.11 -1.90 -1.84 132.00 134.60 1xcb h PRO 65 Ca 0.60 -0.20 -0.01 0.00 0.11 0.00 0.00 66.00 66.49 1xcb h PRO 65 Cb 1.30 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 1xcb h PRO 65 CO -0.85 0.76 -0.03 0.28 -0.21 0.00 0.00 178.00 177.94 1xcb h VAL 66 N 0.57 1.37 -0.58 3.15 2.07 -1.34 -2.51 116.25 118.98 1xcb h VAL 66 Ca 0.13 -1.16 -0.05 0.00 0.82 0.00 0.00 66.70 66.44 1xcb h VAL 66 Cb 0.39 2.07 -0.03 0.00 -1.52 0.00 0.00 31.29 32.21 1xcb h VAL 66 CO 0.01 0.31 0.16 0.25 0.02 0.00 0.00 177.57 178.32 1xcb h LEU 67 N -0.36 0.83 -0.13 2.57 5.85 -1.42 -0.14 115.31 122.51 1xcb h LEU 67 Ca 0.01 -0.15 0.02 0.00 0.84 0.00 0.00 57.88 58.60 1xcb h LEU 67 Cb 0.52 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 1xcb h LEU 67 CO 0.01 0.80 -0.01 0.50 -0.34 0.00 0.00 178.44 179.40 1xcb h LYS 68 N 0.86 0.03 -0.57 1.25 3.64 -1.31 0.49 116.57 120.96 1xcb h LYS 68 Ca 0.19 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.53 1xcb h LYS 68 Cb 0.29 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.07 1xcb h LYS 68 CO -0.00 0.02 0.22 -0.09 -2.27 0.00 0.00 179.45 177.33 1xcb h ARG 69 N 0.03 0.83 0.09 1.90 9.65 -1.08 0.90 114.38 126.70 1xcb h ARG 69 Ca 0.06 -0.13 -0.00 0.00 -1.10 0.00 0.00 59.98 58.80 1xcb h ARG 69 Cb 0.07 -0.14 0.00 0.00 -1.39 0.00 0.00 29.97 28.51 1xcb h ARG 69 CO -0.11 0.69 -0.04 1.49 2.80 0.00 0.00 179.97 184.80 1xcb h GLU 70 N 0.82 -0.12 -0.62 0.20 4.22 -0.21 -1.38 114.58 117.48 1xcb h GLU 70 Ca 0.19 0.01 0.04 0.00 0.08 0.00 0.00 59.36 59.68 1xcb h GLU 70 Cb 0.17 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.41 1xcb h GLU 70 CO -0.02 0.28 0.37 -0.07 -2.18 0.00 0.00 179.01 177.39 1xcb h LEU 71 N -0.54 0.58 -1.16 1.64 4.07 0.16 -1.25 115.31 118.82 1xcb h LEU 71 Ca -0.01 0.01 -0.04 0.00 0.08 0.00 0.00 57.88 57.92 1xcb h LEU 71 Cb 0.45 -0.11 -0.02 0.00 1.08 0.00 0.00 40.66 42.06 1xcb h LEU 71 CO 0.02 0.39 0.17 0.03 -1.08 0.00 0.00 178.44 177.98 1xcb h ARG 72 N 0.71 0.76 -0.40 1.13 3.08 -0.79 0.45 114.38 119.33 1xcb h ARG 72 Ca 0.26 -0.13 -0.14 0.00 0.07 0.00 0.00 59.98 60.05 1xcb h ARG 72 Cb 0.08 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 1xcb h ARG 72 CO -0.13 0.66 -0.31 1.25 -1.07 0.00 0.00 179.97 180.36 1xcb h HIS 73 N 0.75 1.02 -0.11 3.04 2.76 -0.39 -1.81 115.15 120.41 1xcb h HIS 73 Ca 0.18 -0.27 -0.01 0.00 -2.20 0.00 0.00 60.37 58.06 1xcb h HIS 73 Cb 0.20 -0.23 -0.00 0.00 1.55 0.00 0.00 27.41 28.93 1xcb h HIS 73 CO 0.01 1.07 0.02 0.82 -1.30 0.00 0.00 177.93 178.55 1xcb h ILE 74 N 0.74 1.21 0.00 6.26 2.04 -0.67 -2.92 117.51 124.17 1xcb h ILE 74 Ca 0.08 -0.65 0.00 0.00 1.00 0.00 0.00 64.86 65.29 1xcb h ILE 74 Cb 0.87 1.43 0.00 0.00 -0.74 0.00 0.00 36.82 38.39 1xcb h ILE 74 CO 0.08 0.19 0.00 0.18 0.00 0.00 0.00 178.15 178.60 1xcb n LEU 75 N -4.85 0.00 0.00 1.44 4.32 0.09 -4.88 117.00 113.12 1xcb n LEU 75 Ca -0.06 0.37 0.00 0.00 -0.02 0.00 0.00 56.01 56.30 1xcb n LEU 75 Cb 0.16 -0.37 0.00 0.00 -1.62 0.00 0.00 43.42 41.59 1xcb n LEU 75 CO 0.35 -0.19 0.00 0.61 -1.22 0.00 0.00 177.39 176.93 1xcb n GLY 76 N -0.05 2.42 0.00 -0.72 0.00 -0.93 -4.91 105.19 101.00 1xcb n GLY 76 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1xcb n GLY 76 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xcb n LEU 77 N 0.00 0.00 0.09 0.99 7.99 -0.73 -2.92 117.00 122.42 1xcb n LEU 77 Ca 0.00 0.00 -0.11 0.00 -0.01 0.00 0.00 56.01 55.89 1xcb n LEU 77 Cb 0.00 0.00 -0.07 0.00 -0.11 0.00 0.00 43.42 43.24 1xcb n LEU 77 CO 0.00 0.00 0.39 -0.55 -1.51 0.00 0.00 177.39 175.72 1xcb h ASN 78 N 0.00 -0.25 -2.47 -1.43 -1.07 -1.84 -3.44 115.58 105.08 1xcb h ASN 78 Ca 0.00 -0.27 -0.23 0.00 0.07 0.00 0.00 56.30 55.87 1xcb h ASN 78 Cb 0.00 0.06 0.12 0.00 -2.07 0.00 0.00 38.32 36.43 1xcb h ASN 78 CO 0.00 0.26 0.03 -2.11 0.07 0.00 0.00 177.43 175.68 1xcb n ARG 79 N -4.98 -2.60 -3.87 4.14 1.85 -1.15 -5.01 116.66 105.03 1xcb n ARG 79 Ca -0.08 -0.98 -0.30 0.00 -1.00 0.00 0.00 57.85 55.49 1xcb n ARG 79 Cb 0.26 -0.99 -0.15 0.00 -1.05 0.00 0.00 32.46 30.52 1xcb n ARG 79 CO 0.00 0.00 0.00 0.21 -0.01 0.00 0.00 177.63 177.83 1xcb s LYS 80 N -4.39 1.13 0.52 2.89 2.20 -1.26 -4.67 119.74 116.15 1xcb s LYS 80 Ca 0.41 -1.33 -0.19 0.00 -0.36 0.00 0.00 55.97 54.50 1xcb s LYS 80 Cb -0.05 -2.51 -0.07 0.00 -1.51 0.00 0.00 37.83 33.69 1xcb s LYS 80 CO 0.32 -0.90 1.06 -1.58 -0.36 0.00 0.00 175.35 173.89 1xcb s TRP 81 N 1.34 2.92 -0.08 4.03 0.52 0.31 -4.91 118.94 123.06 1xcb s TRP 81 Ca 0.07 1.56 -0.13 0.00 0.02 0.00 0.00 56.10 57.62 1xcb s TRP 81 Cb -0.18 -3.10 -0.05 0.00 -1.15 0.00 0.00 33.47 28.99 1xcb s TRP 81 CO -0.16 -1.06 0.32 0.20 0.02 0.00 0.00 176.95 176.28 1xcb s GLY 82 N -2.10 2.33 0.46 0.98 0.00 -1.26 -1.55 107.32 106.18 1xcb s GLY 82 Ca 0.68 -0.37 0.01 0.00 0.00 0.00 0.00 44.72 45.03 1xcb