#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kph s ASN 18 N 0.00 6.92 0.00 1.08 -0.87 -1.26 -4.73 114.94 116.07 3kph s ASN 18 Ca 0.00 1.61 0.00 0.00 -1.57 0.00 0.00 52.86 52.90 3kph s ASN 18 Cb 0.00 -2.54 0.00 0.00 -0.02 0.00 0.00 41.25 38.69 3kph s ASN 18 CO 0.00 -0.80 0.00 -0.11 -2.57 0.00 0.00 177.10 173.62 3kph n LEU 19 N 6.73 0.00 0.00 0.60 7.94 -1.26 -4.95 117.00 126.06 3kph n LEU 19 Ca 0.14 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.04 3kph n LEU 19 Cb 0.45 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.40 3kph n LEU 19 CO 0.56 0.00 0.00 0.59 -1.11 0.00 0.00 177.39 177.43 3kph n ASN 20 N 0.00 0.00 -0.73 1.96 3.02 -1.26 -4.95 115.26 113.29 3kph n ASN 20 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 3kph n ASN 20 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 3kph n ASN 20 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3kph n ASN 21 N 0.00 0.89 -0.02 6.41 5.15 -1.26 -2.53 115.26 123.91 3kph n ASN 21 Ca 0.00 -0.92 0.05 0.00 -0.60 0.00 0.00 54.58 53.11 3kph n ASN 21 Cb 0.00 -0.23 -0.12 0.00 -0.53 0.00 0.00 39.78 38.90 3kph n ASN 21 CO 0.00 0.00 0.00 1.33 1.40 0.00 0.00 177.26 179.99 3kph n VAL 22 N 0.50 0.18 -3.53 3.44 0.24 -1.26 -4.94 118.33 112.96 3kph n VAL 22 Ca 0.00 -0.41 -0.37 0.00 -2.04 0.00 0.00 64.34 61.52 3kph n VAL 22 Cb 0.17 0.01 -0.08 0.00 -1.47 0.00 0.00 33.84 32.46 3kph n VAL 22 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 3kph s VAL 23 N -2.97 5.29 0.19 3.34 0.11 -1.05 -4.84 120.40 120.46 3kph s VAL 23 Ca -0.06 0.44 -0.31 0.00 -2.93 0.00 0.00 61.98 59.12 3kph s VAL 23 Cb 0.09 -3.61 -0.10 0.00 -1.53 0.00 0.00 36.38 31.23 3kph s VAL 23 CO 0.65 0.31 1.50 -0.36 -3.33 0.00 0.00 175.10 173.87 3kph s PHE 24 N 1.11 3.07 0.91 1.54 0.40 -1.26 -5.00 117.98 118.74 3kph s PHE 24 Ca 0.13 0.80 -0.11 0.00 -0.60 0.00 0.00 56.93 57.15 3kph s PHE 24 Cb -0.14 -3.86 0.14 0.00 0.51 0.00 0.00 43.02 39.67 3kph s PHE 24 CO 0.06 -3.05 1.09 0.95 0.70 0.00 0.00 175.22 174.97 3kph s THR 25 N 0.74 2.59 -0.37 0.64 -4.23 -1.26 -4.77 115.64 108.98 3kph s THR 25 Ca 0.66 0.19 0.25 0.00 -1.18 0.00 0.00 61.69 61.61 3kph s THR 25 Cb -0.42 -2.58 0.27 0.00 1.34 0.00 0.00 72.50 71.11 3kph s THR 25 CO 0.35 -0.25 1.76 0.78 -0.54 0.00 0.00 174.62 176.72 3kph h ASN 26 N -1.66 0.00 0.20 3.99 4.21 -1.99 -0.94 115.58 119.41 3kph h ASN 26 Ca -0.49 0.00 -0.01 0.00 1.21 0.00 0.00 56.30 57.01 3kph h ASN 26 Cb 1.28 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.48 3kph h ASN 26 CO 0.52 0.00 -0.10 0.50 -1.29 0.00 0.00 177.43 177.06 3kph h LYS 27 N 0.00 -0.27 -0.87 0.81 3.11 -1.99 -2.40 116.57 114.96 3kph h LYS 27 Ca 0.00 0.02 0.09 0.00 -2.81 0.00 0.00 60.65 57.95 3kph h LYS 27 Cb 0.37 0.06 -0.07 0.00 -1.00 0.00 0.00 32.23 31.59 3kph h LYS 27 CO 0.00 0.09 0.52 0.93 -2.81 0.00 0.00 179.45 178.18 3kph h GLU 28 N -0.94 0.84 -0.80 1.90 5.08 -1.81 -0.57 114.58 118.27 3kph h GLU 28 Ca -0.03 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.25 3kph h GLU 28 Cb 0.47 -0.19 -0.04 0.00 0.50 0.00 0.00 28.75 29.50 3kph h GLU 28 CO 0.05 0.56 0.37 -0.07 -1.00 0.00 0.00 179.01 178.91 3kph h LEU 29 N 0.87 1.06 -0.61 1.33 3.38 -1.24 -2.17 115.31 117.93 3kph h LEU 29 Ca 0.42 -0.13 -0.12 0.00 0.09 0.00 0.00 57.88 58.13 3kph h LEU 29 Cb 0.36 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 3kph h LEU 29 CO -0.24 0.90 -0.18 -0.33 0.09 0.00 0.00 178.44 178.68 3kph h GLU 30 N 1.14 0.91 -0.21 1.13 4.39 -0.65 -1.73 114.58 119.57 3kph h GLU 30 Ca 0.27 -0.36 0.04 0.00 0.34 0.00 0.00 59.36 59.65 3kph h GLU 30 Cb 0.14 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 28.71 3kph h GLU 30 CO -0.03 1.02 -0.01 -0.44 -1.16 0.00 0.00 179.01 178.39 3kph h ASP 31 N 0.80 -0.10 -0.68 1.42 3.45 -0.73 -1.76 116.42 118.81 3kph h ASP 31 Ca 0.11 0.05 -0.02 0.00 0.43 0.00 0.00 57.03 57.60 3kph h ASP 31 Cb 0.73 0.09 -0.03 0.00 -0.56 0.00 0.00 39.33 39.56 3kph h ASP 31 CO 0.06 -0.02 0.35 0.40 -1.57 0.00 0.00 179.24 178.46 3kph h ILE 32 N 0.05 1.22 -0.50 0.35 2.04 -1.24 -2.41 117.51 117.03 3kph h ILE 32 Ca 0.10 -0.59 -0.05 0.00 1.00 0.00 0.00 64.86 65.31 3kph h ILE 32 Cb 0.13 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 36.49 3kph h ILE 32 CO -0.17 0.26 0.10 1.88 0.00 0.00 0.00 178.15 180.21 3kph h TYR 33 N 0.99 0.79 0.05 1.37 0.99 -0.75 -3.18 116.97 117.22 3kph h TYR 33 Ca 0.25 -0.07 0.03 0.00 2.00 0.00 0.00 58.73 60.93 3kph h TYR 33 Cb 0.07 -0.23 -0.05 0.00 1.00 0.00 0.00 36.73 37.53 3kph h TYR 33 CO 0.01 0.68 -0.33 -0.91 -0.00 0.00 0.00 178.16 177.61 3kph h ASN 34 N 0.74 -0.97 -1.31 3.88 -0.26 -0.81 -2.37 115.58 114.48 3kph h ASN 34 Ca 0.16 0.12 0.38 0.00 -0.56 0.00 0.00 56.30 56.40 3kph h ASN 34 Cb 0.30 0.38 -0.05 0.00 -1.06 0.00 0.00 38.32 37.89 3kph h ASN 34 CO 0.00 -0.40 1.20 0.18 -1.06 0.00 0.00 177.43 177.36 3kph n LEU 35 N -5.42 0.00 -2.92 1.61 7.99 -1.20 -1.69 117.00 115.37 3kph n LEU 35 Ca -0.06 0.79 -0.31 0.00 -0.01 0.00 0.00 56.01 56.42 3kph n LEU 35 Cb 0.33 -0.33 -0.06 0.00 -0.11 0.00 0.00 43.42 43.25 3kph n LEU 35 CO 0.20 -0.79 2.49 -1.20 -1.51 0.00 0.00 177.39 176.59 3kph n SER 36 N -3.36 7.43 0.10 -1.43 7.64 -0.89 -4.61 113.62 118.50 3kph n SER 36 Ca 0.29 -2.77 -0.03 0.00 1.01 0.00 0.00 58.87 57.38 3kph n SER 36 Cb 1.60 -1.43 -0.04 0.00 -1.01 0.00 0.00 64.21 63.32 3kph n SER 36 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 3kph h ASN 37 N 4.14 0.00 -2.59 6.43 7.08 -1.58 -3.44 115.58 125.62 3kph h ASN 37 Ca 0.60 0.00 -0.46 0.00 -3.08 0.00 0.00 56.30 53.36 3kph h ASN 37 Cb 0.65 0.00 0.23 0.00 -2.08 0.00 0.00 38.32 37.12 3kph h ASN 37 CO 1.21 0.76 -0.83 0.29 -2.08 0.00 0.00 177.43 176.78 3kph n LYS 38 N -3.32 -1.65 0.03 4.14 4.01 -1.26 -4.95 118.16 115.17 3kph n LYS 38 Ca 0.01 -0.46 -0.03 0.00 -0.51 0.00 0.00 58.31 57.32 3kph n LYS 38 Cb 0.83 -1.81 -0.09 0.00 -0.51 0.00 0.00 35.03 33.46 3kph n LYS 38 CO 0.00 0.00 0.00 1.49 -1.11 0.00 0.00 177.40 177.78 3kph h GLU 39 N -2.14 0.00 0.05 1.97 4.57 -2.01 -3.37 114.58 113.65 3kph h GLU 39 Ca -0.54 0.00 -0.27 0.00 -1.18 0.00 0.00 59.36 57.37 3kph h GLU 39 Cb 1.35 0.00 0.02 0.00 -0.16 0.00 0.00 28.75 29.95 3kph h GLU 39 CO 0.40 0.41 -1.10 1.05 -1.18 0.00 0.00 179.01 178.60 3kph h GLU 40 N 0.00 0.55 -0.91 1.92 9.09 -1.97 -3.08 114.58 120.17 3kph h GLU 40 Ca -0.17 -0.66 0.00 0.00 0.05 0.00 0.00 59.36 58.58 3kph h GLU 40 Cb 1.71 0.20 0.00 0.00 -1.65 0.00 0.00 28.75 29.01 3kph h GLU 40 CO 0.06 1.27 0.00 0.25 0.05 0.00 0.00 179.01 180.64 3kph n THR 41 N -3.77 0.24 -0.11 -1.06 -2.24 -1.26 -3.47 114.28 102.61 3kph n THR 41 Ca -0.10 0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 61.47 3kph n THR 41 Cb 0.92 -0.51 -0.12 0.00 -2.10 0.00 0.00 70.33 68.52 3kph n THR 41 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 3kph n LYS 42 N 0.37 0.65 0.23 -0.78 3.00 -1.16 -3.31 