#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dfp s LEU 17 N 0.00 4.52 -1.99 1.39 2.96 0.28 -4.23 118.68 121.61 1dfp s LEU 17 Ca 0.00 1.64 0.00 0.00 -0.22 0.00 0.00 54.13 55.55 1dfp s LEU 17 Cb 0.00 -3.47 0.00 0.00 0.50 0.00 0.00 46.19 43.22 1dfp s LEU 17 CO 0.00 0.14 0.00 0.61 -1.32 0.00 0.00 176.35 175.78 1dfp n GLY 18 N 1.28 1.04 0.00 7.98 0.00 -1.25 -2.84 105.19 111.40 1dfp n GLY 18 Ca -0.04 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1dfp n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dfp n GLY 19 N -0.69 2.63 3.20 -0.02 0.00 -1.26 -4.89 105.19 104.16 1dfp n GLY 19 Ca -0.22 -1.92 -0.09 0.00 0.00 0.00 0.00 46.02 43.79 1dfp n GLY 19 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1dfp s ARG 20 N 3.40 0.79 0.34 1.61 1.70 -0.37 -4.94 118.95 121.48 1dfp s ARG 20 Ca 0.00 -0.85 -0.29 0.00 -0.47 0.00 0.00 55.73 54.13 1dfp s ARG 20 Cb 0.00 0.32 -0.11 0.00 -0.57 0.00 0.00 34.95 34.59 1dfp s ARG 20 CO 0.00 -0.24 1.53 -1.91 -1.08 0.00 0.00 175.30 173.60 1dfp n GLU 21 N 0.19 2.68 -2.63 3.89 2.13 -1.26 -0.96 120.64 124.68 1dfp n GLU 21 Ca -0.16 0.95 -0.30 0.00 0.66 0.00 0.00 57.16 58.30 1dfp n GLU 21 Cb 0.61 -2.70 -0.02 0.00 0.27 0.00 0.00 31.44 29.61 1dfp n GLU 21 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1dfp s ALA 22 N -0.65 3.30 0.12 4.31 0.00 0.03 -4.82 121.76 124.06 1dfp s ALA 22 Ca 0.58 -0.21 -0.31 0.00 0.00 0.00 0.00 51.96 52.01 1dfp s ALA 22 Cb -0.49 -2.77 -0.10 0.00 0.00 0.00 0.00 23.12 19.76 1dfp s ALA 22 CO 0.57 -0.20 1.83 -1.21 0.00 0.00 0.00 175.76 176.75 1dfp s GLU 23 N -4.25 4.14 0.00 0.00 8.01 -1.26 -4.88 118.70 120.45 1dfp s GLU 23 Ca 0.52 2.59 0.00 0.00 0.01 0.00 0.00 54.97 58.09 1dfp s GLU 23 Cb -0.10 -3.58 0.00 0.00 -4.31 0.00 0.00 34.13 26.13 1dfp s GLU 23 CO 0.37 -0.84 0.00 0.00 0.01 0.00 0.00 175.26 174.80 1dfp n ALA 24 N 5.64 0.00 -2.19 5.21 0.00 -1.26 -2.06 120.51 125.85 1dfp n ALA 24 Ca 0.18 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.39 1dfp n ALA 24 Cb 0.38 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.85 1dfp n ALA 24 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1dfp n HIS 25 N -0.04 2.79 1.74 0.00 8.25 -1.26 -4.66 115.22 122.04 1dfp n HIS 25 Ca 0.00 -2.44 0.11 0.00 -0.26 0.00 0.00 57.72 55.13 1dfp n HIS 25 Cb 0.00 -0.27 0.65 0.00 1.12 0.00 0.00 29.99 31.49 1dfp n HIS 25 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1dfp n ALA 26 N -0.64 2.50 -3.39 -1.41 0.00 -0.88 -4.02 120.51 112.69 1dfp n ALA 26 Ca 0.40 -0.14 -0.26 0.00 0.00 0.00 0.00 53.44 53.44 1dfp n ALA 26 Cb 0.88 -1.36 -0.09 0.00 0.00 0.00 0.00 19.45 18.89 1dfp n ALA 26 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1dfp n ARG 27 N -0.89 1.01 0.04 0.00 1.74 -1.26 -5.00 116.66 112.30 1dfp n ARG 27 Ca 0.16 -3.63 0.22 0.00 -0.77 0.00 0.00 57.85 53.83 1dfp n ARG 27 Cb 0.08 -1.68 0.69 0.00 -1.02 0.00 0.00 32.46 30.53 1dfp n ARG 27 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 1dfp h PRO 28 N 4.73 0.00 0.00 5.56 0.11 -1.78 -0.74 132.00 139.87 1dfp h PRO 28 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1dfp h PRO 28 Cb 0.83 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.94 1dfp h PRO 28 CO 0.53 0.00 -0.44 2.48 -0.21 0.00 0.00 178.00 180.36 1dfp n TYR 29 N -3.61 0.06 -2.08 0.65 0.18 -1.13 -2.46 117.16 108.78 1dfp n TYR 29 Ca 0.10 0.02 -0.42 0.00 1.88 0.00 0.00 57.90 59.48 1dfp n TYR 29 Cb 0.79 -0.33 -0.03 0.00 -0.38 0.00 0.00 39.34 39.39 1dfp n TYR 29 CO 0.00 0.00 0.00 1.41 -2.08 0.00 0.00 176.86 176.19 1dfp s MET 30 N -3.02 4.29 0.10 -3.48 1.75 -0.29 0.10 119.30 118.76 1dfp s MET 30 Ca 0.11 2.20 0.06 0.00 -1.25 0.00 0.00 55.69 56.80 1dfp s MET 30 Cb 0.17 -3.19 -0.03 0.00 2.84 0.00 0.00 34.83 34.62 1dfp s MET 30 CO 0.68 -0.46 -0.14 0.00 -0.65 0.00 0.00 175.02 174.45 1dfp s ALA 31 N 0.77 1.37 -0.17 4.11 0.00 -0.81 -4.50 121.76 122.53 1dfp s ALA 31 Ca 0.64 -1.18 -0.02 0.00 0.00 0.00 0.00 51.96 51.41 1dfp s ALA 31 Cb -0.40 -0.09 -0.01 0.00 0.00 0.00 0.00 23.12 22.62 1dfp s ALA 31 CO 0.34 0.14 -0.09 0.45 0.00 0.00 0.00 175.76 176.59 1dfp s SER 32 N -2.15 4.11 -0.27 0.00 0.15 -0.82 -1.54 113.70 113.17 1dfp s SER 32 Ca 0.04 -0.37 -0.14 0.00 0.70 0.00 0.00 55.95 56.19 1dfp s SER 32 Cb -0.07 -1.66 -0.04 0.00 -1.71 0.00 0.00 66.02 62.53 1dfp s SER 32 CO 0.03 0.07 0.33 -0.69 1.20 0.00 0.00 173.24 174.17 1dfp s VAL 33 N 0.91 5.21 0.06 4.45 1.01 0.49 -0.59 120.40 131.94 1dfp s VAL 33 Ca -0.02 0.48 0.07 0.00 0.00 0.00 0.00 61.98 62.50 1dfp s VAL 33 Cb -0.15 -3.65 -0.04 0.00 0.00 0.00 0.00 36.38 32.54 1dfp s VAL 33 CO 0.00 0.19 -0.15 -1.10 0.00 0.00 0.00 175.10 174.05 1dfp s GLN 34 N 1.90 2.11 -0.26 2.72 -0.21 0.80 0.31 119.66 127.03 1dfp s GLN 34 Ca 0.13 -0.98 0.02 0.00 0.02 0.00 0.00 55.36 54.55 1dfp s GLN 34 Cb -0.16 -2.25 0.06 0.00 1.00 0.00 0.00 33.01 31.67 1dfp s GLN 34 CO 0.10 0.53 -0.07 -1.17 -2.12 0.00 0.00 175.29 172.56 1dfp s LEU 35 N -1.71 3.19 -1.25 2.90 0.20 -0.81 -1.49 118.68 119.71 1dfp s LEU 35 Ca 0.17 -1.38 -0.07 0.00 0.69 0.00 0.00 54.13 53.53 1dfp s LEU 35 Cb -0.11 -1.39 0.01 0.00 -0.43 0.00 0.00 46.19 44.27 1dfp s LEU 35 CO 0.08 -0.23 0.97 0.59 -0.29 0.00 0.00 176.35 177.47 1dfp n ASN 36 N 4.52 -5.90 -0.03 3.68 3.02 -0.48 -2.82 115.26 117.25 1dfp n ASN 36 Ca -0.11 -0.44 -0.00 0.00 -0.03 0.00 0.00 54.58 53.99 1dfp n ASN 36 Cb 0.43 -4.56 -0.00 0.00 -0.61 0.00 0.00 39.78 35.04 1dfp n ASN 36 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1dfp n GLY 38 N -1.79 0.47 3.17 7.41 0.00 -1.26 -5.04 105.19 108.15 1dfp n GLY 38 Ca -0.01 -0.35 -0.27 0.00 0.00 0.00 0.00 46.02 45.39 1dfp n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dfp s ALA 39 N -1.98 1.62 0.09 4.61 0.00 -1.13 -5.09 121.76 119.89 1dfp s ALA 39 Ca 0.00 -0.77 -0.34 0.00 0.00 0.00 0.00 51.96 50.85 1dfp s ALA 39 Cb 0.00 -0.50 -0.14 0.00 0.00 0.00 0.00 23.12 22.48 1dfp s ALA 39 CO 0.00 0.32 1.61 1.58 0.00 0.00 0.00 175.76 179.27 1dfp n HIS 40 N 2.99 2.18 -0.03 0.00 -0.00 -1.26 -1.92 115.22 117.18 1dfp n HIS 40 Ca -0.17 0.27 -0.07 0.00 -0.00 0.00 0.00 57.72 57.75 1dfp n HIS 40 Cb 0.53 -2.54 -0.02 0.00 -0.00 0.00 0.00 29.99 27.96 1dfp n HIS 40 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.34 176.23 1dfp n LEU 41 N 3.98 1.25 -4.27 0.27 7.94 0.15 -4.86 117.00 121.45 1dfp n LEU 41 Ca 0.19 0.19 -0.18 0.00 -1.11 0.00 0.00 56.01 55.10 1dfp n LEU 41 Cb 0.27 -0.45 -0.09 0.00 0.53 0.00 0.00 43.42 43.68 1dfp n LEU 41 CO 0.66 -0.29 -0.14 0.00 -1.11 0.00 0.00 177.39 176.51 1dfp s GLY 43 N -3.33 1.81 0.28 0.00 0.00 0.48 -0.38 107.32 106.18 1dfp s GLY 43 Ca 0.40 -1.93 -0.19 0.00 0.00 0.00 0.00 44.72 43.00 1dfp s GLY 43 CO 0.25 -1.56 0.89 -0.32 0.00 0.00 0.00 173.10 172.36 1dfp s GLY 44 N -4.56 0.18 -0.03 0.20 0.00 -0.59 -4.09 107.32 98.43 1dfp s GLY 44 Ca 0.60 -0.48 -0.00 0.00 0.00 0.00 0.00 44.72 44.84 1dfp s GLY 44 CO 0.37 0.72 0.02 0.14 0.00 0.00 0.00 173.10 174.35 1dfp s VAL 45 N -2.49 0.04 -0.13 1.40 1.01 -0.64 -1.93 120.40 117.66 1dfp s VAL 45 Ca 0.17 0.21 -0.29 0.00 0.00 0.00 0.00 61.98 62.07 1dfp s VAL 45 Cb -0.04 -0.19 -0.03 0.00 0.00 0.00 0.00 36.38 36.12 1dfp s VAL 45 CO 0.08 0.14 1.39 -0.22 0.00 0.00 0.00 175.10 176.48 1dfp s LEU 46 N 1.34 4.23 0.00 3.92 2.96 0.12 -1.01 118.68 130.23 1dfp s LEU 46 Ca -0.06 1.87 0.03 0.00 -0.22 0.00 0.00 54.13 55.76 1dfp s LEU 46 Cb -0.13 