#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cdp s SER 4 N 0.00 -0.16 -0.12 0.00 0.15 -1.26 0.26 113.70 112.56 2cdp s SER 4 Ca 0.00 0.33 0.01 0.00 0.70 0.00 0.00 55.95 56.99 2cdp s SER 4 Cb 0.00 0.31 0.02 0.00 -1.71 0.00 0.00 66.02 64.64 2cdp s SER 4 CO 0.00 -0.07 -0.13 -0.63 1.20 0.00 0.00 173.24 173.61 2cdp s ILE 5 N 0.28 1.42 -0.08 6.45 1.01 0.37 -4.99 121.20 125.66 2cdp s ILE 5 Ca -0.02 -0.56 -0.00 0.00 0.00 0.00 0.00 60.65 60.07 2cdp s ILE 5 Cb -0.03 -1.34 -0.03 0.00 0.01 0.00 0.00 42.46 41.07 2cdp s ILE 5 CO -0.01 0.43 -0.06 0.00 0.00 0.00 0.00 174.94 175.30 2cdp s ALA 6 N 1.33 3.00 -0.09 9.38 0.00 -1.26 -0.19 121.76 133.92 2cdp s ALA 6 Ca 0.00 -0.87 0.01 0.00 0.00 0.00 0.00 51.96 51.10 2cdp s ALA 6 Cb -0.14 -1.29 0.02 0.00 0.00 0.00 0.00 23.12 21.71 2cdp s ALA 6 CO -0.07 0.51 -0.10 0.08 0.00 0.00 0.00 175.76 176.19 2cdp s VAL 7 N -0.61 1.09 0.02 0.00 1.01 0.74 -5.01 120.40 117.64 2cdp s VAL 7 Ca 0.09 -0.39 -0.30 0.00 0.00 0.00 0.00 61.98 61.38 2cdp s VAL 7 Cb -0.12 -1.05 -0.04 0.00 0.00 0.00 0.00 36.38 35.17 2cdp s VAL 7 CO 0.02 0.36 1.13 -1.61 0.00 0.00 0.00 175.10 175.00 2cdp s GLU 8 N 1.18 4.46 0.45 2.72 0.41 -1.26 -0.51 118.70 126.14 2cdp s GLU 8 Ca -0.05 1.65 0.15 0.00 -0.41 0.00 0.00 54.97 56.31 2cdp s GLU 8 Cb -0.14 -3.41 1.07 0.00 -1.78 0.00 0.00 34.13 29.87 2cdp s GLU 8 CO -0.02 -0.23 2.00 0.00 -0.49 0.00 0.00 175.26 176.52 2cdp h ALA 9 N 6.89 2.04 0.00 5.21 0.00 -1.49 -1.54 119.26 130.38 2cdp h ALA 9 Ca -0.40 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2cdp h ALA 9 Cb 1.21 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2cdp h ALA 9 CO 0.80 -0.15 0.00 -0.85 0.00 0.00 0.00 179.25 179.05 2cdp n GLU 10 N -4.47 0.25 -1.26 0.00 0.00 -1.26 -2.90 120.64 111.00 2cdp n GLU 10 Ca 0.08 0.09 -0.28 0.00 0.00 0.00 0.00 57.16 57.05 2cdp n GLU 10 Cb 0.34 -1.50 0.14 0.00 0.00 0.00 0.00 31.44 30.43 2cdp n GLU 10 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2cdp n ASN 11 N -1.33 5.18 -4.69 -1.84 3.02 -0.58 -4.99 115.26 110.04 2cdp n ASN 11 Ca 0.09 -3.68 -0.38 0.00 -0.03 0.00 0.00 54.58 50.59 2cdp n ASN 11 Cb 0.19 -0.88 0.06 0.00 -0.61 0.00 0.00 39.78 38.54 2cdp n ASN 11 CO 0.00 0.00 0.00 2.22 -2.62 0.00 0.00 177.26 176.86 2cdp n PHE 12 N -1.06 1.57 0.20 3.10 1.16 -1.14 -4.91 117.46 116.38 2cdp n PHE 12 Ca 0.60 0.43 0.10 0.00 -1.87 0.00 0.00 57.45 56.72 2cdp n PHE 12 Cb 1.29 -2.24 0.13 0.00 -1.61 0.00 0.00 39.48 37.05 2cdp n PHE 12 CO 0.00 0.00 0.00 -0.91 -1.87 0.00 0.00 176.76 173.98 2cdp h ASN 13 N 0.71 0.00 -3.81 5.98 2.35 -0.51 -3.48 115.58 116.82 2cdp h ASN 13 Ca -0.50 0.00 0.17 0.00 -0.55 0.00 0.00 56.30 55.42 2cdp h ASN 13 Cb 1.34 0.00 -0.23 0.00 0.05 0.00 0.00 38.32 39.48 2cdp h ASN 13 CO 0.53 0.11 0.74 0.00 -1.65 0.00 0.00 177.43 177.16 2cdp s ALA 14 N -3.16 -2.02 0.10 -0.83 0.00 -1.21 -5.01 121.76 109.63 2cdp s ALA 14 Ca 0.06 1.67 0.03 0.00 0.00 0.00 0.00 51.96 53.72 2cdp s ALA 14 Cb 0.06 -0.83 -0.04 0.00 0.00 0.00 0.00 23.12 22.31 2cdp s ALA 14 CO 0.69 -0.36 -0.08 0.14 0.00 0.00 0.00 175.76 176.15 2cdp s VAL 15 N -1.43 0.83 0.29 0.00 -7.23 -1.26 -0.81 120.40 110.79 2cdp s VAL 15 Ca 0.04 -1.82 -0.16 0.00 -1.81 0.00 0.00 61.98 58.23 2cdp s VAL 15 Cb -0.01 -1.55 0.01 0.00 0.56 0.00 0.00 36.38 35.40 2cdp s VAL 15 CO -0.04 -0.73 0.62 -0.83 -0.31 0.00 0.00 175.10 173.82 2cdp s GLY 16 N -2.80 0.30 0.00 2.32 0.00 -0.63 -4.88 107.32 101.62 2cdp s GLY 16 Ca 0.09 -0.65 0.00 0.00 0.00 0.00 0.00 44.72 44.16 2cdp s GLY 16 CO -0.02 -0.37 0.00 0.61 0.00 0.00 0.00 173.10 173.32 2cdp n GLY 17 N -0.45 3.96 0.00 0.20 0.00 -1.26 -1.68 105.19 105.97 2cdp n GLY 17 Ca -0.03 -1.60 0.05 0.00 0.00 0.00 0.00 46.02 44.44 2cdp n GLY 17 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2cdp n THR 18 N -1.97 0.00 -0.22 2.61 5.66 -1.26 -4.75 114.28 114.36 2cdp n THR 18 Ca 0.00 -0.22 -0.02 0.00 -3.05 0.00 0.00 64.05 60.76 2cdp n THR 18 Cb 0.00 0.30 0.19 0.00 -1.55 0.00 0.00 70.33 69.27 2cdp n THR 18 CO 0.00 0.00 0.00 0.15 -3.05 0.00 0.00 175.07 172.17 2cdp h PHE 19 N 0.00 0.99 0.00 1.09 3.57 -1.96 -3.53 116.94 117.10 2cdp h PHE 19 Ca 0.00 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.47 2cdp h PHE 19 Cb 0.43 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 38.85 2cdp h PHE 19 CO 0.00 0.71 0.00 -0.35 -2.23 0.00 