118.16 117.17 3kph n LYS 42 Ca 0.00 0.20 0.14 0.00 -0.00 0.00 0.00 58.31 58.64 3kph n LYS 42 Cb 0.22 -1.55 0.32 0.00 0.00 0.00 0.00 35.03 34.02 3kph n LYS 42 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.40 178.89 3kph h GLU 43 N -0.19 0.00 0.20 1.64 4.81 -1.79 -2.82 114.58 116.44 3kph h GLU 43 Ca -0.57 0.00 -0.32 0.00 -0.13 0.00 0.00 59.36 58.34 3kph h GLU 43 Cb 1.85 0.00 0.02 0.00 0.63 0.00 0.00 28.75 31.25 3kph h GLU 43 CO -0.12 0.00 -1.49 0.28 -0.73 0.00 0.00 179.01 176.95 3kph h VAL 44 N 0.00 1.26 0.00 0.32 2.07 -1.77 -3.16 116.25 114.97 3kph h VAL 44 Ca 0.00 -2.76 -0.00 0.00 0.82 0.00 0.00 66.70 64.76 3kph h VAL 44 Cb 0.86 2.95 -0.00 0.00 -1.52 0.00 0.00 31.29 33.57 3kph h VAL 44 CO 0.00 0.84 -0.02 0.25 0.02 0.00 0.00 177.57 178.66 3kph h LEU 45 N 0.12 0.00 -0.13 2.57 7.12 -1.52 0.88 115.31 124.35 3kph h LEU 45 Ca -0.24 0.00 -0.09 0.00 0.13 0.00 0.00 57.88 57.67 3kph h LEU 45 Cb 2.10 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 42.23 3kph h LEU 45 CO 0.23 0.02 -0.27 0.11 -0.13 0.00 0.00 178.44 178.40 3kph h LYS 46 N 0.00 0.41 -0.30 1.25 1.57 -1.47 -1.98 116.57 116.05 3kph h LYS 46 Ca -0.00 -0.27 -0.05 0.00 -1.87 0.00 0.00 60.65 58.46 3kph h LYS 46 Cb 0.10 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 3kph h LYS 46 CO 0.00 0.88 -0.02 -0.07 -0.57 0.00 0.00 179.45 179.67 3kph h LEU 47 N 0.00 0.53 -0.51 2.94 4.07 -1.18 -2.19 115.31 118.98 3kph h LEU 47 Ca 0.00 -0.33 0.06 0.00 0.08 0.00 0.00 57.88 57.69 3kph h LEU 47 Cb 0.87 -0.14 -0.05 0.00 1.08 0.00 0.00 40.66 42.42 3kph h LEU 47 CO 0.06 0.73 0.23 0.15 -1.08 0.00 0.00 178.44 178.53 3kph h PHE 48 N 0.32 0.42 -0.58 1.13 3.57 -0.94 -0.33 116.94 120.54 3kph h PHE 48 Ca 0.08 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.64 3kph h PHE 48 Cb 0.47 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 39.06 3kph h PHE 48 CO 0.04 0.18 0.38 -0.22 -2.23 0.00 0.00 178.31 176.47 3kph h LYS 49 N 0.45 0.63 -0.16 1.11 3.64 -1.17 -1.40 116.57 119.67 3kph h LYS 49 Ca 0.23 -0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.51 3kph h LYS 49 Cb 0.19 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 31.86 3kph h LYS 49 CO -0.19 0.42 -0.15 -0.07 -2.27 0.00 0.00 179.45 177.19 3kph h LEU 50 N 0.65 0.41 -0.28 5.20 4.07 -0.52 -3.05 115.31 121.79 3kph h LEU 50 Ca 0.24 -0.47 0.00 0.00 0.08 0.00 0.00 57.88 57.73 3kph h LEU 50 Cb 0.13 -0.11 -0.01 0.00 1.08 0.00 0.00 40.66 41.74 3kph h LEU 50 CO -0.06 0.79 0.18 0.50 -1.08 0.00 0.00 178.44 178.76 3kph h LYS 51 N 0.03 0.35 -0.23 1.13 1.63 -0.52 -1.57 116.57 117.40 3kph h LYS 51 Ca 0.03 -0.02 0.07 0.00 -0.85 0.00 0.00 60.65 59.87 3kph h LYS 51 Cb 0.67 -0.08 -0.01 0.00 -0.60 0.00 0.00 32.23 32.21 3kph h LYS 51 CO 0.04 0.23 0.17 0.28 -3.45 0.00 0.00 179.45 176.72 3kph h VAL 52 N 0.36 0.82 0.00 2.00 2.07 -1.32 0.17 116.25 120.36 3kph h VAL 52 Ca 0.10 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.62 3kph h VAL 52 Cb -0.03 0.88 0.00 0.00 -1.52 0.00 0.00 31.29 30.62 3kph h VAL 52 CO -0.03 0.00 -0.00 0.78 0.02 0.00 0.00 177.57 178.34 3kph h ASN 53 N 0.00 -0.00 -0.70 0.57 2.35 -1.26 -2.11 115.58 114.42 3kph h ASN 53 Ca 0.11 -0.69 0.08 0.00 -0.55 0.00 0.00 56.30 55.25 3kph h ASN 53 Cb 0.45 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.77 3kph h ASN 53 CO -0.00 0.69 0.46 -0.61 -1.65 0.00 0.00 177.43 176.32 3kph h GLN 54 N -0.70 0.63 0.18 0.81 4.15 -0.56 -0.90 115.11 118.72 3kph h GLN 54 Ca -0.00 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.37 3kph h GLN 54 Cb 0.69 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 28.24 3kph h GLN 54 CO 0.00 0.41 -0.09 0.35 -1.93 0.00 0.00 178.83 177.58 3kph h PHE 55 N 0.65 -0.22 -0.54 3.99 3.57 -0.60 0.68 116.94 124.47 3kph h PHE 55 Ca 0.32 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.84 3kph h PHE 55 Cb 0.39 0.07 -0.04 0.00 2.79 0.00 0.00 35.95 39.17 3kph h PHE 55 CO -0.00 -0.05 0.32 1.88 -2.23 0.00 0.00 178.31 178.23 3kph h TYR 56 N -0.35 0.60 0.14 0.41 -1.99 -0.67 0.10 116.97 115.21 3kph h TYR 56 Ca -0.02 0.02 0.02 0.00 2.00 0.00 0.00 58.73 60.74 3kph h TYR 56 Cb 0.28 -0.19 -0.04 0.00 2.00 0.00 0.00 36.73 38.77 3kph h TYR 56 CO -0.03 0.34 -0.40 -0.09 -0.00 0.00 0.00 178.16 177.98 3kph h ARG 57 N 0.64 -0.63 -0.54 4.88 2.43 -1.02 -0.01 114.38 120.14 3kph h ARG 57 Ca 0.22 0.04 0.09 0.00 -0.81 0.00 0.00 59.98 59.51 3kph h ARG 57 Cb 0.02 0.14 -0.07 0.00 -0.42 0.00 0.00 29.97 29.64 3kph h ARG 57 CO -0.10 -0.42 0.15 1.25 -1.51 0.00 0.00 179.97 179.35 3kph h HIS 58 N -0.65 0.26 0.20 2.20 2.76 -0.47 0.12 115.15 119.57 3kph h HIS 58 Ca 0.02 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.21 3kph h HIS 58 Cb 0.67 -0.03 0.00 0.00 1.55 0.00 0.00 27.41 29.60 3kph h HIS 58 CO -0.34 0.04 -0.10 0.00 -1.30 0.00 0.00 177.93 176.23 3kph h ALA 59 N 1.39 -0.28 0.00 5.26 0.00 -0.31 -2.72 119.26 122.60 3kph h ALA 59 Ca 0.27 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 3kph h ALA 59 Cb 0.34 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 3kph h ALA 59 CO -0.31 -0.60 -0.23 0.74 0.00 0.00 0.00 179.25 178.85 3kph h PHE 60 N -0.38 0.00 -0.43 0.00 -1.00 -0.83 -2.12 116.94 112.17 3kph h PHE 60 Ca -0.03 0.00 0.04 0.00 2.81 0.00 0.00 57.97 60.79 3kph h PHE 60 Cb 0.29 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 39.81 3kph h PHE 60 CO -0.03 0.23 0.20 0.78 -1.61 0.00 0.00 178.31 177.88 3kph h GLY 61 N 1.75 0.59 1.06 -1.45 0.00 -0.51 -1.22 103.07 103.30 3kph h GLY 61 Ca -0.00 -0.14 0.02 0.00 0.00 0.00 0.00 47.33 47.21 3kph h GLY 61 CO 0.03 0.09 0.60 -2.22 0.00 0.00 0.00 176.54 175.04 3kph h ILE 62 N 0.41 1.20 0.00 2.60 2.04 -1.09 -2.01 117.51 120.66 3kph h ILE 62 Ca 0.19 -0.41 0.00 0.00 1.00 0.00 0.00 64.86 65.64 3kph h ILE 62 Cb 0.12 -0.10 0.00 0.00 -0.74 0.00 0.00 36.82 36.10 3kph h ILE 62 CO -0.15 0.22 0.00 0.52 0.00 0.00 0.00 178.15 178.74 3kph n VAL 63 N -4.41 0.51 -1.81 1.67 0.31 -0.52 -2.12 118.33 111.96 3kph n VAL 63 Ca 0.11 0.13 0.04 0.00 -0.01 0.00 0.00 64.34 64.61 3kph n VAL 63 Cb 0.05 -0.77 0.06 0.00 -0.91 0.00 0.00 33.84 32.28 3kph n VAL 63 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 3kph n ASN 64 N -1.46 0.99 0.00 4.52 2.04 -0.85 -4.31 115.26 116.18 3kph n ASN 64 Ca 0.06 -2.49 0.00 0.00 -0.44 0.00 0.00 54.58 51.71 3kph n ASN 64 Cb 0.23 -0.32 0.00 0.00 -2.53 0.00 0.00 39.78 37.17 3kph n ASN 64 CO 0.00 0.00 0.00 -0.67 -0.44 0.00 0.00 177.26 176.15 3kph n ASP 65 N -0.40 0.00 -0.27 0.53 2.03 -0.81 -4.86 116.55 112.77 3kph n ASP 65 Ca 0.07 -0.82 0.00 0.00 0.52 0.00 0.00 54.79 54.56 3kph n ASP 65 Cb 0.77 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.17 3kph n ASP 65 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 3kph n TYR 66 N 0.00 0.00 0.13 -0.67 4.01 -0.90 -4.86 117.16 114.87 3kph n TYR 66 Ca 0.00 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.77 