#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nam s THR 2 N 0.00 4.93 -0.02 1.55 -4.23 -1.26 -5.01 115.64 111.61 1nam s THR 2 Ca 0.00 0.25 0.11 0.00 -1.18 0.00 0.00 61.69 60.87 1nam s THR 2 Cb 0.00 -3.75 -0.06 0.00 1.34 0.00 0.00 72.50 70.03 1nam s THR 2 CO 0.00 -0.44 1.38 -0.07 -0.54 0.00 0.00 174.62 174.95 1nam h LEU 3 N 1.39 0.00 -7.94 4.79 4.07 -1.96 -3.45 115.31 112.21 1nam h LEU 3 Ca -0.48 0.00 -0.27 0.00 0.08 0.00 0.00 57.88 57.22 1nam h LEU 3 Cb 1.19 0.00 -0.25 0.00 1.08 0.00 0.00 40.66 42.68 1nam h LEU 3 CO 0.65 0.73 -0.73 -0.76 -1.08 0.00 0.00 178.44 177.25 1nam s LEU 4 N -6.61 2.11 -0.06 1.67 1.43 -1.26 -0.32 118.68 115.63 1nam s LEU 4 Ca 0.02 -0.25 0.03 0.00 -1.03 0.00 0.00 54.13 52.90 1nam s LEU 4 Cb 0.09 -0.12 0.01 0.00 0.03 0.00 0.00 46.19 46.19 1nam s LEU 4 CO 0.78 -0.08 -0.15 -0.70 0.23 0.00 0.00 176.35 176.43 1nam s GLU 5 N -0.68 1.89 -0.10 1.70 2.56 -0.55 -4.79 118.70 118.72 1nam s GLU 5 Ca -0.04 -0.52 0.03 0.00 0.00 0.00 0.00 54.97 54.43 1nam s GLU 5 Cb -0.05 -1.55 0.01 0.00 2.00 0.00 0.00 34.13 34.54 1nam s GLU 5 CO -0.00 0.10 -0.20 -0.65 -0.56 0.00 0.00 175.26 173.95 1nam s GLN 6 N 0.45 2.71 -0.01 4.30 -0.21 -1.26 -0.30 119.66 125.33 1nam s GLN 6 Ca -0.12 -0.75 -0.03 0.00 0.02 0.00 0.00 55.36 54.47 1nam s GLN 6 Cb -0.15 -2.13 -0.00 0.00 1.00 0.00 0.00 33.01 31.74 1nam s GLN 6 CO 0.04 0.08 0.06 0.54 -2.12 0.00 0.00 175.29 173.89 1nam s ASN 7 N 0.59 0.03 0.73 5.90 4.22 -0.38 -4.43 114.94 121.59 1nam s ASN 7 Ca -0.14 -0.10 -0.07 0.00 -2.14 0.00 0.00 52.86 50.42 1nam s ASN 7 Cb -0.17 0.15 0.08 0.00 1.28 0.00 0.00 41.25 42.59 1nam s ASN 7 CO 0.04 -0.18 1.04 -2.16 -2.04 0.00 0.00 177.10 173.81 1nam s PRO 8 N -0.67 2.04 0.05 3.55 0.04 -1.26 -0.25 135.00 138.50 1nam s PRO 8 Ca -0.07 -0.33 0.07 0.00 0.04 0.00 0.00 61.00 60.71 1nam s PRO 8 Cb -0.05 -2.15 -0.23 0.00 0.04 0.00 0.00 34.50 32.11 1nam s PRO 8 CO 0.00 -1.35 1.03 -0.09 0.04 0.00 0.00 177.00 176.63 1nam h ARG 9 N -0.68 0.04 -3.56 4.56 2.43 -1.85 -3.39 114.38 111.93 1nam h ARG 9 Ca -0.44 -0.06 -0.05 0.00 -0.81 0.00 0.00 59.98 58.63 1nam h ARG 9 Cb 1.31 0.02 -0.08 0.00 -0.42 0.00 0.00 29.97 30.80 1nam h ARG 9 CO 0.57 0.86 -0.06 1.67 -1.51 0.00 0.00 179.97 181.50 1nam s TRP 10 N -2.66 0.30 -0.16 2.20 -2.14 -1.26 -0.73 118.94 114.50 1nam s TRP 10 Ca -0.02 -0.68 -0.13 0.00 2.66 0.00 0.00 56.10 57.93 1nam s TRP 10 Cb 0.09 0.27 0.04 0.00 -3.10 0.00 0.00 33.47 30.78 1nam s TRP 10 CO 0.83 -1.05 0.41 1.03 -2.66 0.00 0.00 176.95 175.51 1nam s ARG 11 N -3.93 0.46 -0.18 3.25 1.81 0.90 -4.84 118.95 116.42 1nam s ARG 11 Ca 0.21 0.63 -0.06 0.00 -1.72 0.00 0.00 55.73 54.79 1nam s ARG 11 Cb -0.02 0.17 -0.03 0.00 -0.45 0.00 0.00 34.95 34.62 1nam s ARG 11 CO 0.09 -0.08 0.02 -0.51 -0.68 0.00 0.00 175.30 174.13 1nam s LEU 12 N 0.52 3.46 -0.23 2.53 1.43 -1.26 -0.75 118.68 124.39 1nam s LEU 12 Ca -0.02 -0.08 -0.16 0.00 -1.03 0.00 0.00 54.13 52.83 1nam s LEU 12 Cb -0.04 -1.87 0.07 0.00 0.03 0.00 0.00 46.19 44.37 1nam s LEU 12 CO -0.03 0.13 0.58 -0.69 0.23 0.00 0.00 176.35 176.57 1nam s VAL 13 N 0.62 -0.01 0.67 -1.59 1.01 0.38 -4.95 120.40 116.53 1nam s VAL 13 Ca 0.00 0.02 -0.15 0.00 0.00 0.00 0.00 61.98 61.85 1nam s VAL 13 Cb -0.14 -0.83 0.01 0.00 0.00 0.00 0.00 36.38 35.42 1nam s VAL 13 CO 0.02 0.01 1.15 -2.16 0.00 0.00 0.00 175.10 174.12 1nam s PRO 14 N 1.00 2.61 0.02 2.72 0.04 -1.26 -0.57 135.00 139.56 1nam s PRO 14 Ca -0.05 1.55 -0.38 0.00 0.04 0.00 0.00 61.00 62.15 1nam s PRO 14 Cb -0.05 -1.91 -0.20 0.00 0.04 0.00 0.00 34.50 32.38 1nam s PRO 14 CO -0.09 -1.43 1.00 -2.13 0.04 0.00 0.00 177.00 174.39 1nam n ARG 15 N -2.42 0.00 0.00 4.56 0.63 -1.26 -2.42 116.66 115.74 1nam n ARG 15 Ca 0.12 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.05 1nam n ARG 15 Cb 0.51 -1.43 0.00 0.00 0.45 0.00 0.00 32.46 31.99 1nam n ARG 15 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1nam n GLY 16 N 1.55 2.65 3.70 5.14 0.00 0.75 -4.92 105.19 114.05 1nam n GLY 16 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 1nam n GLY 16 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1nam s GLN 17 N -0.50 4.38 0.57 1.61 0.74 -1.02 -3.92 119.66 121.53 1nam s GLN 17 Ca 0.00 1.75 -0.20 0.00 0.05 0.00 0.00 55.36 56.96 1nam s GLN 17 Cb 0.00 -3.46 -0.04 0.00 1.10 0.00 0.00 33.01 30.61 1nam s GLN 17 CO 0.00 -0.37 1.29 0.00 -0.55 0.00 0.00 175.29 175.66 1nam s ALA 18 N 1.70 2.66 0.00 1.58 0.00 -1.26 -4.63 121.76 121.82 1nam s ALA 18 Ca 0.58 1.20 0.02 0.00 0.00 0.00 0.00 51.96 53.76 1nam s ALA 18 Cb -0.28 -3.52 -0.01 0.00 0.00 0.00 0.00 23.12 19.31 1nam s ALA 18 CO 0.26 -1.32 -0.05 0.54 0.00 0.00 0.00 175.76 175.18 1nam s VAL 19 N -1.41 0.40 -0.07 0.00 0.11 -0.42 -5.00 120.40 114.03 1nam s VAL 19 Ca 0.75 -0.34 -0.03 0.00 -2.93 0.00 0.00 61.98 59.43 1nam s VAL 19 Cb -0.37 -0.37 -0.04 0.00 -1.53 0.00 0.00 36.38 34.08 1nam s VAL 19 CO 0.41 0.03 0.09 0.20 -3.33 0.00 0.00 175.10 172.50 1nam s ASN 20 N -0.34 5.86 0.13 3.54 0.01 -1.26 -0.81 114.94 122.06 1nam s ASN 20 Ca -0.00 0.27 0.06 0.00 -0.71 0.00 0.00 52.86 52.48 1nam s ASN 20 Cb -0.03 -1.77 -0.04 0.00 0.41 0.00 0.00 41.25 39.82 1nam s ASN 20 CO -0.00 0.35 -0.13 -0.76 -1.51 0.00 0.00 177.10 175.04 1nam s LEU 21 N -1.27 2.42 -0.09 0.60 1.43 -0.05 -4.57 118.68 117.15 1nam s LEU 21 Ca 0.18 -0.84 -0.11 0.00 -1.03 0.00 0.00 54.13 52.33 1nam s LEU 21 Cb -0.12 -0.52 0.03 0.00 0.03 0.00 0.00 46.19 45.61 1nam s LEU 21 CO 0.08 -0.17 0.29 -0.60 0.23 0.00 0.00 176.35 176.17 1nam s ARG 22 N -2.83 0.40 -0.01 1.70 3.52 0.65 -1.74 118.95 120.65 1nam s ARG 22 Ca 0.10 0.26 0.03 0.00 -0.13 0.00 0.00 55.73 55.99 1nam s ARG 22 Cb -0.04 0.19 -0.01 0.00 -1.56 0.00 0.00 34.95 33.54 1nam s ARG 22 CO 0.03 -0.07 -0.10 0.00 -0.81 0.00 0.00 175.30 174.35 1nam s ILE 24 N -0.13 2.80 -0.12 0.00 -1.09 0.59 -0.61 121.20 122.64 1nam s ILE 24 Ca 0.02 -0.72 -0.28 0.00 -2.23 0.00 0.00 60.65 57.44 1nam s ILE 24 Cb -0.05 -2.19 -0.01 0.00 -1.58 0.00 0.00 42.46 38.62 1nam s ILE 24 CO -0.00 0.51 0.95 -0.22 -1.23 0.00 0.00 174.94 174.94 1nam s LEU 25 N 0.82 4.23 -0.04 2.97 2.96 0.19 -1.48 118.68 128.33 1nam s LEU 25 Ca -0.05 1.43 0.19 0.00 -0.22 0.00 0.00 54.13 55.48 1nam s LEU 25 Cb -0.15 -3.45 -0.22 0.00 0.50 0.00 0.00 46.19 42.86 1nam s LEU 25 CO 0.00 -0.42 0.50 0.29 -1.32 0.00 0.00 176.35 175.41 1nam n LYS 26 N 4.99 0.65 -4.04 1.98 5.02 0.56 -4.83 118.16 122.49 1nam n LYS 26 Ca 0.07 0.04 -0.31 0.00 -2.02 0.00 0.00 58.31 56.09 1nam n LYS 26 Cb 0.49 -1.64 -0.16 0.00 -0.02 0.00 0.00 35.03 33.70 1nam n LYS 26 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1nam s ASN 27 N -5.36 3.30 0.00 4.39 3.84 -1.22 -5.01 114.94 114.89 1nam s ASN 27 Ca -0.06 -0.80 0.12 0.00 0.21 0.00 0.00 52.86 52.32 1nam s ASN 27 Cb 0.09 -1.32 0.48 0.00 -0.55 0.00 0.00 41.25 39.95 1nam s ASN 27 CO 0.84 -0.10 1.34 -1.54 -2.79 0.00 0.00 177.10 174.86 1nam n SER 28 N 4.66 0.97 -0.16 -4.21 3.41 -1.26 -2.73 113.62 114.30 1nam n SER 28 Ca -0.17 -1.82 0.07 0.00 -0.26 0.00 0.00 58.87 56.69 1nam n SER 28 Cb 0.48 -0.10 0.36 0.00 -0.26 0.00 0.00 64.21 64.69 1nam n SER 28 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1nam n GLN 29 N -0.04 1.21 -3.16 4.33 6.02 -1.26 -4.06 117.38 120.42 1nam n GLN 29 Ca 0.10 -0.32 -0.22 0.00 -0.01 0.00 0.00 57.00 56.55 1nam n GLN 29 Cb 0.18 -1.24 -0.05 