0.00 178.31 176.44 2cdp n PRO 26 N -4.35 0.43 -4.23 6.41 -0.04 -1.26 -5.05 135.00 126.92 2cdp n PRO 26 Ca 0.07 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.36 2cdp n PRO 26 Cb 0.12 -0.04 -0.14 0.00 -0.04 0.00 0.00 33.50 33.40 2cdp n PRO 26 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2cdp s VAL 27 N 0.00 0.55 0.22 0.52 1.01 -1.26 -4.61 120.40 116.83 2cdp s VAL 27 Ca 0.00 -0.39 0.08 0.00 0.00 0.00 0.00 61.98 61.67 2cdp s VAL 27 Cb 0.00 -0.48 -0.05 0.00 0.00 0.00 0.00 36.38 35.85 2cdp s VAL 27 CO 0.00 0.09 -0.14 -0.44 0.00 0.00 0.00 175.10 174.61 2cdp s SER 28 N -0.33 2.68 -0.04 3.32 0.01 -0.87 -4.99 113.70 113.48 2cdp s SER 28 Ca 0.01 -1.05 -0.01 0.00 1.31 0.00 0.00 55.95 56.22 2cdp s SER 28 Cb -0.03 -0.15 -0.04 0.00 0.21 0.00 0.00 66.02 66.01 2cdp s SER 28 CO -0.00 -0.18 0.03 -0.69 0.41 0.00 0.00 173.24 172.81 2cdp s VAL 29 N -2.94 4.45 0.12 3.43 1.01 -1.26 -0.85 120.40 124.36 2cdp s VAL 29 Ca 0.24 -0.36 -0.10 0.00 0.00 0.00 0.00 61.98 61.76 2cdp s VAL 29 Cb -0.00 -2.95 0.00 0.00 0.00 0.00 0.00 36.38 33.43 2cdp s VAL 29 CO 0.08 0.48 0.27 -0.72 0.00 0.00 0.00 175.10 175.21 2cdp s TYR 30 N -1.03 0.15 -0.01 5.22 -0.85 -0.35 -4.92 117.35 115.56 2cdp s TYR 30 Ca 0.18 -0.54 0.06 0.00 -0.52 0.00 0.00 57.07 56.25 2cdp s TYR 30 Cb -0.12 0.02 -0.02 0.00 0.38 0.00 0.00 41.96 42.23 2cdp s TYR 30 CO 0.08 -0.64 -0.20 0.99 -1.52 0.00 0.00 175.55 174.25 2cdp s THR 31 N -3.88 1.59 -0.27 -3.49 2.01 -1.26 -1.11 115.64 109.22 2cdp s THR 31 Ca 0.08 -0.88 -0.14 0.00 0.31 0.00 0.00 61.69 61.06 2cdp s THR 31 Cb 0.04 -1.32 0.09 0.00 0.01 0.00 0.00 72.50 71.31 2cdp s THR 31 CO -0.08 0.43 0.65 0.54 -0.69 0.00 0.00 174.62 175.47 2cdp s VAL 32 N -0.49 -0.21 -1.54 3.82 0.11 0.39 -4.96 120.40 117.51 2cdp s VAL 32 Ca 0.08 0.01 -0.02 0.00 -2.93 0.00 0.00 61.98 59.12 2cdp s VAL 32 Cb -0.08 -0.95 0.00 0.00 -1.53 0.00 0.00 36.38 33.82 2cdp s VAL 32 CO -0.01 0.01 0.32 0.59 -3.33 0.00 0.00 175.10 172.68 2cdp n ASN 33 N 4.56 -5.70 -0.15 3.54 3.02 -1.26 -1.49 115.26 117.79 2cdp n ASN 33 Ca -0.18 -0.16 -0.02 0.00 -0.03 0.00 0.00 54.58 54.19 2cdp n ASN 33 Cb 0.56 -4.62 -0.01 0.00 -0.61 0.00 0.00 39.78 35.11 2cdp n ASN 33 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2cdp n GLY 34 N -1.27 0.54 3.26 7.41 0.00 -1.26 -5.02 105.19 108.84 2cdp n GLY 34 Ca -0.16 -0.44 -0.32 0.00 0.00 0.00 0.00 46.02 45.10 2cdp n GLY 34 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2cdp s ASN 35 N -2.48 3.15 -0.11 1.61 0.02 -0.55 -5.13 114.94 111.46 2cdp s ASN 35 Ca 0.00 -0.52 -0.07 0.00 -1.02 0.00 0.00 52.86 51.25 2cdp s ASN 35 Cb 0.00 -1.13 -0.04 0.00 0.02 0.00 0.00 41.25 40.10 2cdp s ASN 35 CO 0.00 0.21 0.16 -0.89 0.02 0.00 0.00 177.10 176.59 2cdp s THR 36 N 0.07 5.48 0.29 1.60 2.01 -1.26 -0.47 115.64 123.36 2cdp s THR 36 Ca -0.10 0.21 -0.18 0.00 0.31 0.00 0.00 61.69 61.93 2cdp s THR 36 Cb -0.16 -3.43 0.02 0.00 0.01 0.00 0.00 72.50 68.95 2cdp s THR 36 CO 0.06 0.59 0.69 0.00 -0.69 0.00 0.00 174.62 175.27 2cdp s ALA 37 N -1.06 -0.94 0.04 7.40 0.00 -0.27 -4.63 121.76 122.31 2cdp s ALA 37 Ca 0.16 -0.50 0.01 0.00 0.00 0.00 0.00 51.96 51.63 2cdp s ALA 37 Cb -0.12 0.86 -0.04 0.00 0.00 0.00 0.00 23.12 23.82 2cdp s ALA 37 CO 0.06 -1.00 0.08 0.96 0.00 0.00 0.00 175.76 175.86 2cdp s ILE 38 N -3.64 4.66 0.09 0.00 -4.36 -0.17 -1.21 121.20 116.56 2cdp s ILE 38 Ca 0.14 -0.57 0.01 0.00 -0.26 0.00 0.00 60.65 59.96 2cdp s ILE 38 Cb -0.05 -3.19 -0.00 0.00 1.25 0.00 0.00 42.46 40.47 2cdp s ILE 38 CO 0.08 0.24 0.11 -0.46 0.24 0.00 0.00 174.94 175.15 2cdp n ASN 39 N 0.82 -0.29 -2.85 4.36 6.94 -0.03 -2.41 115.26 121.79 2cdp n ASN 39 Ca -0.11 -1.55 -0.21 0.00 -0.02 0.00 0.00 54.58 52.70 2cdp n ASN 39 Cb 0.52 0.59 0.01 0.00 -2.36 0.00 0.00 39.78 38.54 2cdp n ASN 39 CO 0.00 0.00 0.00 -1.22 -1.03 0.00 0.00 177.26 175.01 2cdp n TYR 40 N -0.16 -1.64 -2.91 -2.53 4.01 -1.26 -2.04 117.16 110.62 2cdp n TYR 40 Ca 0.01 0.31 -0.43 0.00 -0.16 0.00 0.00 57.90 57.64 2cdp n TYR 40 Cb 0.16 -3.83 -0.05 0.00 -0.31 0.00 0.00 39.34 35.31 2cdp n TYR 40 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 2cdp s VAL 41 N -3.02 4.63 0.46 -0.72 1.01 -1.26 -4.38 120.40 117.12 2cdp s VAL 41 Ca 0.21 0.72 0.01 0.00 0.00 0.00 0.00 61.98 62.92 2cdp s VAL 41 Cb -0.10 -4.31 0.00 0.00 0.00 0.00 0.00 36.38 31.97 2cdp s