3kph n TYR 66 Cb 0.21 0.06 0.13 0.00 -0.31 0.00 0.00 39.34 39.43 3kph n TYR 66 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 3kph n ASN 67 N 0.00 0.07 0.13 7.72 6.94 -1.25 -0.17 115.26 128.70 3kph n ASN 67 Ca 0.00 0.53 0.13 0.00 -0.02 0.00 0.00 54.58 55.22 3kph n ASN 67 Cb 0.57 -0.54 0.34 0.00 -2.36 0.00 0.00 39.78 37.79 3kph n ASN 67 CO 0.00 0.00 0.00 1.23 -1.03 0.00 0.00 177.26 177.46 3kph h GLY 68 N 0.58 0.00 -6.55 4.83 0.00 -1.93 -3.43 103.07 96.57 3kph h GLY 68 Ca 0.00 0.00 -0.61 0.00 0.00 0.00 0.00 47.33 46.72 3kph h GLY 68 CO 0.00 0.00 0.18 -2.27 0.00 0.00 0.00 176.54 174.45 3kph s LEU 69 N -4.92 4.11 0.20 3.11 2.96 0.76 -4.97 118.68 119.94 3kph s LEU 69 Ca 0.10 0.55 -0.15 0.00 -0.22 0.00 0.00 54.13 54.41 3kph s LEU 69 Cb 0.11 -2.86 0.21 0.00 0.50 0.00 0.00 46.19 44.15 3kph s LEU 69 CO 0.62 -0.46 1.62 0.25 -1.32 0.00 0.00 176.35 177.06 3kph h LEU 70 N 9.12 -0.64 -0.36 -0.68 6.46 -1.84 -0.67 115.31 126.70 3kph h LEU 70 Ca -0.26 0.19 0.00 0.00 -0.12 0.00 0.00 57.88 57.69 3kph h LEU 70 Cb 1.12 0.40 0.00 0.00 -0.73 0.00 0.00 40.66 41.45 3kph h LEU 70 CO 0.80 -0.22 0.00 -0.62 -0.62 0.00 0.00 178.44 177.78 3kph n GLU 71 N -5.43 0.57 -0.10 1.25 4.71 -1.26 -3.94 120.64 116.44 3kph n GLU 71 Ca 0.07 0.00 -0.14 0.00 -0.01 0.00 0.00 57.16 57.08 3kph n GLU 71 Cb 0.33 -1.10 -0.03 0.00 -1.01 0.00 0.00 31.44 29.62 3kph n GLU 71 CO 0.00 0.00 0.00 0.10 0.09 0.00 0.00 177.13 177.32 3kph h TYR 72 N 0.16 1.02 -0.66 -0.32 -0.00 -1.37 -2.82 116.97 112.97 3kph h TYR 72 Ca 0.00 -0.32 0.01 0.00 -0.00 0.00 0.00 58.73 58.42 3kph h TYR 72 Cb 0.10 -0.21 -0.03 0.00 -0.00 0.00 0.00 36.73 36.59 3kph h TYR 72 CO 0.00 1.12 0.44 0.87 -0.00 0.00 0.00 178.16 180.58 3kph h LYS 73 N 0.63 0.86 0.12 0.10 1.57 -1.81 -0.27 116.57 117.76 3kph h LYS 73 Ca 0.05 -0.05 0.02 0.00 -1.87 0.00 0.00 60.65 58.80 3kph h LYS 73 Cb 0.97 -0.19 -0.04 0.00 0.08 0.00 0.00 32.23 33.04 3kph h LYS 73 CO 0.09 0.57 -0.37 0.93 -0.57 0.00 0.00 179.45 180.10 3kph h GLU 74 N 0.89 -0.58 -0.40 3.15 5.08 -1.82 -0.71 114.58 120.18 3kph h GLU 74 Ca 0.24 0.04 0.06 0.00 -1.00 0.00 0.00 59.36 58.71 3kph h GLU 74 Cb -0.09 0.13 -0.05 0.00 0.50 0.00 0.00 28.75 29.23 3kph h GLU 74 CO -0.06 -0.39 0.08 0.82 -1.00 0.00 0.00 179.01 178.47 3kph h ILE 75 N -0.60 0.79 0.01 3.13 2.04 -1.23 -0.78 117.51 120.88 3kph h ILE 75 Ca 0.03 -0.07 0.02 0.00 1.00 0.00 0.00 64.86 65.84 3kph h ILE 75 Cb 0.63 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 3kph h ILE 75 CO -0.22 0.04 -0.12 0.15 0.00 0.00 0.00 178.15 178.00 3kph h PHE 76 N 0.21 -0.31 -0.66 1.37 3.57 -0.68 -2.23 116.94 118.20 3kph h PHE 76 Ca 0.20 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.69 3kph h PHE 76 Cb 0.24 0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.08 3kph h PHE 76 CO -0.20 -0.18 0.37 -0.91 -2.23 0.00 0.00 178.31 175.15 3kph h ASN 77 N -0.21 0.81 -0.74 0.41 2.35 -0.76 -1.86 115.58 115.58 3kph h ASN 77 Ca 0.04 -0.06 -0.01 0.00 -0.55 0.00 0.00 56.30 55.73 3kph h ASN 77 Cb 0.26 -0.20 -0.04 0.00 0.05 0.00 0.00 38.32 38.39 3kph h ASN 77 CO -0.11 0.65 0.44 -0.03 -1.65 0.00 0.00 177.43 176.72 3kph h MET 78 N 0.92 1.01 -0.44 0.81 4.05 -0.85 0.10 114.93 120.53 3kph h MET 78 Ca 0.24 -0.10 0.04 0.00 -0.28 0.00 0.00 59.70 59.60 3kph h MET 78 Cb 0.01 -0.21 -0.04 0.00 -0.80 0.00 0.00 31.60 30.56 3kph h MET 78 CO -0.04 0.73 0.20 0.52 0.23 0.00 0.00 176.91 178.55 3kph h MET 79 N 1.02 0.39 0.00 0.39 2.86 -0.74 0.69 114.93 119.54 3kph h MET 79 Ca 0.27 -0.02 -0.10 0.00 -2.06 0.00 0.00 59.70 57.78 3kph h MET 79 Cb -0.02 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.54 3kph h MET 79 CO -0.05 0.26 -0.49 0.74 1.06 0.00 0.00 176.91 178.43 3kph h PHE 80 N 0.40 0.00 0.15 -0.22 -1.00 -1.13 -1.45 116.94 113.70 3kph h PHE 80 Ca 0.20 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.97 3kph h PHE 80 Cb 0.14 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.70 3kph h PHE 80 CO -0.12 0.49 -0.07 1.25 -1.61 0.00 0.00 178.31 178.24 3kph h LEU 81 N 0.00 -0.18 -1.64 1.54 7.12 -0.32 -0.13 115.31 121.71 3kph h LEU 81 Ca -0.00 -0.25 -0.04 0.00 0.13 0.00 0.00 57.88 57.72 3kph h LEU 81 Cb 1.25 0.05 -0.01 0.00 -0.53 0.00 0.00 40.66 41.42 3kph h LEU 81 CO 0.06 0.16 -0.15 0.11 -0.13 0.00 0.00 178.44 178.49 3kph h LYS 82 N -0.53 0.04 -0.11 1.25 1.57 -0.87 -2.58 116.57 115.33 3kph h LYS 82 Ca -0.02 -0.01 -0.05 0.00 -1.87 0.00 0.00 60.65 58.71 3kph h LYS 82 Cb 0.41 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.71 3kph h LYS 82 CO 0.03 0.19 -0.11 1.25 -0.57 0.00 0.00 179.45 180.25 3kph h LEU 83 N 0.03 0.29 -1.03 2.94 7.12 -1.04 -2.79 115.31 120.83 3kph h LEU 83 Ca 0.01 -0.48 0.19 0.00 0.13 0.00 0.00 57.88 57.72 3kph h LEU 83 Cb 0.30 -0.08 -0.10 0.00 -0.53 0.00 0.00 40.66 40.24 3kph h LEU 83 CO 0.02 0.71 0.61 0.77 -0.13 0.00 0.00 178.44 180.43 3kph h SER 84 N -0.12 0.78 -0.58 1.25 4.64 -0.62 0.28 113.55 119.17 3kph h SER 84 Ca 0.02 0.09 -0.07 0.00 -0.47 0.00 0.00 61.79 61.36 3kph h SER 84 Cb 0.63 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 62.64 3kph h SER 84 CO 0.03 0.29 0.09 0.58 -0.87 0.00 0.00 176.83 176.95 3kph h VAL 85 N 0.77 1.26 -0.19 0.95 2.07 -1.39 -1.65 116.25 118.06 3kph h VAL 85 Ca 0.57 -0.99 -0.06 0.00 0.82 0.00 0.00 66.70 67.04 3kph h VAL 85 Cb 0.89 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 3kph h VAL 85 CO -0.36 0.36 -0.16 0.58 0.02 0.00 0.00 177.57 178.01 3kph h VAL 86 N 0.87 1.21 -0.27 2.57 2.07 -0.29 -1.98 116.25 120.42 3kph h VAL 86 Ca 0.18 -0.94 -0.08 0.00 0.82 0.00 0.00 66.70 66.68 3kph h VAL 86 Cb 0.42 1.24 -0.01 0.00 -1.52 0.00 0.00 31.29 31.42 3kph h VAL 86 CO 0.01 0.29 -0.19 -0.26 0.02 0.00 0.00 177.57 177.44 3kph h PHE 87 N 0.29 0.54 -0.47 1.57 -1.00 -0.29 -1.70 116.94 115.88 3kph h PHE 87 Ca 0.06 -0.10 0.02 0.00 2.81 0.00 0.00 57.97 60.76 3kph h PHE 87 Cb 0.46 -0.14 -0.03 0.00 3.61 0.00 0.00 35.95 39.85 3kph h PHE 87 CO 0.01 0.66 0.29 -0.44 -1.61 0.00 0.00 178.31 177.21 3kph h ASP 88 N 0.44 0.47 0.97 2.17 3.32 -0.55 0.38 116.42 123.62 3kph h ASP 88 Ca 0.07 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.08 3kph h ASP 88 Cb 0.59 -0.10 0.01 0.00 0.22 0.00 0.00 39.33 40.05 3kph h ASP 88 CO 0.04 0.33 -0.48 0.74 -1.72 0.00 0.00 179.24 178.16 3kph h THR 89 N 0.58 0.00 -0.76 0.35 2.02 -1.29 -2.87 112.91 110.93 3kph h THR 89 Ca 0.19 0.00 0.18 0.00 0.77 0.00 0.00 66.41 67.54 3kph h THR 89 Cb 0.00 0.00 -0.13 0.00 -1.74 0.00 0.00 68.15 66.28 3kph h THR 89 CO -0.08 0.00 0.05 -0.61 0.37 0.00 0.00 175.52 175.25 3kph h GLN 90 N -1.32 0.13 -0.82 6.66 5.75 -1.00 -0.61 115.11 123.91 3kph h GLN 90 Ca -0.13 -0.01 0.14 0.00 -0.15 0.00 0.00 58.65 58.50 3kph h GLN 90 Cb 1.02 -0.03 -0.09 0.00 1.07 0.00 0.00 27.48 29.45 3kph h GLN 90 CO 0.21 0.09 0.40 0.00 -2.65 0.00 0.00 178.83 176.88 3kph h ARG 