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 43.02 1dfp s LEU 46 CO -0.03 -0.81 0.40 0.55 -1.32 0.00 0.00 176.35 175.14 1dfp n VAL 47 N 5.38 0.00 -3.70 1.68 3.14 -0.67 -1.53 118.33 122.63 1dfp n VAL 47 Ca 0.15 -0.47 -0.01 0.00 -2.96 0.00 0.00 64.34 61.05 1dfp n VAL 47 Cb 0.44 1.04 -0.01 0.00 -1.06 0.00 0.00 33.84 34.25 1dfp n VAL 47 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1dfp s ALA 48 N -0.74 -1.90 0.50 1.55 0.00 -1.20 -4.70 121.76 115.27 1dfp s ALA 48 Ca 0.03 0.36 0.24 0.00 0.00 0.00 0.00 51.96 52.59 1dfp s ALA 48 Cb 0.03 0.52 1.31 0.00 0.00 0.00 0.00 23.12 24.98 1dfp s ALA 48 CO 0.08 -1.05 1.95 0.93 0.00 0.00 0.00 175.76 177.67 1dfp h GLU 49 N 2.00 0.12 0.00 0.00 5.08 -1.96 -3.09 114.58 116.73 1dfp h GLU 49 Ca -0.27 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 1dfp h GLU 49 Cb 1.22 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1dfp h GLU 49 CO 0.27 0.08 -0.11 0.94 -1.00 0.00 0.00 179.01 179.18 1dfp n GLN 50 N -4.39 1.19 -4.52 2.33 7.27 -1.26 -0.67 117.38 117.34 1dfp n GLN 50 Ca 0.13 -1.50 -0.21 0.00 0.07 0.00 0.00 57.00 55.50 1dfp n GLN 50 Cb 0.67 -0.93 -0.15 0.00 2.41 0.00 0.00 30.24 32.24 1dfp n GLN 50 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 1dfp s TRP 51 N -1.12 1.07 -0.04 3.69 0.52 -1.17 -0.06 118.94 121.83 1dfp s TRP 51 Ca 0.09 -0.21 0.07 0.00 0.02 0.00 0.00 56.10 56.07 1dfp s TRP 51 Cb 0.08 -0.69 -0.01 0.00 -1.15 0.00 0.00 33.47 31.69 1dfp s TRP 51 CO 0.01 -0.03 -0.24 0.08 0.02 0.00 0.00 176.95 176.79 1dfp s VAL 52 N -0.23 1.90 -0.15 4.03 1.01 -0.15 -1.67 120.40 125.14 1dfp s VAL 52 Ca 0.04 -1.01 -0.09 0.00 0.00 0.00 0.00 61.98 60.92 1dfp s VAL 52 Cb -0.05 -1.60 -0.04 0.00 0.00 0.00 0.00 36.38 34.69 1dfp s VAL 52 CO -0.00 0.54 0.15 -0.22 0.00 0.00 0.00 175.10 175.56 1dfp s LEU 53 N -0.35 4.32 0.00 3.92 2.96 -0.18 -0.18 118.68 129.16 1dfp s LEU 53 Ca 0.03 0.40 0.00 0.00 -0.22 0.00 0.00 54.13 54.34 1dfp s LEU 53 Cb -0.11 -2.10 0.00 0.00 0.50 0.00 0.00 46.19 44.48 1dfp s LEU 53 CO 0.01 0.31 0.00 -0.24 -1.32 0.00 0.00 176.35 175.11 1dfp n SER 54 N 2.61 0.00 -4.76 3.68 2.88 0.02 -1.62 113.62 116.42 1dfp n SER 54 Ca -0.18 -0.38 -0.36 0.00 -1.33 0.00 0.00 58.87 56.62 1dfp n SER 54 Cb 0.54 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.92 1dfp n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1dfp s ALA 55 N -1.57 3.60 0.17 -1.46 0.00 -1.26 -1.86 121.76 119.37 1dfp s ALA 55 Ca 0.00 -0.71 -0.14 0.00 0.00 0.00 0.00 51.96 51.10 1dfp s ALA 55 Cb 0.00 -1.84 0.07 0.00 0.00 0.00 0.00 23.12 21.34 1dfp s ALA 55 CO 0.00 0.47 1.83 0.00 0.00 0.00 0.00 175.76 178.06 1dfp h ALA 56 N 5.56 0.64 0.00 0.00 0.00 -1.73 -2.74 119.26 120.99 1dfp h ALA 56 Ca -0.49 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1dfp h ALA 56 Cb 1.20 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1dfp h ALA 56 CO 0.61 0.07 0.00 0.45 0.00 0.00 0.00 179.25 180.38 1dfp h HIS 57 N 0.67 0.00 -0.65 0.00 3.86 -1.90 -2.84 115.15 114.28 1dfp h HIS 57 Ca 0.19 0.00 0.05 0.00 -1.16 0.00 0.00 60.37 59.45 1dfp h HIS 57 Cb -0.06 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 28.36 1dfp h HIS 57 CO -0.05 0.00 0.37 0.00 0.86 0.00 0.00 177.93 179.11 1dfp n LEU 59 N -4.78 6.84 0.42 0.00 4.32 -1.07 -4.64 117.00 118.09 1dfp n LEU 59 Ca 0.08 -3.67 -0.19 0.00 -0.02 0.00 0.00 56.01 52.20 1dfp n LEU 59 Cb 0.16 -0.94 -0.10 0.00 -1.62 0.00 0.00 43.42 40.92 1dfp n LEU 59 CO 0.29 1.25 0.57 -0.08 -1.22 0.00 0.00 177.39 178.20 1dfp h GLU 60 N 1.50 -1.09 -4.54 3.23 4.57 -1.41 -3.40 114.58 113.43 1dfp h GLU 60 Ca 0.48 0.07 -0.66 0.00 -1.18 0.00 0.00 59.36 58.08 1dfp h GLU 60 Cb 1.31 0.25 -0.40 0.00 -0.16 0.00 0.00 28.75 29.75 1dfp h GLU 60 CO 1.14 -0.73 -0.70 0.34 -1.18 0.00 0.00 179.01 177.88 1dfp s ASP 61 N -4.21 4.75 0.00 1.04 2.15 -1.26 -5.13 116.67 114.01 1dfp s ASP 61 Ca -0.19 -2.24 0.00 0.00 0.43 0.00 0.00 52.55 50.55 1dfp s ASP 61 Cb 0.03 -1.64 0.00 0.00 -0.30 0.00 0.00 42.92 41.01 1dfp s ASP 61 CO 0.61 -0.37 0.00 0.00 -0.17 0.00 0.00 175.17 175.23 1dfp n ALA 61 N 4.15 0.00 1.27 3.66 0.00 -1.26 -5.04 120.51 123.29 1dfp n ALA 61 Ca 0.04 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.52 1dfp n ALA 61 Cb 0.41 0.00 0.14 0.00 0.00 0.00 0.00 19.45 20.00 1dfp n ALA 61 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1dfp n ASP 61 N 0.00 1.26 -4.78 0.00 9.92 -1.26 -4.90 116.55 116.78 1dfp n ASP 61 Ca 0.00 -1.96 -0.33 0.00 -0.53 0.00 0.00 54.79 51.98 1dfp n ASP 61 Cb 0.00 -0.15 0.04 0.00 -0.64 0.00 0.00 41.12 40.37 1dfp n ASP 61 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 1dfp s GLY 62 N -1.07 2.08 -0.41 0.44 0.00 -1.26 -4.94 107.32 102.16 1dfp s GLY 62 Ca 0.18 0.44 -0.29 0.00 0.00 0.00 0.00 44.72 45.05 1dfp s GLY 62 CO 0.12 0.78 1.36 1.25 0.00 0.00 0.00 173.10 176.62 1dfp s LYS 63 N -4.21 3.63 -0.05 2.90 2.20 -1.26 -4.96 119.74 117.99 1dfp s LYS 63 Ca 0.65 0.92 -0.03 0.00 -0.36 0.00 0.00 55.97 57.15 1dfp s LYS 63 Cb -0.18 -3.99 -0.04 0.00 -1.51 0.00 0.00 37.83 32.11 1dfp s LYS 63 CO 0.42 -1.49 0.10 0.08 -0.36 0.00 0.00 175.35 174.10 1dfp s VAL 64 N 5.17 4.96 0.16 4.02 1.01 -1.26 -1.38 120.40 133.08 1dfp s VAL 64 Ca 0.59 -0.18 -0.14 0.00 0.00 0.00 0.00 61.98 62.24 1dfp s VAL 64 Cb -0.13 -3.22 0.02 0.00 0.00 0.00 0.00 36.38 33.05 1dfp s VAL 64 CO 0.31 0.46 0.40 -1.10 0.00 0.00 0.00 175.10 175.18 1dfp s GLN 65 N -1.43 1.19 -0.06 2.72 -0.21 -0.55 -3.09 119.66 118.22 1dfp s GLN 65 Ca 0.20 -0.89 0.05 0.00 0.02 0.00 0.00 55.36 54.73 1dfp s GLN 65 Cb -0.12 0.46 -0.00 0.00 1.00 0.00 0.00 33.01 34.34 1dfp s GLN 65 CO 0.10 -0.47 -0.22 0.08 -2.12 0.00 0.00 175.29 172.66 1dfp s VAL 66 N -3.87 1.83 -0.30 1.09 1.01 0.22 -0.14 120.40 120.25 1dfp s VAL 66 Ca 0.09 -0.93 -0.09 0.00 0.00 0.00 0.00 61.98 61.05 1dfp s VAL 66 Cb 0.01 -1.57 -0.01 0.00 0.00 0.00 0.00 36.38 34.82 1dfp s VAL 66 CO -0.06 0.51 0.13 -0.22 0.00 0.00 0.00 175.10 175.46 1dfp s LEU 67 N 0.06 3.94 0.29 3.92 2.96 0.24 -0.20 118.68 129.89 1dfp s LEU 67 Ca -0.08 -0.48 0.08 0.00 -0.22 0.00 0.00 54.13 53.42 1dfp s LEU 67 Cb -0.14 -1.97 -0.03 0.00 0.50 0.00 0.00 46.19 44.54 1dfp s LEU 67 CO 0.04 -0.16 0.20 -0.76 -1.32 0.00 0.00 176.35 174.35 1dfp s LEU 68 N 1.60 3.60 -0.35 -0.68 1.43 -0.42 -1.95 118.68 121.90 1dfp s LEU 68 Ca 0.05 -0.45 0.00 0.00 -1.03 0.00 0.00 54.13 52.70 1dfp s LEU 68 Cb -0.17 -2.15 0.00 0.00 0.03 0.00 0.00 46.19 43.90 1dfp s LEU 68 CO 0.05 -0.18 0.00 0.61 0.23 0.00 0.00 176.35 177.06 1dfp n GLY 69 N -1.21 0.51 3.93 -3.19 0.00 -1.26 -2.16 105.19 101.80 1dfp n GLY 69 Ca -0.05 -0.12 -0.25 0.00 0.00 0.00 0.00 46.02 45.60 1dfp n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dfp s ALA 70 N -1.69 3.61 0.12 4.61 0.00 -1.26 -3.61 121.76 123.53 1dfp s ALA 70 Ca 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 51.96 51.17 1dfp s ALA 70 Cb 0.00 -2.26 0.00 0.00 0.00 0.00 0.00 23.12 20.86 1dfp s ALA 70 CO 0.00 -0.15 0.00 1.58 0.00 0.00 0.00 175.76 177.19 1dfp n HIS 71 N -1.96 -1.00 -3.79 0.00 -0.00 -1.26 -4.90 115.22 102.31 1dfp n HIS 71 Ca -0.03 0.18 -0.36 0.00 0.46 0.00 0.00 57.72 57.97 1dfp n HIS 71 Cb 0.56 0.46 -0.07 0.00 -0.12 0.00 0.00 29.99 30.82 1dfp n HIS 71 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 1dfp s SER 72 N -5.07 6.33 0.48 0.26 0.15 -1.26 -1.69 113.70 112.89 1dfp s SER 72 Ca 0.00 0.39 0.27 0.00 0.70 0.00 0.00 