0.00 1.02 0.00 0.00 30.24 30.15 1nam n GLN 29 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1nam n TYR 30 N -0.40 1.36 0.58 1.08 4.01 -1.11 -4.37 117.16 118.31 1nam n TYR 30 Ca 0.11 -3.84 0.13 0.00 -0.16 0.00 0.00 57.90 54.13 1nam n TYR 30 Cb 0.12 -0.44 0.44 0.00 -0.31 0.00 0.00 39.34 39.16 1nam n TYR 30 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1nam n PRO 30 N 0.47 0.22 -2.32 -0.72 -0.04 -1.22 -4.08 135.00 127.30 1nam n PRO 30 Ca 0.26 0.26 -0.43 0.00 -0.04 0.00 0.00 63.50 63.56 1nam n PRO 30 Cb 0.54 -1.80 -0.02 0.00 -0.04 0.00 0.00 33.50 32.18 1nam n PRO 30 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1nam s TRP 31 N -3.16 2.36 -0.09 0.54 0.52 -1.01 -4.77 118.94 113.33 1nam s TRP 31 Ca 0.09 0.68 0.03 0.00 0.02 0.00 0.00 56.10 56.92 1nam s TRP 31 Cb 0.12 -4.26 -0.01 0.00 -1.15 0.00 0.00 33.47 28.17 1nam s TRP 31 CO 0.52 -2.07 -0.20 -1.64 0.02 0.00 0.00 176.95 173.58 1nam s MET 32 N 4.93 2.97 0.21 4.98 -1.94 -1.25 -1.32 119.30 127.88 1nam s MET 32 Ca 0.63 -0.82 0.10 0.00 -1.71 0.00 0.00 55.69 53.89 1nam s MET 32 Cb -0.15 -2.36 -0.05 0.00 2.01 0.00 0.00 34.83 34.28 1nam s MET 32 CO 0.32 0.28 -0.18 -1.12 -0.01 0.00 0.00 175.02 174.31 1nam s SER 33 N 0.11 2.98 -0.17 3.03 0.01 -0.09 -0.80 113.70 118.78 1nam s SER 33 Ca -0.10 -0.96 -0.05 0.00 1.31 0.00 0.00 55.95 56.15 1nam s SER 33 Cb -0.16 -0.20 -0.03 0.00 0.21 0.00 0.00 66.02 65.84 1nam s SER 33 CO 0.06 -0.04 0.00 0.26 0.41 0.00 0.00 173.24 173.93 1nam s TRP 34 N -2.42 3.12 0.04 2.43 0.52 -0.66 -0.29 118.94 121.68 1nam s TRP 34 Ca 0.22 -0.15 0.08 0.00 0.02 0.00 0.00 56.10 56.28 1nam s TRP 34 Cb -0.04 -2.01 -0.03 0.00 -1.15 0.00 0.00 33.47 30.24 1nam s TRP 34 CO 0.09 0.03 -0.24 0.71 0.02 0.00 0.00 176.95 177.57 1nam s TYR 35 N 0.39 2.40 -0.07 -1.98 1.51 0.11 -1.04 117.35 118.68 1nam s TYR 35 Ca -0.01 -0.36 0.02 0.00 -1.01 0.00 0.00 57.07 55.71 1nam s TYR 35 Cb -0.13 -1.42 -0.03 0.00 -0.11 0.00 0.00 41.96 40.27 1nam s TYR 35 CO 0.02 0.17 -0.11 1.14 -1.11 0.00 0.00 175.55 175.65 1nam s GLN 36 N -1.29 2.70 -0.22 -0.62 -2.07 -0.02 0.11 119.66 118.25 1nam s GLN 36 Ca 0.13 -0.64 -0.04 0.00 -1.82 0.00 0.00 55.36 52.98 1nam s GLN 36 Cb -0.10 -2.49 -0.01 0.00 -1.09 0.00 0.00 33.01 29.32 1nam s GLN 36 CO 0.03 0.59 -0.03 -1.14 -1.32 0.00 0.00 175.29 173.42 1nam s GLN 37 N -0.63 3.44 0.79 9.60 0.74 -0.16 -0.57 119.66 132.86 1nam s GLN 37 Ca 0.09 -0.60 -0.09 0.00 0.05 0.00 0.00 55.36 54.82 1nam s GLN 37 Cb -0.11 -3.04 0.17 0.00 1.10 0.00 0.00 33.01 31.13 1nam s GLN 37 CO 0.01 -0.16 1.08 -0.40 -0.55 0.00 0.00 175.29 175.27 1nam n ASP 38 N 4.71 0.60 0.28 6.67 3.85 -0.69 -1.54 116.55 130.44 1nam n ASP 38 Ca -0.18 -1.71 0.16 0.00 -0.71 0.00 0.00 54.79 52.36 1nam n ASP 38 Cb 0.51 -0.78 0.84 0.00 -1.35 0.00 0.00 41.12 40.34 1nam n ASP 38 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.20 176.12 1nam h LEU 39 N 0.00 0.00 -3.07 -2.12 3.38 -1.92 0.39 115.31 111.97 1nam h LEU 39 Ca -0.35 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.50 1nam h LEU 39 Cb 1.10 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.78 1nam h LEU 39 CO 0.30 0.06 0.15 0.00 0.09 0.00 0.00 178.44 179.04 1nam n GLN 40 N -3.39 3.27 -0.94 1.13 0.00 -1.26 -4.94 117.38 111.26 1nam n GLN 40 Ca -0.02 -2.29 0.00 0.00 0.00 0.00 0.00 57.00 54.69 1nam n GLN 40 Cb 0.21 -2.01 0.00 0.00 0.00 0.00 0.00 30.24 28.45 1nam n GLN 40 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 1nam n LYS 41 N 0.09 -0.10 -2.11 2.61 4.76 0.14 -4.98 118.16 118.57 1nam n LYS 41 Ca 0.28 0.03 -0.43 0.00 -2.87 0.00 0.00 58.31 55.32 1nam n LYS 41 Cb 1.08 -2.99 -0.03 0.00 -1.84 0.00 0.00 35.03 31.25 