VAL 41 CO 0.25 -0.64 0.68 0.20 0.00 0.00 0.00 175.10 175.59 2cdp s ASN 42 N 2.05 5.74 0.00 3.32 -0.87 -1.26 -1.03 114.94 122.89 2cdp s ASN 42 Ca 0.33 0.20 0.00 0.00 -1.57 0.00 0.00 52.86 51.82 2cdp s ASN 42 Cb -0.12 -1.39 0.00 0.00 -0.02 0.00 0.00 41.25 39.72 2cdp s ASN 42 CO 0.21 -0.76 0.00 1.67 -2.57 0.00 0.00 177.10 175.65 2cdp n GLN 43 N -2.10 0.00 -0.83 -0.60 7.27 -0.63 -1.72 117.38 118.77 2cdp n GLN 43 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.09 2cdp n GLN 43 Cb 0.58 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.23 2cdp n GLN 43 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2cdp n GLY 44 N 0.00 1.13 3.75 1.69 0.00 -0.47 -4.63 105.19 106.66 2cdp n GLY 44 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 2cdp n GLY 44 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2cdp s ASP 45 N -3.02 4.19 0.06 1.61 1.01 -0.70 -4.56 116.67 115.27 2cdp s ASP 45 Ca 0.00 1.69 -0.25 0.00 0.71 0.00 0.00 52.55 54.70 2cdp s ASP 45 Cb 0.00 -2.39 0.06 0.00 1.01 0.00 0.00 42.92 41.60 2cdp s ASP 45 CO 0.00 -2.21 0.59 -0.72 0.21 0.00 0.00 175.17 173.03 2cdp s TYR 46 N -2.93 -0.52 -0.05 4.23 -0.85 -0.68 -0.85 117.35 115.72 2cdp s TYR 46 Ca 0.62 0.57 0.03 0.00 -0.52 0.00 0.00 57.07 57.77 2cdp s TYR 46 Cb -0.17 0.44 0.01 0.00 0.38 0.00 0.00 41.96 42.61 2cdp s TYR 46 CO 0.56 -0.71 -0.11 0.00 -1.52 0.00 0.00 175.55 173.77 2cdp s ALA 47 N -2.63 1.11 -0.08 9.51 0.00 -0.23 -1.61 121.76 127.83 2cdp s ALA 47 Ca -0.04 -0.39 -0.01 0.00 0.00 0.00 0.00 51.96 51.52 2cdp s ALA 47 Cb -0.01 -0.46 -0.03 0.00 0.00 0.00 0.00 23.12 22.63 2cdp s ALA 47 CO -0.03 0.14 -0.04 -0.51 0.00 0.00 0.00 175.76 175.32 2cdp s ASP 48 N 0.44 4.88 0.04 0.00 1.01 0.01 -0.74 116.67 122.31 2cdp s ASP 48 Ca -0.09 0.03 0.03 0.00 0.71 0.00 0.00 52.55 53.23 2cdp s ASP 48 Cb -0.13 -1.35 -0.02 0.00 1.01 0.00 0.00 42.92 42.44 2cdp s ASP 48 CO 0.02 0.35 -0.10 -0.31 0.21 0.00 0.00 175.17 175.34 2cdp s TYR 49 N -0.71 0.88 -0.10 4.23 2.02 0.67 0.31 117.35 124.65 2cdp s TYR 49 Ca 0.11 -0.38 -0.01 0.00 -0.37 0.00 0.00 57.07 56.42 2cdp s TYR 49 Cb -0.11 -0.52 -0.03 0.00 -0.40 0.00 0.00 41.96 40.89 2cdp s TYR 49 CO 0.02 -0.02 -0.05 0.99 -1.57 0.00 0.00 175.55 174.93 2cdp s THR 50 N -0.98 3.87 0.07 -0.71 2.01 -1.26 -0.94 115.64 117.69 2cdp s THR 50 Ca -0.03 -0.39 0.04 0.00 0.31 0.00 0.00 61.69 61.61 2cdp s THR 50 Cb -0.08 -2.63 -0.03 0.00 0.01 0.00 0.00 72.50 69.77 2cdp s THR 50 CO 0.01 0.56 -0.11 0.27 -0.69 0.00 0.00 174.62 174.66 2cdp s ILE 51 N -0.36 0.85 -0.05 1.82 -4.36 -0.08 -5.00 121.20 114.02 2cdp s ILE 51 Ca 0.06 -1.30 0.06 0.00 -0.26 0.00 0.00 60.65 59.21 2cdp s ILE 51 Cb -0.12 -0.96 -0.01 0.00 1.25 0.00 0.00 42.46 42.61 2cdp s ILE 51 CO 0.02 -0.36 -0.24 0.00 0.24 0.00 0.00 174.94 174.59 2cdp s ALA 52 N -1.59 2.20 -0.26 2.27 0.00 -1.26 -1.31 121.76 121.81 2cdp s ALA 52 Ca -0.03 -1.05 0.02 0.00 0.00 0.00 0.00 51.96 50.90 2cdp s ALA 52 Cb -0.08 -0.68 0.06 0.00 0.00 0.00 0.00 23.12 22.42 2cdp s ALA 52 CO 0.01 0.44 -0.08 0.08 0.00 0.00 0.00 175.76 176.21 2cdp s VAL 53 N -0.25 2.00 0.12 0.00 1.01 0.15 -4.99 120.40 118.44 2cdp s VAL 53 Ca -0.01 -1.58 -0.13 0.00 0.00 0.00 0.00 61.98 60.26 2cdp s VAL 53 Cb -0.13 -2.18 -0.09 0.00 0.00 0.00 0.00 36.38 33.98 2cdp s VAL 53 CO 0.03 -0.10 1.40 0.00 0.00 0.00 0.00 175.10 176.43 2cdp h ALA 54 N 7.81 0.45 -3.02 5.51 0.00 -1.92 0.26 119.26 128.36 2cdp h ALA 54 Ca -0.17 -0.49 -0.66 0.00 0.00 0.00 0.00 54.91 53.59 2cdp h ALA 54 Cb 1.05 -0.08 -0.29 0.00 0.00 0.00 0.00 17.79 18.47 2cdp h ALA 54 CO 0.45 0.62 -0.74 -1.14 0.00 0.00 0.00 179.25 178.44 2cdp s GLN 55 N -4.17 3.30 0.56 0.00 2.00 -1.26 -4.73 119.66 115.35 2cdp s GLN 55 Ca -0.11 -0.67 -0.20 0.00 -2.00 0.00 0.00 55.36 52.37 2cdp s GLN 55 Cb 0.10 -2.96 -0.05 0.00 0.80 0.00 0.00 33.01 30.89 2cdp s GLN 55 CO 0.88 -0.21 1.15 0.00 -0.50 0.00 0.00 175.29 176.60 2cdp n ALA 56 N 4.77 0.79 0.00 1.58 0.00 -1.26 -4.67 120.51 121.71 2cdp n ALA 56 Ca -0.18 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2cdp n ALA 56 Cb 0.50 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.74 2cdp n ALA 56 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cdp n GLY 57 N 1.04 1.31 3.64 0.00 0.00 -0.20 -4.92 105.19 106.05 2cdp n GLY 57 Ca 0.12 -1.09 -0.43 0.00 0.00 0.00 0.00 46.02 44.63 2cdp n GLY 57 