55.95 57.31 1dfp s SER 72 Cb 0.00 -2.09 0.74 0.00 -1.71 0.00 0.00 66.02 62.96 1dfp s SER 72 CO 0.00 0.30 1.76 -0.07 1.20 0.00 0.00 173.24 176.42 1dfp h LEU 73 N 5.75 0.00 0.00 3.45 3.38 -1.03 -3.38 115.31 123.47 1dfp h LEU 73 Ca -0.48 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.33 1dfp h LEU 73 Cb 1.19 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.92 1dfp h LEU 73 CO 0.66 0.00 -1.57 -1.54 0.09 0.00 0.00 178.44 176.08 1dfp n SER 74 N -3.07 3.16 -4.76 -0.43 3.41 -1.26 -5.04 113.62 105.62 1dfp n SER 74 Ca 0.03 -0.04 -0.39 0.00 -0.26 0.00 0.00 58.87 58.20 1dfp n SER 74 Cb 0.44 0.06 -0.05 0.00 -0.26 0.00 0.00 64.21 64.40 1dfp n SER 74 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1dfp s GLN 75 N -2.20 4.70 0.20 4.33 -1.52 -1.26 -5.02 119.66 118.89 1dfp s GLN 75 Ca -0.11 1.58 -0.30 0.00 -1.95 0.00 0.00 55.36 54.58 1dfp s GLN 75 Cb 0.03 -3.14 -0.08 0.00 -0.22 0.00 0.00 33.01 29.60 1dfp s GLN 75 CO 0.26 0.34 1.17 -1.25 -0.25 0.00 0.00 175.29 175.56 1dfp s PRO 76 N -1.47 4.52 0.01 2.91 0.04 -1.26 -4.78 135.00 134.97 1dfp s PRO 76 Ca 0.44 1.86 0.01 0.00 0.04 0.00 0.00 61.00 63.35 1dfp s PRO 76 Cb -0.27 -3.23 -0.01 0.00 0.04 0.00 0.00 34.50 31.03 1dfp s PRO 76 CO 0.34 -0.03 -0.05 -1.21 0.04 0.00 0.00 177.00 176.09 1dfp s GLU 77 N -0.47 0.37 0.31 4.56 2.02 -1.26 -5.06 118.70 119.17 1dfp s GLU 77 Ca 0.51 -0.40 0.02 0.00 0.02 0.00 0.00 54.97 55.12 1dfp s GLU 77 Cb -0.32 -0.23 0.56 0.00 0.10 0.00 0.00 34.13 34.24 1dfp s GLU 77 CO 0.38 0.05 1.91 -1.35 0.02 0.00 0.00 175.26 176.27 1dfp h PRO 78 N 5.36 0.96 0.00 0.39 0.11 -1.96 -2.76 132.00 134.11 1dfp h PRO 78 Ca -0.30 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.75 1dfp h PRO 78 Cb 1.20 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 32.10 1dfp h PRO 78 CO 0.46 0.63 0.00 0.66 -0.21 0.00 0.00 178.00 179.54 1dfp h SER 79 N 0.99 0.00 -3.95 -2.05 4.64 -1.96 -3.46 113.55 107.76 1dfp h SER 79 Ca 0.38 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 61.19 1dfp h SER 79 Cb 0.22 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 62.37 1dfp h SER 79 CO -0.14 0.00 0.52 -0.54 -0.87 0.00 0.00 176.83 175.79 1dfp s LYS 80 N -3.33 4.01 -0.28 4.77 1.02 -1.04 -4.10 119.74 120.79 1dfp s LYS 80 Ca 0.05 1.88 -0.21 0.00 0.02 0.00 0.00 55.97 57.71 1dfp s LYS 80 Cb 0.10 -2.66 0.10 0.00 -0.52 0.00 0.00 37.83 34.84 1dfp s LYS 80 CO 0.46 -0.37 0.81 0.50 -0.92 0.00 0.00 175.35 175.84 1dfp s ARG 81 N -2.33 0.66 -0.14 1.68 3.52 -0.92 -4.99 118.95 116.44 1dfp s ARG 81 Ca 0.58 0.94 -0.09 0.00 -0.13 0.00 0.00 55.73 57.02 1dfp s ARG 81 Cb -0.32 0.24 -0.04 0.00 -1.56 0.00 0.00 34.95 33.27 1dfp s ARG 81 CO 0.40 -0.10 0.17 -1.17 -0.81 0.00 0.00 175.30 173.78 1dfp s LEU 82 N 0.90 4.33 0.06 -0.88 1.98 -1.26 -1.30 118.68 122.50 1dfp s LEU 82 Ca -0.04 0.44 0.07 0.00 -2.89 0.00 0.00 54.13 51.71 1dfp s LEU 82 Cb -0.05 -2.14 -0.03 0.00 0.66 0.00 0.00 46.19 44.63 1dfp s LEU 82 CO -0.10 0.31 -0.19 -0.31 -1.89 0.00 0.00 176.35 174.17 1dfp s TYR 83 N -0.49 1.63 0.27 5.38 1.51 0.72 -4.98 117.35 121.39 1dfp s TYR 83 Ca 0.14 -0.38 -0.16 0.00 -1.01 0.00 0.00 57.07 55.65 1dfp s TYR 83 Cb -0.12 -0.95 -0.08 0.00 -0.11 0.00 0.00 41.96 40.69 1dfp s TYR 83 CO 0.03 0.10 0.71 -0.51 -1.11 0.00 0.00 175.55 174.77 1dfp s ASP 84 N -1.36 6.87 -0.26 2.29 1.01 -1.26 -0.61 116.67 123.35 1dfp s ASP 84 Ca 0.05 1.29 -0.16 0.00 0.71 0.00 0.00 52.55 54.45 1dfp s ASP 84 Cb -0.09 -2.37 -0.03 0.00 1.01 0.00 0.00 42.92 41.43 1dfp s ASP 84 CO 0.02 -0.09 0.42 -0.69 0.21 0.00 0.00 175.17 175.05 1dfp s VAL 85 N -1.77 5.14 -0.04 -1.27 1.01 -1.18 -0.23 120.40 122.07 1dfp s VAL 85 Ca 0.48 0.68 -0.11 0.00 0.00 0.00 0.00 61.98 63.03 1dfp s VAL 85 Cb -0.13 -3.74 -0.31 0.00 0.00 0.00 0.00 36.38 32.19 1dfp s VAL 85 CO 0.19 0.15 0.71 0.25 0.00 0.00 0.00 175.10 176.39 1dfp h LEU 86 N 8.53 0.65 -7.49 3.92 6.46 -0.73 -3.47 115.31 123.19 1dfp h LEU 86 Ca -0.31 -0.93 -0.21 0.00 -0.12 0.00 0.00 57.88 56.30 1dfp h LEU 86 Cb 1.16 -0.21 -0.29 0.00 -0.73 0.00 0.00 40.66 40.58 1dfp h LEU 86 CO 0.67 1.78 -0.56 -0.13 -0.62 0.00 0.00 178.44 179.59 1dfp s ARG 87 N -2.58 0.15 -0.30 1.25 0.52 -1.19 -4.98 118.95 111.82 1dfp s ARG 87 Ca -0.15 0.32 -0.03 0.00 -0.52 0.00 0.00 55.73 55.35 1dfp s ARG 87 Cb 0.05 -0.05 0.04 0.00 0.52 0.00 0.00 34.95 35.52 1dfp s ARG 87 CO 0.87 -0.10 0.01 0.00 0.02 0.00 0.00 175.30 176.10 1dfp s ALA 88 N 0.68 2.84 -0.50 2.13 0.00 -1.26 -0.73 121.76 124.92 1dfp s ALA 88 Ca -0.05 -1.71 -0.07 0.00 0.00 0.00 0.00 51.96 50.13 1dfp s ALA 88 Cb -0.07 -1.96 0.13 0.00 0.00 0.00 0.00 23.12 21.22 1dfp s ALA 88 CO -0.03 -1.21 0.36 0.08 0.00 0.00 0.00 175.76 174.95 1dfp s VAL 89 N 1.29 4.04 0.62 0.00 1.01 0.56 -4.98 120.40 122.95 1dfp s VAL 89 Ca -0.04 -2.06 -0.13 0.00 0.00 0.00 0.00 61.98 59.75 1dfp s VAL 89 Cb -0.19 -3.66 -0.03 0.00 0.00 0.00 0.00 36.38 32.50 1dfp s VAL 89 CO -0.01 -0.79 1.04 -2.84 0.00 0.00 0.00 175.10 172.50 1dfp s PRO 90 N 1.03 3.39 0.23 2.72 0.02 -1.26 -1.12 135.00 140.00 1dfp s PRO 90 Ca 0.09 0.96 -0.30 0.00 0.02 0.00 0.00 61.00 61.76 1dfp s PRO 90 Cb -0.24 -2.05 -0.10 0.00 0.02 0.00 0.00 34.50 32.14 1dfp s PRO 90 CO -0.02 -0.74 1.40 -1.58 -0.33 0.00 0.00 177.00 175.73 1dfp s HIS 91 N -2.87 3.11 0.01 6.54 5.65 0.13 -4.89 115.29 122.96 1dfp s HIS 91 Ca 0.59 1.07 0.31 0.00 0.25 0.00 0.00 55.06 57.28 1dfp s HIS 91 Cb -0.13 -3.75 1.48 0.00 -1.18 0.00 0.00 32.58 29.00 1dfp s HIS 91 CO 0.46 -2.43 1.92 -1.00 -0.65 0.00 0.00 174.74 173.05 1dfp h PRO 92 N 5.25 0.00 -0.01 2.88 0.13 -1.91 -2.99 132.00 135.35 1dfp h PRO 92 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1dfp h PRO 92 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1dfp h PRO 92 CO 0.78 0.00 -0.25 -0.25 -0.23 0.00 0.00 178.00 178.05 1dfp n ASP 93 N -2.65 1.61 -4.82 1.44 8.00 -1.26 -4.94 116.55 113.92 1dfp n ASP 93 Ca -0.00 -1.29 -0.33 0.00 0.71 0.00 0.00 54.79 53.87 1dfp n ASP 93 Cb 0.16 0.20 -0.05 0.00 -0.02 0.00 0.00 41.12 41.40 1dfp n ASP 93 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1dfp s SER 94 N -2.36 6.72 0.01 -2.24 1.04 -1.13 -4.89 113.70 110.85 1dfp s SER 94 Ca 0.25 1.72 0.00 0.00 0.48 0.00 0.00 55.95 58.41 1dfp s SER 94 Cb 0.19 -2.54 -0.01 0.00 0.10 0.00 0.00 66.02 63.76 1dfp s SER 94 CO 0.48 -0.51 -0.02 -1.58 0.98 0.00 0.00 173.24 172.59 1dfp s GLN 95 N -3.38 0.20 0.52 4.02 2.00 -1.26 -5.03 119.66 116.73 1dfp s GLN 95 Ca 0.63 -0.38 0.35 0.00 -2.00 0.00 0.00 55.36 53.96 1dfp s GLN 95 Cb -0.11 0.04 1.50 0.00 0.80 0.00 0.00 33.01 35.24 1dfp s GLN 95 CO 0.18 -0.02 1.76 -1.35 -0.50 0.00 0.00 175.29 175.36 1dfp h PRO 96 N 5.24 0.06 -0.20 1.67 0.11 -1.97 -2.45 132.00 134.46 1dfp h PRO 96 Ca -0.29 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1dfp h PRO 96 Cb 1.21 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1dfp h PRO 96 CO 0.45 0.04 0.00 -0.40 -0.21 0.00 0.00 178.00 177.88 1dfp n ASP 97 N -4.25 1.51 -4.03 -2.05 5.68 -1.26 -4.93 116.55 107.22 1dfp n ASP 97 Ca 0.28 -1.77 -0.11 0.00 -0.50 0.00 0.00 54.79 52.69 1dfp n ASP 97 Cb 1.29 -0.13 -0.11 0.00 -1.14 0.00 0.00 41.12 41.03 1dfp n ASP 97 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 1dfp s THR 98 N -1.75 0.36 -1.79 2.12 -4.23 -0.93 -5.01 115.64 104.42 1dfp s THR 98 Ca 0.28 -1.01 0.04 0.00 -1.18 0.00 0.00 61.69 59.82 1dfp s THR 98 Cb 0.15 -0.47 0.14 0.00 1.34 0.00 