s GLY 82 CO 0.25 0.17 0.09 1.04 0.00 0.00 0.00 173.10 174.65 1xcb n LEU 83 N 2.53 0.00 0.00 0.66 4.77 0.19 -1.50 117.00 123.65 1xcb n LEU 83 Ca -0.14 -2.75 0.00 0.00 -0.03 0.00 0.00 56.01 53.09 1xcb n LEU 83 Cb 0.53 0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.84 1xcb n LEU 83 CO 0.37 -0.44 0.00 0.00 -1.33 0.00 0.00 177.39 175.99 1xcb s ILE 85 N -2.00 2.32 -0.45 0.00 1.01 -0.94 0.00 121.20 121.15 1xcb s ILE 85 Ca 0.00 -0.87 -0.13 0.00 0.00 0.00 0.00 60.65 59.65 1xcb s ILE 85 Cb 0.00 -1.97 0.07 0.00 0.01 0.00 0.00 42.46 40.56 1xcb s ILE 85 CO 0.00 0.52 0.34 -0.69 0.00 0.00 0.00 174.94 175.12 1xcb s VAL 86 N 1.10 4.93 0.00 2.92 1.01 -1.03 -1.74 120.40 127.59 1xcb s VAL 86 Ca 0.00 -1.11 0.00 0.00 0.00 0.00 0.00 61.98 60.87 1xcb s VAL 86 Cb -0.14 -3.93 0.00 0.00 0.00 0.00 0.00 36.38 32.30 1xcb s VAL 86 CO -0.07 -0.52 0.00 0.61 0.00 0.00 0.00 175.10 175.12 1xcb n GLY 87 N 5.11 2.30 0.00 4.51 0.00 -0.04 -2.81 105.19 114.25 1xcb n GLY 87 Ca -0.12 -2.15 0.00 0.00 0.00 0.00 0.00 46.02 43.76 1xcb n GLY 87 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xcb n GLY 89 N -0.69 0.51 0.33 -0.02 0.00 -1.26 -3.93 105.19 100.13 1xcb n GLY 89 Ca 0.00 -2.00 -0.15 0.00 0.00 0.00 0.00 46.02 43.88 1xcb n GLY 89 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1xcb h ARG 90 N 0.00 -0.61 0.38 1.61 3.08 -1.98 0.50 114.38 117.36 1xcb h ARG 90 Ca 0.00 0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.07 1xcb h ARG 90 Cb 0.00 0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.19 1xcb h ARG 90 CO 0.00 -0.40 -0.18 1.25 -1.07 0.00 0.00 179.97 179.56 1xcb h LEU 91 N -0.63 -0.43 -0.88 3.04 5.85 -1.90 -2.03 115.31 118.33 1xcb h LEU 91 Ca -0.01 -0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.65 1xcb h LEU 91 Cb 0.58 0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.67 1xcb h LEU 91 CO -0.07 -0.17 0.57 1.23 -0.34 0.00 0.00 178.44 179.66 1xcb h GLY 92 N -0.69 1.26 0.85 3.75 0.00 -1.67 0.62 103.07 107.20 1xcb h GLY 92 Ca -0.05 -0.44 -0.02 0.00 0.00 0.00 0.00 47.33 46.82 1xcb h GLY 92 CO 0.09 0.39 0.05 1.76 0.00 0.00 0.00 176.54 178.82 1xcb h SER 93 N 1.12 0.28 -0.27 0.19 0.02 -0.02 -2.12 113.55 112.77 1xcb h SER 93 Ca 0.34 -0.23 0.01 0.00 -0.84 0.00 0.00 61.79 61.07 1xcb h SER 93 Cb -0.04 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.41 1xcb h SER 93 CO -0.10 0.44 0.15 0.00 -1.14 0.00 0.00 176.83 176.18 1xcb h ALA 94 N 0.85 0.33 -0.92 3.77 0.00 -1.12 -2.63 119.26 119.55 1xcb h ALA 94 Ca 0.06 -0.00 0.14 0.00 0.00 0.00 0.00 54.91 55.11 1xcb h ALA 94 Cb 0.27 -0.07 -0.09 0.00 0.00 0.00 0.00 17.79 17.89 1xcb h ALA 94 CO 0.00 -0.23 0.53 -0.07 0.00 0.00 0.00 179.25 179.48 1xcb h LEU 95 N 0.32 0.70 -0.06 0.00 3.38 -0.71 -2.41 115.31 116.53 1xcb h LEU 95 Ca 0.11 0.08 0.04 0.00 0.09 0.00 0.00 57.88 58.19 1xcb h LEU 95 Cb 0.00 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 40.65 1xcb h LEU 95 CO -0.05 0.32 -0.26 0.00 0.09 0.00 0.00 178.44 178.54 1xcb h ALA 96 N 1.56 -0.30 0.00 1.53 0.00 -1.00 -1.29 119.26 119.76 1xcb h ALA 96 Ca 0.49 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.41 1xcb h ALA 96 Cb 0.63 0.48 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1xcb h ALA 96 CO -0.33 -0.74 0.00 -0.25 0.00 0.00 0.00 179.25 177.93 1xcb n ASP 97 N -5.38 0.00 -4.64 0.00 8.00 -0.92 -4.74 116.55 108.87 1xcb n ASP 97 Ca -0.04 -1.16 -0.42 0.00 0.71 0.00 0.00 54.79 53.88 1xcb n ASP 97 Cb 0.29 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.35 1xcb n ASP 97 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1xcb s TYR 98 N -2.00 3.30 -0.11 1.24 5.04 -0.49 -4.95 117.35 119.38 1xcb s TYR 98 Ca 0.04 1.17 -0.05 0.00 -2.44 0.00 0.00 57.07 55.79 1xcb s TYR 98 Cb 0.02 -3.13 -0.19 0.00 0.35 0.00 0.00 41.96 39.00 1xcb s TYR 98 CO 0.03 -0.45 3.41 -0.35 -1.34 0.00 0.00 175.55 176.85 1xcb n PRO 99 N 6.12 2.08 0.00 4.97 -0.04 -1.26 -4.31 135.00 142.56 1xcb n PRO 99 Ca 0.07 -1.31 0.00 0.00 -0.04 0.00 0.00 63.50 62.22 1xcb n PRO 99 Cb 0.47 -2.02 0.00 0.00 -0.04 0.00 0.00 33.50 31.91 1xcb n PRO 99 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1xcb n GLY 100 N 2.10 -1.06 0.00 0.55 0.00 -1.26 -4.87 105.19 100.65 1xcb n GLY 100 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.46 1xcb n GLY 100 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1xcb n PHE 101 N -0.04 0.00 0.00 1.61 3.01 -1.26 -4.89 117.46 115.88 1xcb n PHE 101 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 1xcb n PHE 101 Cb 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.50 1xcb n PHE 101 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1xcb n GLY 102 N 2.42 1.21 0.00 1.37 0.00 -1.23 -4.66 105.19 104.30 1xcb n GLY 102 Ca 0.00 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.42 