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2cdp s ASN 58 N 0.00 6.76 -0.19 1.61 0.01 -1.26 -0.75 114.94 121.12 2cdp s ASN 58 Ca 0.00 1.24 -0.05 0.00 -0.71 0.00 0.00 52.86 53.33 2cdp s ASN 58 Cb 0.00 -2.54 -0.03 0.00 0.41 0.00 0.00 41.25 39.09 2cdp s ASN 58 CO 0.00 -1.00 0.01 -0.31 -1.51 0.00 0.00 177.10 174.29 2cdp s TYR 59 N 4.11 3.09 0.07 2.20 2.02 0.10 -4.57 117.35 124.37 2cdp s TYR 59 Ca 0.54 -0.27 -0.30 0.00 -0.37 0.00 0.00 57.07 56.66 2cdp s TYR 59 Cb -0.16 -2.06 -0.05 0.00 -0.40 0.00 0.00 41.96 39.29 2cdp s TYR 59 CO 0.20 -0.09 1.01 0.99 -1.57 0.00 0.00 175.55 176.09 2cdp s THR 60 N 0.72 4.52 -0.15 -0.71 2.01 -0.29 -0.63 115.64 121.11 2cdp s THR 60 Ca 0.01 1.95 -0.16 0.00 0.31 0.00 0.00 61.69 63.80 2cdp s THR 60 Cb -0.14 -4.25 -0.04 0.00 0.01 0.00 0.00 72.50 68.08 2cdp s THR 60 CO 0.02 0.23 0.37 -0.63 -0.69 0.00 0.00 174.62 173.92 2cdp s ILE 61 N 0.49 5.25 -0.12 1.82 1.01 0.59 -1.45 121.20 128.79 2cdp s ILE 61 Ca 0.50 0.72 0.00 0.00 0.00 0.00 0.00 60.65 61.87 2cdp s ILE 61 Cb -0.24 -3.71 0.02 0.00 0.01 0.00 0.00 42.46 38.54 2cdp s ILE 61 CO 0.30 0.35 -0.10 -0.55 0.00 0.00 0.00 174.94 174.93 2cdp s SER 62 N 0.61 2.31 0.12 3.58 0.15 -0.24 -0.11 113.70 120.12 2cdp s SER 62 Ca 0.20 -0.36 -0.10 0.00 0.70 0.00 0.00 55.95 56.40 2cdp s SER 62 Cb -0.14 -0.95 -0.06 0.00 -1.71 0.00 0.00 66.02 63.16 2cdp s SER 62 CO 0.07 -0.09 0.44 -0.31 1.20 0.00 0.00 173.24 174.55 2cdp s TYR 63 N 1.55 3.54 -0.82 3.44 2.02 0.32 -0.77 117.35 126.63 2cdp s TYR 63 Ca 0.03 0.80 -0.14 0.00 -0.37 0.00 0.00 57.07 57.39 2cdp s TYR 63 Cb -0.13 -2.18 0.22 0.00 -0.40 0.00 0.00 41.96 39.47 2cdp s TYR 63 CO -0.08 0.45 0.76 -0.65 -1.57 0.00 0.00 175.55 174.46 2cdp s GLN 64 N -2.20 3.58 0.11 -0.62 -1.52 0.09 -0.48 119.66 118.62 2cdp s GLN 64 Ca 0.37 -2.44 0.09 0.00 -1.95 0.00 0.00 55.36 51.44 2cdp s GLN 64 Cb -0.13 -4.43 -0.04 0.00 -0.22 0.00 0.00 33.01 28.20 2cdp s GLN 64 CO 0.20 -1.29 -0.23 0.00 -0.25 0.00 0.00 175.29 173.72 2cdp s ALA 65 N 0.21 2.00 0.11 6.09 0.00 -0.76 -0.82 121.76 128.59 2cdp s ALA 65 Ca 0.17 -1.32 0.03 0.00 0.00 0.00 0.00 51.96 50.85 2cdp s ALA 65 Cb -0.11 -0.29 -0.04 0.00 0.00 0.00 0.00 23.12 22.68 2cdp s ALA 65 CO -0.08 0.42 -0.09 0.20 0.00 0.00 0.00 175.76 176.21 2cdp s GLY 66 N -1.95 0.88 0.02 0.00 0.00 -0.06 -1.49 107.32 104.72 2cdp s GLY 66 Ca 0.09 -1.31 -0.14 0.00 0.00 0.00 0.00 44.72 43.36 2cdp s GLY 66 CO 0.05 -1.40 0.31 -0.45 0.00 0.00 0.00 173.10 171.61 2cdp s SER 67 N -2.80 -0.15 -0.16 1.64 0.15 -1.22 -0.20 113.70 110.97 2cdp s SER 67 Ca 0.10 -0.07 0.17 0.00 0.70 0.00 0.00 55.95 56.85 2cdp s SER 67 Cb 0.01 0.34 0.38 0.00 -1.71 0.00 0.00 66.02 65.04 2cdp s SER 67 CO -0.01 -0.54 1.25 0.61 1.20 0.00 0.00 173.24 175.74 2cdp n GLY 68 N 0.88 4.67 3.21 9.45 0.00 -1.26 -1.20 105.19 120.94 2cdp n GLY 68 Ca -0.20 -1.13 -0.12 0.00 0.00 0.00 0.00 46.02 44.57 2cdp n GLY 68 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2cdp s VAL 69 N -2.91 0.36 0.00 1.61 -7.23 -1.26 -4.93 120.40 106.03 2cdp s VAL 69 Ca 0.36 -1.96 -0.12 0.00 -1.81 0.00 0.00 61.98 58.45 2cdp s VAL 69 Cb 0.31 -2.19 -0.05 0.00 0.56 0.00 0.00 36.38 35.01 2cdp s VAL 69 CO 0.04 -0.37 0.36 -0.89 -0.31 0.00 0.00 175.10 173.93 2cdp s THR 70 N -3.88 5.13 0.00 5.32 2.01 -1.26 -4.17 115.64 118.79 2cdp s THR 70 Ca 0.27 0.62 0.00 0.00 0.31 0.00 0.00 61.69 62.89 2cdp s THR 70 Cb 0.07 -3.64 0.00 0.00 0.01 0.00 0.00 72.50 68.94 2cdp s THR 70 CO 0.05 0.51 0.00 0.61 -0.69 0.00 0.00 174.62 175.10 2cdp n GLY 71 N 1.59 0.93 3.75 4.40 0.00 -1.26 -4.62 105.19 109.98 2cdp n GLY 71 Ca -0.13 -0.05 -0.40 0.00 0.00 0.00 0.00 46.02 45.44 2cdp n GLY 71 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2cdp s GLY 72 N -2.05 2.76 -0.05 -0.02 0.00 -1.26 -1.02 107.32 105.68 2cdp s GLY 72 Ca 0.00 0.24 -0.05 0.00 0.00 0.00 0.00 44.72 44.91 2cdp s GLY 72 CO 0.00 1.04 0.15 -0.56 0.00 0.00 0.00 173.10 173.73 2cdp s SER 73 N -0.06 -0.14 -0.27 1.64 0.01 -1.26 -1.05 113.70 112.57 2cdp s SER 73 Ca 0.37 0.25 -0.13 0.00 1.31 0.00 0.00 55.95 57.75 2cdp s SER 73 Cb -0.20 0.30 -0.04 0.00 0.21 0.00 0.00 66.02 66.29 2cdp s SER 73 CO 0.22 -0.09 0.30 -0.63 0.41 0.00 0.00 173.24 173.45 2cdp s ILE 74 N -0.09 5.23 -0.21 1.44 1.01 -0.29 -0.85 121.20 127.44 2cdp s ILE 74 Ca -0.02 0.42 -0.08 0.00 0.00 0.00 0.00 60.65 