0.00 72.50 73.67 1dfp s THR 98 CO 0.22 -0.43 1.05 2.30 -0.54 0.00 0.00 174.62 177.21 1dfp n ILE 99 N 1.51 0.27 -3.19 2.99 -0.00 -1.26 -4.67 119.36 115.01 1dfp n ILE 99 Ca -0.23 -0.22 -0.37 0.00 -0.00 0.00 0.00 62.75 61.92 1dfp n ILE 99 Cb 0.55 -0.00 -0.06 0.00 -0.00 0.00 0.00 39.64 40.13 1dfp n ILE 99 CO 0.00 0.00 0.00 -1.81 -0.00 0.00 0.00 176.55 174.74 1dfp s ASP 100 N -0.84 7.06 -1.52 7.28 1.01 -1.26 -4.15 116.67 124.25 1dfp s ASP 100 Ca 0.11 1.33 -0.10 0.00 0.71 0.00 0.00 52.55 54.59 1dfp s ASP 100 Cb 0.06 -2.38 0.07 0.00 1.01 0.00 0.00 42.92 41.68 1dfp s ASP 100 CO 0.06 0.15 0.78 1.41 0.21 0.00 0.00 175.17 177.78 1dfp n HIS 101 N 1.20 -1.97 -1.51 4.23 8.25 -1.26 -4.48 115.22 119.68 1dfp n HIS 101 Ca -0.06 0.84 -0.39 0.00 -0.26 0.00 0.00 57.72 57.84 1dfp n HIS 101 Cb 0.51 -3.74 -0.02 0.00 1.12 0.00 0.00 29.99 27.86 1dfp n HIS 101 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1dfp n ASP 102 N -2.86 8.34 -4.24 0.41 2.03 -1.26 -4.39 116.55 114.59 1dfp n ASP 102 Ca -0.08 -2.73 -0.25 0.00 0.52 0.00 0.00 54.79 52.26 1dfp n ASP 102 Cb 0.57 -1.52 -0.14 0.00 -0.72 0.00 0.00 41.12 39.32 1dfp n ASP 102 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1dfp s LEU 103 N -0.30 2.16 -0.08 -2.67 1.43 -1.26 -3.21 118.68 114.75 1dfp s LEU 103 Ca 0.65 -0.50 -0.05 0.00 -1.03 0.00 0.00 54.13 53.19 1dfp s LEU 103 Cb 0.18 -0.95 0.03 0.00 0.03 0.00 0.00 46.19 45.48 1dfp s LEU 103 CO -0.07 0.16 0.19 -0.22 0.23 0.00 0.00 176.35 176.64 1dfp s LEU 104 N -1.11 0.96 -0.12 1.79 2.96 -0.78 -0.70 118.68 121.68 1dfp s LEU 104 Ca 0.07 0.39 -0.02 0.00 -0.22 0.00 0.00 54.13 54.35 1dfp s LEU 104 Cb -0.09 0.59 -0.03 0.00 0.50 0.00 0.00 46.19 47.17 1dfp s LEU 104 CO 0.02 -0.11 -0.05 -0.76 -1.32 0.00 0.00 176.35 174.13 1dfp s LEU 105 N 0.62 3.24 -0.17 -0.68 1.43 -0.28 -0.80 118.68 122.04 1dfp s LEU 105 Ca -0.04 -0.08 0.00 0.00 -1.03 0.00 0.00 54.13 52.98 1dfp s LEU 105 Cb -0.06 -1.75 0.01 0.00 0.03 0.00 0.00 46.19 44.41 1dfp s LEU 105 CO -0.03 0.24 -0.16 -0.76 0.23 0.00 0.00 176.35 175.87 1dfp s LEU 106 N -0.07 2.38 -0.19 1.79 1.43 0.74 -0.32 118.68 124.45 1dfp s LEU 106 Ca 0.01 -0.53 -0.19 0.00 -1.03 0.00 0.00 54.13 52.39 1dfp s LEU 106 Cb -0.13 -1.55 -0.03 0.00 0.03 0.00 0.00 46.19 44.51 1dfp s LEU 106 CO 0.03 0.05 0.56 -1.58 0.23 0.00 0.00 176.35 175.64 1dfp s GLN 107 N 1.03 4.22 0.65 1.70 0.74 0.10 -0.98 119.66 127.13 1dfp s GLN 107 Ca -0.01 0.51 -0.11 0.00 0.05 0.00 0.00 55.36 55.79 1dfp s GLN 107 Cb -0.15 -3.55 -0.02 0.00 1.10 0.00 0.00 33.01 30.40 1dfp s GLN 107 CO -0.04 -0.15 1.05 -0.51 -0.55 0.00 0.00 175.29 175.08 1dfp s LEU 108 N 1.62 3.21 0.52 3.68 1.43 0.91 -0.07 118.68 129.97 1dfp s LEU 108 Ca 0.26 1.55 0.23 0.00 -1.03 0.00 0.00 54.13 55.15 1dfp s LEU 108 Cb -0.16 -4.49 1.42 0.00 0.03 0.00 0.00 46.19 43.00 1dfp s LEU 108 CO 0.10 -1.18 2.11 0.28 0.23 0.00 0.00 176.35 177.90 1dfp h SER 109 N -0.45 0.00 -5.08 2.29 0.02 -0.94 -3.41 113.55 105.98 1dfp h SER 109 Ca -0.44 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.47 1dfp h SER 109 Cb 1.20 0.00 -0.12 0.00 0.14 0.00 0.00 62.40 63.62 1dfp h SER 109 CO 0.59 0.09 -0.02 -1.83 -1.14 0.00 0.00 176.83 174.52 1dfp s GLU 110 N -4.54 1.18 0.19 3.45 -1.05 -1.26 -5.02 118.70 111.66 1dfp s GLU 110 Ca -0.04 -0.74 -0.33 0.00 -0.15 0.00 0.00 54.97 53.71 1dfp s GLU 110 Cb 0.15 0.49 -0.13 0.00 -0.44 0.00 0.00 34.13 34.20 1dfp s GLU 110 CO 0.61 -0.48 1.63 1.63 0.95 0.00 0.00 175.26 179.60 1dfp n LYS 111 N -0.27 2.42 -2.10 -4.83 5.02 -1.26 -4.78 118.16 112.36 1dfp n LYS 111 Ca -0.14 0.87 -0.40 0.00 -2.02 0.00 0.00 58.31 56.62 1dfp n LYS 111 Cb 0.63 -2.67 -0.02 0.00 -0.02 0.00 0.00 35.03 32.96 1dfp n LYS 111 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1dfp s ALA 112 N 0.92 3.41 -0.23 7.82 0.00 0.16 -4.97 121.76 128.87 1dfp s ALA 112 Ca 0.76 1.25 -0.27 0.00 0.00 0.00 0.00 51.96 53.70 1dfp s ALA 112 Cb -0.60 -3.48 0.00 0.00 0.00 0.00 0.00 23.12 19.04 1dfp s ALA 112 CO 0.37 -0.71 0.95 0.95 0.00 0.00 0.00 175.76 177.32 1dfp s THR 113 N -1.19 4.75 0.42 0.00 -4.23 -1.26 -4.97 115.64 109.16 1dfp s THR 113 Ca 0.52 1.83 -0.00 0.00 -1.18 0.00 0.00 61.69 62.86 1dfp s THR 113 Cb -0.39 -4.23 -0.02 0.00 1.34 0.00 0.00 72.50 69.21 1dfp s THR 113 CO 0.51 -0.13 0.65 -0.76 -0.54 0.00 0.00 174.62 174.35 1dfp s LEU 114 N 3.00 3.76 0.00 4.79 1.43 -1.26 -4.86 118.68 125.53 1dfp s LEU 114 Ca 0.40 0.42 0.00 0.00 -1.03 0.00 0.00 54.13 53.92 1dfp s LEU 114 Cb -0.15 -3.30 0.00 0.00 0.03 0.00 0.00 46.19 42.77 1dfp s LEU 114 CO 0.07 -0.56 0.00 0.61 0.23 0.00 0.00 176.35 176.70 1dfp n GLY 115 N -2.01 -1.11 0.40 -3.19 0.00 -0.51 -4.93 105.19 93.83 1dfp n GLY 115 Ca -0.01 -0.83 0.21 0.00 0.00 0.00 0.00 46.02 45.40 1dfp n GLY 115 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1dfp h PRO 118 N 0.00 0.43 -0.46 1.61 0.11 -2.00 -1.71 132.00 129.98 1dfp h PRO 118 Ca 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.08 1dfp h PRO 118 Cb 0.00 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.01 1dfp h PRO 118 CO 0.00 0.28 0.00 0.00 -0.21 0.00 0.00 178.00 178.07 1dfp n ALA 119 N -2.44 2.28 -3.68 -0.75 0.00 -1.26 -4.81 120.51 109.84 1dfp n ALA 119 Ca 0.25 -1.16 -0.22 0.00 0.00 0.00 0.00 53.44 52.31 1dfp n ALA 119 Cb 0.83 -0.63 -0.18 0.00 0.00 0.00 0.00 19.45 19.48 1dfp n ALA 119 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1dfp s VAL 120 N -1.03 0.04 -0.29 0.00 1.01 -0.64 -4.09 120.40 115.39 1dfp s VAL 120 Ca 0.33 0.18 -0.22 0.00 0.00 0.00 0.00 61.98 62.26 1dfp s VAL 120 Cb 0.17 -0.38 0.14 0.00 0.00 0.00 0.00 36.38 36.31 1dfp s VAL 120 CO 0.23 0.07 1.05 -0.60 0.00 0.00 0.00 175.10 175.85 1dfp s ARG 121 N 2.10 0.42 0.59 2.72 3.52 -1.03 -1.43 118.95 125.85 1dfp s ARG 121 Ca 0.04 0.57 -0.18 0.00 -0.13 0.00 0.00 55.73 56.03 1dfp s ARG 121 Cb -0.13 0.17 -0.04 0.00 -1.56 0.00 0.00 34.95 33.39 1dfp s ARG 121 CO -0.05 -0.06 1.12 -2.14 -0.81 0.00 0.00 175.30 173.36 1dfp s PRO 122 N 0.58 3.15 -0.17 5.12 0.02 -1.26 -2.84 135.00 139.59 1dfp s PRO 122 Ca -0.00 1.53 0.01 0.00 0.02 0.00 0.00 61.00 62.55 1dfp s PRO 122 Cb -0.05 -1.98 0.01 0.00 0.02 0.00 0.00 34.50 32.50 1dfp s PRO 122 CO -0.10 -1.00 -0.17 -1.17 -0.33 0.00 0.00 177.00 174.23 1dfp s LEU 123 N -4.19 2.30 0.53 -5.54 2.96 -0.58 -4.95 118.68 109.20 1dfp s LEU 123 Ca 0.71 -0.57 -0.19 0.00 -0.22 0.00 0.00 54.13 53.86 1dfp s LEU 123 Cb -0.23 -1.52 -0.07 0.00 0.50 0.00 0.00 46.19 44.87 1dfp s LEU 123 CO 0.32 0.03 1.05 -2.16 -1.32 0.00 0.00 176.35 174.27 1dfp s PRO 124 N 1.12 3.62 0.03 0.98 0.04 -1.26 -4.61 135.00 134.91 1dfp s PRO 124 Ca 0.01 1.31 -0.02 0.00 0.04 0.00 0.00 61.00 62.34 1dfp s PRO 124 Cb -0.14 -2.07 -0.04 0.00 0.04 0.00 0.00 34.50 32.29 1dfp s PRO 124 CO -0.07 -0.58 0.20 1.67 0.04 0.00 0.00 177.00 178.27 1dfp s TRP 124 N -2.15 3.54 0.22 0.56 -2.14 -1.26 -4.06 118.94 113.64 1dfp s TRP 124 Ca 0.66 0.32 -0.32 0.00 2.66 0.00 0.00 56.10 59.42 1dfp s TRP 124 Cb -0.16 -1.81 -0.13 0.00 -3.10 0.00 0.00 33.47 28.27 1dfp s TRP 124 CO 0.26 0.62 1.63 0.94 -2.66 0.00 0.00 176.95 177.74 1dfp n GLN 125 N 0.64 2.54 -0.04 3.25 -0.06 -0.91 -4.89 117.38 117.92 1dfp n GLN 125 Ca -0.08 0.91 0.04 0.00 -2.00 0.00 0.00 57.00 55.88 1dfp n GLN 125 Cb 0.52 -2.71 -0.17 0.00 -4.06 0.00 0.00 30.24 23.82 1dfp n GLN 125 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 1dfp n ARG 126 