#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2of7 n LEU 18 N 0.00 7.20 -0.01 0.99 7.94 -1.26 -4.56 117.00 127.30 2of7 n LEU 18 Ca 0.00 -5.07 0.03 0.00 -1.11 0.00 0.00 56.01 49.86 2of7 n LEU 18 Cb 0.00 -1.04 -0.07 0.00 0.53 0.00 0.00 43.42 42.83 2of7 n LEU 18 CO 0.00 1.90 -0.65 -1.14 -1.11 0.00 0.00 177.39 176.40 2of7 n ARG 19 N -0.37 0.74 0.17 1.96 0.63 -1.26 -3.09 116.66 115.45 2of7 n ARG 19 Ca 0.50 -0.07 0.13 0.00 -0.92 0.00 0.00 57.85 57.49 2of7 n ARG 19 Cb 0.27 -1.22 0.28 0.00 0.45 0.00 0.00 32.46 32.24 2of7 n ARG 19 CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 2of7 h GLU 20 N 0.00 0.00 -0.00 -0.14 4.22 -2.00 -2.81 114.58 113.85 2of7 h GLU 20 Ca -0.05 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.39 2of7 h GLU 20 Cb 0.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.90 2of7 h GLU 20 CO 0.00 0.00 -0.27 -2.13 -2.18 0.00 0.00 179.01 174.43 2of7 n ARG 21 N -2.75 2.91 -0.04 1.92 0.63 -1.26 -3.17 116.66 114.90 2of7 n ARG 21 Ca 0.05 -0.36 -0.16 0.00 -0.92 0.00 0.00 57.85 56.45 2of7 n ARG 21 Cb 0.48 -1.00 -0.06 0.00 0.45 0.00 0.00 32.46 32.33 2of7 n ARG 21 CO 0.00 0.00 0.00 1.57 -2.51 0.00 0.00 177.63 176.69 2of7 h LYS 22 N 0.63 0.82 -0.23 -0.14 5.09 -1.65 -2.90 116.57 118.19 2of7 h LYS 22 Ca 0.00 -0.61 0.05 0.00 0.09 0.00 0.00 60.65 60.18 2of7 h LYS 22 Cb 0.27 0.11 -0.07 0.00 0.10 0.00 0.00 32.23 32.63 2of7 h LYS 22 CO 0.00 1.23 -0.46 -0.22 -2.09 0.00 0.00 179.45 177.91 2of7 h LYS 23 N 0.58 -0.44 -0.21 0.07 3.64 -1.66 -1.27 116.57 117.28 2of7 h LYS 23 Ca -0.03 0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.33 2of7 h LYS 23 Cb 1.31 0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 33.22 2of7 h LYS 23 CO 0.15 -0.30 -0.07 1.79 -2.27 0.00 0.00 179.45 178.75 2of7 h THR 24 N -0.46 1.30 -0.08 1.00 1.35 -1.66 -1.70 112.91 112.65 2of7 h THR 24 Ca 0.08 -1.10 0.02 0.00 -0.55 0.00 0.00 66.41 64.87 2of7 h THR 24 Cb 0.63 1.59 -0.00 0.00 -1.73 0.00 0.00 68.15 68.63 2of7 h THR 24 CO -0.48 0.33 0.28 0.03 -0.25 0.00 0.00 175.52 175.44 2of7 h ARG 25 N 0.12 0.00 0.09 4.72 2.47 -1.32 0.49 114.38 120.96 2of7 h ARG 25 Ca 0.05 0.00 -0.36 0.00 -1.26 0.00 0.00 59.98 58.41 2of7 h ARG 25 Cb 0.54 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 28.83 2of7 h ARG 25 CO 0.02 0.00 -2.05 -2.37 0.56 0.00 0.00 179.97 176.13 2of7 n THR 26 N -3.16 1.71 -0.19 2.04 5.66 -0.49 -2.73 114.28 117.12 2of7 n THR 26 Ca -0.00 -0.66 -0.00 0.00 -3.05 0.00 0.00 64.05 60.33 2of7 n THR 26 Cb 0.36 -1.58 0.08 0.00 -1.55 0.00 0.00 70.33 67.63 2of7 n THR 26 CO 0.00 0.00 0.00 0.03 -3.05 0.00 0.00 175.07 172.05 2of7 h ARG 27 N 0.05 0.09 -0.25 1.09 3.08 -0.65 -0.84 114.38 116.95 2of7 h ARG 27 Ca -0.44 -0.01 -0.08 0.00 0.07 0.00 0.00 59.98 59.53 2of7 h ARG 27 Cb 2.02 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 32.03 2of7 h ARG 27 CO 0.06 0.06 -0.18 0.93 -1.07 0.00 0.00 179.97 179.76 2of7 h GLU 28 N 0.09 0.44 -0.03 0.04 5.08 -1.03 -0.88 114.58 118.29 2of7 h GLU 28 Ca 0.29 -0.14 -0.21 0.00 -1.00 0.00 0.00 59.36 58.31 2of7 h GLU 28 Cb 0.46 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.67 2of7 h GLU 28 CO -0.51 0.61 -0.86 0.00 -1.00 0.00 0.00 179.01 177.25 2of7 h ALA 29 N 1.41 0.47 -0.45 3.43 0.00 -1.25 -0.64 119.26 122.22 2of7 h ALA 29 Ca 0.07 -0.67 -0.05 0.00 0.00 0.00 0.00 54.91 54.25 2of7 h ALA 29 Cb 0.55 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 2of7 h ALA 29 CO 0.04 0.81 0.08 0.82 0.00 0.00 0.00 179.25 181.00 2of7 h ILE 30 N 0.23 1.24 -0.03 0.00 2.04 -1.05 -1.28 117.51 118.67 2of7 h ILE 30 Ca -0.06 -0.88 0.02 0.00 1.00 0.00 0.00 64.86 64.95 2of7 h ILE 30 Cb 1.47 0.94 -0.03 0.00 -0.74 0.00 0.00 36.82 38.47 2of7 h ILE 30 CO 0.15 0.31 -0.11 0.03 0.00 0.00 0.00 178.15 178.52 2of7 h ARG 31 N 0.61 -0.18 -0.48 2.37 3.08 -1.08 -2.41 114.38 116.30 2of7 h ARG 31 Ca 0.14 0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.17 2of7 h ARG 31 Cb 0.37 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.44 2of7 h ARG 31 CO 0.01 -0.12 0.19 0.00 -1.07 0.00 0.00 179.97 178.98 2of7 h ALA 32 N 0.81 0.63 0.10 0.04 0.00 -1.11 -2.17 119.26 117.55 2of7 h ALA 32 Ca 0.05 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2of7 h ALA 32 Cb 0.25 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2of7 h ALA 32 CO -0.13 0.24 -0.23 0.00 0.00 0.00 0.00 179.25 179.12 2of7 h ALA 33 N 1.04 -0.80 -0.47 0.00 0.00 -1.15 0.61 119.26 118.48 2of7 h ALA 33 Ca 0.16 -0.06 0.10 0.00 0.00 0.00 0.00 54.91 55.11 2of7 h ALA 33 Cb 0.20 0.60 -0.09 0.00 0.00 0.00 0.00 17.79 18.50 2of7 h ALA 33 CO -0.01 -0.85 -0.17 1.15 0.00 0.00 0.00 179.25 179.37 2of7 h THR 34 N -0.36 0.44 -0.01 0.00 2.02 -1.46 0.47 112.91 114.00 2of7 h THR 34 Ca -0.01 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.20 2of7 h THR 34 Cb 0.35 0.44 -0.05 0.00 -1.74 0.00 0.00 68.15 67.15 2of7 h THR 34 CO -0.10 0.00 -0.33 1.88 0.37 0.00 0.00 175.52 177.34 2of7 h TYR 35 N -0.06 -0.90 -0.70 3.16 0.05 -1.39 -1.54 116.97 115.58 2of7 h TYR 35 Ca 0.23 0.03 0.15 0.00 0.05 0.00 0.00 58.73 59.18 2of7 h TYR 35 Cb 0.41 0.40 -0.13 0.00 1.01 0.00 0.00 36.73 38.42 2of7 h TYR 35 CO -0.45 -0.42 -0.12 0.78 -1.05 0.00 0.00 178.16 176.91 2of7 h GLY 36 N -0.47 0.60 2.00 3.88 0.00 0.61 -1.67 103.07 108.01 2of7 h GLY 36 Ca 0.06 0.19 -0.08 0.00 0.00 0.00 0.00 47.33 47.51 2of7 h GLY 36 CO -0.28 -0.27 -0.36 1.41 0.00 0.00 0.00 176.54 177.04 2of7 h LEU 37 N 0.03 0.00 -0.03 3.11 3.38 0.15 -3.15 115.31 118.81 2of7 h LEU 37 Ca 0.35 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.20 2of7 h LEU 37 Cb 0.57 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.32 2of7 h LEU 37 CO -0.69 0.36 -0.45 0.40 0.09 0.00 0.00 178.44 178.15 2of7 h ILE 38 N 0.00 1.45 -0.17 1.22 2.04 -0.35 -0.30 117.51 121.39 2of7 h ILE 38 Ca -0.00 -1.95 0.03 0.00 1.00 0.00 0.00 64.86 63.94 2of7 h ILE 38 Cb 0.72 2.54 -0.06 0.00 -0.74 0.00 0.00 36.82 39.28 2of7 h ILE 38 CO 0.05 0.56 -0.48 0.03 0.00 0.00 0.00 178.15 178.30 2of7 h ARG 39 N -0.19 -0.46 -0.30 2.37 3.08 -1.52 0.18 114.38 117.54 2of7 h ARG 39 Ca -0.05 0.03 0.01 0.00 0.07 0.00 0.00 59.98 60.05 2of7 h ARG 39 Cb 1.15 0.10 -0.02 0.00 0.08 0.00 0.00 29.97 31.28 2of7 h ARG 39 CO 0.09 -0.31 0.17 1.96 -1.07 0.00 0.00 179.97 180.81 2of7 h GLN 40 N -0.48 0.33 0.00 0.04 4.20 -1.58 -3.38 115.11 114.24 2of7 h GLN 40 Ca 0.04 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.73 2of7 h GLN 40 Cb 0.59 