60.97 2cdp s ILE 74 Cb -0.02 -3.63 -0.04 0.00 0.01 0.00 0.00 42.46 38.78 2cdp s ILE 74 CO 0.00 0.20 0.09 -0.70 0.00 0.00 0.00 174.94 174.54 2cdp s GLU 75 N 1.87 3.92 -0.25 2.79 2.12 0.09 -0.73 118.70 128.51 2cdp s GLU 75 Ca 0.12 -0.36 -0.09 0.00 0.36 0.00 0.00 54.97 55.00 2cdp s GLU 75 Cb -0.16 -3.33 -0.04 0.00 0.26 0.00 0.00 34.13 30.86 2cdp s GLU 75 CO 0.10 0.10 0.12 0.12 -0.54 0.00 0.00 175.26 175.16 2cdp s PHE 76 N 0.87 3.19 0.18 5.30 5.36 -0.08 -1.07 117.98 131.73 2cdp s PHE 76 Ca 0.05 -0.07 0.09 0.00 -0.96 0.00 0.00 56.93 56.03 2cdp s PHE 76 Cb -0.13 -2.26 -0.04 0.00 -0.34 0.00 0.00 43.02 40.24 2cdp s PHE 76 CO 0.03 -0.15 -0.18 -0.51 -1.46 0.00 0.00 175.22 172.95 2cdp s LEU 77 N 1.37 2.46 -0.02 6.12 1.02 -0.03 -0.57 118.68 129.04 2cdp s LEU 77 Ca 0.06 -0.89 0.03 0.00 0.02 0.00 0.00 54.13 53.35 2cdp s LEU 77 Cb -0.15 -0.85 -0.00 0.00 0.02 0.00 0.00 46.19 45.21 2cdp s LEU 77 CO 0.06 -0.04 -0.11 -0.69 0.02 0.00 0.00 176.35 175.59 2cdp s VAL 78 N -2.17 0.92 -0.15 -1.59 1.01 -0.68 -0.68 120.40 117.07 2cdp s VAL 78 Ca 0.18 -0.47 -0.29 0.00 0.00 0.00 0.00 61.98 61.40 2cdp s VAL 78 Cb -0.05 -0.79 -0.00 0.00 0.00 0.00 0.00 36.38 35.53 2cdp s VAL 78 CO 0.07 0.27 1.02 0.21 0.00 0.00 0.00 175.10 176.67 2cdp s ASN 79 N -0.06 7.19 -0.24 3.32 3.84 -0.45 -0.39 114.94 128.15 2cdp s ASN 79 Ca 0.01 1.47 0.01 0.00 0.21 0.00 0.00 52.86 54.56 2cdp s ASN 79 Cb -0.07 -2.55 0.06 0.00 -0.55 0.00 0.00 41.25 38.14 2cdp s ASN 79 CO 0.00 -0.53 -0.06 -1.61 -2.79 0.00 0.00 177.10 172.11 2cdp s GLU 80 N 2.46 1.73 -1.30 0.43 2.02 0.99 -4.75 118.70 120.28 2cdp s GLU 80 Ca 0.47 -1.04 -0.01 0.00 0.02 0.00 0.00 54.97 54.41 2cdp s GLU 80 Cb -0.17 -2.63 -0.00 0.00 0.10 0.00 0.00 34.13 31.43 2cdp s GLU 80 CO 0.13 -0.59 0.68 -1.71 0.02 0.00 0.00 175.26 173.80 2cdp n ASN 81 N 4.63 -1.27 -0.00 -0.19 5.15 -1.26 -2.36 115.26 119.96 2cdp n ASN 81 Ca -0.12 -0.84 -0.00 0.00 -0.60 0.00 0.00 54.58 53.02 2cdp n ASN 81 Cb 0.44 -3.98 -0.00 0.00 -0.53 0.00 0.00 39.78 35.70 2cdp n ASN 81 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2cdp n GLY 82 N -1.60 0.48 2.92 8.20 0.00 -1.26 -5.01 105.19 108.92 2cdp n GLY 82 Ca -0.29 -0.05 -0.13 0.00 0.00 0.00 0.00 46.02 45.54 2cdp n GLY 82 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cdp s SER 83 N -2.05 0.31 0.14 1.61 1.04 -1.00 -5.14 113.70 108.62 2cdp s SER 83 Ca 0.00 -0.10 -0.31 0.00 0.48 0.00 0.00 55.95 56.03 2cdp s SER 83 Cb 0.00 -0.02 -0.08 0.00 0.10 0.00 0.00 66.02 66.02 2cdp s SER 83 CO 0.00 -0.00 1.29 0.26 0.98 0.00 0.00 173.24 175.77 2cdp s TRP 84 N -0.21 3.32 -0.25 5.02 0.52 -1.26 -0.01 118.94 126.07 2cdp s TRP 84 Ca -0.01 1.18 -0.02 0.00 0.02 0.00 0.00 56.10 57.28 2cdp s TRP 84 Cb -0.02 -3.56 0.03 0.00 -1.15 0.00 0.00 33.47 28.76 2cdp s TRP 84 CO -0.00 -1.81 -0.06 0.00 0.02 0.00 0.00 176.95 175.10 2cdp s ALA 85 N 0.63 2.69 0.14 0.98 0.00 0.48 -4.89 121.76 121.79 2cdp s ALA 85 Ca 0.59 -1.45 -0.31 0.00 0.00 0.00 0.00 51.96 50.79 2cdp s ALA 85 Cb -0.34 -1.67 -0.09 0.00 0.00 0.00 0.00 23.12 21.02 2cdp s ALA 85 CO 0.33 -0.79 1.41 0.45 0.00 0.00 0.00 175.76 177.16 2cdp s SER 86 N 1.33 6.78 -0.12 0.00 0.15 -1.26 -1.68 113.70 118.89 2cdp s SER 86 Ca 0.00 2.41 -0.10 0.00 0.70 0.00 0.00 55.95 58.96 2cdp s SER 86 Cb -0.16 -2.59 -0.06 0.00 -1.71 0.00 0.00 66.02 61.50 2cdp s SER 86 CO -0.05 -0.67 -0.22 0.29 1.20 0.00 0.00 173.24 173.79 2cdp n LYS 87 N 3.70 0.35 -3.97 5.44 4.76 0.27 -4.97 118.16 123.73 2cdp n LYS 87 Ca 0.11 0.14 -0.09 0.00 -2.87 0.00 0.00 58.31 55.60 2cdp n LYS 87 Cb 0.42 -1.09 -0.10 0.00 -1.84 0.00 0.00 35.03 32.41 2cdp n LYS 87 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2cdp s THR 88 N -2.44 0.13 -0.06 -0.18 -4.23 -1.09 -5.01 115.64 102.76 2cdp s THR 88 Ca -0.21 -1.08 0.01 0.00 -1.18 0.00 0.00 61.69 59.23 2cdp s THR 88 Cb 0.06 -0.66 0.02 0.00 1.34 0.00 0.00 72.50 73.25 2cdp s THR 88 CO 0.28 -0.60 -0.09 -0.69 -0.54 0.00 0.00 174.62 172.99 2cdp s VAL 89 N -2.17 0.91 -0.16 2.29 1.01 -1.26 -0.90 120.40 120.12 2cdp s VAL 89 Ca -0.09 -0.32 -0.01 0.00 0.00 0.00 0.00 61.98 61.56 2cdp s VAL 89 Cb -0.04 -0.87 0.04 0.00 0.00 0.00 0.00 36.38 35.51 2cdp s VAL 89 CO -0.03 0.31 -0.05 -0.89 0.00 0.00 0.00 175.10 174.44 2cdp s THR 90 N 0.90 1.05 0.36 3.92 2.01 0.09 -4.97 115.64 118.99 2cdp s THR 90 Ca -0.11 -0.55 -0.28 0.00 0.31 0.00 0.00 61.69 61.06 2cdp s THR 90 Cb -0.15 -1.21 -0.11 0.00 0.01 0.00 0.00 72.50 71.04 2cdp s THR 90 CO 0.01 0.15 1.47 0.00 -0.69 0.00 0.00 174.62 175.56 2cdp s ALA 91 N 1.67 3.58 -0.27 7.40 0.00 -1.26 -1.14 121.76 131.74 2cdp s ALA 91 Ca 0.01 1.52 -0.10 0.00 0.00 0.00 0.00 51.96 53.40 2cdp s ALA 91 Cb -0.15 -3.59 -0.04 0.00 0.00 0.00 0.00 23.12 19.34 2cdp s ALA 91 CO -0.08 -0.98 0.15 0.08 0.00 0.00 0.00 175.76 174.93 2cdp s VAL 92 N -0.96 4.90 0.25 0.00 1.01 -0.22 -4.89 120.40 120.49 2cdp s VAL 92 Ca 0.54 -0.02 -0.30 0.00 0.00 0.00 0.00 61.98 62.20 2cdp s VAL 92 Cb -0.45 -3.34 -0.14 0.00 0.00 0.00 0.00 36.38 32.44 2cdp s VAL 92 CO 0.59 0.25 1.22 -2.65 0.00 0.00 0.00 175.10 174.52 2cdp n PRO 93 N 5.01 1.65 -2.64 2.72 -0.02 -1.26 -4.65 135.00 135.81 2cdp n PRO 93 Ca -0.15 0.58 -0.42 0.00 -2.02 0.00 0.00 63.50 61.50 2cdp n PRO 93 Cb 0.51 -2.11 -0.03 0.00 -0.02 0.00 0.00 33.50 31.85 2cdp n PRO 93 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 2cdp s ASN 94 N -0.11 6.19 0.00 2.55 3.84 -1.26 -3.46 114.94 122.70 2cdp s ASN 94 Ca 0.65 -0.68 0.02 0.00 0.21 0.00 0.00 52.86 53.05 2cdp s ASN 94 Cb -0.70 -2.52 0.03 0.00 -0.55 0.00 0.00 41.25 37.51 2cdp s ASN 94 CO 0.55 -1.70 0.91 0.00 -2.79 0.00 0.00 177.10 174.07 2cdp n GLN 95 N 8.85 0.00 0.00 0.43 6.02 -0.57 -4.98 117.38 127.13 2cdp n GLN 95 Ca 0.03 -0.87 0.00 0.00 -0.01 0.00 0.00 57.00 56.16 2cdp n GLN 95 Cb 0.48 -0.35 0.00 0.00 1.02 0.00 0.00 30.24 31.39 2cdp n GLN 95 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2cdp n GLY 96 N 0.03 2.99 0.33 1.08 0.00 -0.34 -4.67 105.19 104.61 2cdp n GLY 96 Ca -0.00 -1.47 0.02 0.00 0.00 0.00 0.00 46.02 44.57 2cdp n GLY 96 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 2cdp h TRP 97 N 0.00 1.02 -0.23 1.61 4.06 -1.90 -2.36 115.95 118.14 2cdp h TRP 97 Ca 0.00 0.03 0.00 0.00 2.06 0.00 0.00 58.89 60.98 2cdp h TRP 97 Cb 0.00 -0.33 0.00 0.00 -1.00 0.00 0.00 29.16 27.83 2cdp h TRP 97 CO 0.00 0.49 0.00 -0.25 -3.56 0.00 0.00 178.44 175.12 2cdp n ASP 98 N -4.62 2.83 -3.60 -3.49 8.00 -1.26 -4.44 116.55 109.98 2cdp n ASP 98 Ca 0.14 -1.90 -0.41 0.00 0.71 0.00 0.00 54.79 53.33 2cdp n ASP 98 Cb 0.21 -0.14 -0.01 0.00 -0.02 0.00 0.00 41.12 41.16 2cdp n ASP 98 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2cdp n ASN 99 N 1.12 6.75 -4.70 -2.24 5.15 -0.89 -4.99 115.26 115.46 2cdp n ASN 99 Ca 0.17 -2.99 -0.44 0.00 -0.60 0.00 0.00 54.58 50.73 2cdp n ASN 99 Cb 0.53 -1.47 -0.03 0.00 -0.53 0.00 0.00 39.78 38.27 2cdp n ASN 99 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 2cdp n PHE 100 N 3.27 2.56 -3.99 1.20 3.72 -1.26 -4.56 117.46 118.40 2cdp n PHE 100 Ca 0.57 0.11 -0.10 0.00 -0.05 0.00 0.00 57.45 57.98 2cdp n PHE 100 Cb 0.30 -2.63 -0.11 0.00 -0.94 0.00 0.00 39.48 36.09 2cdp n PHE 100 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 2cdp s GLN 101 N 1.24 0.33 0.26 -1.08 -1.52 -0.55 -4.86 119.66 113.49 2cdp s GLN 101 Ca 0.77 -0.59 -0.29 0.00 -1.95 0.00 0.00 55.36 53.29 2cdp s GLN 101 Cb -0.57 0.02 -0.09 0.00 -0.22 0.00 0.00 33.01 32.14 2cdp s GLN 101 CO 0.35 -0.02 1.25 -2.14 -0.25 0.00 0.00 175.29 174.47 2cdp s PRO 102 N -1.37 4.45 -0.06 2.91 0.02 -1.26 -1.82 135.00 137.86 2cdp s PRO 102 Ca -0.14 2.04 -0.01 0.00 0.02 0.00 0.00 61.00 62.91 2cdp s PRO 102 Cb -0.09 -3.15 0.03 0.00 0.02 0.00 0.00 34.50 31.30 2cdp s PRO 102 CO -0.01 -0.10 0.00 -1.17 -0.33 0.00 0.00 177.00 175.39 2cdp s LEU 103 N -1.04 0.66 -0.21 -5.54 2.96 0.36 -4.95 118.68 110.92 2cdp s LEU 103 Ca 0.51 -0.06 -0.29 0.00 -0.22 0.00 0.00 54.13 54.06 2cdp s LEU 103 Cb -0.36 -0.39 -0.02 0.00 0.50 0.00 0.00 46.19 45.92 2cdp s LEU 103 CO 0.44 -0.18 1.40 0.21 -1.32 0.00 0.00 176.35 176.90 2cdp s ASN 104 N 1.81 6.69 -0.20 3.68 3.84 -1.26 -0.52 114.94 128.98 2cdp s ASN 104 Ca 0.02 1.57 0.10 0.00 0.21 0.00 0.00 52.86 54.76 2cdp s ASN 104 Cb -0.13 -2.54 0.60 0.00 -0.55 0.00 0.00 41.25 38.64 2cdp s ASN 104 CO -0.04 -1.00 1.47 0.61 -2.79 0.00 0.00 177.10 175.35 2cdp n GLY 105 N 4.15 2.77 7.00 1.21 0.00 0.84 -4.97 105.19 116.18 2cdp n GLY 105 Ca 0.16 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.47 2cdp n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cdp n GLY 106 N 0.33 -0.73 3.11 -0.02 0.00 -1.26 -4.70 105.19 101.92 2cdp n GLY 106 Ca 0.24 -1.15 -0.14 0.00 0.00 