N 3.24 0.67 -2.29 3.69 1.74 -1.26 -3.71 116.66 118.75 1dfp n ARG 126 Ca 0.14 -0.14 -0.42 0.00 -0.77 0.00 0.00 57.85 56.67 1dfp n ARG 126 Cb 0.33 -1.52 -0.03 0.00 -1.02 0.00 0.00 32.46 30.23 1dfp n ARG 126 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1dfp s VAL 127 N -3.18 3.72 -1.21 1.55 1.01 -1.26 -4.92 120.40 116.10 1dfp s VAL 127 Ca -0.09 0.65 -0.21 0.00 0.00 0.00 0.00 61.98 62.33 1dfp s VAL 127 Cb 0.11 -4.22 -0.01 0.00 0.00 0.00 0.00 36.38 32.26 1dfp s VAL 127 CO 0.88 -0.94 1.83 -0.62 0.00 0.00 0.00 175.10 176.24 1dfp s ASP 128 N 4.97 5.88 0.01 3.32 2.15 -1.26 -4.88 116.67 126.87 1dfp s ASP 128 Ca 0.60 -1.95 -0.02 0.00 0.43 0.00 0.00 52.55 51.61 1dfp s ASP 128 Cb -0.13 -2.58 -0.01 0.00 -0.30 0.00 0.00 42.92 39.89 1dfp s ASP 128 CO 0.27 -2.17 0.03 -0.13 -0.17 0.00 0.00 175.17 173.01 1dfp s ARG 129 N 5.46 0.34 0.38 4.34 1.81 -1.26 -5.05 118.95 124.96 1dfp s ARG 129 Ca 0.61 -0.47 -0.27 0.00 -1.72 0.00 0.00 55.73 53.88 1dfp s ARG 129 Cb 0.01 0.13 -0.09 0.00 -0.45 0.00 0.00 34.95 34.55 1dfp s ARG 129 CO 0.09 -0.06 1.27 -0.51 -0.68 0.00 0.00 175.30 175.40 1dfp s ASP 129 N -1.27 6.50 0.16 0.23 1.01 -1.26 -4.99 116.67 117.04 1dfp s ASP 129 Ca -0.14 2.58 -0.30 0.00 0.71 0.00 0.00 52.55 55.40 1dfp s ASP 129 Cb -0.08 -2.64 -0.07 0.00 1.01 0.00 0.00 42.92 41.14 1dfp s ASP 129 CO -0.00 -0.71 0.97 -0.69 0.21 0.00 0.00 175.17 174.95 1dfp s VAL 130 N -1.26 4.30 0.37 -1.27 1.01 -1.26 -4.98 120.40 117.31 1dfp s VAL 130 Ca 0.54 2.04 -0.28 0.00 0.00 0.00 0.00 61.98 64.29 1dfp s VAL 130 Cb -0.37 -4.30 -0.11 0.00 0.00 0.00 0.00 36.38 31.60 1dfp s VAL 130 CO 0.47 0.37 1.46 0.00 0.00 0.00 0.00 175.10 177.40 1dfp s ALA 131 N -0.42 3.55 0.72 5.51 0.00 -1.26 -4.96 121.76 124.90 1dfp s ALA 131 Ca 0.45 1.52 -0.16 0.00 0.00 0.00 0.00 51.96 53.77 1dfp s ALA 131 Cb -0.25 -3.59 0.03 0.00 0.00 0.00 0.00 23.12 19.31 1dfp s ALA 131 CO 0.31 -1.00 1.26 -2.14 0.00 0.00 0.00 175.76 174.19 1dfp s PRO 132 N -2.06 2.15 0.00 0.00 0.02 -1.26 -2.23 135.00 131.62 1dfp s PRO 132 Ca 0.52 1.95 0.00 0.00 0.02 0.00 0.00 61.00 63.49 1dfp s PRO 132 Cb -0.45 -1.81 0.00 0.00 0.02 0.00 0.00 34.50 32.25 1dfp s PRO 132 CO 0.61 -1.87 0.00 0.41 -0.33 0.00 0.00 177.00 175.82 1dfp n GLY 133 N 0.75 2.70 3.77 0.52 0.00 0.28 -4.92 105.19 108.29 1dfp n GLY 133 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 1dfp n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1dfp s THR 134 N -2.07 2.52 -0.23 2.61 2.01 -0.95 -4.61 115.64 114.92 1dfp s THR 134 Ca 0.00 0.46 -0.13 0.00 0.31 0.00 0.00 61.69 62.33 1dfp s THR 134 Cb 0.00 -3.27 -0.04 0.00 0.01 0.00 0.00 72.50 69.20 1dfp s THR 134 CO 0.00 0.06 0.28 -0.76 -0.69 0.00 0.00 174.62 173.51 1dfp s LEU 135 N -2.55 4.11 0.19 4.42 1.43 -1.26 -0.68 118.68 124.34 1dfp s LEU 135 Ca 0.58 0.27 0.10 0.00 -1.03 0.00 0.00 54.13 54.06 1dfp s LEU 135 Cb -0.39 -2.30 -0.04 0.00 0.03 0.00 0.00 46.19 43.49 1dfp s LEU 135 CO 0.50 -0.03 -0.18 0.00 0.23 0.00 0.00 176.35 176.86 1dfp s ASP 137 N -2.72 5.27 -0.09 0.00 2.15 0.12 -0.59 116.67 120.81 1dfp s ASP 137 Ca 0.22 -0.08 0.04 0.00 0.43 0.00 0.00 52.55 53.17 1dfp s ASP 137 Cb -0.08 -1.92 -0.01 0.00 -0.30 0.00 0.00 42.92 40.61 1dfp s ASP 137 CO 0.12 0.08 -0.22 -0.69 -0.17 0.00 0.00 175.17 174.29 1dfp s VAL 138 N 0.90 2.26 0.15 1.11 1.01 -1.00 -1.25 120.40 123.58 1dfp s VAL 138 Ca 0.03 -0.97 0.10 0.00 0.00 0.00 0.00 61.98 61.14 1dfp s VAL 138 Cb -0.14 -1.86 -0.04 0.00 0.00 0.00 0.00 36.38 34.34 1dfp s VAL 138 CO 0.02 0.56 -0.24 0.00 0.00 0.00 0.00 175.10 175.45 1dfp s ALA 139 N 0.11 2.28 0.00 5.51 0.00 -1.25 -2.28 121.76 126.13 1dfp s ALA 139 Ca -0.11 -1.49 0.00 0.00 0.00 0.00 0.00 51.96 50.36 1dfp s ALA 139 Cb -0.16 -0.31 0.00 0.00 0.00 0.00 0.00 23.12 22.65 1dfp s ALA 139 CO 0.06 0.43 0.00 0.41 0.00 0.00 0.00 175.76 176.66 1dfp n GLY 140 N 0.64 0.58 1.10 0.00 0.00 -0.89 -4.55 105.19 102.07 1dfp n GLY 140 Ca -0.16 -0.85 -0.02 0.00 0.00 0.00 0.00 46.02 44.99 1dfp n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1dfp n TRP 141 N -0.14 1.04 -2.64 1.61 8.01 -1.26 -2.25 117.44 121.81 1dfp n TRP 141 Ca 0.00 -1.48 -0.24 0.00 -1.31 0.00 0.00 57.50 54.47 1dfp n TRP 141 Cb 0.00 -0.46 0.03 0.00 -2.01 0.00 0.00 31.31 28.87 1dfp n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1dfp s GLY 142 N -2.45 1.63 -0.01 6.99 0.00 -1.25 -4.52 107.32 107.70 1dfp s GLY 142 Ca 0.44 -0.95 -0.22 0.00 0.00 0.00 0.00 44.72 43.99 1dfp s GLY 142 CO 0.01 -0.70 0.59 1.39 0.00 0.00 0.00 173.10 174.40 1dfp n ILE 143 N -2.38 0.00 0.98 0.90 -0.00 -0.48 -2.02 119.36 116.36 1dfp n ILE 143 Ca 0.04 0.00 0.10 0.00 -0.00 0.00 0.00 62.75 62.89 1dfp n ILE 143 Cb 0.58 -0.01 -0.06 0.00 -0.00 0.00 0.00 39.64 40.15 1dfp n ILE 143 CO 0.00 0.00 0.00 1.33 -0.00 0.00 0.00 176.55 177.88 1dfp n VAL 144 N 0.86 0.00 -4.04 1.39 0.24 -0.03 0.07 118.33 116.83 1dfp n VAL 144 Ca 0.11 -0.14 -0.14 0.00 -2.04 0.00 0.00 64.34 62.13 1dfp n VAL 144 Cb 0.04 1.13 -0.02 0.00 -1.47 0.00 0.00 33.84 33.52 1dfp n VAL 144 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 1dfp n ASN 145 N -0.73 -1.50 -0.01 -1.34 0.23 -1.26 -4.35 115.26 106.30 1dfp n ASN 145 Ca 0.07 -2.90 0.14 0.00 -0.53 0.00 0.00 54.58 51.36 1dfp n ASN 145 Cb 0.40 2.74 0.64 0.00 -2.08 0.00 0.00 39.78 41.48 1dfp n ASN 145 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 1dfp n HIS 146 N -0.59 0.00 1.64 -2.53 8.25 -1.26 -2.55 115.22 118.18 1dfp n HIS 146 Ca -0.00 0.00 0.15 0.00 -0.26 0.00 0.00 57.72 57.60 1dfp n HIS 146 Cb 0.60 -0.38 0.70 0.00 1.12 0.00 0.00 29.99 32.03 1dfp n HIS 146 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1dfp n ALA 147 N -1.38 2.68 -2.15 -1.41 0.00 -1.26 -4.93 120.51 112.07 1dfp n ALA 147 Ca 0.10 -0.30 -0.07 0.00 0.00 0.00 0.00 53.44 53.17 1dfp n ALA 147 Cb 0.30 -1.35 -0.00 0.00 0.00 0.00 0.00 19.45 18.40 1dfp n ALA 147 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dfp n GLY 149 N 1.15 0.08 3.69 0.00 0.00 -1.06 -4.99 105.19 104.07 1dfp n GLY 149 Ca 0.19 -0.58 -0.42 0.00 0.00 0.00 0.00 46.02 45.21 1dfp n GLY 149 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1dfp s ARG 150 N -4.38 4.39 -0.16 1.61 3.52 -1.26 -4.89 118.95 117.78 1dfp s ARG 150 Ca 0.00 1.55 -0.13 0.00 -0.13 0.00 0.00 55.73 57.03 1dfp s ARG 150 Cb -0.00 -3.54 -0.05 0.00 -1.56 0.00 0.00 34.95 29.80 1dfp s ARG 150 CO 0.01 -0.37 0.28 1.03 -0.81 0.00 0.00 175.30 175.43 1dfp s ARG 151 N 2.04 4.20 0.61 5.12 0.52 -1.26 -0.85 118.95 129.34 1dfp s ARG 151 Ca 0.53 0.07 -0.11 0.00 -0.52 0.00 0.00 55.73 55.70 1dfp s ARG 151 Cb -0.22 -3.41 -0.04 0.00 0.52 0.00 0.00 34.95 31.80 1dfp s ARG 151 CO 0.21 0.28 1.01 -1.25 0.02 0.00 0.00 175.30 175.57 1dfp s PRO 152 N 0.34 3.60 -0.06 3.54 0.04 -1.26 -4.99 135.00 136.20 1dfp s PRO 152 Ca 0.16 0.70 -0.09 0.00 0.04 0.00 0.00 61.00 61.81 1dfp s PRO 152 Cb -0.13 -2.11 -0.29 0.00 0.04 0.00 0.00 34.50 32.01 1dfp s PRO 152 CO 0.04 -0.53 0.60 0.22 0.04 0.00 0.00 177.00 177.36 1dfp h ASP 153 N -0.25 0.54 -2.28 6.66 3.58 -1.94 -3.47 116.42 119.26 1dfp h ASP 153 Ca -0.44 -0.91 -0.54 0.00 0.42 0.00 0.00 57.03 55.56 1dfp h ASP 153 Cb 1.19 -0.18 -0.07 0.00 1.72 0.00 0.00 39.33 41.99 1dfp h ASP 153 CO 0.62 1.78 -0.59 -0.94 -2.88 0.00 0.00 179.24 177.23 1dfp s SER 154 N -7.19 5.07 0.35 2.28 1.04 -1.26 -0.33 113.70 113.64 1dfp s SER 154 Ca -0.17 -0.42 -0.28 0.00 0.48 0.00 