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.29 2of7 h GLN 40 CO -0.42 0.22 0.00 1.04 -0.67 0.00 0.00 178.83 179.00 2of7 n GLN 41 N -4.93 0.86 0.00 1.46 6.02 -0.13 -5.12 117.38 115.54 2of7 n GLN 41 Ca -0.01 -0.80 0.00 0.00 -0.01 0.00 0.00 57.00 56.19 2of7 n GLN 41 Cb 0.06 -0.81 0.00 0.00 1.02 0.00 0.00 30.24 30.50 2of7 n GLN 41 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2of7 n GLY 42 N -0.19 -1.48 0.25 1.08 0.00 0.60 -4.18 105.19 101.27 2of7 n GLY 42 Ca 0.00 -1.57 -0.11 0.00 0.00 0.00 0.00 46.02 44.34 2of7 n GLY 42 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2of7 h TYR 43 N 0.00 -0.51 0.00 1.61 3.20 -1.90 -3.25 116.97 116.13 2of7 h TYR 43 Ca 0.00 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.82 2of7 h TYR 43 Cb 0.00 0.17 -0.00 0.00 1.54 0.00 0.00 36.73 38.43 2of7 h TYR 43 CO 0.00 -0.21 -0.16 1.49 -1.64 0.00 0.00 178.16 177.64 2of7 h GLU 44 N -1.04 0.00 0.00 1.82 4.57 -1.98 0.49 114.58 118.44 2of7 h GLU 44 Ca -0.06 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 2of7 h GLU 44 Cb 0.53 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.12 2of7 h GLU 44 CO 0.09 0.16 0.00 0.00 -1.18 0.00 0.00 179.01 178.09 2of7 n ALA 45 N -2.33 1.51 -2.68 2.92 0.00 -1.25 -4.51 120.51 114.17 2of7 n ALA 45 Ca -0.02 0.03 -0.43 0.00 0.00 0.00 0.00 53.44 53.02 2of7 n ALA 45 Cb 0.27 -1.26 -0.04 0.00 0.00 0.00 0.00 19.45 18.42 2of7 n ALA 45 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2of7 s THR 46 N -3.16 4.42 0.00 0.00 2.01 0.17 -5.01 115.64 114.07 2of7 s THR 46 Ca 0.04 0.15 -0.13 0.00 0.31 0.00 0.00 61.69 62.07 2of7 s THR 46 Cb 0.08 -4.54 -0.05 0.00 0.01 0.00 0.00 72.50 67.99 2of7 s THR 46 CO 0.26 -1.13 0.37 0.42 -0.69 0.00 0.00 174.62 173.85 2of7 s THR 47 N 3.87 5.10 0.29 -0.82 -4.23 -1.26 -5.00 115.64 113.58 2of7 s THR 47 Ca 0.28 0.68 0.00 0.00 -1.18 0.00 0.00 61.69 61.48 2of7 s THR 47 Cb -0.13 -3.66 0.35 0.00 1.34 0.00 0.00 72.50 70.39 2of7 s THR 47 CO 0.18 0.53 1.61 1.62 -0.54 0.00 0.00 174.62 178.01 2of7 h VAL 48 N 3.57 0.19 -0.28 2.29 3.04 -1.98 0.16 116.25 123.24 2of7 h VAL 48 Ca -0.52 -0.03 0.07 0.00 -1.01 0.00 0.00 66.70 65.21 2of7 h VAL 48 Cb 1.22 0.09 -0.07 0.00 -2.01 0.00 0.00 31.29 30.51 2of7 h VAL 48 CO 0.62 0.02 -0.24 -0.33 -1.01 0.00 0.00 177.57 176.63 2of7 h GLU 49 N 0.09 -0.22 -1.00 4.17 3.07 -1.94 0.17 114.58 118.92 2of7 h GLU 49 Ca 0.55 0.01 0.08 0.00 -0.50 0.00 0.00 59.36 59.51 2of7 h GLU 49 Cb 1.10 0.05 -0.07 0.00 -0.84 0.00 0.00 28.75 28.99 2of7 h GLU 49 CO -0.77 -0.15 0.64 1.96 -1.40 0.00 0.00 179.01 179.29 2of7 h GLN 50 N -0.23 1.08 -0.04 2.33 4.20 -1.46 -2.95 115.11 118.04 2of7 h GLN 50 Ca 0.15 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.79 2of7 h GLN 50 Cb 0.46 -0.24 -0.00 0.00 0.30 0.00 0.00 27.48 27.99 2of7 h GLN 50 CO -0.41 0.72 0.02 0.82 -0.67 0.00 0.00 178.83 179.31 2of7 h ILE 51 N 1.12 1.13 -0.06 2.54 2.04 0.73 -2.72 117.51 122.29 2of7 h ILE 51 Ca 0.45 -0.38 0.03 0.00 1.00 0.00 0.00 64.86 65.96 2of7 h ILE 51 Cb 0.27 1.30 -0.06 0.00 -0.74 0.00 0.00 36.82 37.59 2of7 h ILE 51 CO -0.20 0.11 -0.51 0.00 0.00 0.00 0.00 178.15 177.54 2of7 h ALA 52 N 0.87 -0.85 -0.65 1.87 0.00 -0.66 -1.28 119.26 118.56 2of7 h ALA 52 Ca 0.01 -0.06 0.14 0.00 0.00 0.00 0.00 54.91 55.00 2of7 h ALA 52 Cb 0.15 0.93 -0.10 0.00 0.00 0.00 0.00 17.79 18.76 2of7 h ALA 52 CO -0.00 -1.06 0.05 1.49 0.00 0.00 0.00 179.25 179.73 2of7 h GLU 53 N -0.61 0.16 -0.00 0.00 4.81 -1.51 0.87 114.58 118.29 2of7 h GLU 53 Ca 0.03 -0.01 -0.15 0.00 -0.13 0.00 0.00 59.36 59.10 2of7 h GLU 53 Cb 0.69 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.02 2of7 h GLU 53 CO -0.39 0.10 -0.72 -0.09 -0.73 0.00 0.00 179.01 177.19 2of7 h ARG 54 N 0.16 0.01 0.00 1.92 2.43 -1.34 -1.74 114.38 115.83 2of7 h ARG 54 Ca 0.35 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.50 2of7 h ARG 54 Cb 0.57 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.12 2of7 h ARG 54 CO -0.52 0.73 -0.24 0.00 -1.51 0.00 0.00 179.97 178.43 2of7 n ALA 55 N -2.41 2.64 -3.15 2.80 0.00 0.07 -4.89 120.51 115.57 2of7 n ALA 55 Ca -0.01 -0.15 -0.04 0.00 0.00 0.00 0.00 53.44 53.24 2of7 n ALA 55 Cb 0.70 -1.34 0.01 0.00 0.00 0.00 0.00 19.45 18.82 2of7 n ALA 55 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2of7 n GLU 56 N -1.95 -1.44 -3.54 0.00 0.28 0.28 -4.84 120.64 109.43 2of7 n GLU 56 Ca 0.05 1.35 -0.14 0.00 -0.16 0.00 0.00 57.16 58.26 2of7 n GLU 56 Cb 0.40 -5.46 -0.05 0.00 1.43 0.00 0.00 31.44 27.76 2of7 n GLU 56 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 2of7 s VAL 57 N -3.05 0.00 0.38 3.84 1.01 -0.88 -5.03 120.40 116.66 2of7 s VAL 57 Ca 0.06 0.00 -0.26 0.00 0.00 0.00 0.00 61.98 61.79 2of7 s VAL 57 Cb -0.01 -1.00 -0.09 0.00 0.00 0.00 0.00 36.38 35.28 2of7 s VAL 57 CO 0.76 0.00 1.11 -0.94 0.00 0.00 0.00 175.10 176.03 2of7 s SER 58 N -1.25 6.75 0.63 3.32 1.04 -1.26 -3.98 113.70 118.95 2of7 s SER 58 Ca -0.06 2.22 0.23 0.00 0.48 0.00 0.00 55.95 58.82 2of7 s SER 58 Cb -0.00 -2.61 1.07 0.00 0.10 0.00 0.00 66.02 64.58 2of7 s SER 58 CO 0.05 -0.50 1.57 -0.65 0.98 0.00 0.00 173.24 174.68 2of7 h PRO 59 N 2.82 0.00 0.00 4.02 0.11 -1.92 -2.43 132.00 134.60 2of7 h PRO 59 Ca -0.48 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.55 2of7 h PRO 59 Cb 1.22 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.32 2of7 h PRO 59 CO 0.63 0.00 -2.07 -1.13 -0.21 0.00 0.00 178.00 175.22 2of7 n SER 60 N -3.14 0.06 -0.14 -2.05 3.41 -1.26 -2.91 113.62 107.59 2of7 n SER 60 Ca 0.08 0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.62 2of7 n SER 60 Cb 0.89 1.77 0.01 0.00 -0.26 0.00 0.00 64.21 66.62 2of7 n SER 60 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2of7 h THR 61 N 0.00 1.09 0.82 6.66 2.02 -1.84 -1.23 112.91 120.43 2of7 h THR 61 Ca -0.12 -0.20 -0.04 0.00 0.77 0.00 0.00 66.41 66.83 2of7 h THR 61 Cb 1.26 0.47 -0.00 0.00 -1.74 0.00 0.00 68.15 68.14 2of7 h THR 61 CO 0.01 0.10 -0.49 0.58 0.37 0.00 0.00 175.52 176.09 2of7 h VAL 62 N 0.57 0.02 -0.76 3.16 2.07 -1.52 -2.00 116.25 117.79 2of7 h VAL 62 Ca 0.16 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.84 2of7 h VAL 62 Cb -0.04 0.02 -0.14 0.00 -1.52 0.00 0.00 31.29 29.60 2of7 h VAL 62 CO -0.05 0.00 -0.20 -0.07 0.02 0.00 0.00 177.57 177.27 2of7 h LEU 63 N -1.22 -0.75 -1.78 2.57 4.07 -1.60 0.94 115.31 117.54 2of7 h LEU 63 Ca -0.11 0.23 -0.03 0.00 0.08 0.00 0.00 57.88 58.05 2of7 h LEU 63 Cb 0.97 0.49 -0.00 