1nam n LYS 41 CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 1nam s GLN 42 N -0.22 3.92 0.22 1.97 2.00 -1.26 -4.70 119.66 121.60 1nam s GLN 42 Ca 0.00 1.80 -0.28 0.00 -2.00 0.00 0.00 55.36 54.87 1nam s GLN 42 Cb 0.00 -4.00 -0.09 0.00 0.80 0.00 0.00 33.01 29.72 1nam s GLN 42 CO 0.00 -1.14 0.89 -0.51 -0.50 0.00 0.00 175.29 174.03 1nam s LEU 43 N 4.79 4.62 -0.13 3.68 2.01 -1.26 -1.70 118.68 130.69 1nam s LEU 43 Ca 0.71 1.86 -0.10 0.00 0.01 0.00 0.00 54.13 56.61 1nam s LEU 43 Cb -0.27 -3.54 0.04 0.00 0.01 0.00 0.00 46.19 42.44 1nam s LEU 43 CO 0.28 0.16 0.33 -1.58 1.01 0.00 0.00 176.35 176.55 1nam s GLN 44 N -1.21 0.35 0.45 1.70 0.74 0.26 -4.97 119.66 116.97 1nam s GLN 44 Ca 0.40 0.55 -0.24 0.00 0.05 0.00 0.00 55.36 56.12 1nam s GLN 44 Cb -0.25 0.07 -0.07 0.00 1.10 0.00 0.00 33.01 33.86 1nam s GLN 44 CO 0.30 -0.10 1.26 -0.46 -0.55 0.00 0.00 175.29 175.74 1nam s TRP 45 N 0.69 2.76 -0.01 1.67 -0.00 -1.26 -0.84 118.94 121.94 1nam s TRP 45 Ca -0.04 1.46 -0.03 0.00 -0.00 0.00 0.00 56.10 57.48 1nam s TRP 45 Cb -0.05 -3.57 -0.02 0.00 -0.00 0.00 0.00 33.47 29.82 1nam s TRP 45 CO -0.05 -1.98 -0.07 1.28 -0.00 0.00 0.00 176.95 176.13 1nam n LEU 46 N -0.30 0.84 -3.80 5.86 4.77 -0.20 -4.85 117.00 119.31 1nam n LEU 46 Ca 0.06 0.12 -0.12 0.00 -0.03 0.00 0.00 56.01 56.05 1nam n LEU 46 Cb 0.46 -0.30 -0.09 0.00 -2.33 0.00 0.00 43.42 41.16 1nam n LEU 46 CO 0.52 -0.27 -0.05 -0.36 -1.33 0.00 0.00 177.39 175.90 1nam s PHE 47 N -2.15 -0.07 -0.08 -1.77 0.40 -1.18 -4.99 117.98 108.14 1nam s PHE 47 Ca -0.07 0.02 -0.00 0.00 -0.60 0.00 0.00 56.93 56.28 1nam s PHE 47 Cb 0.02 0.03 0.02 0.00 0.51 0.00 0.00 43.02 43.61 1nam s PHE 47 CO 0.10 -0.39 -0.05 0.99 0.70 0.00 0.00 175.22 176.57 1nam s THR 48 N -1.74 0.71 -0.20 0.64 2.01 -1.26 -1.65 115.64 114.14 1nam s THR 48 Ca -0.11 -0.14 -0.01 0.00 0.31 0.00 0.00 61.69 61.75 1nam s THR 48 Cb -0.04 -0.76 0.05 0.00 0.01 0.00 0.00 72.50 71.76 1nam s THR 48 CO 0.01 0.30 -0.03 -0.76 -0.69 0.00 0.00 174.62 173.45 1nam s LEU 49 N 1.49 1.83 -0.15 4.42 1.43 0.02 -4.99 118.68 122.72 1nam s LEU 49 Ca -0.01 -0.88 -0.09 0.00 -1.03 0.00 0.00 54.13 52.12 1nam s LEU 49 Cb -0.13 -0.92 -0.24 0.00 0.03 0.00 0.00 46.19 44.93 1nam s LEU 49 CO -0.04 -0.23 0.25 -1.14 0.23 0.00 0.00 176.35 175.42 1nam n ARG 50 N 4.85 0.71 -4.51 1.70 3.00 -1.26 -3.87 116.66 117.28 1nam n ARG 50 Ca -0.11 0.31 -0.34 0.00 -0.00 0.00 0.00 57.85 57.71 1nam n ARG 50 Cb 0.46 -1.69 -0.10 0.00 0.00 0.00 0.00 32.46 31.13 1nam n ARG 50 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 1nam s SER 51 N -6.97 4.85 0.14 6.15 0.01 -1.26 -4.90 113.70 111.71 1nam s SER 51 Ca -0.25 0.01 -0.35 0.00 1.31 0.00 0.00 55.95 56.67 1nam s SER 51 Cb 0.07 -1.26 -0.15 0.00 0.21 0.00 0.00 66.02 64.89 1nam s SER 51 CO 0.71 0.35 1.50 -2.65 0.41 0.00 0.00 173.24 173.57 1nam n PRO 52 N 2.06 1.84 0.00 12.44 -0.02 -1.26 -0.66 135.00 149.41 1nam n PRO 52 Ca -0.18 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 1nam n PRO 52 Cb 0.53 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 1nam n PRO 52 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nam n GLY 53 N 3.14 1.54 3.66 -1.23 0.00 0.55 -5.00 105.19 107.85 1nam n GLY 53 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1nam n GLY 53 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1nam s ASP 54 N -1.70 6.55 0.08 1.61 -0.00 0.17 -4.88 116.67 118.51 1nam s ASP 54 Ca 0.00 2.49 0.09 0.00 -0.00 0.00 0.00 52.55 55.13 1nam s ASP 54 Cb 0.00 -2.54 -0.03 0.00 -0.00 0.00 0.00 42.92 40.35 1nam s ASP 54 CO 0.00 -0.98 -0.23 -0.75 -0.00 0.00 0.00 175.17 173.20 1nam s LYS 55 N 4.01 1.37 -0.06 8.23 2.20 -1.26 -0.74 119.74 133.48 1nam s LYS 55 Ca 0.81 -1.14 -0.30 0.00 -0.36 0.00 0.00 55.97 54.98 1nam s LYS 55 Cb -0.39 -1.63 0.11 0.00 -1.51 0.00 0.00 37.83 34.41 1nam s LYS 55 CO 0.36 0.40 0.93 -2.00 -0.36 0.00 0.00 175.35 174.68 1nam s GLU 56 N -1.64 0.73 0.16 4.03 2.12 -0.06 -4.97 118.70 119.07 1nam s GLU 56 Ca 0.09 -0.15 0.11 0.00 0.36 0.00 0.00 54.97 55.38 1nam s GLU 56 Cb -0.10 0.34 -0.04 0.00 0.26 0.00 0.00 34.13 34.59 1nam s GLU 56 CO 0.04 -0.30 -0.24 0.14 -0.54 0.00 0.00 175.26 174.36 1nam s VAL 57 N -2.48 2.24 -0.30 3.70 -7.23 -1.26 -0.36 120.40 114.71 1nam s VAL 57 Ca 0.03 -1.90 -0.11 0.00 -1.81 0.00 0.00 61.98 58.19 1nam s VAL 57 Cb -0.01 -2.03 0.16 0.00 0.56 0.00 0.00 36.38 35.06 1nam s VAL 57 CO -0.05 -0.06 0.81 -0.75 -0.31 0.00 0.00 175.10 174.73 1nam s LYS 58 N -2.44 0.43 -0.22 4.82 2.47 -0.83 -5.01 119.74 118.97 1nam s LYS 58 Ca 0.17 1.00 -0.20 0.00 -1.56 0.00 0.00 55.97 55.38 1nam s LYS 58 Cb -0.09 0.59 -0.02 0.00 -1.46 0.00 0.00 37.83 36.85 1nam s LYS 58 CO 0.08 -0.23 0.61 -1.12 0.16 0.00 0.00 175.35 174.85 1nam s SER 59 N 2.73 6.63 0.28 1.43 0.01 -1.26 -1.81 113.70 121.71 1nam s SER 59 Ca 0.00 0.76 0.09 0.00 1.31 0.00 0.00 55.95 58.12 1nam s SER 59 Cb -0.10 -2.33 -0.04 0.00 0.21 0.00 0.00 66.02 63.75 1nam s SER 59 CO -0.18 -0.29 0.02 -0.22 0.41 0.00 0.00 173.24 172.98 1nam s LEU 60 N 2.08 3.18 -0.10 2.44 2.96 -0.82 -5.02 118.68 123.40 1nam s LEU 60 Ca 0.27 -0.70 -0.30 0.00 -0.22 0.00 0.00 54.13 53.18 1nam s LEU 60 Cb -0.16 -1.68 -0.08 0.00 0.50 0.00 0.00 46.19 44.77 1nam s LEU 60 CO 0.10 -0.07 2.08 -2.65 -1.32 0.00 0.00 176.35 174.49 1nam n PRO 61 N -0.94 2.33 0.00 0.98 -0.02 -1.26 -2.05 135.00 134.04 1nam n PRO 61 Ca -0.06 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 1nam n PRO 61 Cb 0.60 -3.03 0.00 0.00 -0.02 0.00 0.00 33.50 31.05 1nam n PRO 61 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nam n GLY 62 N 5.13 0.83 3.54 -1.23 0.00 -1.26 -5.02 105.19 107.18 1nam n GLY 62 Ca 0.26 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.12 1nam n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nam s ALA 63 N -2.16 -1.82 -0.14 4.61 0.00 -0.87 -1.38 121.76 120.01 1nam s ALA 63 Ca 0.00 1.40 0.02 0.00 0.00 0.00 0.00 51.96 53.38 1nam s ALA 63 Cb 0.00 -0.20 0.01 0.00 0.00 0.00 0.00 23.12 22.92 1nam s ALA 63 CO 0.00 -0.35 -0.21 -0.51 0.00 0.00 0.00 175.76 174.69 1nam s ASP 64 N -1.16 3.20 0.05 0.00 1.01 -0.46 -1.95 116.67 117.36 1nam s ASP 64 Ca -0.08 -0.58 0.05 0.00 0.71 0.00 0.00 52.55 52.65 1nam s ASP 64 Cb -0.00 -1.46 -0.04 0.00 1.01 0.00 0.00 42.92 42.43 1nam s ASP 64 CO 0.08 0.08 -0.09 -0.31 0.21 0.00 0.00 175.17 175.14 1nam s TYR 65 N 0.80 2.80 -0.03 4.23 1.51 -0.75 -0.30 117.35 125.61 1nam s TYR 65 Ca -0.07 -0.11 -0.01 0.00 -1.01 0.00 0.00 57.07 55.87 1nam s TYR 65 Cb -0.16 -1.52 0.03 0.00 -0.11 0.00 0.00 41.96 40.20 1nam s TYR 65 CO -0.01 0.38 0.05 -1.17 -1.11 0.00 0.00 175.55 173.68 1nam s LEU 66 N -1.74 0.74 -0.02 -1.29 2.96 -0.63 -1.97 118.68 116.73 1nam s LEU 66 Ca 0.19 0.07 0.06 0.00 -0.22 0.00 0.00 54.13 54.23 1nam s LEU 66 Cb -0.11 -0.06 -0.01 0.00 0.50 0.00 0.00 46.19 46.50 1nam s LEU 66 CO 0.10 -0.17 -0.19 0.00 -1.32 0.00 0.00 176.35 174.77 1nam s ALA 67 N 1.45 1.56 -0.04 5.97 0.00 0.51 0.12 121.76 131.33 1nam s ALA 67 Ca -0.04 -0.80 0.02 0.00 0.00 0.00 0.00 51.96 51.13 1nam s ALA 67 Cb -0.13 -0.41 0.02 0.00 0.00 0.00 0.00 23.12 22.60 1nam s ALA 67 CO -0.03 0.37 -0.06 0.99 0.00 0.00 0.00 175.76 177.03 1nam s THR 68 N -0.40 0.64 -0.50 0.00 2.01 -1.06 -0.88 115.64 115.45 1nam s THR 68 Ca 0.06 -0.21 -0.26 0.00 0.31 0.00 0.00 61.69 61.59 1nam s THR 68 Cb -0.08 -0.63 