0.00 55.95 55.56 1dfp s SER 154 Cb 0.06 -1.15 -0.12 0.00 0.10 0.00 0.00 66.02 64.91 1dfp s SER 154 CO 0.83 -0.01 1.28 -0.11 0.98 0.00 0.00 173.24 176.21 1dfp n LEU 155 N -0.94 3.52 -4.56 2.42 7.94 -0.68 -4.89 117.00 119.80 1dfp n LEU 155 Ca -0.07 1.20 -0.26 0.00 -1.11 0.00 0.00 56.01 55.77 1dfp n LEU 155 Cb 0.58 -1.48 -0.11 0.00 0.53 0.00 0.00 43.42 42.94 1dfp n LEU 155 CO 0.42 -0.53 -0.30 -1.10 -1.11 0.00 0.00 177.39 174.77 1dfp s GLN 156 N -1.89 1.85 0.22 1.96 -1.52 -0.95 -0.79 119.66 118.54 1dfp s GLN 156 Ca 0.56 -2.03 -0.22 0.00 -1.95 0.00 0.00 55.36 51.72 1dfp s GLN 156 Cb -0.57 -1.43 0.05 0.00 -0.22 0.00 0.00 33.01 30.84 1dfp s GLN 156 CO 0.62 -0.06 0.66 -3.38 -0.25 0.00 0.00 175.29 172.88 1dfp s HIS 157 N -2.86 -0.36 -0.01 0.91 -3.43 -0.14 -2.09 115.29 107.31 1dfp s HIS 157 Ca 0.35 0.03 -0.16 0.00 -0.80 0.00 0.00 55.06 54.48 1dfp s HIS 157 Cb 0.09 0.63 0.03 0.00 -1.43 0.00 0.00 32.58 31.90 1dfp s HIS 157 CO 0.17 -1.04 0.34 0.14 -2.00 0.00 0.00 174.74 172.35 1dfp s VAL 158 N -3.82 0.05 -0.25 -5.38 -7.23 -0.97 -1.24 120.40 101.57 1dfp s VAL 158 Ca 0.06 -0.45 -0.11 0.00 -1.81 0.00 0.00 61.98 59.67 1dfp s VAL 158 Cb -0.03 -0.66 -0.05 0.00 0.56 0.00 0.00 36.38 36.20 1dfp s VAL 158 CO -0.03 -0.25 0.19 -0.76 -0.31 0.00 0.00 175.10 173.94 1dfp s LEU 159 N -1.37 4.09 0.04 1.32 2.01 -1.26 -2.37 118.68 121.14 1dfp s LEU 159 Ca -0.13 0.11 0.08 0.00 0.01 0.00 0.00 54.13 54.20 1dfp s LEU 159 Cb -0.05 -2.14 -0.03 0.00 0.01 0.00 0.00 46.19 43.99 1dfp s LEU 159 CO 0.04 0.02 -0.22 -0.76 1.01 0.00 0.00 176.35 176.43 1dfp s LEU 160 N 1.30 2.16 0.04 1.79 1.43 0.24 -4.93 118.68 120.70 1dfp s LEU 160 Ca 0.08 -0.53 -0.27 0.00 -1.03 0.00 0.00 54.13 52.39 1dfp s LEU 160 Cb -0.14 -1.08 -0.05 0.00 0.03 0.00 0.00 46.19 44.95 1dfp s LEU 160 CO 0.07 0.20 0.83 -2.84 0.23 0.00 0.00 176.35 174.83 1dfp s PRO 161 N -1.14 4.54 0.10 1.29 0.02 -1.26 -0.65 135.00 137.91 1dfp s PRO 161 Ca 0.09 1.18 -0.30 0.00 0.02 0.00 0.00 61.00 61.98 1dfp s PRO 161 Cb -0.09 -3.39 -0.06 0.00 0.02 0.00 0.00 34.50 30.98 1dfp s PRO 161 CO 0.02 0.21 1.14 0.08 -0.33 0.00 0.00 177.00 178.11 1dfp s VAL 162 N 0.17 4.03 0.02 3.83 1.01 0.15 -0.95 120.40 128.66 1dfp s VAL 162 Ca 0.42 1.57 -0.12 0.00 0.00 0.00 0.00 61.98 63.85 1dfp s VAL 162 Cb -0.21 -4.00 -0.06 0.00 0.00 0.00 0.00 36.38 32.11 1dfp s VAL 162 CO 0.25 0.18 0.38 -0.76 0.00 0.00 0.00 175.10 175.15 1dfp s LEU 163 N 0.47 4.42 0.34 3.92 1.43 -0.10 -0.56 118.68 128.60 1dfp s LEU 163 Ca 0.54 0.85 -0.27 0.00 -1.03 0.00 0.00 54.13 54.21 1dfp s LEU 163 Cb -0.29 -2.70 -0.09 0.00 0.03 0.00 0.00 46.19 43.14 1dfp s LEU 163 CO 0.31 0.27 1.14 1.51 0.23 0.00 0.00 176.35 179.82 1dfp s ASP 164 N -1.35 6.92 0.38 2.29 -4.77 -1.26 -4.19 116.67 114.67 1dfp s ASP 164 Ca 0.27 2.33 0.11 0.00 -3.30 0.00 0.00 52.55 51.96 1dfp s ASP 164 Cb -0.15 -2.62 0.89 0.00 -1.09 0.00 0.00 42.92 39.95 1dfp s ASP 164 CO 0.14 -0.40 1.87 -0.09 0.70 0.00 0.00 175.17 177.40 1dfp h ARG 165 N 3.25 0.59 -0.30 2.11 2.43 -1.96 -1.35 114.38 119.15 1dfp h ARG 165 Ca -0.48 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 58.64 1dfp h ARG 165 Cb 1.22 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.62 1dfp h ARG 165 CO 0.65 0.39 0.14 0.00 -1.51 0.00 0.00 179.97 179.63 1dfp h ALA 166 N 1.61 0.39 -0.50 2.80 0.00 -1.96 0.76 119.26 122.36 1dfp h ALA 166 Ca 0.44 -0.10 -0.11 0.00 0.00 0.00 0.00 54.91 55.14 1dfp h ALA 166 Cb 0.81 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1dfp h ALA 166 CO -0.19 -0.04 -0.11 1.15 0.00 0.00 0.00 179.25 180.06 1dfp h THR 167 N 0.35 1.26 -0.04 0.00 2.02 -1.79 -2.37 112.91 112.35 1dfp h THR 167 Ca 0.10 -1.24 -0.07 0.00 0.77 0.00 0.00 66.41 65.97 1dfp h THR 167 Cb 0.14 1.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.53 1dfp h THR 167 CO -0.01 0.43 -0.30 0.00 0.37 0.00 0.00 175.52 176.01 1dfp n ASN 169 N -4.15 4.44 -0.05 0.00 5.03 0.24 -1.08 115.26 119.68 1dfp n ASN 169 Ca -0.02 -2.86 -0.13 0.00 0.87 0.00 0.00 54.58 52.45 1dfp n ASN 169 Cb 0.37 -1.75 -0.14 0.00 -1.02 0.00 0.00 39.78 37.24 1dfp n ASN 169 CO 0.00 0.00 0.00 -1.14 -1.83 0.00 0.00 177.26 174.29 1dfp n ARG 170 N 8.35 0.68 0.11 3.52 0.00 -1.26 -2.39 116.66 125.66 1dfp n ARG 170 Ca 0.48 0.20 0.13 0.00 -0.00 0.00 0.00 57.85 58.66 1dfp n ARG 170 Cb 0.46 -1.68 0.40 0.00 0.00 0.00 0.00 32.46 31.65 1dfp n ARG 170 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 1dfp n THR 170 N -3.09 0.63 0.00 5.15 -2.24 -1.26 -4.46 114.28 109.01 1dfp n THR 170 Ca -0.27 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.24 1dfp n THR 170 Cb 1.07 -0.62 0.00 0.00 -2.10 0.00 0.00 70.33 68.68 1dfp n THR 170 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1dfp n HIS 171 N -2.30 0.00 -3.73 4.78 8.25 -1.26 -4.77 115.22 116.19 1dfp n HIS 171 Ca 0.05 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.18 1dfp n HIS 171 Cb 0.42 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.45 1dfp n HIS 171 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 1dfp s HIS 172 N 1.41 3.76 0.00 4.41 3.76 -0.24 -4.91 115.29 123.47 1dfp s HIS 172 Ca 0.00 -3.11 0.00 0.00 -0.15 0.00 0.00 55.06 51.80 1dfp s HIS 172 Cb 0.00 -3.07 0.00 0.00 1.11 0.00 0.00 32.58 30.62 1dfp s HIS 172 CO 0.00 -0.69 0.08 -3.47 -0.85 0.00 0.00 174.74 169.82 1dfp n ASP 173 N 2.31 -0.17 0.00 1.40 -0.08 -1.26 -1.01 116.55 117.75 1dfp n ASP 173 Ca 0.20 -0.17 0.00 0.00 -1.51 0.00 0.00 54.79 53.31 1dfp n ASP 173 Cb 0.36 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.82 1dfp n ASP 173 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1dfp n GLY 174 N 1.01 0.25 0.16 0.27 0.00 -1.01 -4.90 105.19 100.97 1dfp n GLY 174 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.04 1dfp n GLY 174 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dfp h ALA 175 N 0.00 0.95 -1.78 4.61 0.00 -1.38 -3.43 119.26 118.23 1dfp h ALA 175 Ca 0.00 -0.46 -0.56 0.00 0.00 0.00 0.00 54.91 53.88 1dfp h ALA 175 Cb 0.50 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 18.15 1dfp h ALA 175 CO 0.00 0.63 0.94 0.42 0.00 0.00 0.00 179.25 181.24 1dfp s ILE 176 N -3.55 4.21 0.13 0.00 -1.09 -1.26 -5.02 121.20 114.62 1dfp s ILE 176 Ca -0.00 1.28 0.01 0.00 -2.23 0.00 0.00 60.65 59.70 1dfp s ILE 176 Cb 0.12 -4.50 0.02 0.00 -1.58 0.00 0.00 42.46 36.52 1dfp s ILE 176 CO 0.73 -0.87 0.18 0.35 -1.23 0.00 0.00 174.94 174.10 1dfp n THR 177 N 6.68 0.00 0.46 2.92 -2.24 -1.26 -4.95 114.28 115.89 1dfp n THR 177 Ca 0.13 -0.34 0.12 0.00 -2.27 0.00 0.00 64.05 61.69 1dfp n THR 177 Cb 0.48 -1.11 0.46 0.00 -2.10 0.00 0.00 70.33 68.07 1dfp n THR 177 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1dfp n GLU 178 N -1.30 0.18 -0.21 -0.78 1.02 -1.26 -2.16 120.64 116.13 1dfp n GLU 178 Ca 0.03 0.36 0.11 0.00 -0.02 0.00 0.00 57.16 57.64 1dfp n GLU 178 Cb 0.12 -1.81 0.26 0.00 -0.02 0.00 0.00 31.44 29.98 1dfp n GLU 178 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1dfp n ARG 179 N -2.15 2.34 -4.45 3.49 1.74 -1.26 -4.93 116.66 111.45 1dfp n ARG 179 Ca 0.03 -2.04 -0.22 0.00 -0.77 0.00 0.00 57.85 54.85 1dfp n ARG 179 Cb 0.26 -1.48 -0.11 0.00 -1.02 0.00 0.00 32.46 30.11 1dfp n ARG 179 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1dfp s LEU 180 N -1.36 2.32 0.30 0.55 1.43 -0.92 -1.07 118.68 119.95 1dfp s LEU 180 Ca 0.38 -1.31 -0.17 0.00 -1.03 0.00 0.00 54.13 52.00 