0.00 1.08 0.00 0.00 40.66 43.19 2of7 h LEU 63 CO 0.12 -0.26 -0.16 -0.09 -1.08 0.00 0.00 178.44 176.98 2of7 h ARG 64 N -0.01 0.00 0.08 1.13 2.43 -1.09 -2.52 114.38 114.40 2of7 h ARG 64 Ca 0.36 0.00 -0.35 0.00 -0.81 0.00 0.00 59.98 59.18 2of7 h ARG 64 Cb 0.56 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.08 2of7 h ARG 64 CO -0.79 0.16 -1.96 0.66 -1.51 0.00 0.00 179.97 176.53 2of7 n TYR 65 N -4.03 1.08 -3.62 2.20 4.01 0.16 -4.85 117.16 112.11 2of7 n TYR 65 Ca -0.02 0.27 -0.29 0.00 -0.16 0.00 0.00 57.90 57.69 2of7 n TYR 65 Cb 0.24 -1.16 -0.15 0.00 -0.31 0.00 0.00 39.34 37.97 2of7 n TYR 65 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 2of7 s PHE 66 N -2.57 0.98 0.20 -0.72 0.08 0.30 -5.02 117.98 111.23 2of7 s PHE 66 Ca -0.18 -1.36 -0.11 0.00 0.12 0.00 0.00 56.93 55.40 2of7 s PHE 66 Cb 0.07 -1.27 0.24 0.00 -0.57 0.00 0.00 43.02 41.49 2of7 s PHE 66 CO 0.78 -0.85 1.72 -1.35 -0.10 0.00 0.00 175.22 175.42 2of7 h PRO 67 N 8.06 0.29 -5.97 0.24 0.11 -1.75 -3.34 132.00 129.65 2of7 h PRO 67 Ca -0.14 -0.02 -0.55 0.00 0.11 0.00 0.00 66.00 65.41 2of7 h PRO 67 Cb 1.00 -0.07 -0.14 0.00 0.11 0.00 0.00 31.00 31.90 2of7 h PRO 67 CO 0.44 0.19 -0.75 0.95 -0.21 0.00 0.00 178.00 178.62 2of7 s THR 68 N -6.12 2.17 0.62 -1.15 -4.23 -1.26 -4.88 115.64 100.80 2of7 s THR 68 Ca -0.13 -2.30 0.40 0.00 -1.18 0.00 0.00 61.69 58.47 2of7 s THR 68 Cb 0.16 -2.18 0.42 0.00 1.34 0.00 0.00 72.50 72.24 2of7 s THR 68 CO 0.74 -0.46 2.32 0.03 -0.54 0.00 0.00 174.62 176.71 2of7 h ARG 69 N 2.45 0.00 -0.16 3.99 3.08 -2.00 0.09 114.38 121.82 2of7 h ARG 69 Ca -0.40 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.57 2of7 h ARG 69 Cb 1.24 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.28 2of7 h ARG 69 CO 0.60 0.00 -0.28 0.93 -1.07 0.00 0.00 179.97 180.16 2of7 h GLU 70 N 0.00 0.31 -0.22 0.04 3.07 -1.96 -2.56 114.58 113.26 2of7 h GLU 70 Ca -0.00 -0.11 -0.15 0.00 -0.50 0.00 0.00 59.36 58.60 2of7 h GLU 70 Cb 0.03 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 27.91 2of7 h GLU 70 CO 0.00 0.56 -0.47 -0.44 -1.40 0.00 0.00 179.01 177.27 2of7 h ASP 71 N 0.27 0.62 -0.18 1.42 3.32 -1.32 -1.55 116.42 119.00 2of7 h ASP 71 Ca 0.04 -0.30 -0.01 0.00 0.02 0.00 0.00 57.03 56.78 2of7 h ASP 71 Cb 0.64 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.01 2of7 h ASP 71 CO 0.05 0.99 0.06 0.40 -1.72 0.00 0.00 179.24 179.02 2of7 h ILE 72 N 0.46 1.18 -0.61 0.35 2.04 -1.53 -2.74 117.51 116.65 2of7 h ILE 72 Ca 0.03 -0.56 0.09 0.00 1.00 0.00 0.00 64.86 65.41 2of7 h ILE 72 Cb 0.99 1.22 -0.07 0.00 -0.74 0.00 0.00 36.82 38.23 2of7 h ILE 72 CO 0.09 0.17 0.24 0.58 0.00 0.00 0.00 178.15 179.24 2of7 h VAL 73 N 0.11 0.79 -1.78 1.67 2.07 -1.27 -2.79 116.25 115.05 2of7 h VAL 73 Ca 0.06 -0.15 -0.71 0.00 0.82 0.00 0.00 66.70 66.72 2of7 h VAL 73 Cb 0.22 0.32 -0.25 0.00 -1.52 0.00 0.00 31.29 30.06 2of7 h VAL 73 CO -0.00 0.08 0.93 0.18 0.02 0.00 0.00 177.57 178.78 2of7 n LEU 74 N -4.97 7.34 -0.08 2.57 7.99 -0.60 -4.54 117.00 124.70 2of7 n LEU 74 Ca 0.09 -4.66 -0.11 0.00 -0.01 0.00 0.00 56.01 51.31 2of7 n LEU 74 Cb 0.26 -1.10 -0.06 0.00 -0.11 0.00 0.00 43.42 42.42 2of7 n LEU 74 CO 0.23 1.74 -0.37 0.74 -1.51 0.00 0.00 177.39 178.22 2of7 h THR 75 N 1.96 0.42 -1.24 -5.08 2.02 -1.20 -3.38 112.91 106.41 2of7 h THR 75 Ca 0.54 -1.51 -0.33 0.00 0.77 0.00 0.00 66.41 65.88 2of7 h THR 75 Cb 0.18 0.99 -0.01 0.00 -1.74 0.00 0.00 68.15 67.58 2of7 h THR 75 CO 1.33 0.14 1.03 -0.62 0.37 0.00 0.00 175.52 177.78 2of7 s ASP 76 N -6.18 4.56 0.00 4.18 -1.08 -1.26 -4.84 116.67 112.04 2of7 s ASP 76 Ca -0.20 0.42 0.26 0.00 -0.52 0.00 0.00 52.55 52.51 2of7 s ASP 76 Cb 0.03 -2.53 0.67 0.00 -1.46 0.00 0.00 42.92 39.63 2of7 s ASP 76 CO 0.37 -3.02 1.52 -0.62 0.52 0.00 0.00 175.17 173.93 2of7 n GLU 77 N 8.98 0.20 0.00 4.34 1.02 -1.26 -5.02 120.64 128.90 2of7 n GLU 77 Ca 0.36 -0.11 0.00 0.00 -0.02 0.00 0.00 57.16 57.39 2of7 n GLU 77 Cb 0.50 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.42 2of7 n GLU 77 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2of7 n TYR 78 N -1.30 0.00 0.15 -0.32 4.01 -1.26 -4.74 117.16 113.69 2of7 n TYR 78 Ca 0.07 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.67 2of7 n TYR 78 Cb 0.33 0.00 -0.09 0.00 -0.31 0.00 0.00 39.34 39.28 2of7 n TYR 78 CO 0.00 0.00 0.00 0.22 -0.46 0.00 0.00 176.86 176.62 2of7 h ASP 79 N 0.00 -1.32 -0.45 7.72 1.82 -1.95 -1.86 116.42 120.38 2of7 h ASP 79 Ca 0.00 0.13 0.01 0.00 -0.39 0.00 0.00 57.03 56.78 2of7 h ASP 79 Cb 0.00 0.47 -0.02 0.00 0.68 0.00 0.00 39.33 40.46 2of7 h ASP 79 CO 0.00 -0.51 0.30 1.55 -1.61 0.00 0.00 179.24 178.96 2of7 h PRO 80 N -0.72 0.55 -1.00 0.28 0.13 -1.99 0.70 132.00 129.95 2of7 h PRO 80 Ca -0.02 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 2of7 h PRO 80 Cb 0.69 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 31.69 2of7 h PRO 80 CO -0.19 0.36 0.00 1.33 -0.23 0.00 0.00 178.00 179.27 2of7 n VAL 81 N -4.47 0.42 0.00 1.56 0.24 -0.70 -1.77 118.33 113.60 2of7 n VAL 81 Ca 0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.34 2of7 n VAL 81 Cb 0.09 -0.67 0.00 0.00 -1.47 0.00 0.00 33.84 31.79 2of7 n VAL 81 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2of7 n ALA 83 N 0.32 0.00 -0.19 2.33 0.00 0.24 -1.99 120.51 121.22 2of7 n ALA 83 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2of7 n ALA 83 Cb 0.32 0.00 0.10 0.00 0.00 0.00 0.00 19.45 19.86 2of7 n ALA 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2of7 h ALA 84 N 0.00 0.65 -0.99 0.00 0.00 -1.59 0.61 119.26 117.94 2of7 h ALA 84 Ca 0.00 0.14 0.20 0.00 0.00 0.00 0.00 54.91 55.25 2of7 h ALA 84 Cb 0.00 0.21 -0.10 0.00 0.00 0.00 0.00 17.79 17.91 2of7 h ALA 84 CO 0.00 -0.34 0.61 1.49 0.00 0.00 0.00 179.25 181.02 2of7 h GLU 85 N 0.21 0.66 0.21 0.00 4.57 -1.64 -1.31 114.58 117.29 2of7 h GLU 85 Ca 0.30 -0.04 -0.28 0.00 -1.18 0.00 0.00 59.36 58.16 2of7 h GLU 85 Cb 0.46 -0.15 0.03 0.00 -0.16 0.00 0.00 28.75 28.93 2of7 h GLU 85 CO -0.42 0.44 -1.24 1.25 -1.18 0.00 0.00 179.01 177.86 2of7 h LEU 86 N 0.68 0.69 0.46 1.64 5.85 -1.01 -3.30 115.31 120.33 2of7 h LEU 86 Ca 0.56 -0.93 -0.02 0.00 0.84 0.00 0.00 57.88 58.32 2of7 h LEU 86 Cb 0.98 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.79 2of7 h LEU 86 CO -0.33 1.60 -0.22 0.00 -0.34 0.00 0.00 178.44 179.14 2of7 h ALA 87 N 0.12 -0.61 0.00 1.25 0.00 0.32 -2.77 119.26 117.57 2of7 h ALA 87 Ca -0.22 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 