0.00 0.00 46.02 44.96 2cdp n GLY 106 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cdp s SER 107 N -4.00 1.16 -0.02 1.61 1.04 -1.26 -0.30 113.70 111.94 2cdp s SER 107 Ca 0.00 -0.64 0.02 0.00 0.48 0.00 0.00 55.95 55.81 2cdp s SER 107 Cb 0.00 0.02 0.00 0.00 0.10 0.00 0.00 66.02 66.14 2cdp s SER 107 CO 0.00 -0.20 -0.07 0.54 0.98 0.00 0.00 173.24 174.49 2cdp s VAL 108 N -1.66 0.59 -0.12 5.02 0.11 0.20 -4.90 120.40 119.63 2cdp s VAL 108 Ca -0.04 -0.26 -0.27 0.00 -2.93 0.00 0.00 61.98 58.47 2cdp s VAL 108 Cb -0.08 -0.53 -0.02 0.00 -1.53 0.00 0.00 36.38 34.22 2cdp s VAL 108 CO 0.00 0.19 0.92 -0.47 -3.33 0.00 0.00 175.10 172.41 2cdp s TYR 109 N 0.19 3.49 -0.15 1.54 5.04 -1.26 0.01 117.35 126.22 2cdp s TYR 109 Ca -0.02 1.45 0.01 0.00 -2.44 0.00 0.00 57.07 56.07 2cdp s TYR 109 Cb -0.07 -3.09 0.02 0.00 0.35 0.00 0.00 41.96 39.17 2cdp s TYR 109 CO -0.00 -0.19 -0.18 -0.51 -1.34 0.00 0.00 175.55 173.33 2cdp s LEU 110 N 1.90 1.92 0.76 6.97 1.43 0.07 -4.98 118.68 126.75 2cdp s LEU 110 Ca 0.44 -0.55 -0.12 0.00 -1.03 0.00 0.00 54.13 52.87 2cdp s LEU 110 Cb -0.18 -1.32 0.05 0.00 0.03 0.00 0.00 46.19 44.78 2cdp s LEU 110 CO 0.16 0.01 1.11 -0.94 0.23 0.00 0.00 176.35 176.92 2cdp s SER 111 N 1.18 4.47 0.35 2.29 1.04 -1.26 -1.04 113.70 120.73 2cdp s SER 111 Ca 0.00 1.94 -0.29 0.00 0.48 0.00 0.00 55.95 58.09 2cdp s SER 111 Cb -0.14 -2.54 -0.11 0.00 0.10 0.00 0.00 66.02 63.33 2cdp s SER 111 CO -0.08 -2.06 1.52 0.00 0.98 0.00 0.00 173.24 173.60 2cdp n ALA 112 N -3.27 2.41 0.00 5.32 0.00 -1.26 -4.66 120.51 119.06 2cdp n ALA 112 Ca 0.10 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.89 2cdp n ALA 112 Cb 0.52 -2.43 0.00 0.00 0.00 0.00 0.00 19.45 17.54 2cdp n ALA 112 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cdp n GLY 113 N 1.01 0.50 3.58 0.00 0.00 0.91 -4.97 105.19 106.22 2cdp n GLY 113 Ca 0.04 -1.72 -0.33 0.00 0.00 0.00 0.00 46.02 44.00 2cdp n GLY 113 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2cdp s THR 114 N -2.46 3.64 0.01 2.61 2.01 -1.26 0.35 115.64 120.55 2cdp s THR 114 Ca 0.00 -0.58 0.00 0.00 0.31 0.00 0.00 61.69 61.43 2cdp s THR 114 Cb 0.00 -2.51 -0.01 0.00 0.01 0.00 0.00 72.50 69.99 2cdp s THR 114 CO 0.00 0.54 -0.02 -1.00 -0.69 0.00 0.00 174.62 173.45 2cdp s HIS 115 N -0.85 0.19 -0.23 4.92 4.02 -0.43 -5.00 115.29 117.92 2cdp s HIS 115 Ca 0.14 -0.30 -0.11 0.00 1.02 0.00 0.00 55.06 55.81 2cdp s HIS 115 Cb -0.11 -0.13 -0.05 0.00 -1.02 0.00 0.00 32.58 31.27 2cdp s HIS 115 CO 0.03 -0.10 0.16 -0.65 1.02 0.00 0.00 174.74 175.20 2cdp s GLN 116 N -0.84 4.11 -0.02 1.40 -1.52 -1.26 -0.90 119.66 120.62 2cdp s GLN 116 Ca -0.09 -0.23 0.08 0.00 -1.95 0.00 0.00 55.36 53.17 2cdp s GLN 116 Cb -0.06 -3.50 -0.02 0.00 -0.22 0.00 0.00 33.01 29.21 2cdp s GLN 116 CO -0.00 0.13 -0.26 0.14 -0.25 0.00 0.00 175.29 175.05 2cdp s VAL 117 N 0.85 2.03 -0.03 1.09 -7.23 -0.12 -1.34 120.40 115.64 2cdp s VAL 117 Ca 0.08 -1.09 0.07 0.00 -1.81 0.00 0.00 61.98 59.23 2cdp s VAL 117 Cb -0.13 -1.68 -0.01 0.00 0.56 0.00 0.00 36.38 35.11 2cdp s VAL 117 CO 0.03 0.57 -0.23 -0.60 -0.31 0.00 0.00 175.10 174.56 2cdp s ARG 118 N -0.55 2.01 -0.18 4.82 3.52 0.15 -0.23 118.95 128.49 2cdp s ARG 118 Ca 0.08 -0.82 -0.01 0.00 -0.13 0.00 0.00 55.73 54.84 2cdp s ARG 118 Cb -0.10 -1.87 -0.00 0.00 -1.56 0.00 0.00 34.95 31.42 2cdp s ARG 118 CO -0.00 0.45 -0.11 -0.51 -0.81 0.00 0.00 175.30 174.31 2cdp s LEU 119 N -0.41 2.61 -0.03 -0.88 1.43 0.08 -0.85 118.68 120.63 2cdp s LEU 119 Ca 0.05 -0.46 0.04 0.00 -1.03 0.00 0.00 54.13 52.74 2cdp s LEU 119 Cb -0.10 -1.62 -0.01 0.00 0.03 0.00 0.00 46.19 44.49 2cdp s LEU 119 CO 0.00 0.03 -0.17 -2.28 0.23 0.00 0.00 176.35 174.17 2cdp s HIS 120 N 1.12 1.61 -0.94 0.29 5.65 -0.24 -1.06 115.29 121.72 2cdp s HIS 120 Ca 0.01 -0.41 -0.24 0.00 0.25 0.00 0.00 55.06 54.67 2cdp s HIS 120 Cb -0.14 -1.07 0.02 0.00 -1.18 0.00 0.00 32.58 30.20 2cdp s HIS 120 CO -0.03 -0.12 1.60 0.20 -0.65 0.00 0.00 174.74 175.74 2cdp s GLY 121 N -0.09 0.86 0.00 1.59 0.00 -0.03 -0.74 107.32 108.93 2cdp s GLY 121 Ca -0.01 -1.90 0.25 0.00 0.00 0.00 0.00 44.72 43.07 2cdp s GLY 121 CO 0.01 2.95 1.38 0.00 0.00 0.00 0.00 173.10 177.45 2cdp n ALA 122 N 10.60 3.31 -1.53 3.20 0.00 -0.03 -1.37 120.51 134.69 2cdp n ALA 122 Ca 0.32 -0.49 -0.30 0.00 0.00 0.00 0.00 53.44 52.97 2cdp n ALA 