1dfp s LEU 180 Cb 0.21 -0.48 0.02 0.00 0.03 0.00 0.00 46.19 45.97 1dfp s LEU 180 CO 0.30 -0.51 0.67 0.00 0.23 0.00 0.00 176.35 177.03 1dfp s MET 181 N -3.83 1.86 0.14 1.70 0.23 -0.51 -4.75 119.30 114.14 1dfp s MET 181 Ca 0.34 -1.21 -0.00 0.00 -1.03 0.00 0.00 55.69 53.78 1dfp s MET 181 Cb 0.07 0.57 -0.04 0.00 -1.53 0.00 0.00 34.83 33.90 1dfp s MET 181 CO 0.14 -0.84 0.03 0.00 -2.03 0.00 0.00 175.02 172.33 1dfp s ALA 183 N -3.90 0.00 0.58 0.00 0.00 -0.78 -0.92 121.76 116.74 1dfp s ALA 183 Ca 0.23 -0.60 -0.19 0.00 0.00 0.00 0.00 51.96 51.39 1dfp s ALA 183 Cb 0.07 0.23 -0.04 0.00 0.00 0.00 0.00 23.12 23.38 1dfp s ALA 183 CO 0.02 -0.29 1.19 -1.21 0.00 0.00 0.00 175.76 175.47 1dfp s GLU 184 N -2.51 3.09 -0.28 0.00 2.02 -0.12 -1.89 118.70 119.01 1dfp s GLU 184 Ca -0.06 1.79 0.16 0.00 0.02 0.00 0.00 54.97 56.89 1dfp s GLU 184 Cb -0.02 -1.97 0.48 0.00 0.10 0.00 0.00 34.13 32.72 1dfp s GLU 184 CO -0.04 -1.10 1.13 -1.13 0.02 0.00 0.00 175.26 174.13 1dfp n SER 185 N -1.47 2.94 -4.46 -0.19 3.41 -1.26 -4.59 113.62 108.00 1dfp n SER 185 Ca 0.13 -2.78 -0.44 0.00 -0.26 0.00 0.00 58.87 55.53 1dfp n SER 185 Cb 0.50 -0.43 -0.02 0.00 -0.26 0.00 0.00 64.21 63.99 1dfp n SER 185 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1dfp s ASN 186 N -3.68 6.67 0.00 4.04 2.47 -1.26 -2.09 114.94 121.10 1dfp s ASN 186 Ca 0.37 -2.11 0.00 0.00 0.42 0.00 0.00 52.86 51.53 1dfp s ASN 186 Cb 0.37 -2.42 0.00 0.00 -1.45 0.00 0.00 41.25 37.75 1dfp s ASN 186 CO -0.01 -1.07 0.00 0.54 -3.72 0.00 0.00 177.10 172.84 1dfp n ARG 187 N 6.68 -1.07 -3.72 0.43 5.12 -0.69 -4.94 116.66 118.47 1dfp n ARG 187 Ca 0.27 0.27 -0.16 0.00 -1.93 0.00 0.00 57.85 56.30 1dfp n ARG 187 Cb 0.48 -4.09 -0.16 0.00 -1.16 0.00 0.00 32.46 27.54 1dfp n ARG 187 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 1dfp s ARG 188 N -1.08 0.02 -0.16 5.56 0.52 -1.26 -3.79 118.95 118.76 1dfp s ARG 188 Ca 0.00 0.38 -0.34 0.00 -0.52 0.00 0.00 55.73 55.25 1dfp s ARG 188 Cb 0.00 -0.27 0.14 0.00 0.52 0.00 0.00 34.95 35.34 1dfp s ARG 188 CO 0.00 -0.23 1.24 0.34 0.02 0.00 0.00 175.30 176.67 1dfp s ASP 189 N 1.60 -0.11 0.45 0.23 2.15 -1.13 -3.99 116.67 115.87 1dfp s ASP 189 Ca -0.04 -0.03 -0.07 0.00 0.43 0.00 0.00 52.55 52.84 1dfp s ASP 189 Cb -0.12 0.14 -0.05 0.00 -0.30 0.00 0.00 42.92 42.59 1dfp s ASP 189 CO -0.05 -0.23 0.77 -0.94 -0.17 0.00 0.00 175.17 174.55 1dfp s SER 190 N -2.35 6.35 0.19 -0.34 1.04 -1.26 -0.55 113.70 116.78 1dfp s SER 190 Ca 0.11 0.98 0.02 0.00 0.48 0.00 0.00 55.95 57.53 1dfp s SER 190 Cb 0.00 -2.27 -0.01 0.00 0.10 0.00 0.00 66.02 63.85 1dfp s SER 190 CO -0.04 -0.50 0.22 0.00 0.98 0.00 0.00 173.24 173.90 1dfp n LYS 192 N -0.34 1.03 0.00 0.00 4.81 -1.26 0.32 118.16 122.71 1dfp n LYS 192 Ca 0.02 0.37 0.00 0.00 -0.87 0.00 0.00 58.31 57.84 1dfp n LYS 192 Cb 0.34 -2.03 0.00 0.00 0.02 0.00 0.00 35.03 33.36 1dfp n LYS 192 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1dfp n GLY 193 N 3.61 0.58 0.08 3.14 0.00 -1.26 -1.39 105.19 109.96 1dfp n GLY 193 Ca 0.24 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.38 1dfp n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1dfp n ASP 194 N 0.00 0.72 -4.47 1.61 8.00 0.15 -3.87 116.55 118.69 1dfp n ASP 194 Ca 0.00 0.18 -0.42 0.00 0.71 0.00 0.00 54.79 55.26 1dfp n ASP 194 Cb 0.00 0.58 0.00 0.00 -0.02 0.00 0.00 41.12 41.69 1dfp n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1dfp n SER 195 N -2.43 -0.59 0.00 -2.24 7.64 -1.25 -1.49 113.62 113.24 1dfp n SER 195 Ca 0.01 0.94 0.00 0.00 1.01 0.00 0.00 58.87 60.83 1dfp n SER 195 Cb 0.51 -1.14 0.00 0.00 -1.01 0.00 0.00 64.21 62.58 1dfp n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1dfp n GLY 196 N 1.71 2.59 3.80 0.23 0.00 0.27 -0.38 105.19 113.41 1dfp n GLY 196 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 1dfp n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1dfp s GLY 197 N -1.96 1.59 0.29 -0.02 0.00 -0.56 -3.30 107.32 103.37 1dfp s GLY 197 Ca 0.00 -0.45 -0.18 0.00 0.00 0.00 0.00 44.72 44.08 1dfp s GLY 197 CO 0.00 0.07 0.77 2.56 0.00 0.00 0.00 173.10 176.50 1dfp s PRO 198 N -5.26 4.17 -0.33 2.90 0.04 -1.26 0.00 135.00 135.26 1dfp s PRO 198 Ca 0.63 0.85 0.02 0.00 0.04 0.00 0.00 61.00 62.53 1dfp s PRO 198 Cb -0.14 -2.61 0.08 0.00 0.04 0.00 0.00 34.50 31.87 1dfp s PRO 198 CO 0.53 0.24 0.03 -1.17 0.04 0.00 0.00 177.00 176.67 1dfp s LEU 199 N -2.53 4.38 -0.21 -3.56 1.98 0.14 -3.81 118.68 115.07 1dfp s LEU 199 Ca 0.50 -1.80 -0.06 0.00 -2.89 0.00 0.00 54.13 49.87 1dfp s LEU 199 Cb -0.13 -1.66 -0.03 0.00 0.66 0.00 0.00 46.19 45.03 1dfp s LEU 199 CO 0.19 -0.34 0.04 -0.69 -1.89 0.00 0.00 176.35 173.66 1dfp s VAL 200 N 1.05 4.31 -0.19 1.68 1.01 -0.38 -0.77 120.40 127.12 1dfp s VAL 200 Ca 0.03 -0.19 0.00 0.00 0.00 0.00 0.00 61.98 61.83 1dfp s VAL 200 Cb -0.20 -2.97 0.01 0.00 0.00 0.00 0.00 36.38 33.22 1dfp s VAL 200 CO -0.05 0.40 -0.17 0.00 0.00 0.00 0.00 175.10 175.28 1dfp n GLY 202 N 4.62 -0.50 3.04 0.00 0.00 -1.26 -1.40 105.19 109.69 1dfp n GLY 202 Ca -0.20 0.21 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1dfp n GLY 202 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dfp n GLY 207 N -1.78 0.78 3.59 -0.02 0.00 -1.26 -5.01 105.19 101.48 1dfp n GLY 207 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1dfp n GLY 207 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1dfp s VAL 208 N -3.30 4.21 -0.11 1.61 1.01 -0.49 -5.06 120.40 118.27 1dfp s VAL 208 Ca 0.00 -0.26 -0.29 0.00 0.00 0.00 0.00 61.98 61.43 1dfp s VAL 208 Cb 0.00 -2.83 -0.04 0.00 0.00 0.00 0.00 36.38 33.51 1dfp s VAL 208 CO 0.00 0.52 1.51 -0.22 0.00 0.00 0.00 175.10 176.92 1dfp s LEU 209 N -0.05 4.24 -0.00 3.92 0.20 -1.26 -0.71 118.68 125.02 1dfp s LEU 209 Ca 0.03 1.99 0.00 0.00 0.69 0.00 0.00 54.13 56.85 1dfp s LEU 209 Cb -0.13 -3.53 -0.00 0.00 -0.43 0.00 0.00 46.19 42.09 1dfp s LEU 209 CO 0.02 -0.90 0.00 1.21 -0.29 0.00 0.00 176.35 176.40 1dfp n GLU 210 N 7.00 0.09 -3.67 1.98 4.07 0.05 -2.13 120.64 128.02 1dfp n GLU 210 Ca 0.16 -0.00 -0.08 0.00 -0.06 0.00 0.00 57.16 57.18 1dfp n GLU 210 Cb 0.44 -1.01 -0.02 0.00 -0.06 0.00 0.00 31.44 30.79 1dfp n GLU 210 CO 0.00 0.00 0.00 0.20 -0.06 0.00 0.00 177.13 177.27 1dfp s GLY 211 N -2.05 -0.31 -0.06 8.31 0.00 -0.62 -3.17 107.32 109.42 1dfp s GLY 211 Ca -0.00 0.17 0.05 0.00 0.00 0.00 0.00 44.72 44.94 1dfp s GLY 211 CO 0.01 0.05 -0.22 0.14 0.00 0.00 0.00 173.10 173.08 1dfp s VAL 212 N -3.63 1.83 0.03 1.40 1.01 -0.56 0.27 120.40 120.74 1dfp s VAL 212 Ca 0.08 -0.93 -0.30 0.00 0.00 0.00 0.00 61.98 60.83 1dfp s VAL 212 Cb -0.03 -1.56 -0.08 0.00 0.00 0.00 0.00 36.38 34.71 1dfp s VAL 212 CO -0.01 0.51 1.75 -0.69 0.00 0.00 0.00 175.10 176.66 1dfp s VAL 213 N 0.03 3.14 0.17 2.92 1.01 0.10 -0.90 120.40 126.86 1dfp s VAL 213 Ca -0.07 0.39 -0.30 0.00 0.00 0.00 0.00 61.98 61.99 1dfp s VAL 213 Cb -0.14 -3.25 -0.08 0.00 0.00 0.00 0.00 36.38 32.91 1dfp s VAL 213 CO 0.04 -0.02 1.26 -0.89 0.00 0.00 0.00 175.10 175.49 1dfp s THR 214 N 3.52 3.48 -0.08 3.92 2.01 -1.09 -0.56 115.64 126.84 1dfp s THR 214 Ca 0.78 1.19 -0.17 0.00 0.31 0.00 0.00 61.69 63.81 1dfp s THR 214 Cb -0.39 -3.76 -0.05 0.00 0.01 0.00 0.00 72.50 68.31 1dfp s THR 214 CO 0.34 0.16 0.44 -0.94 -0.69 0.00 0.00 174.62 173.93 1dfp s SER 215 N 0.43 6.71 -0.19 3.53 1.04 -1.26 -4.78 113.70 119.18 1dfp s SER 215 Ca 0.56 