2of7 h ALA 87 Cb 1.96 0.24 -0.00 0.00 0.00 0.00 0.00 17.79 19.99 2of7 h ALA 87 CO 0.22 -0.83 0.01 0.00 0.00 0.00 0.00 179.25 178.66 2of7 n ALA 88 N -2.37 2.57 0.13 0.00 0.00 -0.51 -4.34 120.51 115.99 2of7 n ALA 88 Ca -0.11 -0.07 -0.01 0.00 0.00 0.00 0.00 53.44 53.25 2of7 n ALA 88 Cb 0.26 -1.66 0.25 0.00 0.00 0.00 0.00 19.45 18.30 2of7 n ALA 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2of7 h ARG 89 N 2.98 0.10 -0.33 0.00 2.47 -1.56 -3.46 114.38 114.58 2of7 h ARG 89 Ca 0.01 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.67 2of7 h ARG 89 Cb 0.42 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.74 2of7 h ARG 89 CO 0.04 0.55 0.00 -0.35 0.56 0.00 0.00 179.97 180.77 2of7 n PRO 90 N -3.98 1.23 -1.67 0.04 -0.04 -1.26 -4.91 135.00 124.41 2of7 n PRO 90 Ca -0.02 -0.28 -0.50 0.00 -0.04 0.00 0.00 63.50 62.67 2of7 n PRO 90 Cb 0.50 -1.21 -0.05 0.00 -0.04 0.00 0.00 33.50 32.70 2of7 n PRO 90 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2of7 n ALA 91 N -0.18 0.57 0.00 0.55 0.00 -1.26 -4.61 120.51 115.58 2of7 n ALA 91 Ca 0.03 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.84 2of7 n ALA 91 Cb 0.14 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.24 2of7 n ALA 91 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2of7 n GLY 92 N 3.84 0.00 3.75 0.00 0.00 -1.26 -4.74 105.19 106.78 2of7 n GLY 92 Ca 0.21 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 2of7 n GLY 92 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2of7 s GLU 93 N 0.00 4.71 1.01 1.61 2.12 -1.26 -5.04 118.70 121.85 2of7 s GLU 93 Ca 0.00 1.62 -0.19 0.00 0.36 0.00 0.00 54.97 56.76 2of7 s GLU 93 Cb 0.00 -3.27 -0.06 0.00 0.26 0.00 0.00 34.13 31.06 2of7 s GLU 93 CO 0.00 0.27 -0.50 -2.30 -0.54 0.00 0.00 175.26 172.19 2of7 n PRO 94 N 1.88 -0.42 0.11 4.30 -0.01 -1.26 -4.82 135.00 134.77 2of7 n PRO 94 Ca 0.00 -0.11 -0.13 0.00 -0.01 0.00 0.00 63.50 63.25 2of7 n PRO 94 Cb 0.47 -1.37 -0.08 0.00 -0.01 0.00 0.00 33.50 32.51 2of7 n PRO 94 CO 0.00 0.00 0.00 2.35 -0.01 0.00 0.00 175.50 177.84 2of7 h TRP 95 N -1.37 -0.26 -1.22 6.00 2.91 -1.96 -3.10 115.95 116.95 2of7 h TRP 95 Ca -0.45 -0.01 0.38 0.00 1.13 0.00 0.00 58.89 59.94 2of7 h TRP 95 Cb 1.33 0.09 -0.11 0.00 -0.51 0.00 0.00 29.16 29.95 2of7 h TRP 95 CO 0.19 0.07 0.79 0.77 -1.03 0.00 0.00 178.44 179.24 2of7 h SER 96 N -0.62 0.30 0.83 2.65 0.02 -1.99 -1.26 113.55 113.48 2of7 h SER 96 Ca -0.03 0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 61.03 2of7 h SER 96 Cb 0.45 0.08 -0.00 0.00 0.14 0.00 0.00 62.40 63.07 2of7 h SER 96 CO 0.05 -0.09 -1.17 0.47 -1.14 0.00 0.00 176.83 174.95 2of7 n ASP 97 N -4.65 0.72 0.05 3.07 8.00 -1.24 -1.91 116.55 120.59 2of7 n ASP 97 Ca 0.33 0.28 -0.13 0.00 0.71 0.00 0.00 54.79 55.98 2of7 n ASP 97 Cb 1.24 0.68 -0.02 0.00 -0.02 0.00 0.00 41.12 42.99 2of7 n ASP 97 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2of7 h SER 98 N 0.00 0.55 0.77 -2.24 0.02 -1.18 -1.62 113.55 109.85 2of7 h SER 98 Ca -0.01 -0.41 -0.19 0.00 -0.84 0.00 0.00 61.79 60.34 2of7 h SER 98 Cb 1.02 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 63.37 2of7 h SER 98 CO 0.00 1.19 -0.89 0.25 -1.14 0.00 0.00 176.83 176.24 2of7 h LEU 99 N 0.27 0.10 0.04 5.07 5.85 -1.37 -0.11 115.31 125.16 2of7 h LEU 99 Ca -0.06 -0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.57 2of7 h LEU 99 Cb 1.48 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.48 2of7 h LEU 99 CO 0.15 0.94 -0.02 -0.09 -0.34 0.00 0.00 178.44 179.08 2of7 h ARG 100 N 0.04 -0.05 -0.07 1.25 2.43 -1.44 -2.50 114.38 114.03 2of7 h ARG 100 Ca -0.03 0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.16 2of7 h ARG 100 Cb 1.55 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 31.10 2of7 h ARG 100 CO 0.12 0.51 -0.11 1.25 -1.51 0.00 0.00 179.97 180.23 2of7 h HIS 101 N -0.65 -0.33 -0.13 2.20 2.76 -1.22 -2.28 115.15 115.48 2of7 h HIS 101 Ca -0.01 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.19 2of7 h HIS 101 Cb 0.58 0.15 -0.01 0.00 1.55 0.00 0.00 27.41 29.69 2of7 h HIS 101 CO 0.12 -0.10 0.09 -0.39 -1.30 0.00 0.00 177.93 176.35 2of7 h VAL 102 N -0.08 1.02 0.10 5.26 -1.51 -1.06 -2.27 116.25 117.71 2of7 h VAL 102 Ca 0.01 -0.06 -0.26 0.00 -1.23 0.00 0.00 66.70 65.16 2of7 h VAL 102 Cb 0.12 0.84 0.01 0.00 -2.13 0.00 0.00 31.29 30.13 2of7 h VAL 102 CO -0.11 0.03 -1.17 0.25 -1.23 0.00 0.00 177.57 175.34 2of7 h LEU 103 N 0.17 0.48 -0.45 4.19 5.85 -1.30 -2.06 115.31 122.18 2of7 h LEU 103 Ca 0.05 -0.47 -0.04 0.00 0.84 0.00 0.00 57.88 58.25 2of7 h LEU 103 Cb 0.00 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 40.86 2of7 h LEU 103 CO -0.01 1.34 0.11 0.03 -0.34 0.00 0.00 178.44 179.57 2of7 h ARG 104 N 0.12 0.72 -0.01 1.25 3.08 -1.17 -2.46 114.38 115.91 2of7 h ARG 104 Ca -0.13 -0.17 -0.00 0.00 0.07 0.00 0.00 59.98 59.75 2of7 h ARG 104 Cb 1.87 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 31.83 2of7 h ARG 104 CO 0.20 0.72 -0.01 -0.22 -1.07 0.00 0.00 179.97 179.58 2of7 h LYS 105 N 0.60 0.02 -0.90 0.04 1.63 -1.47 0.42 116.57 116.92 2of7 h LYS 105 Ca 0.14 -0.01 0.21 0.00 -0.85 0.00 0.00 60.65 60.14 2of7 h LYS 105 Cb 0.32 0.00 -0.06 0.00 -0.60 0.00 0.00 32.23 31.88 2of7 h LYS 105 CO 0.00 0.51 0.60 0.00 -3.45 0.00 0.00 179.45 177.11 2of7 h ALA 106 N 0.52 2.27 0.00 5.00 0.00 -1.39 -2.57 119.26 123.09 2of7 h ALA 106 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2of7 h ALA 106 Cb 0.50 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2of7 h ALA 106 CO 0.00 -0.56 -0.68 -0.07 0.00 0.00 0.00 179.25 177.95 2of7 h LEU 107 N 0.36 0.00 0.00 0.00 3.38 -1.35 -3.48 115.31 114.22 2of7 h LEU 107 Ca 0.46 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.40 2of7 h LEU 107 Cb 1.