122 Cb 0.50 -1.01 0.22 0.00 0.00 0.00 0.00 19.45 19.16 2cdp n ALA 122 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2cdp s GLY 123 N -2.53 1.70 0.15 0.00 0.00 -1.24 -4.87 107.32 100.54 2cdp s GLY 123 Ca 0.21 -1.16 0.10 0.00 0.00 0.00 0.00 44.72 43.88 2cdp s GLY 123 CO 0.55 -0.30 1.27 1.48 0.00 0.00 0.00 173.10 176.10 2cdp h SER 124 N -2.17 0.00 -3.90 1.64 4.64 -1.45 -3.46 113.55 108.85 2cdp h SER 124 Ca -0.44 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 60.40 2cdp h SER 124 Cb 1.25 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.35 2cdp h SER 124 CO 0.33 0.83 0.40 0.21 -0.87 0.00 0.00 176.83 177.73 2cdp s ASN 125 N -6.55 7.06 0.42 4.97 3.84 -0.70 -4.91 114.94 119.07 2cdp s ASN 125 Ca 0.01 2.02 0.18 0.00 0.21 0.00 0.00 52.86 55.28 2cdp s ASN 125 Cb 0.09 -2.59 1.09 0.00 -0.55 0.00 0.00 41.25 39.28 2cdp s ASN 125 CO 0.80 -0.27 1.84 -1.13 -2.79 0.00 0.00 177.10 175.55 2cdp h ASN 126 N 3.02 0.41 -3.26 -4.21 -1.24 -1.91 -3.29 115.58 105.10 2cdp h ASN 126 Ca -0.47 0.05 -0.68 0.00 0.71 0.00 0.00 56.30 55.90 2cdp h ASN 126 Cb 1.21 -0.03 -0.14 0.00 0.73 0.00 0.00 38.32 40.09 2cdp h ASN 126 CO 0.64 0.15 -0.61 0.26 -1.29 0.00 0.00 177.43 176.59 2cdp s TRP 127 N -5.44 3.20 0.00 0.67 0.52 -1.26 -1.60 118.94 115.03 2cdp s TRP 127 Ca -0.08 0.22 0.00 0.00 0.02 0.00 0.00 56.10 56.26 2cdp s TRP 127 Cb 0.23 -1.80 0.00 0.00 -1.15 0.00 0.00 33.47 30.75 2cdp s TRP 127 CO 0.79 0.49 0.00 1.04 0.02 0.00 0.00 176.95 179.29 2cdp n GLN 128 N 2.11 0.00 -3.51 4.98 1.13 -0.20 -4.43 117.38 117.46 2cdp n GLN 128 Ca -0.19 0.00 -0.08 0.00 -1.94 0.00 0.00 57.00 54.79 2cdp n GLN 128 Cb 0.54 -0.11 -0.02 0.00 0.11 0.00 0.00 30.24 30.75 2cdp n GLN 128 CO 0.00 0.00 0.00 1.67 -1.44 0.00 0.00 177.06 177.29 2cdp s TRP 129 N -0.47 -0.33 0.18 1.08 1.48 -1.25 -4.24 118.94 115.40 2cdp s TRP 129 Ca 0.00 0.21 0.08 0.00 -1.06 0.00 0.00 56.10 55.33 2cdp s TRP 129 Cb 0.00 0.53 -0.04 0.00 -1.16 0.00 0.00 33.47 32.80 2cdp s TRP 129 CO 0.00 -0.50 -0.02 -0.80 -4.06 0.00 0.00 176.95 171.56 2cdp s ASN 130 N -2.41 4.64 -0.11 -2.66 0.01 0.72 -4.33 114.94 110.80 2cdp s ASN 130 Ca 0.05 -0.46 -0.05 0.00 -0.71 0.00 0.00 52.86 51.70 2cdp s ASN 130 Cb -0.01 -0.93 0.05 0.00 0.41 0.00 0.00 41.25 40.77 2cdp s ASN 130 CO -0.08 0.08 0.23 -0.22 -1.51 0.00 0.00 177.10 175.61 2cdp s LEU 131 N -2.98 0.11 -0.15 0.60 2.96 -1.01 -0.88 118.68 117.33 2cdp s LEU 131 Ca 0.27 0.51 -0.15 0.00 -0.22 0.00 0.00 54.13 54.54 2cdp s LEU 131 Cb -0.09 0.64 -0.12 0.00 0.50 0.00 0.00 46.19 47.12 2cdp s LEU 131 CO 0.18 -0.20 0.21 -0.78 -1.32 0.00 0.00 176.35 174.44 2cdp h ASP 132 N 7.74 0.00 -5.22 3.68 3.58 -1.24 -0.44 116.42 124.53 2cdp h ASP 132 Ca -0.28 -0.38 0.11 0.00 0.42 0.00 0.00 57.03 56.90 2cdp h ASP 132 Cb 1.13 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 42.14 2cdp h ASP 132 CO 0.26 0.94 0.41 -1.59 -2.88 0.00 0.00 179.24 176.38 2cdp s LYS 133 N -2.09 1.55 0.06 0.28 -2.85 -1.25 -1.38 119.74 114.06 2cdp s LYS 133 Ca -0.16 -0.92 -0.02 0.00 -1.00 0.00 0.00 55.97 53.88 2cdp s LYS 133 Cb 0.01 0.48 -0.04 0.00 -2.06 0.00 0.00 37.83 36.23 2cdp s LYS 133 CO 0.38 -0.72 -0.00 -0.59 0.10 0.00 0.00 175.35 174.52 2cdp s PHE 134 N -2.99 0.51 -0.01 1.78 -0.12 0.33 -0.73 117.98 116.76 2cdp s PHE 134 Ca 0.15 -1.04 0.02 0.00 -0.05 0.00 0.00 56.93 56.01 2cdp s PHE 134 Cb -0.03 -0.37 -0.01 0.00 -0.63 0.00 0.00 43.02 41.98 2cdp s PHE 134 CO 0.06 -0.41 -0.08 0.99 -0.05 0.00 0.00 175.22 175.73 2cdp s THR 135 N -3.93 0.62 -0.16 -4.49 2.01 0.05 -0.19 115.64 109.56 2cdp s THR 135 Ca 0.08 -0.35 0.01 0.00 0.31 0.00 0.00 61.69 61.74 2cdp s THR 135 Cb 0.08 -0.52 0.00 0.00 0.01 0.00 0.00 72.50 72.06 2cdp s THR 135 CO -0.09 0.17 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.08 2cdp s LEU 136 N -0.21 2.39 -0.13 4.42 1.43 0.74 -1.08 118.68 126.24 2cdp s LEU 136 Ca 0.03 -0.51 0.01 0.00 -1.03 0.00 0.00 54.13 52.63 2cdp s LEU 136 Cb -0.03 -1.54 0.02 0.00 0.03 0.00 0.00 46.19 44.67 2cdp s LEU 136 CO -0.00 0.07 -0.14 -0.44 0.23 0.00 0.00 176.35 176.06 2cdp s SER 137 N 0.90 2.57 0.00 2.29 0.01 -0.53 -0.48 113.70 118.47 2cdp s SER 137 Ca -0.04 -0.46 0.00 0.00 1.31 0.00 0.00 55.95 56.76 2cdp s SER 137 Cb -0.15 -1.13 0.00 0.00 0.21 0.00 0.00 66.02 64.95 2cdp s SER 137 CO -0.02 -0.03 0.00 -0.46 0.41 0.00 0.00 173.24 173.14