0.85 -0.36 0.00 0.48 0.00 0.00 55.95 57.48 1dfp s SER 215 Cb -0.34 -2.27 0.15 0.00 0.10 0.00 0.00 66.02 63.66 1dfp s SER 215 CO 0.35 0.13 1.35 -0.83 0.98 0.00 0.00 173.24 175.22 1dfp s GLY 216 N -0.00 -0.31 -0.59 7.32 0.00 -1.26 -4.89 107.32 107.59 1dfp s GLY 216 Ca 0.24 1.48 -0.24 0.00 0.00 0.00 0.00 44.72 46.20 1dfp s GLY 216 CO 0.11 0.45 0.98 -0.56 0.00 0.00 0.00 173.10 174.07 1dfp s SER 217 N -2.39 6.30 0.02 1.64 0.01 -1.26 -4.98 113.70 113.04 1dfp s SER 217 Ca 0.12 -0.48 -0.05 0.00 1.31 0.00 0.00 55.95 56.86 1dfp s SER 217 Cb 0.02 -2.44 -0.01 0.00 0.21 0.00 0.00 66.02 63.79 1dfp s SER 217 CO -0.04 -1.32 0.07 -0.60 0.41 0.00 0.00 173.24 171.76 1dfp s ARG 218 N 4.12 0.50 0.27 12.44 3.52 -1.26 -5.14 118.95 133.40 1dfp s ARG 218 Ca 0.29 -0.64 -0.29 0.00 -0.13 0.00 0.00 55.73 54.96 1dfp s ARG 218 Cb -0.13 0.19 -0.09 0.00 -1.56 0.00 0.00 34.95 33.36 1dfp s ARG 218 CO 0.17 -0.11 1.10 0.08 -0.81 0.00 0.00 175.30 175.73 1dfp s VAL 219 N -2.06 3.51 -0.02 7.11 1.01 -1.26 -4.94 120.40 123.74 1dfp s VAL 219 Ca -0.10 1.50 -0.18 0.00 0.00 0.00 0.00 61.98 63.20 1dfp s VAL 219 Cb -0.05 -3.96 -0.05 0.00 0.00 0.00 0.00 36.38 32.33 1dfp s VAL 219 CO -0.02 0.35 0.51 0.00 0.00 0.00 0.00 175.10 175.94 1dfp n GLY 221 N 2.40 1.40 3.66 0.00 0.00 -1.26 -4.95 105.19 106.46 1dfp n GLY 221 Ca -0.09 -0.10 -0.37 0.00 0.00 0.00 0.00 46.02 45.45 1dfp n GLY 221 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1dfp s ASN 222 N -2.67 6.27 0.00 1.61 3.84 -0.89 -1.71 114.94 121.39 1dfp s ASN 222 Ca 0.00 0.30 -0.00 0.00 0.21 0.00 0.00 52.86 53.37 1dfp s ASN 222 Cb 0.00 -2.17 -0.01 0.00 -0.55 0.00 0.00 41.25 38.53 1dfp s ASN 222 CO 0.00 -0.01 0.33 -2.11 -2.79 0.00 0.00 177.10 172.52 1dfp n ARG 223 N 4.39 0.12 -0.01 0.43 1.85 -1.24 -4.36 116.66 117.85 1dfp n ARG 223 Ca -0.12 -0.02 0.00 0.00 -1.00 0.00 0.00 57.85 56.71 1dfp n ARG 223 Cb 0.52 -1.47 0.00 0.00 -1.05 0.00 0.00 32.46 30.46 1dfp n ARG 223 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 1dfp n LYS 224 N 2.14 0.00 -1.70 2.89 4.76 -1.26 -4.79 118.16 120.20 1dfp n LYS 224 Ca 0.01 0.00 -0.37 0.00 -2.87 0.00 0.00 58.31 55.07 1dfp n LYS 224 Cb 0.06 0.00 0.06 0.00 -1.84 0.00 0.00 35.03 33.31 1dfp n LYS 224 CO 0.00 0.00 0.00 -2.30 -1.37 0.00 0.00 177.40 173.73 1dfp n PRO 225 N 0.00 1.16 -2.20 1.97 -0.02 -1.26 -4.75 135.00 129.89 1dfp n PRO 225 Ca 0.00 0.45 -0.39 0.00 -2.02 0.00 0.00 63.50 61.53 1dfp n PRO 225 Cb 0.00 -2.45 -0.02 0.00 -0.02 0.00 0.00 33.50 31.01 1dfp n PRO 225 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1dfp s GLY 226 N -1.26 2.94 -0.11 -1.23 0.00 -0.79 -4.86 107.32 102.00 1dfp s GLY 226 Ca 0.79 1.11 -0.00 0.00 0.00 0.00 0.00 44.72 46.62 1dfp s GLY 226 CO 0.43 1.69 -0.10 -0.42 0.00 0.00 0.00 173.10 174.70 1dfp s ILE 227 N -1.27 3.39 0.00 0.90 1.01 -1.26 -1.87 121.20 122.10 1dfp s ILE 227 Ca 0.53 -0.56 0.05 0.00 0.00 0.00 0.00 60.65 60.67 1dfp s ILE 227 Cb -0.35 -2.42 -0.01 0.00 0.01 0.00 0.00 42.46 39.69 1dfp s ILE 227 CO 0.45 0.54 -0.15 -0.31 0.00 0.00 0.00 174.94 175.48 1dfp s TYR 228 N -0.03 1.32 -0.06 3.97 1.51 -0.53 -2.65 117.35 120.87 1dfp s TYR 228 Ca -0.02 -0.27 -0.28 0.00 -1.01 0.00 0.00 57.07 55.49 1dfp s TYR 228 Cb -0.14 -0.83 -0.02 0.00 -0.11 0.00 0.00 41.96 40.86 1dfp s TYR 228 CO 0.03 -0.00 0.92 0.99 -1.11 0.00 0.00 175.55 176.38 1dfp s THR 229 N -0.47 4.88 -0.28 -0.71 2.01 -0.08 -1.42 115.64 119.57 1dfp s THR 229 Ca 0.05 1.89 -0.29 0.00 0.31 0.00 0.00 61.69 63.65 1dfp s THR 229 Cb -0.06 -4.24 0.01 0.00 0.01 0.00 0.00 72.50 68.21 1dfp s THR 229 CO -0.00 0.11 1.10 -0.13 -0.69 0.00 0.00 174.62 175.01 1dfp s ARG 230 N 1.41 4.12 0.32 4.92 0.52 -0.23 -1.50 118.95 128.51 1dfp s ARG 230 Ca 0.47 1.20 0.11 0.00 -0.52 0.00 0.00 55.73 56.99 1dfp s ARG 230 Cb -0.19 -3.72 0.55 0.00 0.52 0.00 0.00 34.95 32.11 1dfp s ARG 230 CO 0.21 -0.83 1.73 -0.39 0.02 0.00 0.00 175.30 176.04 1dfp h VAL 231 N 5.66 1.33 -0.11 3.52 -1.51 -1.87 -3.17 116.25 120.10 1dfp h VAL 231 Ca -0.21 -1.59 0.00 0.00 -1.23 0.00 0.00 66.70 63.67 1dfp h VAL 231 Cb 1.07 1.83 -0.01 0.00 -2.13 0.00 0.00 31.29 32.05 1dfp h VAL 231 CO 1.02 0.46 0.07 0.00 -1.23 0.00 0.00 177.57 177.88 1dfp h ALA 232 N 1.50 1.91 0.00 5.19 0.00 -1.82 -0.37 119.26 125.67 1dfp h ALA 232 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1dfp h ALA 232 Cb 0.83 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1dfp h ALA 232 CO 0.06 0.08 0.00 -1.13 0.00 0.00 0.00 179.25 178.26 1dfp n SER 233 N -4.52 0.00 0.00 0.00 3.41 -1.20 -3.41 113.62 107.90 1dfp n SER 233 Ca -0.01 -0.65 0.00 0.00 -0.26 0.00 0.00 58.87 57.95 1dfp n SER 233 Cb 0.08 -0.10 0.00 0.00 -0.26 0.00 0.00 64.21 63.93 1dfp n SER 233 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1dfp n TYR 234 N -1.10 0.00 -0.26 7.33 4.01 -0.18 -4.79 117.16 122.17 1dfp n TYR 234 Ca 0.20 -0.21 0.19 0.00 -0.16 0.00 0.00 57.90 57.91 1dfp n TYR 234 Cb 0.15 -0.02 0.49 0.00 -0.31 0.00 0.00 39.34 39.65 1dfp n TYR 234 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1dfp h ALA 235 N 0.00 2.16 -0.37 -0.72 0.00 -1.49 -0.80 119.26 118.04 1dfp h ALA 235 Ca 0.00 0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 1dfp h ALA 235 Cb 0.23 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1dfp h ALA 235 CO 0.00 -0.46 -0.13 0.00 0.00 0.00 0.00 179.25 178.66 1dfp h ALA 236 N 1.61 0.51 -0.09 0.00 0.00 -1.86 -1.21 119.26 118.22 1dfp h ALA 236 Ca 0.49 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1dfp h ALA 236 Cb 1.17 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 1dfp h ALA 236 CO -0.20 0.41 0.04 2.35 0.00 0.00 0.00 179.25 181.84 1dfp h TRP 237 N 0.54 0.14 -0.04 0.00 7.01 -1.56 -2.08 115.95 119.95 1dfp h TRP 237 Ca 0.09 -0.01 0.03 0.00 2.11 0.00 0.00 58.89 61.11 1dfp h TRP 237 Cb 0.66 -0.04 -0.04 0.00 -2.10 0.00 0.00 29.16 27.64 1dfp h TRP 237 CO 0.05 0.24 -0.15 0.82 -2.79 0.00 0.00 178.44 176.61 1dfp h ILE 238 N 0.00 0.61 -0.57 2.65 2.04 -1.20 -2.33 117.51 118.72 1dfp h ILE 238 Ca 0.03 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.97 1dfp h ILE 238 Cb 0.15 0.61 -0.06 0.00 -0.74 0.00 0.00 36.82 36.78 1dfp h ILE 238 CO -0.00 0.00 0.23 0.44 0.00 0.00 0.00 178.15 178.81 1dfp h ASP 239 N -0.23 0.25 0.23 1.72 3.32 -1.15 -1.26 116.42 119.30 1dfp h ASP 239 Ca 0.07 0.06 -0.04 0.00 0.02 0.00 0.00 57.03 57.14 1dfp h ASP 239 Cb 0.32 0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.90 1dfp h ASP 239 CO -0.18 0.16 -0.19 0.77 -1.72 0.00 0.00 179.24 178.08 1dfp h SER 240 N 0.42 0.00 0.51 6.45 4.64 -0.98 -2.93 113.55 121.66 1dfp h SER 240 Ca 0.28 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 61.30 1dfp h SER 240 Cb 0.30 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.40 1dfp h SER 240 CO -0.26 0.19 -1.37 0.58 -0.87 0.00 0.00 176.83 175.10 1dfp h VAL 241 N 0.00 1.36 -0.08 0.95 2.07 -0.78 -3.26 116.25 116.50 1dfp h VAL 241 Ca -0.00 -2.92 0.00 0.00 0.82 0.00 0.00 66.70 64.60 1dfp h VAL 241 Cb 0.36 2.91 0.00 0.00 -1.52 0.00 0.00 31.29 33.04 1dfp h VAL 241 CO 0.03 0.86 0.00 0.18 0.02 0.00 0.00 177.57 178.65 1dfp n LEU 242 N -3.54 1.52 0.00 2.57 4.77 -0.57 -5.12 117.00 116.63 1dfp n LEU 242 Ca -0.12 -0.77 0.00 0.00 -0.03 0.00 0.00 56.01 55.09 1dfp n LEU 242 Cb 1.04 -0.49 0.00 0.00 -2.33 0.00 0.00 43.42 41.65 1dfp n LEU 242 CO 0.54 0.28 0.00 0.00 -1.33 0.00 0.00 177.39 176.89