1xcb n GLY 102 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1xcb n GLU 103 N 0.00 0.00 -0.43 1.61 0.00 -1.26 -3.45 120.64 117.11 1xcb n GLU 103 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 57.16 57.24 1xcb n GLU 103 Cb 0.00 0.00 0.28 0.00 0.00 0.00 0.00 31.44 31.72 1xcb n GLU 103 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 1xcb n SER 104 N 0.00 3.97 -3.77 -1.84 7.64 -1.26 -4.82 113.62 113.54 1xcb n SER 104 Ca 0.00 -2.37 -0.28 0.00 1.01 0.00 0.00 58.87 57.23 1xcb n SER 104 Cb 0.00 -0.46 -0.16 0.00 -1.01 0.00 0.00 64.21 62.58 1xcb n SER 104 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1xcb s PHE 105 N -1.68 1.34 -0.11 1.43 0.40 -1.22 0.11 117.98 118.25 1xcb s PHE 105 Ca 0.41 -1.09 0.02 0.00 -0.60 0.00 0.00 56.93 55.67 1xcb s PHE 105 Cb 0.26 -1.18 -0.01 0.00 0.51 0.00 0.00 43.02 42.60 1xcb s PHE 105 CO 0.20 -0.66 -0.19 -2.00 0.70 0.00 0.00 175.22 173.27 1xcb s GLU 106 N 1.75 3.20 -0.07 0.44 2.12 -0.60 -3.55 118.70 121.99 1xcb s GLU 106 Ca -0.01 -0.79 -0.30 0.00 0.36 0.00 0.00 54.97 54.23 1xcb s GLU 106 Cb -0.17 -2.44 -0.04 0.00 0.26 0.00 0.00 34.13 31.73 1xcb s GLU 106 CO -0.09 0.19 1.41 -0.51 -0.54 0.00 0.00 175.26 175.73 1xcb s LEU 107 N 0.34 4.27 -0.08 2.70 1.43 -1.26 -0.63 118.68 125.46 1xcb s LEU 107 Ca -0.15 2.00 0.11 0.00 -1.03 0.00 0.00 54.13 55.06 1xcb s LEU 107 Cb -0.17 -3.55 0.19 0.00 0.03 0.00 0.00 46.19 42.69 1xcb s LEU 107 CO 0.08 -0.78 1.09 0.54 0.23 0.00 0.00 176.35 177.51 1xcb n ARG 108 N 6.19 0.73 0.00 1.70 1.74 -0.83 -4.88 116.66 121.31 1xcb n ARG 108 Ca 0.14 -1.96 0.00 0.00 -0.77 0.00 0.00 57.85 55.26 1xcb n ARG 108 Cb 0.44 -1.04 0.00 0.00 -1.02 0.00 0.00 32.46 30.84 1xcb n ARG 108 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xcb n GLY 109 N -0.76 1.14 2.71 -0.13 0.00 -1.23 -4.98 105.19 101.93 1xcb n GLY 109 Ca 0.09 -0.17 -0.21 0.00 0.00 0.00 0.00 46.02 45.74 1xcb n GLY 109 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xcb s PHE 110 N -1.67 -0.01 0.33 1.61 0.40 -1.26 -2.22 117.98 115.16 1xcb s PHE 110 Ca 0.00 0.15 0.10 0.00 -0.60 0.00 0.00 56.93 56.58 1xcb s PHE 110 Cb 0.00 -0.48 -0.06 0.00 0.51 0.00 0.00 43.02 42.99 1xcb s PHE 110 CO 0.00 -0.39 -0.11 -0.06 0.70 0.00 0.00 175.22 175.36 1xcb s PHE 111 N 2.22 2.36 -0.03 0.36 0.40 -0.71 -0.40 117.98 122.17 1xcb s PHE 111 Ca 0.04 -0.48 -0.30 0.00 -0.60 0.00 0.00 56.93 55.59 1xcb s PHE 111 Cb -0.14 -1.30 0.11 0.00 0.51 0.00 0.00 43.02 42.20 1xcb s PHE 111 CO -0.07 0.60 1.14 0.34 0.70 0.00 0.00 175.22 177.92 1xcb s ASP 112 N -3.58 -0.15 -0.19 1.36 -1.08 -1.21 -0.87 116.67 110.96 1xcb s ASP 112 Ca 0.32 -0.13 0.17 0.00 -0.52 0.00 0.00 52.55 52.39 1xcb s ASP 112 Cb 0.01 0.26 -0.25 0.00 -1.46 0.00 0.00 42.92 41.48 1xcb s ASP 112 CO 0.16 -0.45 0.12 0.52 0.52 0.00 0.00 175.17 176.04 1xcb n VAL 113 N -0.33 1.41 -1.53 1.11 0.31 -1.26 -3.11 118.33 114.93 1xcb n VAL 113 Ca -0.06 -0.85 -0.40 0.00 -0.01 0.00 0.00 64.34 63.02 1xcb n VAL 113 Cb 0.61 -0.53 -0.06 0.00 -0.91 0.00 0.00 33.84 32.95 1xcb n VAL 113 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1xcb n ASP 114 N -2.78 1.93 0.20 4.52 2.03 -1.26 -4.79 116.55 116.39 1xcb n ASP 114 Ca -0.32 -0.15 0.18 0.00 0.52 0.00 0.00 54.79 55.03 1xcb n ASP 114 Cb 1.15 -1.38 0.81 0.00 -0.72 0.00 0.00 41.12 40.98 1xcb n ASP 114 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1xcb h PRO 115 N 16.38 0.00 -0.13 -0.67 0.13 -1.94 0.57 132.00 146.33 1xcb h PRO 115 Ca -0.22 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.91 1xcb h PRO 115 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 1xcb h PRO 115 CO 1.17 0.00 0.00 -1.91 -0.23 0.00 0.00 178.00 177.03 1xcb n GLU 116 N -3.50 1.61 -0.02 0.86 4.07 -1.26 -3.55 120.64 118.85 1xcb n GLU 116 Ca 0.03 -0.92 -0.02 0.00 -0.06 0.00 0.00 57.16 56.19 1xcb n GLU 116 Cb 0.44 -1.38 -0.05 0.00 -0.06 0.00 0.00 31.44 30.39 1xcb n GLU 116 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 1xcb n LYS 117 N 0.14 2.41 -1.70 5.31 5.02 0.19 -4.92 118.16 124.63 1xcb n LYS 117 Ca 0.16 -0.02 -0.44 0.00 -2.02 0.00 0.00 58.31 56.00 1xcb n LYS 117 Cb 0.29 -1.16 -0.04 0.00 -0.02 0.00 0.00 35.03 34.11 1xcb n LYS 117 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1xcb n VAL 118 N -2.12 0.02 0.00 -0.18 0.31 -0.76 -1.48 118.33 114.11 1xcb n VAL 118 Ca -0.08 -0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 1xcb n VAL 118 Cb 0.59 -1.77 0.00 0.00 -0.91 0.00 0.00 33.84 31.75 1xcb n VAL 118 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1xcb n GLY 119 N 3.68 3.09 3.66 2.92 0.00 0.22 -5.00 105.19 113.76 1xcb n GLY 119 Ca 0.16 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.69 1xcb n GLY 119 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1xcb n ARG 120 N -1.69 1.82 -2.06 1.61 0.63 -0.55 -4.57 116.66 111.85 1xcb n ARG 120 Ca 0.00 0.66 -0.43 0.00 -0.92 0.00 0.00 57.85 57.16 1xcb n ARG 120 Cb 0.00 -2.41 -0.03 0.00 0.45 0.00 0.00 32.46 30.47 1xcb n ARG 120 CO 0.00 0.00 0.00 -2.14 -2.51 0.00 0.00 177.63 172.98 1xcb s PRO 121 N 2.07 3.45 -0.11 -0.14 0.02 -1.26 -1.25 135.00 137.78 1xcb s PRO 121 Ca 0.87 1.42 0.01 0.00 0.02 0.00 0.00 61.00 63.32 1xcb s PRO 121 Cb -0.79 -4.15 -0.01 0.00 0.02 0.00 0.00 34.50 29.57 1xcb s PRO 121 CO 0.47 -1.71 -0.17 0.08 -0.33 0.00 0.00 177.00 175.34 1xcb s VAL 122 N 6.39 2.75 -0.12 3.83 1.01 -1.24 -4.86 120.40 128.15 1xcb s VAL 122 Ca 0.76 -0.78 -0.01 0.00 0.00 0.00 0.00 61.98 61.95 1xcb s VAL 122 Cb -0.22 -2.12 0.00 0.00 0.00 0.00 0.00 36.38 34.04 1xcb s VAL 122 CO 0.33 0.54 0.08 -2.11 0.00 0.00 0.00 175.10 173.94 1xcb n ARG 123 N 3.42 -0.38 0.00 2.72 1.85 -1.26 0.17 116.66 123.18 1xcb n ARG 123 Ca -0.18 -0.03 0.00 0.00 -1.00 0.00 0.00 57.85 56.63 1xcb n ARG 123 Cb 0.53 -0.10 0.00 0.00 -1.05 0.00 0.00 32.46 31.83 1xcb n ARG 123 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1xcb n GLY 124 N -0.76 0.95 0.00 2.89 0.00 -1.26 -4.81 105.19 102.20 1xcb n GLY 124 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1xcb n GLY 124 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xcb n GLY 125 N 0.00 0.77 3.65 -0.02 0.00 0.46 -5.12 105.19 104.93 1xcb n GLY 125 Ca 0.00 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 44.78 1xcb n GLY 125 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xcb s VAL 126 N 0.00 0.00 -0.36 1.61 0.11 -1.23 -3.64 120.40 116.89 1xcb s VAL 126 Ca 0.00 0.00 -0.27 0.00 -2.93 0.00 0.00 61.98 58.78 1xcb s VAL 126 Cb 0.00 -1.00 -0.06 0.00 -1.53 0.00 0.00 36.38 33.79 1xcb s VAL 126 CO 0.00 0.00 2.29 -0.63 -3.33 0.00 0.00 175.10 173.43 1xcb s ILE 127 N 0.54 3.03 0.55 7.04 1.01 -0.38 -4.56 121.20 128.43 1xcb s ILE 127 Ca -0.01 0.03 -0.09 0.00 0.00 0.00 0.00 60.65 60.58 1xcb s ILE 127 Cb -0.04 -3.06 0.13 0.00 0.01 0.00 0.00 42.46 39.50 1xcb s ILE 127 CO -0.13 -0.05 0.74 -0.62 0.00 0.00 0.00 174.94 174.88 1xcb n GLU 128 N 8.89 -0.76 0.00 2.79 1.02 0.46 0.70 120.64 133.73 1xcb n GLU 128 Ca 0.33 -1.14 0.00 0.00 -0.02 0.00 0.00 57.16 56.33 1xcb n GLU 128 Cb 0.50 -0.76 0.00 0.00 -0.02 0.00 0.00 31.44 31.16 1xcb n GLU 128 CO 0.00 0.00 0.00 1.58 1.18 0.00 0.00 177.13 179.89 1xcb n HIS 129 N -3.04 0.00 0.03 -0.32 -0.00 -1.26 -3.28 115.22 107.34 1xcb n HIS 129 Ca 0.09 0.00 0.02 0.00 -0.00 0.00 0.00 57.72 57.83 1xcb n HIS 129 Cb 0.32 0.00 -0.03 0.00 -0.00 0.00 0.00 29.99 30.28 1xcb n HIS 129 CO 0.00 0.00 0.00 1.55 -0.00 0.00 0.00 176.34 177.89 1xcb n VAL 130 N 0.00 0.00 0.32 3.57 3.14 -1.18 -3.66 118.33 120.52 1xcb n VAL 130 Ca 0.00 -0.14 0.16 0.00 -2.96 0.00 0.00 64.34 61.40 1xcb n VAL 130 Cb 0.00 0.50 0.66 0.00 -1.06 0.00 0.00 33.84 33.95 1xcb n VAL 130 CO 0.00 0.00 0.00 0.44 -6.46 0.00 0.00 176.83 170.81 1xcb h ASP 131 N 0.00 0.00 0.47 6.55 5.19 -1.96 -2.98 116.42 123.68 1xcb h ASP 131 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1xcb h ASP 131 Cb 0.16 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.67 1xcb h ASP 131 CO 0.00 0.00 -0.30 0.18 -3.12 0.00 0.00 179.24 176.00 1xcb n LEU 132 N -2.72 0.56 -0.33 1.55 7.99 -1.26 -4.45 117.00 118.34 1xcb n LEU 132 Ca 0.01 -0.00 0.09 0.00 -0.01 0.00 0.00 56.01 56.10 1xcb n LEU 132 Cb 0.24 -0.24 0.21 0.00 -0.11 0.00 0.00 43.42 43.52 1xcb n LEU 132 CO 0.23 0.12 0.75 -0.07 -1.51 0.00 0.00 177.39 176.91 1xcb h LEU 133 N 0.41 -0.62 -2.05 2.23 3.38 -1.84 0.40 115.31 117.21 1xcb h LEU 133 Ca 0.00 0.27 -0.02 0.00 0.09 0.00 0.00 57.88 58.22 1xcb h LEU 133 Cb 0.48 0.51 -0.00 0.00 0.09 0.00 0.00 40.66 41.73 1xcb h LEU 133 CO 0.00 -0.31 -0.09 1.55 0.09 0.00 0.00 178.44 179.68 1xcb h PRO 134 N 0.02 0.00 0.02 1.13 0.13 -1.80 0.39 132.00 131.89 1xcb h PRO 134 Ca 0.52 0.00 -0.35 0.00 -0.87 0.00 0.00 66.00 65.29 1xcb h PRO 134 Cb 0.94 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.02 1xcb h PRO 134 CO -0.91 0.09 -2.14 1.04 -0.23 0.00 0.00 178.00 175.85 1xcb n GLN 135 N -3.78 0.68 0.12 0.86 3.00 0.44 -4.38 117.38 114.31 1xcb n GLN 135 Ca -0.02 0.16 0.00 0.00 -0.01 0.00 0.00 57.00 57.13 1xcb n GLN 135 Cb 0.19 -1.63 -0.01 0.00 0.00 0.00 0.00 30.24 28.79 1xcb n GLN 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1xcb h ARG 136 N 0.01 0.00 0.10 -1.09 2.47 -0.12 -3.41 114.38 112.35 1xcb h ARG 136 Ca -0.46 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.26 1xcb h ARG 136 Cb 2.07 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 30.40 1xcb h ARG 136 CO 0.03 0.62 -0.05 0.28 0.56 0.00 0.00 179.97 181.41 1xcb h VAL 137 N 0.00 0.00 -1.47 2.04 2.07 -0.43 -3.40 116.25 115.05 1xcb h VAL 137 Ca -0.01 -0.23 -0.76 0.00 0.82 0.00 0.00 66.70 66.52 1xcb h VAL 137 Cb 