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.98 2of7 h LEU 107 CO -0.16 0.02 0.00 0.61 0.09 0.00 0.00 178.44 179.00 2of7 n GLY 108 N 1.19 1.82 3.74 0.83 0.00 -0.59 -3.93 105.19 108.25 2of7 n GLY 108 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 2of7 n GLY 108 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2of7 s LEU 109 N 0.00 4.40 0.00 0.99 1.43 0.14 -4.57 118.68 121.07 2of7 s LEU 109 Ca 0.00 1.29 0.00 0.00 -1.03 0.00 0.00 54.13 54.39 2of7 s LEU 109 Cb 0.00 -3.10 0.00 0.00 0.03 0.00 0.00 46.19 43.12 2of7 s LEU 109 CO 0.00 -0.00 0.00 0.61 0.23 0.00 0.00 176.35 177.19 2of7 n GLY 110 N 2.63 4.07 3.60 -3.19 0.00 -1.26 -4.25 105.19 106.79 2of7 n GLY 110 Ca -0.03 -1.55 -0.30 0.00 0.00 0.00 0.00 46.02 44.15 2of7 n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2of7 s ALA 111 N -2.18 0.58 0.00 4.61 0.00 -1.26 -4.73 121.76 118.79 2of7 s ALA 111 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 51.96 52.13 2of7 s ALA 111 Cb 0.00 -3.32 0.00 0.00 0.00 0.00 0.00 23.12 19.80 2of7 s ALA 111 CO 0.00 -3.20 0.00 0.41 0.00 0.00 0.00 175.76 172.97 2of7 n GLY 112 N 0.28 2.85 0.91 0.00 0.00 -1.26 -4.49 105.19 103.49 2of7 n GLY 112 Ca 0.07 -1.61 0.12 0.00 0.00 0.00 0.00 46.02 44.60 2of7 n GLY 112 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2of7 n GLU 113 N 0.79 2.24 -0.02 1.61 4.71 -1.26 -3.38 120.64 125.33 2of7 n GLU 113 Ca 0.00 -1.82 -0.16 0.00 -0.01 0.00 0.00 57.16 55.17 2of7 n GLU 113 Cb 0.00 -1.47 -0.09 0.00 -1.01 0.00 0.00 31.44 28.86 2of7 n GLU 113 CO 0.00 0.00 0.00 1.49 0.09 0.00 0.00 177.13 178.71 2of7 h GLU 114 N 4.13 0.45 -0.95 3.49 4.81 -1.96 -2.76 114.58 121.78 2of7 h GLU 114 Ca 0.00 -0.40 0.14 0.00 -0.13 0.00 0.00 59.36 58.98 2of7 h GLU 114 Cb 0.89 0.09 -0.08 0.00 0.63 0.00 0.00 28.75 30.28 2of7 h GLU 114 CO 0.00 1.04 0.60 0.00 -0.73 0.00 0.00 179.01 179.92 2of7 h ALA 115 N 0.42 1.72 -0.41 2.92 0.00 -1.78 -2.61 119.26 119.51 2of7 h ALA 115 Ca -0.04 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 2of7 h ALA 115 Cb 1.16 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 2of7 h ALA 115 CO 0.10 0.02 -0.01 1.49 0.00 0.00 0.00 179.25 180.85 2of7 h GLU 116 N 0.80 0.66 -0.18 0.00 4.81 -1.54 0.01 114.58 119.14 2of7 h GLU 116 Ca 0.48 -0.17 -0.14 0.00 -0.13 0.00 0.00 59.36 59.41 2of7 h GLU 116 Cb 0.68 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.98 2of7 h GLU 116 CO -0.25 0.69 -0.43 1.25 -0.73 0.00 0.00 179.01 179.55 2of7 h LEU 117 N 0.62 0.69 -0.39 1.64 5.85 -1.41 -3.10 115.31 119.21 2of7 h LEU 117 Ca 0.13 -0.57 0.03 0.00 0.84 0.00 0.00 57.88 58.31 2of7 h LEU 117 Cb 0.41 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.21 2of7 h LEU 117 CO 0.02 1.13 0.18 0.40 -0.34 0.00 0.00 178.44 179.83 2of7 h ILE 118 N 0.28 0.96 -0.77 4.05 2.04 -1.16 -1.95 117.51 120.96 2of7 h ILE 118 Ca -0.00 -0.13 0.22 0.00 1.00 0.00 0.00 64.86 65.95 2of7 h ILE 118 Cb 1.04 0.55 -0.03 0.00 -0.74 0.00 0.00 36.82 37.64 2of7 h ILE 118 CO 0.09 0.07 0.64 0.03 0.00 0.00 0.00 178.15 178.99 2of7 h ARG 119 N 0.38 0.00 0.06 2.37 3.08 -0.98 0.68 114.38 119.97 2of7 h ARG 119 Ca 0.17 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 59.97 2of7 h ARG 119 Cb 0.09 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.16 2of7 h ARG 119 CO -0.13 0.00 -0.99 1.25 -1.07 0.00 0.00 179.97 179.04 2of7 h LEU 120 N 0.00 0.76 -0.94 3.04 6.46 -1.29 -1.64 115.31 121.70 2of7 h LEU 120 Ca 0.37 -0.80 -0.03 0.00 -0.12 0.00 0.00 57.88 57.30 2of7 h LEU 120 Cb 1.65 -0.24 -0.04 0.00 -0.73 0.00 0.00 40.66 41.31 2of7 h LEU 120 CO -0.00 1.47 0.39 -0.09 -0.62 0.00 0.00 178.44 179.59 2of7 h ARG 121 N 0.14 1.15 -0.52 1.25 2.43 -0.91 0.00 114.38 117.92 2of7 h ARG 121 Ca -0.14 -0.16 0.04 0.00 -0.81 0.00 0.00 59.98 58.91 2of7 h ARG 121 Cb 1.68 -0.21 -0.04 0.00 -0.42 0.00 0.00 29.97 30.98 2of7 h ARG 121 CO 0.19 0.88 0.28 1.15 -1.51 0.00 0.00 179.97 180.96 2of7 h THR 122 N 1.14 0.98 -0.42 0.20 2.02 -0.57 -1.36 112.91 114.92 2of7 h THR 122 Ca 0.28 -0.19 -0.05 0.00 0.77 0.00 0.00 66.41 67.22 2of7 h THR 122 Cb 0.10 0.39 -0.02 0.00 -1.74 0.00 0.00 68.15 66.89 2of7 h THR 122 CO -0.04 0.10 0.07 0.03 0.37 0.00 0.00 175.52 176.05 2of7 h ARG 123 N 0.54 0.69 -0.23 6.66 2.47 -0.97 -2.91 114.38 120.64 2of7 h ARG 123 Ca 0.22 -0.19 0.03 0.00 -1.26 0.00 0.00 59.98 58.79 2of7 h ARG 123 Cb 0.11 -0.08 -0.03 0.00 -1.65 0.00 0.00 29.97 28.31 2of7 h ARG 123 CO -0.14 0.73 0.02 -0.07 0.56 0.00 0.00 179.97 181.07 2of7 h LEU 124 N 0.55 -0.05 -0.90 3.04 3.38 -0.79 0.13 115.31 120.67 2of7 h LEU 124 Ca 0.13 0.04 0.21 0.00 0.09 0.00 0.00 57.88 58.35 2of7 h LEU 124 Cb 0.38 0.07 -0.17 0.00 0.09 0.00 0.00 40.66 41.03 2of7 h LEU 124 CO 0.01 0.00 -0.12 -0.11 0.09 0.00 0.00 178.44 178.31 2of7 n LEU 125 N -5.12 -0.23 0.08 1.67 7.94 -0.53 -0.57 117.00 120.23 2of7 n LEU 125 Ca -0.02 1.54 -0.16 0.00 -1.11 0.00 0.00 56.01 56.26 2of7 n LEU 125 Cb 0.11 -0.50 -0.08 0.00 0.53 0.00 0.00 43.42 43.47 2of7 n LEU 125 CO 0.26 -1.51 0.08 0.00 -1.11 0.00 0.00 177.39 175.11 2of7 h ALA 126 N 1.80 0.22 0.00 1.96 0.00 -1.10 -3.38 119.26 118.75 2of7 h ALA 126 Ca 0.48 -0.75 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2of7 h ALA 126 Cb 0.85 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2of7 h ALA 126 CO -0.89 0.80 -0.65 0.39 0.00 0.00 0.00 179.25 178.89 2of7 n GLU 127 N -3.73 0.30 -3.83 0.00 -0.58 0.36 -4.75 120.64 108.40 2of7 n GLU 127 Ca -0.09 0.08 -0.30 0.00 -0.42 0.00 0.00 57.16 56.43 2of7 n GLU 127 Cb 0.90 -1.68 -0.15 0.00 -0.57 0.00 0.00 31.44 29.94 2of7 n GLU 127 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2of7 s VAL 128 N -3.17 1.34 0.29 2.62 1.01 0.26 -4.95 120.40 117.80 2of7 s VAL 128 Ca 0.06 -1.70 0.04 0.00 0.00 0.00 0.00 61.98 60.38 2of7 s VAL 128 Cb 0.13 -2.00 0.06 0.00 0.00 0.00 0.00 36.38 34.57 2of7 s VAL 128 CO 0.73 -0.64 1.72 -0.65 0.00 0.00 0.00 175.10 176.26 2of7 h PRO 129 N 7.93 0.39 -0.96 2.72 0.11 -1.85 1.02 132.00 141.36 2of7 h PRO 129 Ca -0.11 -0.16 0.17 0.00 0.11 0.00 0.00 66.00 66.02 2of7 h PRO 129 Cb 1.02 -0.02 -0.17 0.00 0.11 0.00 0.00 31.00 31.94 2of7 h PRO 129 CO 0.49 0.66 -0.30 0.00 -0.21 0.00 0.00 178.00 178.63 2of7 h ALA 130 N 1.34 0.43 -0.10 -0.75 0.00 -1.95 13.25 119.26 131.48 2of7 h ALA 130 Ca 0.05 0.33 -0.02 0.00 0.00 0.00 0.00 54.91 55.27 2of7 h ALA 130 Cb 0.71 0.84 -0.00 0.00 0.00 0.00 0.00 17.79 19.34 2of7 h ALA 130 CO 0.05 -0.49 -0.00 0.28 0.00 0.00 0.00 179.25 179.10 2of7 h VAL 131 N -0.01 1.25 -0.58 0.00 2.07 -1.49 -1.20 116.25 116.29 2of7 h VAL 131 Ca 0.41 -0.80 -0.11 0.00 0.82 0.00 0.00 66.70 67.02 2of7 h VAL 131 Cb 0.66 1.60 -0.02 0.00 -1.52 0.00 0.00 31.29 32.01 2of7 h VAL 131 CO -0.98 0.23 -0.06 -0.09 0.02 0.00 0.00 177.57 176.69 2of7 h ARG 132 N -0.11 1.06 -0.40 1.57 2.43 0.20 -2.92 114.38 116.22 2of7 h ARG 132 Ca 0.03 -0.37 0.08 0.00 -0.81 0.00 0.00 59.98 58.91 2of7 h ARG 132 Cb 0.35 -0.08 -0.09 0.00 -0.42 0.00 0.00 29.97 29.73 2of7 h ARG 132 CO 0.01 1.07 -0.33 0.00 -1.51 0.00 0.00 179.97 179.21 2of7 h ALA 133 N 0.96 -0.18 0.00 2.80 0.00 2.98 -0.01 119.26 125.81 2of7 h ALA 133 Ca 0.16 