0.03 0.00 0.01 0.00 0.00 72.50 71.84 1nam s THR 68 CO -0.00 0.24 0.97 -0.60 -0.69 0.00 0.00 174.62 174.53 1nam s ARG 69 N 0.68 3.49 -0.17 4.92 6.06 0.08 -0.01 118.95 133.99 1nam s ARG 69 Ca -0.10 0.08 -0.22 0.00 -2.50 0.00 0.00 55.73 52.99 1nam s ARG 69 Cb -0.13 -3.97 -0.19 0.00 0.06 0.00 0.00 34.95 30.72 1nam s ARG 69 CO 0.01 -1.35 0.39 0.28 -2.50 0.00 0.00 175.30 172.13 1nam h VAL 70 N 6.08 1.14 -4.76 7.11 2.07 -1.01 0.16 116.25 127.04 1nam h VAL 70 Ca -0.25 -2.07 -0.51 0.00 0.82 0.00 0.00 66.70 64.70 1nam h VAL 70 Cb 1.07 2.36 -0.12 0.00 -1.52 0.00 0.00 31.29 33.09 1nam h VAL 70 CO 1.07 0.38 -0.44 0.35 0.02 0.00 0.00 177.57 178.95 1nam n THR 71 N -4.55 0.00 0.16 2.57 -2.24 -1.18 -4.18 114.28 104.87 1nam n THR 71 Ca -0.19 -2.23 0.10 0.00 -2.27 0.00 0.00 64.05 59.46 1nam n THR 71 Cb 0.52 0.86 0.53 0.00 -2.10 0.00 0.00 70.33 70.13 1nam n THR 71 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1nam n ASP 72 N -1.60 0.51 0.00 3.42 10.43 -1.26 -2.61 116.55 125.45 1nam n ASP 72 Ca -0.03 0.73 0.00 0.00 2.57 0.00 0.00 54.79 58.06 1nam n ASP 72 Cb 0.57 -0.80 0.00 0.00 1.84 0.00 0.00 41.12 42.73 1nam n ASP 72 CO 0.00 0.00 0.00 0.35 -1.07 0.00 0.00 177.20 176.48 1nam n THR 73 N -2.18 0.00 -4.09 -3.53 -2.24 -1.26 -4.88 114.28 96.10 1nam n THR 73 Ca -0.01 -0.40 -0.35 0.00 -2.27 0.00 0.00 64.05 61.02 1nam n THR 73 Cb 0.04 0.92 -0.12 0.00 -2.10 0.00 0.00 70.33 69.07 1nam n THR 73 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1nam s GLU 74 N -1.08 3.65 -0.04 -0.78 2.12 -1.07 0.54 118.70 122.03 1nam s GLU 74 Ca 0.00 -0.51 0.06 0.00 0.36 0.00 0.00 54.97 54.89 1nam s GLU 74 Cb 0.00 -3.08 -0.01 0.00 0.26 0.00 0.00 34.13 31.30 1nam s GLU 74 CO 0.00 0.04 -0.24 -1.17 -0.54 0.00 0.00 175.26 173.35 1nam s LEU 75 N 0.92 2.04 0.34 2.70 2.96 0.22 -0.36 118.68 127.51 1nam s LEU 75 Ca 0.01 -0.47 0.09 0.00 -0.22 0.00 0.00 54.13 53.54 1nam s LEU 75 Cb -0.14 -1.30 -0.06 0.00 0.50 0.00 0.00 46.19 45.19 1nam s LEU 75 CO 0.02 0.25 -0.10 -0.13 -1.32 0.00 0.00 176.35 175.08 1nam s ARG 76 N -0.27 1.81 -0.18 1.98 0.52 0.99 -0.20 118.95 123.59 1nam s ARG 76 Ca 0.01 -1.93 -0.07 0.00 -0.52 0.00 0.00 55.73 53.21 1nam s ARG 76 Cb -0.12 -1.68 0.08 0.00 0.52 0.00 0.00 34.95 33.74 1nam s ARG 76 CO 0.02 0.14 0.39 -1.17 0.02 0.00 0.00 175.30 174.70 1nam s LEU 77 N -3.60 -0.42 -0.23 2.53 2.96 -0.71 -2.57 118.68 116.64 1nam s LEU 77 Ca 0.32 0.89 -0.10 0.00 -0.22 0.00 0.00 54.13 55.03 1nam s LEU 77 Cb 0.02 1.24 -0.05 0.00 0.50 0.00 0.00 46.19 47.90 1nam s LEU 77 CO 0.16 -0.22 0.15 -1.10 -1.32 0.00 0.00 176.35 174.02 1nam s GLN 78 N 2.24 4.09 -0.27 1.98 -0.21 0.12 -0.87 119.66 126.73 1nam s GLN 78 Ca -0.03 -0.27 -0.04 0.00 0.02 0.00 0.00 55.36 55.04 1nam s GLN 78 Cb -0.11 -3.50 0.01 0.00 1.00 0.00 0.00 33.01 30.41 1nam s GLN 78 CO -0.12 0.12 0.01 0.54 -2.12 0.00 0.00 175.29 173.72 1nam s VAL 79 N 0.89 3.49 0.28 1.09 0.11 0.01 -1.60 120.40 124.67 1nam s VAL 79 Ca 0.07 -0.80 0.08 0.00 -2.93 0.00 0.00 61.98 58.40 1nam s VAL 79 Cb -0.13 -2.77 -0.04 0.00 -1.53 0.00 0.00 36.38 31.92 1nam s VAL 79 CO 0.03 0.16 0.18 0.00 -3.33 0.00 0.00 175.10 172.15 1nam s ALA 80 N 1.43 3.57 -1.50 1.54 0.00 0.59 -1.30 121.76 126.09 1nam s ALA 80 Ca 0.02 -1.53 -0.00 0.00 0.00 0.00 0.00 51.96 50.44 1nam s ALA 80 Cb -0.17 -1.16 0.00 0.00 0.00 0.00 0.00 23.12 21.80 1nam s ALA 80 CO -0.01 0.19 0.05 0.09 0.00 0.00 0.00 175.76 176.08 1nam n ASN 81 N -1.18 -5.17 -4.68 0.00 3.02 -1.25 -1.35 115.26 104.66 1nam n ASN 81 Ca -0.06 0.03 -0.42 0.00 -0.03 0.00 0.00 54.58 54.10 1nam n ASN 81 Cb 0.59 -4.32 -0.03 0.00 -0.61 0.00 0.00 39.78 35.41 1nam n ASN 81 