1.47 0.00 0.02 0.00 -1.52 0.00 0.00 31.29 31.26 1xcb h VAL 137 CO 0.08 0.00 0.83 -0.81 0.02 0.00 0.00 177.57 177.69 1xcb n PRO 138 N -3.02 0.98 0.00 1.57 -0.04 -1.26 -0.43 135.00 132.81 1xcb n PRO 138 Ca -0.02 0.36 0.00 0.00 -0.04 0.00 0.00 63.50 63.80 1xcb n PRO 138 Cb 0.05 -2.01 0.00 0.00 -0.04 0.00 0.00 33.50 31.50 1xcb n PRO 138 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1xcb n GLY 139 N 4.03 3.15 0.21 0.55 0.00 -1.26 -4.78 105.19 107.09 1xcb n GLY 139 Ca 0.27 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.21 1xcb n GLY 139 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xcb n ARG 140 N -1.38 0.24 -4.76 1.61 1.74 -0.32 -5.04 116.66 108.74 1xcb n ARG 140 Ca 0.00 0.07 -0.25 0.00 -0.77 0.00 0.00 57.85 56.90 1xcb n ARG 140 Cb 0.00 -1.11 -0.16 0.00 -1.02 0.00 0.00 32.46 30.17 1xcb n ARG 140 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1xcb s ILE 141 N -2.19 1.30 0.00 0.55 1.01 0.43 -4.02 121.20 118.28 1xcb s ILE 141 Ca -0.13 -0.67 0.00 0.00 0.00 0.00 0.00 60.65 59.85 1xcb s ILE 141 Cb 0.04 -1.11 0.00 0.00 0.01 0.00 0.00 42.46 41.40 1xcb s ILE 141 CO 0.21 0.38 0.00 -0.62 0.00 0.00 0.00 174.94 174.91 1xcb n GLU 142 N 3.01 2.72 -4.68 2.79 4.71 -0.57 -4.45 120.64 124.17 1xcb n GLU 142 Ca -0.17 0.00 -0.33 0.00 -0.01 0.00 0.00 57.16 56.65 1xcb n GLU 142 Cb 0.54 -0.95 -0.13 0.00 -1.01 0.00 0.00 31.44 29.88 1xcb n GLU 142 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 1xcb s ILE 143 N -1.91 3.33 -0.08 -3.67 1.01 -0.56 -0.96 121.20 118.35 1xcb s ILE 143 Ca 0.00 -0.57 0.05 0.00 0.00 0.00 0.00 60.65 60.12 1xcb s ILE 143 Cb 0.00 -2.40 -0.01 0.00 0.01 0.00 0.00 42.46 40.06 1xcb s ILE 143 CO 0.00 0.53 -0.23 0.00 0.00 0.00 0.00 174.94 175.23 1xcb s ALA 144 N 0.15 2.21 -0.54 9.38 0.00 -0.72 -1.60 121.76 130.64 1xcb s ALA 144 Ca -0.05 -1.00 -0.20 0.00 0.00 0.00 0.00 51.96 50.71 1xcb s ALA 144 Cb -0.15 -0.78 0.07 0.00 0.00 0.00 0.00 23.12 22.26 1xcb s ALA 144 CO 0.04 0.35 0.71 -0.51 0.00 0.00 0.00 175.76 176.34 1xcb s LEU 145 N 0.10 4.91 -0.70 0.00 1.43 0.10 -0.84 118.68 123.68 1xcb s LEU 145 Ca -0.11 -0.97 -0.27 0.00 -1.03 0.00 0.00 54.13 51.75 1xcb s LEU 145 Cb -0.16 -2.46 0.02 0.00 0.03 0.00 0.00 46.19 43.62 1xcb s LEU 145 CO 0.06 -1.02 1.40 -0.22 0.23 0.00 0.00 176.35 176.80 1xcb s LEU 146 N 2.91 3.20 -0.58 1.79 2.96 -0.78 -2.46 118.68 125.73 1xcb s LEU 146 Ca 0.17 -0.26 0.06 0.00 -0.22 0.00 0.00 54.13 53.88 1xcb s LEU 146 Cb -0.19 -2.59 0.31 0.00 0.50 0.00 0.00 46.19 44.22 1xcb s LEU 146 CO 0.11 -1.93 0.85 0.35 -1.32 0.00 0.00 176.35 174.41 1xcb n THR 147 N 6.57 2.45 -4.36 3.68 -2.24 -1.12 -1.76 114.28 117.50 1xcb n THR 147 Ca 0.07 -5.33 -0.19 0.00 -2.27 0.00 0.00 64.05 56.33 1xcb n THR 147 Cb 0.50 -1.57 -0.10 0.00 -2.10 0.00 0.00 70.33 67.06 1xcb n THR 147 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1xcb s VAL 148 N -3.54 1.81 0.53 2.28 -7.23 -1.26 -4.51 120.40 108.48 1xcb s VAL 148 Ca 0.45 -2.21 -0.19 0.00 -1.81 0.00 0.00 61.98 58.22 1xcb s VAL 148 Cb 0.24 -2.05 -0.11 0.00 0.56 0.00 0.00 36.38 35.02 1xcb s VAL 148 CO -0.09 -0.56 0.40 -2.65 -0.31 0.00 0.00 175.10 171.89 1xcb n PRO 149 N -0.35 0.42 -0.21 4.82 -0.02 -1.26 -4.55 135.00 133.85 1xcb n PRO 149 Ca -0.08 0.16 -0.13 0.00 -2.02 0.00 0.00 63.50 61.43 1xcb n PRO 149 Cb 0.60 -1.52 -0.10 0.00 -0.02 0.00 0.00 33.50 32.46 1xcb n PRO 149 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1xcb h ARG 150 N 0.30 -0.29 -1.17 -0.52 2.43 -1.96 -0.67 114.38 112.50 1xcb h ARG 150 Ca -0.44 0.02 0.44 0.00 -0.81 0.00 0.00 59.98 59.19 1xcb h ARG 150 Cb 1.41 0.07 -0.16 0.00 -0.42 0.00 0.00 29.97 30.87 1xcb h ARG 150 CO 0.47 -0.19 0.70 1.05 -1.51 0.00 0.00 179.97 180.49 1xcb h GLU 151 N -0.30 0.03 0.00 0.20 9.09 -1.98 -3.12 114.58 118.51 1xcb h GLU 151 Ca 0.09 -0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.50 1xcb h GLU 151 Cb 0.55 -0.01 0.00 0.00 -1.65 0.00 0.00 28.75 27.64 1xcb h GLU 151 CO -0.68 0.02 0.00 0.00 0.05 0.00 0.00 179.01 178.40 1xcb n ALA 152 N -2.38 0.00 0.00 1.06 0.00 -0.28 -4.74 120.51 114.17 1xcb n ALA 152 Ca 0.38 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.82 1xcb n ALA 152 Cb 1.39 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.84 1xcb n ALA 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xcb n ALA 153 N -1.36 0.00 -0.31 0.00 0.00 -1.06 -0.90 120.51 116.87 1xcb n ALA 153 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.61 1xcb n ALA 153 Cb 0.00 0.00 0.36 0.00 0.00 0.00 0.00 19.45 19.81 1xcb n ALA 153 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1xcb h GLN 154 N 0.00 0.28 -0.23 0.00 5.75 -1.85 0.50 115.11 119.55 1xcb h GLN 154 Ca 0.00 -0.02 -0.18 0.00 -0.15 0.00 0.00 58.65 58.31 1xcb h GLN 154 Cb 0.00 -0.06 -0.00 0.00 1.07 0.00 0.00 27.48 