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2of7 h ALA 133 Cb 0.63 0.71 0.00 0.00 0.00 0.00 0.00 17.79 19.13 2of7 h ALA 133 CO 0.04 -0.73 0.00 -2.13 0.00 0.00 0.00 179.25 176.43 2of7 n ARG 134 N -5.42 0.38 0.00 0.00 3.00 -0.46 -0.82 116.66 113.35 2of7 n ARG 134 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.86 2of7 n ARG 134 Cb 0.34 -1.31 0.00 0.00 0.00 0.00 0.00 32.46 31.49 2of7 n ARG 134 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 2of7 n LEU 136 N 1.29 0.00 -0.10 6.15 4.32 -0.02 0.24 117.00 128.88 2of7 n LEU 136 Ca 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 56.01 55.90 2of7 n LEU 136 Cb 0.19 0.00 -0.01 0.00 -1.62 0.00 0.00 43.42 41.98 2of7 n LEU 136 CO 0.00 0.00 1.00 -0.08 -1.22 0.00 0.00 177.39 177.09 2of7 h GLU 137 N 0.00 0.44 -0.79 3.23 4.81 -1.23 -3.16 114.58 117.87 2of7 h GLU 137 Ca 0.00 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 2of7 h GLU 137 Cb 0.00 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.28 2of7 h GLU 137 CO 0.00 0.31 0.00 0.09 -0.73 0.00 0.00 179.01 178.68 2of7 n ASN 138 N -4.84 0.00 0.00 1.04 4.13 0.14 -3.57 115.26 112.15 2of7 n ASN 138 Ca -0.01 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.25 2of7 n ASN 138 Cb 0.03 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.27 2of7 n ASN 138 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30 2of7 n SER 140 N 0.41 0.00 -0.12 6.41 2.88 -1.20 -3.06 113.62 118.95 2of7 n SER 140 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2of7 n SER 140 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2of7 n SER 140 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2of7 n ASP 141 N 0.00 0.00 0.00 -3.46 -0.08 -1.23 -4.59 116.55 107.18 2of7 n ASP 141 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 2of7 n ASP 141 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 2of7 n ASP 141 CO 0.00 0.00 0.00 1.07 0.12 0.00 0.00 177.20 178.39 2of7 n THR 142 N -0.03 0.00 -0.05 5.18 5.66 -1.17 -5.00 114.28 118.87 2of7 n THR 142 Ca 0.00 0.00 -0.05 0.00 -3.05 0.00 0.00 64.05 60.95 2of7 n THR 142 Cb 0.00 0.00 -0.08 0.00 -1.55 0.00 0.00 70.33 68.70 2of7 n THR 142 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2of7 n GLY 143 N 0.00 -0.49 2.49 1.09 0.00 -1.26 -5.03 105.19 101.99 2of7 n GLY 143 Ca 0.00 -0.17 -0.08 0.00 0.00 0.00 0.00 46.02 45.77 2of7 n GLY 143 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2of7 n ARG 144 N -2.41 -1.26 0.00 1.61 1.74 -1.26 -5.00 116.66 110.09 2of7 n ARG 144 Ca -0.17 0.51 0.00 0.00 -0.77 0.00 0.00 57.85 57.42 2of7 n ARG 144 Cb 0.83 -3.96 0.00 0.00 -1.02 0.00 0.00 32.46 28.31 2of7 n ARG 144 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2of7 n LEU 146 N -2.45 0.00 -0.33 0.55 0.00 -1.26 -0.30 117.00 113.21 2of7 n LEU 146 Ca -0.04 0.00 0.11 0.00 0.00 0.00 0.00 56.01 56.08 2of7 n LEU 146 Cb 0.57 0.00 0.32 0.00 0.00 0.00 0.00 43.42 44.30 2of7 n LEU 146 CO 0.33 0.00 1.22 0.00 0.00 0.00 0.00 177.39 178.94 2of7 h ALA 147 N 0.00 1.69 -0.20 1.96 0.00 -1.93 -1.01 119.26 119.77 2of7 h ALA 147 Ca 0.00 0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.81 2of7 h ALA 147 Cb 0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2of7 h ALA 147 CO 0.00 0.02 -0.47 0.00 0.00 0.00 0.00 179.25 178.80 2of7 h ARG 148 N 0.81 0.51 0.00 0.00 3.08 -0.88 -2.18 114.38 115.72 2of7 h ARG 148 Ca 0.52 -0.28 -0.10 0.00 0.07 0.00 0.00 59.98 60.18 2of7 h ARG 148 Cb 0.73 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.79 2of7 h ARG 148 CO -0.29 0.87 -0.47 0.00 -1.07 0.00 0.00 179.97 179.01 2of7 h ALA 149 N 1.08 0.93 -0.26 0.04 0.00 -1.64 -2.34 119.26 117.07 2of7 h ALA 149 Ca 0.02 -0.43 -0.19 0.00 0.00 0.00 0.00 54.91 54.32 2of7 h ALA 149 Cb 0.97 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2of7 h ALA 149 CO 0.09 0.59 -0.57 0.82 0.00 0.00 0.00 179.25 180.17 2of7 h ILE 150 N 0.00 1.28 0.08 0.00 2.04 -1.04 -3.07 117.51 116.80 2of7 h ILE 150 Ca -0.00 -1.76 -0.00 0.00 1.00 0.00 0.00 64.86 64.09 2of7 h ILE 150 Cb 1.03 1.72 0.00 0.00 -0.74 0.00 0.00 36.82 38.83 2of7 h ILE 150 CO 0.06 0.57 -0.04 0.00 0.00 0.00 0.00 178.15 178.74 2of7 h ALA 151 N 0.65 -0.11 -0.49 1.87 0.00 -1.16 -1.43 119.26 118.59 2of7 h ALA 151 Ca 0.00 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.94 2of7 h ALA 151 Cb 1.19 0.04 -0.08 0.00 0.00 0.00 0.00 17.79 18.94 2of7 h ALA 151 CO 0.13 -0.56 -0.51 -0.44 0.00 0.00 0.00 179.25 177.87 2of7 h ASP 152 N -0.12 -1.73 -0.02 0.00 3.32 -1.46 3.23 116.42 119.64 2of7 h ASP 152 Ca -0.01 0.24 0.00 0.00 0.02 0.00 0.00 57.03 57.28 2of7 h ASP 152 Cb 0.09 0.73 0.00 0.00 0.22 0.00 0.00 39.33 40.36 2of7 h ASP 152 CO 0.02 -0.32 0.00 -2.11 -1.72 0.00 0.00 179.24 175.11 2of7 n ARG 153 N -5.07 1.05 0.00 3.56 1.85 -1.12 -2.12 116.66 114.80 2of7 n ARG 153 Ca -0.02 -0.07 0.00 0.00 -1.00 0.00 0.00 57.85 56.76 2of7 n ARG 153 Cb 0.29 -1.13 0.00 0.00 -1.05 0.00 0.00 32.46 30.57 2of7 n ARG 153 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 2of7 n THR 154 N -0.56 0.00 -0.34 8.89 -2.24 -0.55 -4.98 114.28 114.50 2of7 n THR 154 Ca 0.06 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 2of7 n THR 154 Cb 0.04 0.53 0.00 0.00 -2.10 0.00 0.00 70.33 68.80 2of7 n THR 154 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2of7 n GLY 155 N 2.13 1.88 3.32 3.38 0.00 1.07 -5.03 105.19 111.94 2of7 n GLY 155 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 2of7 n GLY 155 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2of7 n LEU 156 N 0.00 -1.54 -4.64 0.99 4.32 -1.15 -4.87 117.00 110.11 2of7 n LEU 156 Ca 0.00 0.24 -0.42 0.00 -0.02 0.00 0.00 56.01 55.81 2of7 n LEU 156 Cb 0.00 -1.08 -0.03 0.00 -1.62 0.00 0.00 43.42 40.69 2of7 n LEU 156 CO 0.00 -3.96 1.58 -0.62 -1.22 0.00 0.00 177.39 173.18 2of7 s ASP 157 N -1.80 6.21 0.56 -1.43 2.15 -1.26 -4.72 116.67 116.38 2of7 s ASP 157 Ca 0.53 2.17 0.26 0.00 0.43 0.00 0.00 52.55 55.94 2of7 s ASP 157 Cb -0.19 -2.53 1.49 0.00 -0.30 0.00 0.00 42.92 41.39 2of7 s ASP 157 CO 0.70 -1.32 2.04 1.55 -0.17 0.00 0.00 175.17 177.98 2of7 h PRO 158 N 11.63 0.00 -0.26 4.34 0.13 -1.89 -2.05 132.00 143.90 2of7 h PRO 158 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 2of7 h PRO 158 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2of7 h PRO 158 CO 0.96 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.48 2of7 n ASP 159 N -4.12 2.68 -4.90 1.44 8.00 -1.26 -4.48 116.55 113.92 2of7 n ASP 159 Ca 