91 N 0.13 0.57 -0.65 1.69 3.08 -0.08 0.43 114.38 119.55 3kph h ARG 91 Ca 0.43 -0.03 -0.33 0.00 0.07 0.00 0.00 59.98 60.11 3kph h ARG 91 Cb 0.76 -0.13 -0.20 0.00 0.08 0.00 0.00 29.97 30.49 3kph h ARG 91 CO -0.64 0.38 0.25 0.36 -1.07 0.00 0.00 179.97 179.25 3kph n LYS 92 N -4.89 2.05 -0.41 0.04 2.85 -0.31 -4.26 118.16 113.23 3kph n LYS 92 Ca 0.16 -3.11 0.00 0.00 -1.05 0.00 0.00 58.31 54.31 3kph n LYS 92 Cb 0.41 -1.99 0.00 0.00 -0.65 0.00 0.00 35.03 32.80 3kph n LYS 92 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 3kph n GLU 93 N -1.12 0.00 0.20 -1.58 -0.58 -0.74 -4.99 120.64 111.83 3kph n GLU 93 Ca 0.45 0.00 0.02 0.00 -0.42 0.00 0.00 57.16 57.22 3kph n GLU 93 Cb 1.33 0.00 0.12 0.00 -0.57 0.00 0.00 31.44 32.32 3kph n GLU 93 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3kph h ALA 94 N 0.00 1.52 -0.02 0.62 0.00 -0.35 0.34 119.26 121.37 3kph h ALA 94 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3kph h ALA 94 Cb 0.97 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.76 3kph h ALA 94 CO 0.00 -0.52 0.00 0.09 0.00 0.00 0.00 179.25 178.82 3kph n ASN 95 N -2.01 1.47 -4.51 0.00 3.02 -1.26 -4.08 115.26 107.88 3kph n ASN 95 Ca -0.00 -1.36 -0.42 0.00 -0.03 0.00 0.00 54.58 52.77 3kph n ASN 95 Cb 0.69 -0.01 -0.03 0.00 -0.61 0.00 0.00 39.78 39.82 3kph n ASN 95 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 3kph s ASN 96 N -0.42 6.57 0.21 6.41 3.84 0.12 -4.74 114.94 126.93 3kph s ASN 96 Ca 0.03 -1.75 -0.11 0.00 0.21 0.00 0.00 52.86 51.24 3kph s ASN 96 Cb 0.02 -2.50 0.27 0.00 -0.55 0.00 0.00 41.25 38.49 3kph s ASN 96 CO 0.03 -1.31 1.67 1.62 -2.79 0.00 0.00 177.10 176.32 3kph h VAL 97 N 6.34 0.54 0.00 -5.21 3.04 -1.90 0.35 116.25 119.40 3kph h VAL 97 Ca 0.19 -0.05 -0.01 0.00 -1.01 0.00 0.00 66.70 65.82 3kph h VAL 97 Cb 1.01 0.39 -0.00 0.00 -2.01 0.00 0.00 31.29 30.68 3kph h VAL 97 CO 1.30 0.02 -0.07 -0.33 -1.01 0.00 0.00 177.57 177.49 3kph h GLU 98 N 0.14 0.00 0.02 4.17 4.39 -1.98 -0.03 114.58 121.30 3kph h GLU 98 Ca 0.30 0.00 -0.27 0.00 0.34 0.00 0.00 59.36 59.73 3kph h GLU 98 Cb 0.48 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.15 3kph h GLU 98 CO -0.48 0.07 -1.09 0.37 -1.16 0.00 0.00 179.01 176.72 3kph h GLN 99 N 0.00 0.69 -0.33 2.33 5.75 -1.53 -2.79 115.11 119.23 3kph h GLN 99 Ca -0.00 -0.78 -0.01 0.00 -0.15 0.00 0.00 58.65 57.72 3kph h GLN 99 Cb 0.12 0.23 -0.02 0.00 1.07 0.00 0.00 27.48 28.89 3kph h GLN 99 CO 0.01 1.34 0.18 0.82 -2.65 0.00 0.00 178.83 178.53 3kph h ILE 100 N 0.37 1.13 -0.58 2.39 2.04 -0.24 0.17 117.51 122.80 3kph h ILE 100 Ca -0.14 -0.35 0.09 0.00 1.00 0.00 0.00 64.86 65.46 3kph h ILE 100 Cb 1.74 0.76 -0.07 0.00 -0.74 0.00 0.00 36.82 38.51 3kph h ILE 100 CO 0.21 0.14 0.18 0.11 0.00 0.00 0.00 178.15 178.79 3kph h LYS 101 N 0.42 0.34 -0.55 2.37 1.57 -1.05 0.54 116.57 120.21 3kph h LYS 101 Ca 0.12 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.82 3kph h LYS 101 Cb 0.06 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.27 3kph h LYS 101 CO -0.02 0.22 0.10 0.00 -0.57 0.00 0.00 179.45 179.18 3kph h ARG 102 N 0.35 0.90 -0.86 3.15 3.08 -1.13 -2.24 114.38 117.63 3kph h ARG 102 Ca 0.30 -0.23 0.06 0.00 0.07 0.00 0.00 59.98 60.17 3kph h ARG 102 Cb 0.38 -0.11 -0.06 0.00 0.08 0.00 0.00 29.97 30.27 3kph h ARG 102 CO -0.32 0.86 0.54 -0.91 -1.07 0.00 0.00 179.97 179.07 3kph h ASN 103 N 0.79 0.85 -0.56 7.04 -0.26 0.58 0.21 115.58 124.24 3kph h ASN 103 Ca 0.17 0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.92 3kph h ASN 103 Cb 0.39 -0.17 -0.03 0.00 -1.06 0.00 0.00 38.32 37.46 3kph h ASN 103 CO 0.01 0.55 0.37 0.40 -1.06 0.00 0.00 177.43 177.70 3kph h ILE 104 N 0.99 1.15 -0.27 2.81 2.04 -0.53 0.27 117.51 123.97 3kph h ILE 104 Ca 0.37 -0.28 -0.15 0.00 1.00 0.00 0.00 64.86 65.80 3kph h ILE 104 Cb 0.14 0.33 -0.01 0.00 -0.74 0.00 0.00 36.82 36.54 3kph h ILE 104 CO -0.16 0.14 -0.44 0.00 0.00 0.00 0.00 178.15 177.69 3kph h ALA 105 N 1.64 0.72 -0.59 1.87 0.00 -0.18 -2.70 119.26 120.03 3kph h ALA 105 Ca 0.20 -0.46 -0.10 0.00 0.00 0.00 0.00 54.91 54.55 3kph h ALA 105 Cb -0.08 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 3kph h ALA 105 CO -0.04 0.67 -0.02 0.82 0.00 0.00 0.00 179.25 180.67 3kph h ILE 106 N 0.55 1.27 -0.74 0.00 2.04 0.69 -1.13 117.51 120.18 3kph h ILE 106 Ca 0.04 -1.17 -0.02 0.00 1.00 0.00 0.00 64.86 64.71 3kph h ILE 106 Cb 0.98 0.84 -0.04 0.00 -0.74 0.00 0.00 36.82 37.87 3kph h ILE 106 CO 0.09 0.42 0.38 -0.07 0.00 0.00 0.00 178.15 178.97 3kph h LEU 107 N 0.94 0.94 -1.10 1.44 4.07 -0.89 0.18 115.31 120.90 3kph h LEU 107 Ca 0.16 -0.09 -0.06 0.00 0.08 0.00 0.00 57.88 57.97 3kph h LEU 107 Cb 0.58 -0.24 -0.02 0.00 1.08 0.00 0.00 40.66 42.06 3kph h LEU 107 CO 0.03 0.78 -0.01 0.44 -1.08 0.00 0.00 178.44 178.61 3kph h ASP 108 N 1.05 0.59 0.20 -0.43 5.19 -1.13 -1.69 116.42 120.20 3kph h ASP 108 Ca 0.26 -0.13 -0.16 0.00 -0.62 0.00 0.00 57.03 56.39 3kph h ASP 108 Cb 0.07 -0.16 -0.01 0.00 0.18 0.00 0.00 39.33 39.42 3kph h ASP 108 CO -0.04 0.67 -0.59 -0.33 -3.12 0.00 0.00 179.24 175.83 3kph h GLU 109 N 0.59 0.40 -0.31 3.56 5.08 0.08 -2.09 114.58 121.89 3kph h GLU 109 Ca 0.12 -0.27 -0.04 0.00 -1.00 0.00 0.00 59.36 58.17 3kph h GLU 109 Cb 0.39 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 3kph h GLU 109 CO 0.01 0.87 0.02 0.82 -1.00 0.00 0.00 179.01 179.74 3kph h ILE 110 N 0.30 1.25 -0.52 3.13 2.04 -0.13 -2.12 117.51 121.45 3kph h ILE 110 Ca -0.00 -0.89 -0.06 0.00 1.00 0.00 0.00 64.86 64.91 3kph h ILE 110 Cb 1.12 1.21 -0.02 0.00 -0.74 0.00 0.00 36.82 38.39 3kph h ILE 110 CO 0.10 0.29 0.08 0.24 0.00 0.00 0.00 178.15 178.86 3kph h MET 111 N 0.35 0.83 -0.48 2.37 2.86 -1.29 -2.11 114.93 117.46 3kph h MET 111 Ca 0.09 -0.19 -0.01 0.00 -2.06 0.00 0.00 59.70 57.53 3kph h MET 111 Cb 0.40 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.92 3kph h MET 111 CO 0.01 0.78 0.25 0.00 1.06 0.00 0.00 176.91 179.01 3kph h ALA 112 N 1.29 1.53 0.01 6.32 0.00 -1.12 -1.28 119.26 126.02 3kph h ALA 112 Ca 0.16 -0.09 -0.25 0.00 0.00 0.00 0.00 54.91 54.73 3kph h ALA 112 Cb 0.37 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 17.97 3kph h ALA 112 CO 0.01 0.38 -1.03 -0.22 0.00 0.00 0.00 179.25 178.39 3kph h LYS 113 N 0.67 0.56 -0.50 0.00 1.63 -0.98 -2.20 116.57 115.75 3kph h LYS 113 Ca 0.17 -0.63 0.01 0.00 -0.85 0.00 0.00 60.65 59.36 3kph h LYS 113 Cb 0.05 0.18 -0.03 0.00 -0.60 0.00 0.00 32.23 31.83 3kph h LYS 113 CO -0.03 1.24 0.31 0.00 -3.45 0.00 0.00 179.45 177.53 3kph h ALA 114 N 0.54 0.63 -0.64 5.00 0.00 -0.90 0.23 119.26 124.13 3kph h ALA 114 Ca -0.11 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 3kph h ALA 114 Cb 1.68 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 19.26 3kph h ALA 114 CO 0.19 0.04 0.24 -0.44 0.00 0.00 0.00 179.25 179.28 3kph h ASP 115 N 0.64 0.86 -0.07 0.00 3.45 -1.24 -0.25 116.42 119.80 3kph h ASP 115 Ca 0.19 -0.12 -0.00 0.00 0.43 0.00 0.00 57.03 57.53 3kph h ASP 115 Cb -0.03 -0.22 -0.00 0.00 -0.56 0.00 0.00 39.33 38.51 3kph h ASP 115 CO -0.06 0.78 0.04 -1.13 -1.57 0.00 0.00 179.24 177.29 3kph h ASN 116 N 0.92 0.09 -0.50 6.45 -1.24 -0.57 -1.98 115.58 118.76 3kph h ASN 116 Ca 0.21 -0.11 0.00 0.00 0.71 0.00 0.00 56.30 57.12 3kph h ASN 116 Cb 0.20 -0.02 -0.02 0.00 0.73 0.00 0.00 38.32 39.20 3kph h ASN 116 CO -0.02 0.18 0.33 0.44 -1.29 0.00 0.00 177.43 177.07 3kph h ASP 117 N 0.00 0.57 -0.92 1.15 3.45 -0.22 0.72 116.42 121.17 3kph h ASP 117 Ca 0.03 -0.02 0.10 0.00 0.43 0.00 0.00 57.03 57.57 3kph h ASP 117 Cb 0.11 -0.14 -0.07 0.00 -0.56 0.00 0.00 39.33 38.67 3kph h ASP 117 CO -0.00 0.41 0.59 0.25 -1.57 0.00 0.00 179.24 178.92 3kph h LEU 118 N 0.67 0.85 -0.01 1.55 5.85 -0.88 -1.55 115.31 121.79 3kph h LEU 118 Ca 0.18 0.02 -0.14 0.00 0.84 0.00 0.00 57.88 58.79 3kph h LEU 118 Cb -0.08 -0.15 0.01 0.00 0.37 0.00 0.00 40.66 40.81 3kph h LEU 118 CO -0.04 0.50 -0.52 0.28 -0.34 0.00 0.00 178.44 178.32 3kph h SER 119 N 0.94 0.48 -0.20 1.25 0.02 -0.72 -2.58 113.55 112.72 3kph h SER 119 Ca 0.43 -0.75 0.05 0.00 -0.84 0.00 0.00 61.79 60.68 3kph h SER 119 Cb 0.39 -0.15 -0.06 0.00 0.14 0.00 0.00 62.40 62.72 3kph h SER 119 CO -0.19 1.16 -0.21 0.22 -1.14 0.00 0.00 176.83 176.68 3kph h TYR 120 N -0.16 -0.55 0.14 3.45 3.20 -0.34 -0.84 116.97 121.87 3kph h TYR 120 Ca -0.06 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.83 3kph h TYR 120 Cb 1.23 0.27 0.00 0.00 1.54 0.00 0.00 36.73 39.78 3kph h TYR 120 CO 0.15 -0.29 -0.07 0.74 -1.64 0.00 0.00 178.16 177.05 3kph h PHE 121 N -0.23 -0.18 -0.56 -3.82 0.05 -1.39 -1.21 116.94 109.61 3kph h PHE 121 Ca 0.12 -0.00 0.11 0.00 3.82 0.00 0.00 57.97 62.02 3kph h PHE 121 Cb 0.42 0.06 -0.03 0.00 2.00 0.00 0.00 35.95 38.39 3kph h PHE 121 CO -0.35 -0.01 0.38 0.82 -0.18 0.00 0.00 178.31 178.97 3kph h ILE 122 N -0.31 0.85 0.00 -0.55 2.04 -1.22 0.15 117.51 118.47 3kph h ILE 122 Ca -0.02 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 65.75 3kph h ILE 122 Cb 0.24 0.55 0.00 0.00 -0.74 0.00 0.00 36.82 36.87 3kph h ILE 122 CO 0.03 0.05 -0.47 -1.54 0.00 0.00 0.00 178.15 176.22 3kph n SER 123 N -4.45 0.48 0.06 1.72 3.41 -0.34 -3.43 113.62 111.07 3kph n SER 123 Ca 0.09 -0.10 0.12 0.00 -0.26 0.00 0.00 58.87 58.73 3kph n SER 123 Cb 0.43 0.16 0.27 0.00 -0.26 0.00 0.00 64.21 64.81 3kph n SER 123 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3kph n GLN 124 N -1.62 0.22 -1.02 4.33 1.13 -0.01 -3.86 117.38 116.55 3kph n GLN 124 Ca 0.05 0.09 -0.10 0.00 -1.94 0.00 0.00 57.00 55.11 3kph n GLN 124 Cb 0.36 -1.67 0.26 0.00 0.11 0.00 0.00 30.24 29.30 3kph n GLN 124 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 3kph n ASN 125 N -2.00 4.25 0.00 1.08 4.13 -0.88 -5.03 115.26 116.80 3kph n ASN 125 Ca 0.04 -3.38 0.00 0.00 1.68 0.00 0.00 54.58 52.93 3kph n ASN 125 Cb 0.41 -0.75 0.00 0.00 -1.54 0.00 0.00 39.78 37.91 3kph n ASN 125 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 3kph n LYS 126 N -0.55 0.00 -0.31 3.52 5.02 -1.25 -3.21 118.16 121.38 3kph n LYS 126 Ca 0.44 0.00 0.06 0.00 -2.02 0.00 0.00 58.31 56.79 3kph n LYS 126 Cb 1.40 0.00 0.19 0.00 -0.02 0.00 0.00 35.03 36.61 3kph n LYS 126 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3kph n ASN 127 N 1.24 2.68 -0.02 4.39 3.02 -1.26 -4.35 115.26 120.95 3kph n ASN 127 Ca 0.00 -2.18 -0.06 0.00 -0.03 0.00 0.00 54.58 52.31 3kph n ASN 127 Cb 0.00 -0.39 0.14 0.00 -0.61 0.00 0.00 39.78 38.92 3kph n ASN 127 CO 0.00 0.00 0.00 -0.26 -2.62 0.00 0.00 177.26 174.38 3kph h PHE 128 N 2.30 0.68 -0.06 3.10 -1.00 -1.77 -0.42 116.94 119.77 3kph h PHE 128 Ca 0.00 -0.16 -0.01 0.00 2.81 0.00 0.00 57.97 60.61 3kph h PHE 128 Cb 0.82 -0.16 -0.00 0.00 3.61 0.00 0.00 35.95 40.22 3kph h PHE 128 CO 0.39 0.82 0.00 0.37 -1.61 0.00 0.00 178.31 178.28 3kph h GLN 129 N 0.51 0.11 -0.20 1.51 5.75 -1.79 -1.48 115.11 119.53 3kph h GLN 129 Ca 0.06 -0.03 0.05 0.00 -0.15 0.00 0.00 58.65 58.58 3kph h GLN 129 Cb 0.76 -0.01 -0.05 0.00 1.07 0.00 0.00 27.48 29.25 3kph h GLN 129 CO 0.06 0.37 -0.11 1.49 -2.65 0.00 0.00 178.83 178.00 3kph h GLU 130 N -0.16 -0.09 -0.51 1.69 4.81 -1.81 -0.61 114.58 117.90 3kph h GLU 130 Ca 0.02 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.23 3kph h GLU 130 Cb 0.32 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.70 3kph h GLU 130 CO 0.00 -0.06 0.21 -0.07 -0.73 0.00 0.00 179.01 178.37 3kph h LEU 131 N -0.09 0.66 0.28 1.64 3.38 -1.03 -0.86 115.31 119.29 3kph h LEU 131 Ca 0.11 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 3kph h LEU 131 Cb 0.26 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.84 3kph h LEU 131 CO -0.26 0.59 -0.14 -0.25 0.09 0.00 0.00 178.44 178.48 3kph h TRP 132 N 0.73 -0.35 -0.32 1.13 2.91 -0.40 0.43 115.95 120.08 3kph h TRP 132 Ca 0.18 -0.01 0.07 0.00 1.13 0.00 0.00 58.89 60.26 3kph h TRP 132 Cb 0.13 0.12 -0.08 0.00 -0.51 0.00 0.00 29.16 28.82 3kph h TRP 132 CO 0.01 -0.14 -0.21 -0.44 -1.03 0.00 0.00 178.44 176.63 3kph h ASP 133 N -0.50 -0.70 -0.84 2.65 3.45 -0.85 0.26 116.42 119.90 3kph h ASP 133 Ca -0.04 0.14 0.07 0.00 0.43 0.00 0.00 57.03 57.64 3kph h ASP 133 Cb 0.37 0.35 -0.06 0.00 -0.56 0.00 0.00 39.33 39.43 3kph h ASP 133 CO 0.06 -0.24 0.50 0.50 -1.57 0.00 0.00 179.24 178.49 3kph h LYS 134 N -0.18 0.87 -0.50 3.56 1.63 -0.94 0.44 116.57 121.45 3kph h LYS 134 Ca 0.16 -0.05 -0.07 0.00 -0.85 0.00 0.00 60.65 59.84 3kph h LYS 134 Cb 0.43 -0.20 -0.02 0.00 -0.60 0.00 0.00 32.23 31.84 3kph h LYS 134 CO -0.42 0.57 0.02 0.00 -3.45 0.00 0.00 179.45 176.17 3kph h ALA 135 N 1.42 1.09 0.05 5.00 0.00 0.03 0.28 119.26 127.13 3kph h ALA 135 Ca 0.38 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 3kph h ALA 135 Cb 0.24 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3kph h ALA 135 CO -0.20 0.58 -0.02 0.28 0.00 0.00 0.00 179.25 179.89 3kph h VAL 136 N 0.77 1.10 -0.31 0.00 2.07 0.75 -1.03 116.25 119.62 3kph h VAL 136 Ca 0.15 -0.49 0.05 0.00 0.82 0.00 0.00 66.70 67.23 3kph h VAL 136 Cb 0.44 1.43 -0.05 0.00 -1.52 0.00 0.00 31.29 31.59 3kph h VAL 136 CO 0.02 0.12 0.02 0.50 0.02 0.00 0.00 177.57 178.25 3kph h LYS 137 N -0.28 0.12 -0.22 1.57 3.64 0.10 -0.50 116.57 121.01 3kph h LYS 137 Ca -0.01 -0.01 -0.10 0.00 -1.27 0.00 0.00 60.65 59.26 3kph h LYS 137 Cb 0.25 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.03 3kph h LYS 137 CO 0.01 0.08 -0.31 -0.07 -2.27 0.00 0.00 179.45 176.88 3kph h LEU 138 N 0.12 0.45 -0.06 5.20 3.38 -0.93 -2.36 115.31 121.11 3kph h LEU 138 Ca 0.15 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 3kph h LEU 138 Cb 0.18 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 3kph h LEU 138 CO -0.23 0.74 0.02 0.74 0.09 0.00 0.00 178.44 179.80 3kph h THR 139 N 0.38 1.18 -0.54 0.22 2.02 -0.67 0.81 112.91 116.31 3kph h THR 139 Ca 0.05 -0.55 0.11 0.00 0.77 0.00 0.00 66.41 66.79 3kph h THR 139 Cb 0.74 1.44 -0.11 0.00 -1.74 0.00 0.00 68.15 68.49 3kph h THR 139 CO 0.06 0.15 -0.23 0.11 0.37 0.00 0.00 175.52 175.98 3kph h LYS 140 N -0.12 -0.10 -0.31 6.66 1.57 -0.97 0.38 116.57 123.68 3kph h LYS 140 Ca 0.02 0.01 0.03 0.00 -1.87 0.00 0.00 60.65 58.84 3kph h LYS 140 Cb 0.23 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.54 3kph h LYS 140 CO -0.00 -0.07 0.21 0.93 -0.57 0.00 0.00 179.45 179.95 3kph h GLU 141 N -0.10 0.27 0.00 3.15 5.08 -0.91 -0.57 114.58 121.50 3kph h GLU 141 Ca 0.25 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.58 3kph h GLU 141 Cb 0.49 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.68 3kph h GLU 141 CO -0.61 0.18 -0.03 0.52 -1.00 0.00 0.00 179.01 178.07 3kph h MET 142 N 0.28 0.00 -0.07 2.33 2.86 0.22 -0.81 114.93 119.75 3kph h MET 142 Ca 0.13 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.77 3kph h MET 142 Cb 0.17 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.83 3kph h MET 142 CO -0.03 0.03 0.03 -0.22 1.06 0.00 0.00 176.91 177.78 3kph h LYS 143 N 0.00 0.11 0.27 1.72 3.64 -0.62 0.14 116.57 121.82 3kph h LYS 143 Ca -0.00 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 3kph h LYS 143 Cb 0.34 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.15 3kph h LYS 143 CO 0.00 0.25 -0.13 0.82 -2.27 0.00 0.00 179.45 178.13 3kph h ILE 144 N -0.06 0.75 -0.63 2.00 2.04 -1.43 -2.52 117.51 117.66 3kph h ILE 144 Ca 0.02 -0.70 0.09 0.00 1.00 0.00 0.00 64.86 65.27 3kph h ILE 144 Cb 0.18 1.11 -0.07 0.00 -0.74 0.00 0.00 36.82 37.30 3kph h ILE 144 CO -0.00 0.14 0.26 0.11 0.00 0.00 0.00 178.15 178.66 3kph h LYS 145 N -0.75 0.45 -0.00 2.37 1.79 -1.17 -2.56 116.57 116.70 3kph h LYS 145 Ca -0.04 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.41 3kph h LYS 145 Cb 0.50 -0.10 0.00 0.00 -1.58 0.00 0.00 32.23 31.05 3kph h LYS 145 CO 0.06 0.30 -0.15 1.28 -1.08 0.00 0.00 179.45 179.86 3kph n LEU 146 N -4.95 0.41 -4.58 2.94 4.32 0.48 -4.86 117.00 110.76 3kph n LEU 146 Ca 0.09 0.08 -0.58 0.00 -0.02 0.00 0.00 56.01 55.58 3kph n LEU 146 Cb 0.26 -0.24 -0.08 0.00 -1.62 0.00 0.00 43.42 41.74 3kph n LEU 146 CO 0.23 0.08 1.48 1.17 -1.22 0.00 0.00 177.39 179.13 3kph n LYS 147 N -1.12 0.77 -3.60 3.23 4.81 -0.95 -0.28 118.16 121.02 3kph n LYS 147 Ca 0.12 0.26 -0.23 0.00 -0.87 0.00 0.00 58.31 57.59 3kph n LYS 147 Cb 0.30 -1.99 0.07 0.00 0.02 0.00 0.00 35.03 33.43 3kph n LYS 147 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3kph n GLY 148 N 5.27 -0.47 0.53 3.14 0.00 -1.26 -4.87 105.19 107.53 3kph n GLY 148 Ca 0.35 0.20 0.08 0.00 0.00 0.00 0.00 46.02 46.65 3kph n GLY 148 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3kph n GLN 149 N -4.68 1.39 -4.07 1.61 1.13 0.61 -5.00 117.38 108.38 3kph n GLN 149 Ca -0.09 -1.22 -0.39 0.00 -1.94 0.00 0.00 57.00 53.36 3kph n GLN 149 Cb 0.59 -1.28 -0.00 0.00 0.11 0.00 0.00 30.24 29.66 3kph n GLN 149 CO 0.00 0.00 0.00 1.17 -1.44 0.00 0.00 177.06 176.79 3kph n LYS 150 N 0.54 -0.42 -2.53 -1.09 3.00 -1.26 -4.89 118.16 111.51 3kph n LYS 150 Ca 0.08 0.00 -0.41 0.00 -0.00 0.00 0.00 58.31 57.98 3kph n LYS 150 Cb 0.37 -2.27 -0.04 0.00 0.00 0.00 0.00 35.03 33.09 3kph n LYS 150 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 3kph s LEU 151 N -7.17 4.47 -0.50 3.14 2.96 -1.26 -5.00 118.68 115.32 3kph s LEU 151 Ca 0.35 2.03 0.07 0.00 -0.22 0.00 0.00 54.13 56.36 3kph s LEU 151 Cb -0.20 -3.60 0.19 0.00 0.50 0.00 0.00 46.19 43.08 3kph s LEU 151 CO 0.87 -0.24 0.70 -0.62 -1.32 0.00 0.00 176.35 175.74 3kph s ASP 152 N 0.11 -1.31 -0.11 3.68 2.15 -1.26 -5.14 116.67 114.79 3kph s ASP 152 Ca 0.50 -1.70 -0.13 0.00 0.43 0.00 0.00 52.55 51.66 3kph s ASP 152 Cb -0.28 1.79 0.03 0.00 -0.30 0.00 0.00 42.92 44.16 3kph s ASP 152 CO 0.33 -0.07 0.35 -0.76 -0.17 0.00 0.00 175.17 174.85 3kph s LEU 153 N 0.94 0.68 -0.13 -1.34 2.01 -1.26 -5.16 118.68 114.43 3kph s LEU 153 Ca 0.29 0.61 -0.06 0.00 0.01 0.00 0.00 54.13 54.98 3kph s LEU 153 Cb -0.00 1.22 -0.04 0.00 0.01 0.00 0.00 46.19 47.38 3kph s LEU 153 CO -0.06 -0.17 0.08 -0.13 1.01 0.00 0.00 176.35 177.08 3kph s ARG 154 N -0.05 3.47 0.00 1.70 3.00 -1.26 -4.79 118.95 121.02 3kph s ARG 154 Ca -0.02 -0.27 0.00 0.00 0.00 0.00 0.00 55.73 55.44 3kph s ARG 154 Cb -0.03 -3.09 0.00 0.00 0.00 0.00 0.00 34.95 31.83 3kph s ARG 154 CO 0.01 0.61 0.00 -3.47 0.00 0.00 0.00 175.30 172.46 3kph n ASP 155 N 2.47 0.00 0.11 0.23 -0.08 -1.26 -4.79 116.55 113.24 3kph n ASP 155 Ca -0.19 0.00 -0.01 0.00 -1.51 0.00 0.00 54.79 53.08 3kph n ASP 155 Cb 0.54 0.00 0.02 0.00 2.34 0.00 0.00 41.12 44.02 3kph n ASP 155 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 3kph h GLY 156 N 0.00 0.00 0.00 0.27 0.00 -1.98 -2.90 103.07 98.45 3kph h GLY 156 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3kph h GLY 156 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.72 3kph n GLU 157 N -3.36 0.00 -0.28 4.80 -0.58 -1.26 0.36 120.64 120.32 3kph n GLU 157 Ca 0.01 0.54 0.08 0.00 -0.42 0.00 0.00 57.16 57.37 3kph n GLU 157 Cb 0.78 -1.42 0.21 0.00 -0.57 0.00 0.00 31.44 30.43 3kph n GLU 157 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 3kph h VAL 158 N 0.00 0.29 0.02 2.62 2.07 -1.87 0.67 116.25 120.05 3kph h VAL 158 Ca 0.00 -0.04 -0.00 0.00 0.82 0.00 0.00 66.70 67.48 3kph h VAL 158 Cb 0.00 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 29.93 3kph h VAL 158 CO 0.00 0.02 -0.01 0.00 0.02 0.00 0.00 177.57 177.60 3kph h ALA 159 N 1.77 -0.03 -0.08 1.67 0.00 -1.33 -1.11 119.26 120.15 3kph h ALA 159 Ca 0.48 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 55.24 3kph h ALA 159 Cb 0.90 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 3kph h ALA 159 CO -0.70 -0.51 -0.56 0.97 0.00 0.00 0.00 179.25 178.44 3kph h ILE 160 N -0.04 1.37 -0.69 0.00 6.09 0.18 -2.72 117.51 121.70 3kph h ILE 160 Ca -0.00 -1.88 0.03 0.00 -1.37 0.00 0.00 64.86 61.64 3kph h ILE 160 Cb 0.03 1.93 -0.04 0.00 0.47 0.00 0.00 36.82 39.20 3kph h ILE 160 CO 0.00 0.56 0.43 0.78 -3.07 0.00 0.00 178.15 176.85 3kph h ASN 161 N 0.19 0.71 -0.51 2.19 2.35 0.48 -1.51 115.58 119.48 3kph h ASN 161 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3kph h ASN 161 Cb 1.04 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 39.24 3kph h ASN 161 CO 0.09 0.49 0.32 0.50 -1.65 0.00 0.00 177.43 177.17 3kph h LYS 162 N 0.84 0.67 -0.98 0.81 1.63 -0.97 0.10 116.57 118.69 3kph h LYS 162 Ca 0.28 -0.05 0.01 0.00 -0.85 0.00 0.00 60.65 60.04 3kph h LYS 162 Cb 0.03 -0.15 -0.05 0.00 -0.60 0.00 0.00 32.23 31.46 3kph h LYS 162 CO -0.11 0.47 0.65 0.28 -3.45 0.00 0.00 179.45 177.28 3kph h VAL 163 N 0.68 1.24 -0.31 2.00 2.07 -1.08 0.17 116.25 121.03 3kph h VAL 163 Ca 0.18 -0.45 -0.04 0.00 0.82 0.00 0.00 66.70 67.21 3kph h VAL 163 Cb -0.05 -0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 29.53 3kph h VAL 163 CO -0.04 0.24 0.03 -0.09 0.02 0.00 0.00 177.57 177.74 3kph h ARG 164 N 1.31 0.52 0.00 1.57 9.65 -0.64 0.44 114.38 127.23 3kph h ARG 164 Ca 0.36 -0.15 -0.01 0.00 -1.10 0.00 0.00 59.98 59.09 3kph h ARG 164 Cb -0.12 -0.06 -0.00 0.00 -1.39 0.00 0.00 29.97 28.40 3kph h ARG 164 CO -0.09 0.63 -0.04 1.49 2.80 0.00 0.00 179.97 184.77 3kph h GLU 165 N 0.33 0.00 0.04 0.20 4.81 -0.07 0.14 114.58 120.03 3kph h GLU 165 Ca 0.09 0.00 -0.35 0.00 -0.13 0.00 0.00 59.36 58.97 3kph h GLU 165 Cb 0.37 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.71 3kph h GLU 165 CO 0.01 0.04 -2.12 1.28 -0.73 0.00 0.00 179.01 177.49 3kph n LEU 166 N -4.42 1.71 -0.86 1.64 4.77 -0.02 -4.58 117.00 115.23 3kph n LEU 166 Ca -0.03 0.13 0.04 0.00 -0.03 0.00 0.00 56.01 56.12 3kph n LEU 166 Cb 0.12 -0.39 0.17 0.00 -2.33 0.00 0.00 43.42 40.98 3kph n LEU 166 CO 0.34 0.68 0.30 0.49 -1.33 0.00 0.00 177.39 177.87 3kph n PHE 167 N -3.16 0.20 0.33 -1.77 3.01 0.12 -4.85 117.46 111.34 3kph n PHE 167 Ca -0.32 -1.40 0.06 0.00 1.01 0.00 0.00 57.45 56.81 3kph n PHE 167 Cb 1.06 -0.24 0.34 0.00 -0.01 0.00 0.00 39.48 40.62 3kph n PHE 167 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 3kph h GLY 168 N 1.10 0.00 0.66 1.37 0.00 -0.87 0.51 103.07 105.83 3kph h GLY 168 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 3kph h GLY 168 CO 0.07 0.00 -0.73 -1.14 0.00 0.00 0.00 176.54 174.74 3kph n SER 169 N -2.65 0.66 -4.75 0.19 3.41 -1.26 -4.64 113.62 104.58 3kph n SER 169 Ca -0.01 -0.45 -0.41 0.00 -0.26 0.00 0.00 58.87 57.75 3kph n SER 169 Cb 0.74 0.54 -0.03 0.00 -0.26 0.00 0.00 64.21 65.21 3kph n SER 169 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3kph s ASP 170 N -3.17 6.82 0.20 4.04 -1.08 0.18 -4.92 116.67 118.73 3kph s ASP 170 Ca 0.09 2.53 -0.12 0.00 -0.52 0.00 0.00 52.55 54.52 3kph s ASP 170 Cb 0.16 -2.62 0.23 0.00 -1.46 0.00 0.00 42.92 39.23 3kph s ASP 170 CO 0.76 -0.55 1.69 0.50 0.52 0.00 0.00 175.17 178.09 3kph h LYS 171 N 4.77 0.16 -0.08 4.34 3.64 -1.91 -0.83 116.57 126.65 3kph h LYS 171 Ca -0.46 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 58.86 3kph h LYS 171 Cb 1.22 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 3kph h LYS 171 CO 0.74 0.10 -0.15 -0.91 -2.27 0.00 0.00 179.45 176.97 3kph h ASN 172 N 0.16 0.27 0.83 4.20 2.35 -1.95 -2.46 115.58 118.97 3kph h ASN 172 Ca 0.27 -0.56 0.00 0.00 -0.55 0.00 0.00 56.30 55.47 3kph h ASN 172 Cb 0.41 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.71 3kph h ASN 172 CO -0.42 0.77 0.00 1.62 -1.65 0.00 0.00 177.43 177.76 3kph h VAL 173 N -0.23 0.00 0.28 2.81 3.04 -1.85 -1.30 116.25 118.99 3kph h VAL 173 Ca 0.00 -0.38 -0.01 0.00 -1.01 0.00 0.00 66.70 65.30 3kph h VAL 173 Cb 0.73 1.28 0.00 0.00 -2.01 0.00 0.00 31.29 31.29 3kph h VAL 173 CO 0.03 0.00 -0.13 0.50 -1.01 0.00 0.00 177.57 176.96 3kph h LYS 174 N 0.00 -0.36 -0.94 4.17 3.64 -1.05 -0.54 116.57 121.48 3kph h LYS 174 Ca 0.00 0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.43 3kph h LYS 174 Cb 0.41 0.08 -0.05 0.00 -0.41 0.00 0.00 32.23 32.26 3kph h LYS 174 CO 0.00 -0.01 0.62 0.93 -2.27 0.00 0.00 179.45 178.72 3kph h GLU 175 N -0.87 1.19 -0.53 1.90 5.08 -1.18 -0.62 114.58 119.56 3kph h GLU 175 Ca -0.04 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.22 3kph h GLU 175 Cb 0.51 -0.27 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 3kph h GLU 175 CO 0.06 0.79 0.21 1.25 -1.00 0.00 0.00 179.01 180.32 3kph h LEU 176 N 1.23 0.73 -0.61 1.33 6.46 -1.21 -1.55 115.31 121.68 3kph h LEU 176 Ca 0.36 -0.17 -0.11 0.00 -0.12 0.00 0.00 57.88 57.84 3kph h LEU 176 Cb -0.07 -0.19 -0.02 0.00 -0.73 0.00 0.00 40.66 39.66 3kph h LEU 176 CO -0.10 0.70 -0.08 -0.25 -0.62 0.00 0.00 178.44 178.09 3kph h TRP 177 N 0.71 1.12 0.79 1.25 2.91 -0.48 -0.17 115.95 122.07 3kph h TRP 177 Ca 0.17 -0.22 -0.04 0.00 1.13 0.00 0.00 58.89 59.94 3kph h TRP 177 Cb 0.20 -0.28 0.01 0.00 -0.51 0.00 0.00 29.16 28.58 3kph h TRP 177 CO 0.01 1.03 -0.38 2.35 -1.03 0.00 0.00 178.44 180.42 3kph h TRP 178 N 0.91 -0.98 -0.74 2.65 -0.00 -0.99 -0.58 115.95 116.22 3kph h TRP 178 Ca 0.15 -0.02 0.06 0.00 -0.00 0.00 0.00 58.89 59.07 3kph h TRP 178 Cb 0.64 0.32 -0.05 0.00 -0.00 0.00 0.00 29.16 30.08 3kph h TRP 178 CO 0.04 -0.61 0.49 0.35 -0.00 0.00 0.00 178.44 178.71 3kph h PHE 179 N -1.21 0.81 0.18 2.65 3.57 -1.34 -2.25 116.94 119.35 3kph h PHE 179 Ca -0.11 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.40 3kph h PHE 179 Cb 0.81 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 39.29 3kph h PHE 179 CO 0.02 0.44 -0.09 -0.09 -2.23 0.00 0.00 178.31 176.36 3kph h ARG 180 N 0.81 -0.23 -0.88 1.11 2.43 -0.93 -1.93 114.38 114.75 3kph h ARG 180 Ca 0.31 0.02 0.11 0.00 -0.81 0.00 0.00 59.98 59.61 3kph h ARG 180 Cb 0.20 0.05 -0.08 0.00 -0.42 0.00 0.00 29.97 29.72 3kph h ARG 180 CO -0.10 0.01 0.52 0.66 -1.51 0.00 0.00 179.97 179.55 3kph h SER 181 N -0.45 0.73 -0.19 -3.80 4.64 -0.59 -0.64 113.55 113.25 3kph h SER 181 Ca -0.02 0.06 -0.04 0.00 -0.47 0.00 0.00 61.79 61.31 3kph h SER 181 Cb 0.35 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.35 3kph h SER 181 CO 0.04 0.39 -0.04 -0.07 -0.87 0.00 0.00 176.83 176.28 3kph h LEU 182 N 0.83 0.37 -0.34 5.97 4.07 -1.36 -1.81 115.31 123.03 3kph h LEU 182 Ca 0.44 -0.36 0.04 0.00 0.08 0.00 0.00 57.88 58.08 3kph h LEU 182 Cb 0.46 -0.10 -0.04 0.00 1.08 0.00 0.00 40.66 42.06 3kph h LEU 182 CO -0.27 0.64 0.13 -0.07 -1.08 0.00 0.00 178.44 177.79 3kph h LEU 183 N 0.09 0.15 -0.81 1.67 3.38 -0.59 0.27 115.31 119.47 3kph h LEU 183 Ca 0.05 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 3kph h LEU 183 Cb 0.47 0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.20 3kph h LEU 183 CO 0.02 0.13 0.39 0.58 0.09 0.00 0.00 178.44 179.65 3kph h VAL 184 N 0.28 1.25 -0.54 1.22 2.07 -1.14 -1.26 116.25 118.14 3kph h VAL 184 Ca 0.15 -0.70 -0.06 0.00 0.82 0.00 0.00 66.70 66.91 3kph h VAL 184 Cb 0.11 0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.08 3kph h VAL 184 CO -0.15 0.30 0.11 0.11 0.02 0.00 0.00 177.57 177.96 3kph h LYS 185 N 1.15 0.84 -0.37 1.57 1.57 -0.56 -2.08 116.57 118.69 3kph h LYS 185 Ca 0.28 -0.18 -0.08 0.00 -1.87 0.00 0.00 60.65 58.79 3kph h LYS 185 Cb 0.11 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 3kph h LYS 185 CO -0.04 0.77 -0.12 0.78 -0.57 0.00 0.00 179.45 180.27 3kph h GLY 186 N 0.98 0.71 2.00 3.86 0.00 0.45 -1.87 103.07 109.19 3kph h GLY 186 Ca 0.17 -0.52 -0.13 0.00 0.00 0.00 0.00 47.33 46.85 3kph h GLY 186 CO 0.00 0.48 -0.64 -0.24 0.00 0.00 0.00 176.54 176.14 3kph h VAL 187 N 0.60 1.10 0.03 4.60 3.04 -1.00 -2.68 116.25 121.94 3kph h VAL 187 Ca 0.10 -2.55 -0.26 0.00 -1.01 0.00 0.00 66.70 62.98 3kph h VAL 187 Cb 0.56 2.54 0.02 0.00 -2.01 0.00 0.00 31.29 32.40 3kph h