28.49 1xcb h GLN 154 CO 0.00 0.18 -0.57 -0.22 -2.65 0.00 0.00 178.83 175.57 1xcb h LYS 155 N 0.28 0.73 0.64 1.69 1.63 -1.34 -1.66 116.57 118.54 1xcb h LYS 155 Ca 0.62 -0.47 -0.03 0.00 -0.85 0.00 0.00 60.65 59.92 1xcb h LYS 155 Cb 1.31 0.06 0.00 0.00 -0.60 0.00 0.00 32.23 33.00 1xcb h LYS 155 CO -0.62 1.09 -0.35 0.00 -3.45 0.00 0.00 179.45 176.12 1xcb h ALA 156 N 0.80 -1.21 -1.02 5.00 0.00 -0.28 -2.42 119.26 120.13 1xcb h ALA 156 Ca 0.01 -0.20 0.28 0.00 0.00 0.00 0.00 54.91 55.00 1xcb h ALA 156 Cb 1.15 0.43 -0.13 0.00 0.00 0.00 0.00 17.79 19.24 1xcb h ALA 156 CO 0.12 -1.16 0.61 0.00 0.00 0.00 0.00 179.25 178.82 1xcb h ALA 157 N -1.46 1.95 -0.60 0.00 0.00 -0.57 0.29 119.26 118.87 1xcb h ALA 157 Ca -0.09 0.13 0.12 0.00 0.00 0.00 0.00 54.91 55.07 1xcb h ALA 157 Cb 0.72 0.06 -0.09 0.00 0.00 0.00 0.00 17.79 18.48 1xcb h ALA 157 CO 0.11 -0.46 0.11 -0.44 0.00 0.00 0.00 179.25 178.58 1xcb h ASP 158 N 0.46 -0.04 0.01 0.00 3.45 -0.82 0.27 116.42 119.74 1xcb h ASP 158 Ca 0.67 0.12 -0.00 0.00 0.43 0.00 0.00 57.03 58.25 1xcb h ASP 158 Cb 1.45 0.17 0.00 0.00 -0.56 0.00 0.00 39.33 40.39 1xcb h ASP 158 CO -0.48 -0.01 -0.00 -0.07 -1.57 0.00 0.00 179.24 177.10 1xcb h LEU 159 N 0.23 -0.01 -0.44 1.55 3.38 -0.08 -2.59 115.31 117.35 1xcb h LEU 159 Ca 0.32 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.37 1xcb h LEU 159 Cb 0.48 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.16 1xcb h LEU 159 CO -0.43 -0.00 -0.14 -0.11 0.09 0.00 0.00 178.44 177.85 1xcb n LEU 160 N -2.03 -0.21 0.18 1.67 7.94 -0.80 0.21 117.00 123.97 1xcb n LEU 160 Ca -0.00 0.76 -0.14 0.00 -1.11 0.00 0.00 56.01 55.52 1xcb n LEU 160 Cb 0.00 -0.21 -0.07 0.00 0.53 0.00 0.00 43.42 43.67 1xcb n LEU 160 CO 0.00 -0.71 0.73 0.58 -1.11 0.00 0.00 177.39 176.88 1xcb h VAL 161 N 0.00 0.55 -0.76 1.96 2.07 -0.45 -1.02 116.25 118.60 1xcb h VAL 161 Ca 0.19 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.86 1xcb h VAL 161 Cb 0.30 0.55 -0.05 0.00 -1.52 0.00 0.00 31.29 30.57 1xcb h VAL 161 CO -0.45 0.00 0.51 0.00 0.02 0.00 0.00 177.57 177.65 1xcb h ALA 162 N 0.18 2.09 0.00 1.67 0.00 0.28 0.75 119.26 124.24 1xcb h ALA 162 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1xcb h ALA 162 Cb 0.43 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1xcb h ALA 162 CO -0.00 -0.29 0.00 0.00 0.00 0.00 0.00 179.25 178.95 1xcb n ALA 163 N -2.51 1.74 -1.49 0.00 0.00 0.37 -4.86 120.51 113.76 1xcb n ALA 163 Ca 0.15 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1xcb n ALA 163 Cb 0.52 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.70 1xcb n ALA 163 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xcb n GLY 164 N 0.18 0.98 3.77 0.00 0.00 0.26 -4.09 105.19 106.28 1xcb n GLY 164 Ca 0.04 -0.44 -0.39 0.00 0.00 0.00 0.00 46.02 45.23 1xcb n GLY 164 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1xcb s ILE 165 N -2.52 3.65 -0.03 -0.61 1.10 -0.47 -4.75 121.20 117.58 1xcb s ILE 165 Ca 0.00 1.51 0.07 0.00 -0.51 0.00 0.00 60.65 61.72 1xcb s ILE 165 Cb 0.00 -3.90 -0.24 0.00 0.15 0.00 0.00 42.46 38.47 1xcb s ILE 165 CO 0.00 0.25 0.71 0.11 -2.11 0.00 0.00 174.94 173.90 1xcb h LYS 166 N 3.39 0.07 -1.89 3.50 6.56 -1.35 -3.45 116.57 123.40 1xcb h LYS 166 Ca -0.47 -0.12 -0.02 0.00 -1.06 0.00 0.00 60.65 58.98 1xcb h LYS 166 Cb 1.21 0.04 -0.20 0.00 -0.57 0.00 0.00 32.23 32.72 1xcb h LYS 166 CO 0.65 0.73 0.30 0.20 -2.06 0.00 0.00 179.45 179.27 1xcb s GLY 167 N -5.12 -0.49 -0.08 3.86 0.00 -0.63 -2.24 107.32 102.63 1xcb s GLY 167 Ca -0.07 1.51 0.03 0.00 0.00 0.00 0.00 44.72 46.20 1xcb s GLY 167 CO 0.82 0.96 -0.19 -0.42 0.00 0.00 0.00 173.10 174.27 1xcb s ILE 168 N -1.23 1.62 -0.61 0.90 1.01 0.44 -1.75 121.20 121.58 1xcb s ILE 168 Ca -0.08 -0.77 -0.16 0.00 0.00 0.00 0.00 60.65 59.64 1xcb s ILE 168 Cb -0.00 -1.43 0.15 0.00 0.01 0.00 0.00 42.46 41.19 1xcb s ILE 168 CO 0.07 0.46 0.59 -0.22 0.00 0.00 0.00 174.94 175.84 1xcb s LEU 169 N 0.43 6.23 -0.15 2.97 2.96 -0.02 -1.44 118.68 129.65 1xcb s LEU 169 Ca -0.15 -1.96 -0.27 0.00 -0.22 0.00 0.00 54.13 51.52 1xcb s LEU 169 Cb -0.16 -2.22 -0.01 0.00 0.50 0.00 0.00 46.19 44.30 1xcb s LEU 169 CO 0.06 -0.82 0.92 0.21 -1.32 0.00 0.00 176.35 175.40 1xcb s ASN 170 N 3.28 7.08 -0.03 3.68 2.47 0.68 -1.87 114.94 130.24 1xcb s ASN 170 Ca 0.07 1.33 0.16 0.00 0.42 0.00 0.00 52.86 54.85 1xcb s ASN 170 Cb -0.25 -2.50 -0.25 0.00 -1.45 0.00 0.00 41.25 36.80 1xcb s ASN 170 CO 0.00 -0.45 0.34 0.49 -3.72 0.00 0.00 177.10 173.76 1xcb n PHE 171 N 5.29 0.00 -1.79 0.43 3.01 -0.72 -0.77 117.46 122.91 1xcb n PHE 171 Ca 0.07 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.11 1xcb n PHE 171 Cb 0.48 -0.38 -0.03 0.00 -0.01 0.00 0.00 39.48 39.55 1xcb n PHE 171 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1xcb s ALA 172 