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 1nam s MET 82 N -5.10 4.22 -0.18 3.52 1.75 -1.26 -4.52 119.30 117.73 1nam s MET 82 Ca 0.03 2.09 0.17 0.00 -1.25 0.00 0.00 55.69 56.72 1nam s MET 82 Cb -0.01 -3.75 -0.23 0.00 2.84 0.00 0.00 34.83 33.68 1nam s MET 82 CO 0.03 -0.72 0.08 -1.13 -0.65 0.00 0.00 175.02 172.64 1nam n SER 83 N 6.17 0.40 -4.20 1.11 3.41 -0.48 -0.18 113.62 119.86 1nam n SER 83 Ca 0.15 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.61 1nam n SER 83 Cb 0.43 1.00 -0.11 0.00 -0.26 0.00 0.00 64.21 65.27 1nam n SER 83 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1nam s GLN 84 N -2.49 0.93 1.01 4.33 1.11 -1.26 -4.90 119.66 118.39 1nam s GLN 84 Ca -0.09 -1.23 -0.12 0.00 0.01 0.00 0.00 55.36 53.93 1nam s GLN 84 Cb 0.06 -0.64 0.20 0.00 -1.01 0.00 0.00 33.01 31.62 1nam s GLN 84 CO 0.77 0.10 1.08 0.20 0.01 0.00 0.00 175.29 177.45 1nam s GLY 85 N -2.58 1.61 -0.15 3.09 0.00 -1.26 -4.97 107.32 103.06 1nam s GLY 85 Ca 0.08 0.08 -0.34 0.00 0.00 0.00 0.00 44.72 44.54 1nam s GLY 85 CO 0.01 0.64 1.29 1.09 0.00 0.00 0.00 173.10 176.13 1nam s ARG 86 N -4.67 0.25 0.05 2.90 1.70 -1.00 -4.42 118.95 113.76 1nam s ARG 86 Ca 0.66 -0.11 0.09 0.00 -0.47 0.00 0.00 55.73 55.90 1nam s ARG 86 Cb -0.22 0.10 -0.03 0.00 -0.57 0.00 0.00 34.95 34.23 1nam s ARG 86 CO 0.60 -0.11 -0.25 0.95 -1.08 0.00 0.00 175.30 175.41 1nam s THR 87 N -2.31 2.04 -0.21 4.99 -4.23 -0.59 -1.16 115.64 114.16 1nam s THR 87 Ca 0.12 -1.36 -0.05 0.00 -1.18 0.00 0.00 61.69 59.21 1nam s THR 87 Cb 0.02 -1.75 -0.02 0.00 1.34 0.00 0.00 72.50 72.09 1nam s THR 87 CO -0.04 0.32 0.00 -0.76 -0.54 0.00 0.00 174.62 173.60 1nam s LEU 90 N -1.26 3.20 -0.15 4.79 1.02 -0.70 -0.99 118.68 124.59 1nam s LEU 90 Ca 0.11 -0.25 -0.05 0.00 0.02 0.00 0.00 54.13 53.95 1nam s LEU 90 Cb -0.10 -1.82 -0.04 0.00 0.02 0.00 0.00 46.19 44.25 1nam s LEU 90 CO 0.02 0.03 0.03 -0.31 0.02 0.00 0.00 176.35 176.14 1nam s TYR 91 N 1.23 3.20 0.14 0.29 1.51 0.12 -0.54 117.35 123.30 1nam s TYR 91 Ca 0.03 0.03 -0.21 0.00 -1.01 0.00 0.00 57.07 55.92 1nam s TYR 91 Cb -0.15 -1.99 -0.07 0.00 -0.11 0.00 0.00 41.96 39.64 1nam s TYR 91 CO 0.01 0.20 0.67 0.00 -1.11 0.00 0.00 175.55 175.32 1nam s THR 93 N -1.24 1.42 0.06 0.00 -4.23 0.60 -0.37 115.64 111.89 1nam s THR 93 Ca 0.35 -2.12 0.03 0.00 -1.18 0.00 0.00 61.69 58.76 1nam s THR 93 Cb -0.20 -1.93 -0.03 0.00 1.34 0.00 0.00 72.50 71.69 1nam s THR 93 CO 0.22 -0.68 -0.09 0.00 -0.54 0.00 0.00 174.62 173.53 1nam s SER 95 N -1.88 -0.10 0.38 0.00 0.15 -0.43 -0.70 113.70 111.12 1nam s SER 95 Ca -0.04 -0.45 0.24 0.00 0.70 0.00 0.00 55.95 56.39 1nam s SER 95 Cb -0.07 0.43 0.41 0.00 -1.71 0.00 0.00 66.02 65.07 1nam s SER 95 CO 0.00 -0.81 1.61 0.00 1.20 0.00 0.00 173.24 175.24 1nam h ALA 96 N 2.50 0.97 -2.90 5.45 0.00 -1.78 -2.67 119.26 120.84 1nam h ALA 96 Ca -0.34 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.60 1nam h ALA 96 Cb 1.24 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 1nam h ALA 96 CO 0.50 0.00 0.33 -0.51 0.00 0.00 0.00 179.25 179.57 1nam s ASP 97 N -5.84 -0.04 0.18 0.00 1.01 -1.26 -4.74 116.67 105.98 1nam s ASP 97 Ca 0.07 -0.97 0.23 0.00 0.71 0.00 0.00 52.55 52.60 1nam s ASP 97 Cb 0.07 0.77 0.18 0.00 1.01 0.00 0.00 42.92 44.94 1nam s ASP 97 CO 0.66 -1.51 1.21 0.08 0.21 0.00 0.00 175.17 175.82 1nam h ARG 98 N 2.00 0.00 -5.47 8.23 0.11 -1.96 -3.40 114.38 113.89 1nam h ARG 98 Ca -0.29 0.00 -0.64 0.00 0.10 0.00 0.00 59.98 59.15 1nam h ARG 98 Cb 1.24 0.00 -0.15 0.00 1.11 0.00 0.00 29.97 32.17 1nam h ARG 98 CO 0.37 0.00 -0.57 0.08 0.10 0.00 0.00 179.97 179.95 1nam s VAL 99 N -3.26 4.72 0.00 0.08 1.01 -1.26 -4.83 120.40 116.86 1nam s VAL 