0.05 -1.97 -0.29 0.00 0.71 0.00 0.00 54.79 53.29 2of7 n ASP 159 Cb 0.45 -0.17 0.07 0.00 -0.02 0.00 0.00 41.12 41.44 2of7 n ASP 159 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2of7 s GLY 160 N -0.99 1.61 0.18 0.44 0.00 -0.77 -4.99 107.32 102.81 2of7 s GLY 160 Ca 0.18 -0.58 -0.13 0.00 0.00 0.00 0.00 44.72 44.19 2of7 s GLY 160 CO 0.12 -0.15 1.84 -2.00 0.00 0.00 0.00 173.10 172.91 2of7 h LEU 161 N -0.82 0.63 -1.28 0.66 5.85 -1.96 -3.30 115.31 115.08 2of7 h LEU 161 Ca -0.45 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.20 2of7 h LEU 161 Cb 1.30 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.17 2of7 h LEU 161 CO 0.64 0.45 -0.07 -0.33 -0.34 0.00 0.00 178.44 178.79 2of7 h GLU 162 N 0.75 0.41 0.00 1.25 3.07 -1.94 -1.09 114.58 117.02 2of7 h GLU 162 Ca 0.22 -0.09 -0.16 0.00 -0.50 0.00 0.00 59.36 58.83 2of7 h GLU 162 Cb -0.05 -0.06 -0.03 0.00 -0.84 0.00 0.00 28.75 27.78 2of7 h GLU 162 CO -0.06 0.49 -1.02 -0.24 -1.40 0.00 0.00 179.01 176.77 2of7 h VAL 163 N 0.39 0.84 -0.22 3.13 3.04 -1.83 -2.35 116.25 119.25 2of7 h VAL 163 Ca 0.08 -2.34 -0.15 0.00 -1.01 0.00 0.00 66.70 63.28 2of7 h VAL 163 Cb 0.37 2.33 0.00 0.00 -2.01 0.00 0.00 31.29 31.98 2of7 h VAL 163 CO 0.02 0.48 -0.46 0.03 -1.01 0.00 0.00 177.57 176.62 2of7 h ARG 164 N 0.00 0.70 0.64 4.17 3.08 -1.40 -1.82 114.38 119.75 2of7 h ARG 164 Ca -0.09 -0.46 -0.02 0.00 0.07 0.00 0.00 59.98 59.48 2of7 h ARG 164 Cb 1.56 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 31.67 2of7 h ARG 164 CO 0.07 1.08 -0.45 0.82 -1.07 0.00 0.00 179.97 180.42 2of7 h ILE 165 N 0.41 0.10 -0.41 2.04 2.04 -1.19 -3.10 117.51 117.41 2of7 h ILE 165 Ca 0.00 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.95 2of7 h ILE 165 Cb 1.07 0.10 -0.08 0.00 -0.74 0.00 0.00 36.82 37.17 2of7 h ILE 165 CO 0.10 0.00 -0.12 0.58 0.00 0.00 0.00 178.15 178.71 2of7 h VAL 166 N -1.04 0.56 0.00 1.67 2.07 -1.50 -0.59 116.25 117.41 2of7 h VAL 166 Ca -0.08 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.44 2of7 h VAL 166 Cb 0.86 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 2of7 h VAL 166 CO 0.05 0.00 0.00 -0.24 0.02 0.00 0.00 177.57 177.40 2of7 n SER 167 N -5.32 0.00 0.00 0.57 2.88 -0.69 -1.58 113.62 109.48 2of7 n SER 167 Ca 0.02 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.56 2of7 n SER 167 Cb 0.24 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.70 2of7 n SER 167 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2of7 n SER 169 N 0.76 0.00 -0.03 -3.46 2.88 -0.23 -1.39 113.62 112.15 2of7 n SER 169 Ca 0.00 0.00 -0.21 0.00 -1.33 0.00 0.00 58.87 57.33 2of7 n SER 169 Cb 0.00 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.33 2of7 n SER 169 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 2of7 h LEU 170 N 0.00 0.25 -0.96 2.46 3.38 -1.55 -0.96 115.31 117.93 2of7 h LEU 170 Ca 0.00 -0.78 0.16 0.00 0.09 0.00 0.00 57.88 57.35 2of7 h LEU 170 Cb 0.00 -0.08 -0.10 0.00 0.09 0.00 0.00 40.66 40.57 2of7 h LEU 170 CO 0.00 1.58 0.57 0.58 0.09 0.00 0.00 178.44 181.26 2of7 h VAL 171 N -0.50 0.77 0.00 1.22 2.07 -1.50 0.59 116.25 118.89 2of7 h VAL 171 Ca -0.32 -0.27 -0.03 0.00 0.82 0.00 0.00 66.70 66.90 2of7 h VAL 171 Cb 1.62 -0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 31.30 2of7 h VAL 171 CO -0.02 0.14 -0.25 1.23 0.02 0.00 0.00 177.57 178.69 2of7 h GLY 172 N 0.78 0.00 0.90 2.17 0.00 -1.80 -3.11 103.07 102.02 2of7 h GLY 172 Ca 0.53 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.81 2of7 h GLY 172 CO -0.35 0.00 0.03 -1.33 0.00 0.00 0.00 176.54 174.89 2of7 h GLY 173 N 3.86 0.62 -1.91 4.60 0.00 -0.58 -0.91 103.07 108.75 2of7 h GLY 173 Ca -0.01 -0.43 0.00 0.00 0.00 0.00 0.00 47.33 46.89 2of7 h GLY 173 CO 0.02 0.40 0.00 1.47 0.00 0.00 0.00 176.54 178.43 2of7 n LEU 174 N -4.56 0.98 0.00 3.11 -0.00 0.15 -1.42 117.00 115.26 2of7 n LEU 174 Ca -0.02 -0.49 0.00 0.00 -0.00 0.00 0.00 56.01 55.50 2of7 n LEU 174 Cb 0.24 -0.17 0.00 0.00 -0.00 0.00 0.00 43.42 43.49 2of7 n LEU 174 CO 0.39 0.17 0.00 -0.62 -0.00 0.00 0.00 177.39 177.32 2of7 n GLU 176 N 0.78 0.00 -0.19 1.47 -0.58 -0.35 -2.08 120.64 119.68 2of7 n GLU 176 Ca 0.00 0.00 -0.09 0.00 -0.42 0.00 0.00 57.16 56.65 2of7 n GLU 176 Cb 0.17 0.00 0.02 0.00 -0.57 0.00 0.00 31.44 31.05 2of7 n GLU 176 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 2of7 h VAL 177 N 0.00 1.26 -0.14 2.62 2.07 -1.51 0.35 116.25 120.90 2of7 h VAL 177 Ca 0.00 -1.08 -0.22 0.00 0.82 0.00 0.00 66.70 66.22 2of7 h VAL 177 Cb 0.00 0.86 0.01 0.00 -1.52 0.00 0.00 31.29 30.65 2of7 h VAL 177 CO 0.00 0.39 -0.76 0.77 0.02 0.00 0.00 177.57 177.99 2of7 h SER 178 N 0.85 0.91 -0.74 0.57 4.64 -1.67 0.31 113.55 118.41 2of7 h SER 178 Ca 0.16 -0.63 0.05 0.00 -0.47 0.00 0.00 61.79 60.90 2of7 h SER 178 Cb 0.51 -0.27 -0.05 0.00 -0.31 0.00 0.00 62.40 62.27 2of7 h SER 178 CO 0.02 1.40 0.45 0.03 -0.87 0.00 0.00 176.83 177.86 2of7 h ARG 179 N 0.49 0.82 -0.20 4.77 2.47 -1.81 -2.68 114.38 118.23 2of7 h ARG 179 Ca -0.05 -0.05 -0.11 0.00 -1.26 0.00 0.00 59.98 58.50 2of7 h ARG 179 Cb 1.39 -0.18 -0.00 0.00 -1.65 0.00 0.00 29.97 29.53 2of7 h ARG 179 CO 0.16 0.54 -0.31 -0.92 0.56 0.00 0.00 179.97 179.99 2of7 h TYR 180 N 0.84 0.70 -0.41 3.04 3.20 -0.41 -3.01 116.97 120.92 2of7 h TYR 180 Ca 0.32 -0.24 0.08 0.00 3.14 0.00 0.00 58.73 62.03 2of7 h TYR 180 Cb 0.12 -0.14 -0.08 0.00 1.54 0.00 0.00 36.73 38.18 2of7 h TYR 180 CO -0.05 0.96 -0.11 2.35 -1.64 0.00 0.00 178.16 179.68 2of7 h TRP 181 N 0.24 -0.23 -0.40 -3.82 7.01 -0.43 0.67 115.95 118.98 2of7 h TRP 181 Ca 0.02 0.04 0.12 0.00 2.11 0.00 0.00 58.89 61.17 2of7 h TRP 181 Cb 0.90 0.17 -0.02 0.00 -2.10 0.00 0.00 29.16 28.11 2of7 h TRP 181 CO 0.09 -0.18 0.31 0.00 -2.79 0.00 0.00 178.44 175.86 2of7 h ALA 182 N 1.40 2.32 0.00 2.65 0.00 -1.34 0.39 119.26 124.68 2of7 h ALA 182 Ca 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2of7 h ALA 182 Cb 0.31 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2of7 h ALA 182 CO -0.43 -0.52 -1.27 0.39 0.00 0.00 0.00 179.25 177.42 2of7 n GLU 183 N -4.29 0.50 0.00 0.00 1.02 -0.73 -4.44 120.64 112.70 2of7 n GLU 183 Ca 0.07 -0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.20 2of7 n GLU 183 Cb 0.50 -1.66 0.00 0.00 -0.02 0.00 0.00 31.44 30.26 2of7 n GLU 183 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2of7 n HIS 184 N -2.30 0.00 -0.46 -0.32 8.25 0.15 -4.81 115.22 115.74 2of7 n HIS 184 Ca -0.00 -0.34 0.38 0.00 -0.26 