N -3.09 3.81 -1.31 4.37 0.00 -1.21 -4.86 121.76 119.46 1xcb s ALA 172 Ca -0.06 1.44 -0.17 0.00 0.00 0.00 0.00 51.96 53.17 1xcb s ALA 172 Cb 0.10 -3.71 0.03 0.00 0.00 0.00 0.00 23.12 19.54 1xcb s ALA 172 CO 0.66 -1.04 1.96 -0.35 0.00 0.00 0.00 175.76 176.99 1xcb n PRO 173 N 4.87 2.78 -3.63 0.00 -0.04 -1.26 -4.74 135.00 132.98 1xcb n PRO 173 Ca 0.16 -2.83 -0.12 0.00 -0.04 0.00 0.00 63.50 60.67 1xcb n PRO 173 Cb 0.38 -3.40 -0.07 0.00 -0.04 0.00 0.00 33.50 30.37 1xcb n PRO 173 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1xcb s VAL 174 N 4.54 0.00 -0.51 0.52 -7.23 -1.26 -4.97 120.40 111.49 1xcb s VAL 174 Ca 0.53 0.00 -0.25 0.00 -1.81 0.00 0.00 61.98 60.45 1xcb s VAL 174 Cb 0.08 -1.00 0.04 0.00 0.56 0.00 0.00 36.38 36.06 1xcb s VAL 174 CO 0.03 0.00 0.93 0.54 -0.31 0.00 0.00 175.10 176.28 1xcb s VAL 175 N 0.46 4.43 0.83 1.32 0.11 -1.26 -5.01 120.40 121.29 1xcb s VAL 175 Ca -0.00 0.46 -0.12 0.00 -2.93 0.00 0.00 61.98 59.39 1xcb s VAL 175 Cb -0.05 -4.49 0.10 0.00 -1.53 0.00 0.00 36.38 30.41 1xcb s VAL 175 CO -0.03 -1.00 1.16 -0.76 -3.33 0.00 0.00 175.10 171.15 1xcb s LEU 176 N 3.85 3.04 -0.59 2.54 1.43 -1.26 -5.00 118.68 122.69 1xcb s LEU 176 Ca 0.33 2.21 0.02 0.00 -1.03 0.00 0.00 54.13 55.65 1xcb s LEU 176 Cb -0.12 -4.57 0.15 0.00 0.03 0.00 0.00 46.19 41.68 1xcb s LEU 176 CO 0.22 -2.68 0.36 -1.61 0.23 0.00 0.00 176.35 172.87 1xcb s GLU 177 N -4.42 2.27 0.03 1.70 0.41 -1.26 -5.08 118.70 112.35 1xcb s GLU 177 Ca 0.69 -2.70 0.07 0.00 -0.41 0.00 0.00 54.97 52.62 1xcb s GLU 177 Cb -0.24 -3.49 -0.02 0.00 -1.78 0.00 0.00 34.13 28.59 1xcb s GLU 177 CO 0.53 -1.15 -0.21 0.14 -0.49 0.00 0.00 175.26 174.07 1xcb s VAL 178 N -0.40 1.71 1.01 2.63 -7.23 -1.26 -4.99 120.40 111.87 1xcb s VAL 178 Ca 0.18 -1.12 -0.18 0.00 -1.81 0.00 0.00 61.98 59.05 1xcb s VAL 178 Cb -0.21 -1.46 -0.05 0.00 0.56 0.00 0.00 36.38 35.21 1xcb s VAL 178 CO -0.03 0.30 -0.42 -0.81 -0.31 0.00 0.00 175.10 173.83 1xcb n PRO 179 N 2.06 -0.38 0.23 4.82 -0.04 -1.26 -4.85 135.00 135.58 1xcb n PRO 179 Ca -0.17 -0.10 0.09 0.00 -0.04 0.00 0.00 63.50 63.29 1xcb n PRO 179 Cb 0.53 -1.39 0.56 0.00 -0.04 0.00 0.00 33.50 33.16 1xcb n PRO 179 CO 0.00 0.00 0.00 1.57 -0.04 0.00 0.00 175.50 177.03 1xcb h LYS 180 N -1.37 0.00 0.00 0.54 2.10 -2.04 -2.78 116.57 113.03 1xcb h LYS 180 Ca -0.45 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.20 1xcb h LYS 180 Cb 1.32 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.65 1xcb h LYS 180 CO 0.29 0.21 0.00 0.39 -2.00 0.00 0.00 179.45 178.34 1xcb n GLU 181 N -3.73 0.04 -4.23 0.07 4.71 -1.26 -4.56 120.64 111.67 1xcb n GLU 181 Ca -0.01 0.31 -0.34 0.00 -0.01 0.00 0.00 57.16 57.11 1xcb n GLU 181 Cb 0.33 -1.50 -0.15 0.00 -1.01 0.00 0.00 31.44 29.10 1xcb n GLU 181 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 1xcb s VAL 182 N -2.88 2.66 0.24 2.62 1.01 -1.05 -4.88 120.40 118.12 1xcb s VAL 182 Ca 0.05 -0.75 -0.21 0.00 0.00 0.00 0.00 61.98 61.07 1xcb s VAL 182 Cb 0.06 -2.15 -0.08 0.00 0.00 0.00 0.00 36.38 34.20 1xcb s VAL 182 CO 0.15 0.50 0.76 0.00 0.00 0.00 0.00 175.10 176.51 1xcb s ALA 183 N 1.14 3.38 0.02 5.51 0.00 -0.95 -4.85 121.76 126.02 1xcb s ALA 183 Ca 0.01 0.22 0.04 0.00 0.00 0.00 0.00 51.96 52.23 1xcb s ALA 183 Cb -0.14 -2.88 -0.02 0.00 0.00 0.00 0.00 23.12 20.08 1xcb s ALA 183 CO -0.05 0.30 -0.11 0.08 0.00 0.00 0.00 175.76 175.98 1xcb s VAL 184 N -1.53 0.86 -0.04 0.00 1.01 -1.26 -0.42 120.40 119.02 1xcb s VAL 184 Ca 0.44 -0.80 -0.02 0.00 0.00 0.00 0.00 61.98 61.61 1xcb s VAL 184 Cb -0.17 -0.79 0.03 0.00 0.00 0.00 0.00 36.38 35.45 1xcb s VAL 184 CO 0.21 0.00 0.09 -0.70 0.00 0.00 0.00 175.10 174.71 1xcb s GLU 185 N -0.89 0.03 -0.05 2.72 2.56 -0.52 -4.96 118.70 117.59 1xcb s GLU 185 Ca 0.00 0.26 -0.13 0.00 0.00 0.00 0.00 54.97 55.10 1xcb s GLU 185 Cb -0.07 -0.19 -0.05 0.00 2.00 0.00 0.00 34.13 35.83 1xcb s GLU 185 CO 0.01 -0.15 0.35 -0.80 -0.56 0.00 0.00 175.26 174.10 1xcb s ASN 186 N 1.01 6.68 -0.10 -1.70 0.01 -1.26 -0.23 114.94 119.35 1xcb s ASN 186 Ca -0.08 0.80 0.00 0.00 -0.71 0.00 0.00 52.86 52.88 1xcb s ASN 186 Cb -0.11 -2.21 -0.02 0.00 0.41 0.00 0.00 41.25 39.31 1xcb s ASN 186 CO -0.04 0.29 -0.10 -0.69 -1.51 0.00 0.00 177.10 175.05 1xcb s VAL 187 N -0.74 3.40 -0.10 1.60 1.01 0.05 -4.92 120.40 120.69 1xcb s VAL 187 Ca 0.21 -0.57 -0.14 0.00 0.00 0.00 0.00 61.98 61.49 1xcb s VAL 187 Cb -0.15 -2.40 0.03 0.00 0.00 0.00 0.00 36.38 33.86 1xcb s VAL 187 CO 0.10 0.56 0.36 -1.81 0.00 0.00 0.00 175.10 174.31 1xcb s ASP 188 N -0.26 -0.34 0.03 3.32 1.01 -1.26 -4.70 116.67 114.47 1xcb s ASP 188 Ca 0.03 0.57 0.18 0.00 0.71 0.00 0.00 52.55 54.04 1xcb s ASP 188 Cb -0.13 0.63 -0.16 0.00 1.01 0.00 0.00 42.92 44.28 1xcb s ASP 188 CO 0.03 -0.22 0.71 2.22 0.21 0.00 0.00 175.17 178.12 1xcb n PHE 