VAL 187 CO 0.03 0.63 -1.06 1.88 -1.01 0.00 0.00 177.57 178.04 3kph h TYR 188 N 0.00 0.88 -0.10 3.17 -1.99 -1.23 -2.59 116.97 115.10 3kph h TYR 188 Ca -0.01 -0.50 -0.22 0.00 2.00 0.00 0.00 58.73 60.00 3kph h TYR 188 Cb 1.49 -0.09 0.01 0.00 2.00 0.00 0.00 36.73 40.14 3kph h TYR 188 CO 0.00 1.34 -0.82 1.37 -0.00 0.00 0.00 178.16 180.05 3kph h LEU 189 N 0.31 0.81 -1.30 3.88 8.10 -1.39 -1.23 115.31 124.49 3kph h LEU 189 Ca -0.13 -0.56 -0.02 0.00 0.11 0.00 0.00 57.88 57.28 3kph h LEU 189 Cb 1.72 -0.24 -0.02 0.00 -0.44 0.00 0.00 40.66 41.67 3kph h LEU 189 CO 0.20 1.34 0.20 0.40 -4.11 0.00 0.00 178.44 176.48 3kph h ILE 190 N 0.44 1.18 -0.38 0.15 5.03 -1.55 0.40 117.51 122.77 3kph h ILE 190 Ca -0.06 -0.53 -0.02 0.00 -0.12 0.00 0.00 64.86 64.13 3kph h ILE 190 Cb 1.44 0.59 -0.02 0.00 -3.03 0.00 0.00 36.82 35.80 3kph h ILE 190 CO 0.16 0.21 0.15 0.50 -0.68 0.00 0.00 178.15 178.49 3kph h LYS 191 N 0.68 0.56 -0.11 2.37 3.64 -1.21 -1.16 116.57 121.35 3kph h LYS 191 Ca 0.17 -0.10 0.02 0.00 -1.27 0.00 0.00 60.65 59.46 3kph h LYS 191 Cb 0.12 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 3kph h LYS 191 CO -0.02 0.55 -0.02 0.00 -2.27 0.00 0.00 179.45 177.69 3kph h ARG 192 N 0.46 0.01 -0.58 1.90 3.08 0.01 -2.18 114.38 117.09 3kph h ARG 192 Ca 0.12 -0.00 0.09 0.00 0.07 0.00 0.00 59.98 60.27 3kph h ARG 192 Cb 0.20 -0.00 -0.11 0.00 0.08 0.00 0.00 29.97 30.13 3kph h ARG 192 CO -0.01 0.01 -0.39 -0.92 -1.07 0.00 0.00 179.97 177.59 3kph h TYR 193 N 0.01 -1.13 0.00 3.04 3.20 0.15 0.33 116.97 122.57 3kph h TYR 193 Ca 0.05 0.08 0.00 0.00 3.14 0.00 0.00 58.73 62.00 3kph h TYR 193 Cb 0.07 0.58 0.00 0.00 1.54 0.00 0.00 36.73 38.92 3kph h TYR 193 CO -0.14 -0.41 0.00 0.66 -1.64 0.00 0.00 178.16 176.63 3kph n TYR 194 N -5.42 0.00 -1.06 -3.82 4.02 -0.47 -1.92 117.16 108.48 3kph n TYR 194 Ca 0.03 0.00 0.05 0.00 -0.01 0.00 0.00 57.90 57.97 3kph n TYR 194 Cb 0.35 0.00 0.27 0.00 -0.02 0.00 0.00 39.34 39.94 3kph n TYR 194 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 3kph n GLU 195 N -0.77 2.98 -1.89 -0.72 1.02 0.11 -5.00 120.64 116.37 3kph n GLU 195 Ca 0.09 -2.94 -0.02 0.00 -0.02 0.00 0.00 57.16 54.27 3kph n GLU 195 Cb 0.04 -1.91 -0.01 0.00 -0.02 0.00 0.00 31.44 29.54 3kph n GLU 195 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3kph n GLY 196 N -0.50 -4.30 1.13 0.62 0.00 -0.81 -5.04 105.19 96.30 3kph n GLY 196 Ca 0.26 0.28 0.00 0.00 0.00 0.00 0.00 46.02 46.56 3kph n GLY 196 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3kph n ASP 197 N 0.93 0.00 -0.63 1.61 8.00 -1.24 -4.91 116.55 120.31 3kph n ASP 197 Ca -0.12 0.00 0.05 0.00 0.71 0.00 0.00 54.79 55.44 3kph n ASP 197 Cb 0.18 0.27 -0.01 0.00 -0.02 0.00 0.00 41.12 41.53 3kph n ASP 197 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3kph n ILE 198 N -1.85 0.00 -0.40 0.53 0.13 -1.26 -4.72 119.36 111.79 3kph n ILE 198 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.65 3kph n ILE 198 Cb 0.00 -0.13 0.00 0.00 -0.84 0.00 0.00 39.64 38.67 3kph n ILE 198 CO 0.00 0.00 0.00 -0.62 2.80 0.00 0.00 176.55 178.73 3kph n GLU 199 N -1.74 0.00 0.15 9.51 -0.58 -1.26 -4.77 120.64 121.94 3kph n GLU 199 Ca 0.00 0.00 0.01 0.00 -0.42 0.00 0.00 57.16 56.75 3kph n GLU 199 Cb 0.18 -2.57 0.30 0.00 -0.57 0.00 0.00 31.44 28.78 3kph n GLU 199 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 3kph h LEU 200 N 0.00 0.09 0.00 -4.62 3.38 -1.99 -3.07 115.31 109.10 3kph h LEU 200 Ca 0.00 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.93 3kph h LEU 200 Cb 0.00 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.72 3kph h LEU 200 CO 0.00 0.48 0.13 0.00 0.09 0.00 0.00 178.44 179.14 3kph n ALA 201 N -2.47 0.69 -2.50 1.53 0.00 -1.26 -0.53 120.51 115.98 3kph n ALA 201 Ca -0.02 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.40 3kph n ALA 201 Cb 0.44 -0.58 0.05 0.00 0.00 0.00 0.00 19.45 19.36 3kph n ALA 201 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3kph n THR 202 N -1.11 1.21 0.92 0.00 -2.24 -1.16 -3.53 114.28 108.38 3kph n THR 202 Ca 0.00 -2.63 0.09 0.00 -2.27 0.00 0.00 64.05 59.24 3kph n THR 202 Cb 0.13 0.69 -0.11 0.00 -2.10 0.00 0.00 70.33 68.94 3kph n THR 202 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3kph n THR 203 N -0.36 0.00 0.00 4.28 -2.24 0.31 -5.02 114.28 111.25 3kph n THR 203 Ca 0.14 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 3kph n THR 203 Cb 0.91 1.00 0.00 0.00 -2.10 0.00 0.00 70.33 70.15 3kph n THR 203 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3kph n SER 204 N -1.44 0.00 0.20 3.42 3.41 -1.26 -4.97 113.62 112.98 3kph n SER 204 Ca 0.04 0.00 0.04 0.00 -0.26 0.00 0.00 58.87 58.69 3kph n SER 204 Cb 0.31 0.00 0.44 0.00 -0.26 0.00 0.00 64.21 64.70 3kph n SER 204 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 3kph h ASP 205 N 0.00 0.04 0.22 4.04 3.32 -1.95 -1.23 116.42 120.87 3kph h ASP 205 Ca 0.00 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.03 3kph h ASP 205 Cb 0.00 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.54 3kph h ASP 205 CO 0.00 0.27 -0.11 0.15 -1.72 0.00 0.00 179.24 177.83 3kph h PHE 206 N 0.04 -0.28 -0.66 4.55 3.57 -1.97 -1.85 116.94 120.34 3kph h PHE 206 Ca 0.01 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 3kph h PHE 206 Cb 0.42 0.09 -0.03 0.00 2.79 0.00 0.00 35.95 39.22 3kph h PHE 206 CO 0.00 0.04 0.39 0.00 -2.23 0.00 0.00 178.31 176.51 3kph h ALA 207 N 0.07 1.44 -0.36 2.41 0.00 -1.81 0.51 119.26 121.51 3kph h ALA 207 Ca -0.03 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 3kph h ALA 207 Cb 0.44 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3kph h ALA 207 CO 0.05 0.48 0.18 0.87 0.00 0.00 0.00 179.25 180.83 3kph h LYS 208 N 0.91 0.52 -0.08 0.00 1.57 -1.15 -0.73 116.57 117.62 3kph h LYS 208 Ca 0.24 -0.08 -0.09 0.00 -1.87 0.00 0.00 60.65 58.85 3kph h LYS 208 Cb -0.02 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 3kph h LYS 208 CO -0.04 0.47 -0.36 0.00 -0.57 0.00 0.00 179.45 178.94 3kph h ALA 209 N 1.03 1.25 -0.09 3.86 0.00 -0.73 -1.42 119.26 123.17 3kph h ALA 209 Ca 0.13 -0.36 -0.14 0.00 0.00 0.00 0.00 54.91 54.53 3kph h ALA 209 Cb 0.12 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3kph h ALA 209 CO -0.02 0.52 -0.57 0.28 0.00 0.00 0.00 179.25 179.47 3kph h VAL 210 N 0.13 1.37 -0.02 0.00 2.07 -0.46 -3.27 116.25 116.06 3kph h VAL 210 Ca 0.01 -1.89 0.00 0.00 0.82 0.00 0.00 66.70 65.64 3kph h VAL 210 Cb 0.71 1.93 0.00 0.00 -1.52 0.00 0.00 31.29 32.41 3kph h VAL 210 CO 0.05 0.56 -0.14 0.49 0.02 0.00 0.00 177.57 178.56 3kph n PHE 211 N -3.90 0.00 1.19 1.57 3.72 -0.32 -5.08 117.46 114.63 3kph n PHE 211 Ca -0.02 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.50 3kph n PHE 211 Cb 0.60 0.00 0.26 0.00 -0.94 0.00 0.00 39.48 39.40 3kph n PHE 211 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10