99 Ca 0.03 -0.07 0.00 0.00 0.00 0.00 0.00 61.98 61.94 1nam s VAL 99 Cb 0.11 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 33.41 1nam s VAL 99 CO 0.75 0.51 0.00 0.61 0.00 0.00 0.00 175.10 176.98 1nam n GLY 100 N 3.04 0.00 3.80 4.51 0.00 -1.26 -4.94 105.19 110.34 1nam n GLY 100 Ca -0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.52 1nam n GLY 100 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1nam s ASN 103 N -1.25 5.86 0.38 1.61 0.01 -1.26 -4.98 114.94 115.31 1nam s ASN 103 Ca 0.00 1.83 -0.27 0.00 -0.71 0.00 0.00 52.86 53.71 1nam s ASN 103 Cb 0.00 -2.54 -0.09 0.00 0.41 0.00 0.00 41.25 39.03 1nam s ASN 103 CO 0.00 -1.11 1.29 -0.89 -1.51 0.00 0.00 177.10 174.88 1nam s THR 105 N -2.40 2.70 -0.03 1.60 2.01 -1.26 -4.89 115.64 113.37 1nam s THR 105 Ca 0.64 0.66 -0.20 0.00 0.31 0.00 0.00 61.69 63.10 1nam s THR 105 Cb -0.16 -3.40 -0.05 0.00 0.01 0.00 0.00 72.50 68.90 1nam s THR 105 CO 0.35 0.12 0.56 -0.76 -0.69 0.00 0.00 174.62 174.20 1nam s LEU 106 N -2.19 4.39 -0.09 4.42 2.01 -1.26 -4.44 118.68 121.52 1nam s LEU 106 Ca 0.54 1.07 0.01 0.00 0.01 0.00 0.00 54.13 55.76 1nam s LEU 106 Cb -0.38 -2.85 -0.02 0.00 0.01 0.00 0.00 46.19 42.94 1nam s LEU 106 CO 0.49 0.09 -0.11 -0.31 1.01 0.00 0.00 176.35 177.53 1nam s TYR 107 N -0.05 2.83 -0.07 0.29 1.51 0.12 -4.95 117.35 117.02 1nam s TYR 107 Ca 0.30 -0.25 -0.13 0.00 -1.01 0.00 0.00 57.07 55.97 1nam s TYR 107 Cb -0.17 -1.74 -0.05 0.00 -0.11 0.00 0.00 41.96 39.89 1nam s TYR 107 CO 0.15 0.10 0.34 -0.06 -1.11 0.00 0.00 175.55 174.98 1nam s PHE 108 N -0.36 3.63 0.00 2.71 0.08 -1.26 -1.69 117.98 121.09 1nam s PHE 108 Ca 0.04 0.81 0.00 0.00 0.12 0.00 0.00 56.93 57.90 1nam s PHE 108 Cb -0.12 -2.26 0.00 0.00 -0.57 0.00 0.00 43.02 40.06 1nam s PHE 108 CO 0.02 0.52 0.00 0.41 -0.10 0.00 0.00 175.22 176.08 1nam n GLY 109 N 2.34 -2.78 0.17 4.36 0.00 0.50 -4.96 105.19 104.83 1nam n GLY 109 Ca -0.14 -1.37 0.12 0.00 0.00 0.00 0.00 46.02 44.63 1nam n GLY 109 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1nam n GLU 110 N -1.30 0.52 0.00 1.61 4.71 -1.26 -4.84 120.64 120.08 1nam n GLU 110 Ca 0.00 -0.35 0.00 0.00 -0.01 0.00 0.00 57.16 56.80 1nam n GLU 110 Cb 0.00 -1.49 0.00 0.00 -1.01 0.00 0.00 31.44 28.94 1nam n GLU 110 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1nam n GLY 111 N 1.42 -1.53 3.28 0.62 0.00 -1.26 -4.93 105.19 102.80 1nam n GLY 111 Ca 0.09 -1.30 -0.40 0.00 0.00 0.00 0.00 46.02 44.40 1nam n GLY 111 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1nam s SER 112 N -1.53 5.67 -0.29 1.61 0.01 0.30 -4.72 113.70 114.75 1nam s SER 112 Ca 0.00 -1.45 -0.26 0.00 1.31 0.00 0.00 55.95 55.55 1nam s SER 112 Cb 0.00 -2.00 0.01 0.00 0.21 0.00 0.00 66.02 64.24 1nam s SER 112 CO 0.00 -0.53 0.94 -0.60 0.41 0.00 0.00 173.24 173.46 1nam s ARG 113 N 1.45 4.07 -0.18 12.44 3.52 0.10 -1.72 118.95 138.63 1nam s ARG 113 Ca 0.03 0.93 -0.07 0.00 -0.13 0.00 0.00 55.73 56.48 1nam s ARG 113 Cb -0.23 -3.71 -0.04 0.00 -1.56 0.00 0.00 34.95 29.42 1nam s ARG 113 CO 0.03 -0.73 0.06 -0.51 -0.81 0.00 0.00 175.30 173.34 1nam s LEU 114 N 3.23 3.83 0.00 -0.88 1.43 -0.31 -0.07 118.68 125.91 1nam s LEU 114 Ca 0.39 0.10 0.00 0.00 -1.03 0.00 0.00 54.13 53.59 1nam s LEU 114 Cb -0.14 -1.96 0.00 0.00 0.03 0.00 0.00 46.19 44.12 1nam s LEU 114 CO 0.12 0.19 0.00 -0.38 0.23 0.00 0.00 176.35 176.51 1nam n ILE 115 N 3.44 0.00 0.00 -0.59 5.41 0.07 -2.37 119.36 125.32 1nam n ILE 115 Ca -0.17 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.58 1nam n ILE 115 Cb 0.52 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.45 1nam n ILE 115 CO 0.00 0.00 0.00 0.55 0.00 0.00 0.00 176.55 177.10