189 N 2.44 0.75 -0.31 4.23 1.16 -1.26 -4.44 117.46 120.03 1xcb n PHE 189 Ca -0.15 0.24 -0.02 0.00 -1.87 0.00 0.00 57.45 55.65 1xcb n PHE 189 Cb 0.57 -0.99 0.01 0.00 -1.61 0.00 0.00 39.48 37.46 1xcb n PHE 189 CO 0.00 0.00 0.00 1.28 -1.87 0.00 0.00 176.76 176.17 1xcb n LEU 190 N -2.77 -0.57 -0.34 5.98 4.77 -1.26 -0.22 117.00 122.58 1xcb n LEU 190 Ca -0.11 1.40 0.08 0.00 -0.03 0.00 0.00 56.01 57.35 1xcb n LEU 190 Cb 0.81 -0.30 0.25 0.00 -2.33 0.00 0.00 43.42 41.86 1xcb n LEU 190 CO 0.43 -1.23 1.18 0.00 -1.33 0.00 0.00 177.39 176.44 1xcb h ALA 191 N 0.98 1.47 0.00 -1.18 0.00 -2.02 0.92 119.26 119.43 1xcb h ALA 191 Ca 0.25 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.18 1xcb h ALA 191 Cb 0.45 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1xcb h ALA 191 CO -0.78 0.07 -0.16 0.78 0.00 0.00 0.00 179.25 179.16 1xcb h GLY 192 N 0.83 0.00 0.96 0.00 0.00 -0.89 -1.65 103.07 102.32 1xcb h GLY 192 Ca 0.50 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.83 1xcb h GLY 192 CO -0.31 0.00 0.16 1.41 0.00 0.00 0.00 176.54 177.80 1xcb h LEU 193 N 0.00 0.37 -0.58 3.11 3.38 -0.62 0.14 115.31 121.11 1xcb h LEU 193 Ca -0.00 -0.09 -0.15 0.00 0.09 0.00 0.00 57.88 57.73 1xcb h LEU 193 Cb 0.30 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 1xcb h LEU 193 CO 0.02 0.35 -0.52 0.74 0.09 0.00 0.00 178.44 179.12 1xcb h THR 194 N 0.36 1.32 -0.13 0.22 2.02 -1.36 0.47 112.91 115.81 1xcb h THR 194 Ca 0.11 -1.77 -0.02 0.00 0.77 0.00 0.00 66.41 65.50 1xcb h THR 194 Cb 0.06 1.76 -0.01 0.00 -1.74 0.00 0.00 68.15 68.22 1xcb h THR 194 CO -0.02 0.55 0.01 0.03 0.37 0.00 0.00 175.52 176.46 1xcb h ARG 195 N 0.40 0.18 0.19 6.66 3.08 -1.04 0.37 114.38 124.21 1xcb h ARG 195 Ca 0.01 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 1xcb h ARG 195 Cb 1.05 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.07 1xcb h ARG 195 CO 0.10 0.19 -0.09 1.25 -1.07 0.00 0.00 179.97 180.35 1xcb h LEU 196 N 0.18 -0.22 -0.35 3.04 5.85 0.16 -1.00 115.31 122.98 1xcb h LEU 196 Ca 0.05 -0.31 0.05 0.00 0.84 0.00 0.00 57.88 58.50 1xcb h LEU 196 Cb 0.11 0.06 -0.08 0.00 0.37 0.00 0.00 40.66 41.12 1xcb h LEU 196 CO 0.00 0.26 -0.54 -1.28 -0.34 0.00 0.00 178.44 176.54 1xcb h SER 197 N -0.77 -1.80 -0.87 1.25 0.87 0.95 -0.28 113.55 112.90 1xcb h SER 197 Ca -0.03 0.23 0.03 0.00 -1.23 0.00 0.00 61.79 60.80 1xcb h SER 197 Cb 0.51 0.73 -0.05 0.00 -0.44 0.00 0.00 62.40 63.16 1xcb h SER 197 CO 0.04 -0.42 0.57 0.15 -0.53 0.00 0.00 176.83 176.65 1xcb h PHE 198 N -0.43 1.06 -0.02 2.24 3.57 -0.38 -2.52 116.94 120.47 1xcb h PHE 198 Ca 0.07 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.54 1xcb h PHE 198 Cb 0.62 -0.36 -0.01 0.00 2.79 0.00 0.00 35.95 38.99 1xcb h PHE 198 CO -0.69 0.63 -0.25 0.00 -2.23 0.00 0.00 178.31 175.77 1xcb h ALA 199 N 1.48 1.54 -0.15 2.41 0.00 0.25 -2.76 119.26 122.04 1xcb h ALA 199 Ca 0.34 -0.24 -0.13 0.00 0.00 0.00 0.00 54.91 54.88 1xcb h ALA 199 Cb -0.02 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1xcb h ALA 199 CO -0.09 0.34 -0.39 0.82 0.00 0.00 0.00 179.25 179.92 1xcb h ILE 200 N 0.04 1.35 0.00 0.00 2.04 -0.66 -3.14 117.51 117.14 1xcb h ILE 200 Ca 0.00 -1.67 0.00 0.00 1.00 0.00 0.00 64.86 64.20 1xcb h ILE 200 Cb 0.47 2.02 0.00 0.00 -0.74 0.00 0.00 36.82 38.57 1xcb h ILE 200 CO 0.03 0.51 0.00 0.18 0.00 0.00 0.00 178.15 178.87 1xcb n LEU 201 N -4.29 0.00 -3.20 1.44 4.32 -1.15 -4.10 117.00 110.02 1xcb n LEU 201 Ca -0.07 0.16 -0.24 0.00 -0.02 0.00 0.00 56.01 55.84 1xcb n LEU 201 Cb 0.53 -0.16 -0.06 0.00 -1.62 0.00 0.00 43.42 42.12 1xcb n LEU 201 CO 0.45 -0.02 -0.12 0.59 -1.22 0.00 0.00 177.39 177.06 1xcb n ASN 202 N -1.16 1.90 0.15 -1.43 4.13 -1.05 -4.91 115.26 112.89 1xcb n ASN 202 Ca 0.16 -3.12 0.18 0.00 1.68 0.00 0.00 54.58 53.48 1xcb n ASN 202 Cb 0.15 -0.63 0.78 0.00 -1.54 0.00 0.00 39.78 38.54 1xcb n ASN 202 CO 0.00 0.00 0.00 -0.65 0.28 0.00 0.00 177.26 176.89 1xcb h PRO 203 N 3.61 0.00 0.90 3.52 0.11 -1.71 -2.11 132.00 136.31 1xcb h PRO 203 Ca 0.12 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.18 1xcb h PRO 203 Cb 0.79 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.91 1xcb h PRO 203 CO 0.62 0.00 -0.43 -0.22 -0.21 0.00 0.00 178.00 177.76 1xcb h LYS 204 N 0.00 -1.17 -0.37 1.05 1.63 -1.91 -3.14 116.57 112.65 1xcb h LYS 204 Ca 0.13 0.08 0.08 0.00 -0.85 0.00 0.00 60.65 60.09 1xcb h LYS 204 Cb 0.65 0.27 -0.08 0.00 -0.60 0.00 0.00 32.23 32.46 1xcb h LYS 204 CO -0.00 -0.78 -0.22 2.35 -3.45 0.00 0.00 179.45 177.35 1xcb h TRP 205 N -1.32 -0.58 0.00 1.91 7.01 -1.82 -3.56 115.95 117.60 1xcb h TRP 205 Ca -0.12 0.05 0.00 0.00 2.11 0.00 0.00 58.89 60.92 1xcb h TRP 205 Cb 0.93 0.31 0.00 0.00 -2.10 0.00 0.00 29.16 28.30 1xcb h TRP 205 CO 0.00 -0.30 0.00 -2.13 -2.79 0.00 0.00 178.44 173.22