0.00 0.00 57.72 57.50 2of7 n HIS 184 Cb 0.51 -0.03 0.66 0.00 1.12 0.00 0.00 29.99 32.25 2of7 n HIS 184 CO 0.00 0.00 0.00 0.38 0.64 0.00 0.00 176.34 177.36 2of7 h ASP 185 N 0.00 0.22 0.87 0.41 3.04 -0.36 0.98 116.42 121.58 2of7 h ASP 185 Ca 0.00 0.15 0.00 0.00 -3.24 0.00 0.00 57.03 53.94 2of7 h ASP 185 Cb 0.50 0.14 0.00 0.00 -1.04 0.00 0.00 39.33 38.93 2of7 h ASP 185 CO 0.00 -0.22 0.00 1.12 -2.04 0.00 0.00 179.24 178.10 2of7 h HIS 186 N 0.05 0.00 0.00 4.15 2.07 -1.87 -3.23 115.15 116.33 2of7 h HIS 186 Ca 0.85 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.37 2of7 h HIS 186 Cb 2.70 0.00 0.00 0.00 2.57 0.00 0.00 27.41 32.68 2of7 h HIS 186 CO -0.01 0.00 -0.68 -0.85 -3.07 0.00 0.00 177.93 173.32 2of7 n GLU 187 N -2.31 2.03 -3.84 5.12 0.28 -0.18 -5.03 120.64 116.70 2of7 n GLU 187 Ca 0.03 0.00 -0.12 0.00 -0.16 0.00 0.00 57.16 56.90 2of7 n GLU 187 Cb 0.27 -0.84 -0.14 0.00 1.43 0.00 0.00 31.44 32.16 2of7 n GLU 187 CO 0.00 0.00 0.00 -1.21 -0.16 0.00 0.00 177.13 175.76 2of7 s GLU 188 N -1.40 0.05 0.62 3.44 2.02 0.16 -5.14 118.70 118.45 2of7 s GLU 188 Ca 0.00 0.09 -0.05 0.00 0.02 0.00 0.00 54.97 55.03 2of7 s GLU 188 Cb 0.00 0.00 0.03 0.00 0.10 0.00 0.00 34.13 34.26 2of7 s GLU 188 CO 0.00 -0.03 0.92 -1.54 0.02 0.00 0.00 175.26 174.63 2of7 s SER 189 N 0.15 5.28 0.15 -0.19 1.04 -1.26 -3.85 113.70 115.02 2of7 s SER 189 Ca -0.01 0.52 -0.14 0.00 0.48 0.00 0.00 55.95 56.80 2of7 s SER 189 Cb -0.02 -1.38 0.04 0.00 0.10 0.00 0.00 66.02 64.76 2of7 s SER 189 CO -0.00 -1.26 1.73 0.25 0.98 0.00 0.00 173.24 174.94 2of7 h LEU 190 N -0.28 0.65 -0.75 2.42 5.85 -1.96 -2.53 115.31 118.70 2of7 h LEU 190 Ca -0.45 -0.13 0.07 0.00 0.84 0.00 0.00 57.88 58.21 2of7 h LEU 190 Cb 1.28 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 42.08 2of7 h LEU 190 CO 0.59 0.60 0.43 0.00 -0.34 0.00 0.00 178.44 179.72 2of7 h ALA 191 N 1.08 1.04 0.00 1.25 0.00 -1.99 0.03 119.26 120.66 2of7 h ALA 191 Ca 0.17 0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.91 2of7 h ALA 191 Cb 0.12 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2of7 h ALA 191 CO -0.02 0.10 -0.89 1.05 0.00 0.00 0.00 179.25 179.49 2of7 h GLU 192 N 0.76 0.00 -0.16 0.00 4.11 -1.85 -2.74 114.58 114.71 2of7 h GLU 192 Ca 0.35 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.77 2of7 h GLU 192 Cb 0.25 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 2of7 h GLU 192 CO -0.21 0.86 0.06 -0.07 0.07 0.00 0.00 179.01 179.73 2of7 h LEU 193 N 0.00 0.22 -0.99 3.06 3.38 -1.46 0.45 115.31 119.97 2of7 h LEU 193 Ca -0.02 -0.16 0.14 0.00 0.09 0.00 0.00 57.88 57.93 2of7 h LEU 193 Cb 1.68 -0.06 -0.09 0.00 0.09 0.00 0.00 40.66 42.28 2of7 h LEU 193 CO 0.11 0.32 0.61 0.58 0.09 0.00 0.00 178.44 180.16 2of7 h VAL 194 N 0.11 0.86 -0.46 1.22 2.07 -0.92 0.74 116.25 119.86 2of7 h VAL 194 Ca 0.05 -0.31 -0.11 0.00 0.82 0.00 0.00 66.70 67.15 2of7 h VAL 194 Cb 0.17 -0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 29.79 2of7 h VAL 194 CO -0.00 0.17 -0.14 0.44 0.02 0.00 0.00 177.57 178.05 2of7 h ASP 195 N 0.91 0.93 0.06 0.57 3.45 -1.12 0.13 116.42 121.35 2of7 h ASP 195 Ca 0.51 -0.37 -0.00 0.00 0.43 0.00 0.00 57.03 57.60 2of7 h ASP 195 Cb 0.59 -0.25 0.00 0.00 -0.56 0.00 0.00 39.33 39.11 2of7 h ASP 195 CO -0.30 1.09 -0.03 0.03 -1.57 0.00 0.00 179.24 178.46 2of7 h ARG 196 N 0.76 -0.08 -0.15 3.56 3.08 -0.64 -1.67 114.38 119.23 2of7 h ARG 196 Ca 0.11 0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.22 2of7 h ARG 196 Cb 0.70 0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.72 2of7 h ARG 196 CO 0.05 0.05 -0.17 0.00 -1.07 0.00 0.00 179.97 178.83 2of7 h ALA 197 N 0.75 -0.08 -0.46 0.04 0.00 -0.66 -1.35 119.26 117.49 2of7 h ALA 197 Ca -0.01 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 2of7 h ALA 197 Cb 0.16 0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 2of7 h ALA 197 CO 0.01 -0.62 0.28 -0.07 0.00 0.00 0.00 179.25 178.86 2of7 h LEU 198 N -0.20 0.55 -0.52 0.00 3.38 -0.66 -1.08 115.31 116.79 2of7 h LEU 198 Ca 0.11 -0.05 0.09 0.00 0.09 0.00 0.00 57.88 58.11 2of7 h LEU 198 Cb 0.36 -0.14 -0.07 0.00 0.09 0.00 0.00 40.66 40.90 2of7 h LEU 198 CO -0.28 0.44 0.11 0.44 0.09 0.00 0.00 178.44 179.24 2of7 h ASP 199 N 0.61 0.01 -0.73 -0.43 3.32 -1.14 -0.99 116.42 117.06 2of7 h ASP 199 Ca 0.16 0.09 -0.07 0.00 0.02 0.00 0.00 57.03 57.24 2of7 h ASP 199 Cb -0.01 0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.64 2of7 h ASP 199 CO -0.03 0.03 0.20 0.00 -1.72 0.00 0.00 179.24 177.72 2of7 h ALA 200 N 1.41 0.96 -0.03 3.45 0.00 -0.68 0.67 119.26 125.04 2of7 h ALA 200 Ca 0.26 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 2of7 h ALA 200 Cb 0.36 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2of7 h ALA 200 CO -0.34 0.67 -0.37 -0.07 0.00 0.00 0.00 179.25 179.14 2of7 h LEU 201 N 1.10 0.05 0.00 0.00 3.38 -0.92 -0.43 115.31 118.49 2of7 h LEU 201 Ca 0.23 -0.02 -0.28 0.00 0.09 0.00 0.00 57.88 57.91 2of7 h LEU 201 Cb 0.35 -0.01 -0.05 0.00 0.09 0.00 0.00 40.66 41.04 2of7 h LEU 201 CO -0.00 0.42 -1.72 -0.62 0.09 0.00 0.00 178.44 176.61 2of7 n GLU 202 N -4.09 0.63 0.00 1.13 1.02 -0.40 -4.69 120.64 114.24 2of7 n GLU 202 Ca -0.02 0.26 0.00 0.00 -0.02 0.00 0.00 57.16 57.38 2of7 n GLU 202 Cb 0.42 -1.77 0.00 0.00 -0.02 0.00 0.00 31.44 30.06 2of7 n GLU 202 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2of7 n ASN 203 N -2.99 0.21 0.13 1.62 3.02 0.20 -5.03 115.26 112.43 2of7 n ASN 203 Ca -0.17 -0.61 -0.06 0.00 -0.03 0.00 0.00 54.58 53.71 2of7 n ASN 203 Cb 1.03 0.21 -0.03 0.00 -0.61 0.00 0.00 39.78 40.37 2of7 n ASN 203 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 2of7 h GLY 204 N 0.00 -0.42 -6.81 7.41 0.00 -1.16 -3.34 103.07 98.75 2of7 h GLY 204 Ca 0.00 0.15 -0.56 0.00 0.00 0.00 0.00 47.33 46.92 2of7 h GLY 204 CO 0.00 -0.15 1.03 1.08 0.00 0.00 0.00 176.54 178.50 2of7 s LEU 205 N -8.14 3.57 0.00 3.11 1.02 -1.26 -4.86 118.68 112.12 2of7 s LEU 205 Ca -0.06 0.61 0.00 0.00 0.02 0.00 0.00 54.13 54.70 2of7 s LEU 205 Cb 0.01 -3.46 0.00 0.00 0.02 0.00 0.00 46.19 42.75 2of7 s LEU 205 CO 0.17 -1.42 0.00 -2.65 0.02 0.00 0.00 176.35 172.47 2of7 n PRO 206 N 8.11 -0.15 0.00 1.29 -0.02 -1.26 -5.09 135.00 137.89 2of7 n PRO 206 Ca 0.14 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 2of7 n PRO 206 Cb 0.49 -0.49 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 2of7 n PRO 206 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48