#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dqg s VAL 2 N 0.00 5.40 -0.00 2.53 1.01 -1.25 -3.61 120.40 124.47 2dqg s VAL 2 Ca 0.00 0.17 -0.00 0.00 0.00 0.00 0.00 61.98 62.15 2dqg s VAL 2 Cb 0.00 -3.38 0.00 0.00 0.00 0.00 0.00 36.38 33.00 2dqg s VAL 2 CO 0.00 0.56 0.01 0.00 0.00 0.00 0.00 175.10 175.67 2dqg s GLN 3 N -0.59 0.02 0.11 2.72 -2.07 -0.13 -4.98 119.66 114.74 2dqg s GLN 3 Ca 0.13 -0.01 0.10 0.00 -1.82 0.00 0.00 55.36 53.76 2dqg s GLN 3 Cb -0.12 0.01 -0.04 0.00 -1.09 0.00 0.00 33.01 31.77 2dqg s GLN 3 CO 0.02 -0.00 -0.26 -0.51 -1.32 0.00 0.00 175.29 173.22 2dqg s LEU 4 N -0.04 2.30 -0.19 2.60 1.02 -1.26 -1.27 118.68 121.84 2dqg s LEU 4 Ca -0.00 -0.72 -0.09 0.00 0.02 0.00 0.00 54.13 53.34 2dqg s LEU 4 Cb -0.00 -1.18 0.07 0.00 0.02 0.00 0.00 46.19 45.10 2dqg s LEU 4 CO -0.00 0.17 0.44 -1.58 0.02 0.00 0.00 176.35 175.40 2dqg s GLN 5 N -1.92 0.39 0.17 1.70 0.74 -0.69 -4.29 119.66 115.77 2dqg s GLN 5 Ca 0.13 0.91 -0.20 0.00 0.05 0.00 0.00 55.36 56.25 2dqg s GLN 5 Cb -0.10 0.12 -0.08 0.00 1.10 0.00 0.00 33.01 34.05 2dqg s GLN 5 CO 0.05 -0.19 0.68 -1.21 -0.55 0.00 0.00 175.29 174.08 2dqg s GLU 6 N 1.84 4.27 0.01 1.67 8.01 -1.26 -0.80 118.70 132.44 2dqg s GLU 6 Ca -0.07 0.86 -0.03 0.00 0.01 0.00 0.00 54.97 55.74 2dqg s GLU 6 Cb -0.09 -3.03 -0.01 0.00 -4.31 0.00 0.00 34.13 26.69 2dqg s GLU 6 CO -0.13 0.48 0.04 -1.54 0.01 0.00 0.00 175.26 174.12 2dqg s SER 7 N -1.46 0.12 0.00 -0.19 1.04 0.47 -4.97 113.70 108.71 2dqg s SER 7 Ca 0.38 -0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.50 2dqg s SER 7 Cb -0.18 0.14 0.00 0.00 0.10 0.00 0.00 66.02 66.08 2dqg s SER 7 CO 0.21 -0.29 0.00 0.61 0.98 0.00 0.00 173.24 174.75 2dqg n GLY 8 N 1.72 1.40 3.75 7.32 0.00 -1.26 -0.79 105.19 117.34 2dqg n GLY 8 Ca -0.22 -1.53 -0.38 0.00 0.00 0.00 0.00 46.02 43.89 2dqg n GLY 8 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dqg n PRO 9 N -1.51 1.68 -0.00 1.61 -0.04 -1.26 -4.94 135.00 130.53 2dqg n PRO 9 Ca 0.00 0.62 0.07 0.00 -0.04 0.00 0.00 63.50 64.15 2dqg n PRO 9 Cb 0.00 -2.59 -0.14 0.00 -0.04 0.00 0.00 33.50 30.73 2dqg n PRO 9 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2dqg n SER 10 N -1.08 0.19 -4.04 3.54 7.64 -1.26 -4.80 113.62 113.81 2dqg n SER 10 Ca 0.11 0.08 -0.28 0.00 1.01 0.00 0.00 58.87 59.79 2dqg n SER 10 Cb 0.45 1.48 -0.17 0.00 -1.01 0.00 0.00 64.21 64.96 2dqg n SER 10 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2dqg s LEU 11 N -4.89 1.66 0.11 -3.43 2.96 -1.26 0.47 118.68 114.30 2dqg s LEU 11 Ca -0.07 -0.39 0.03 0.00 -0.22 0.00 0.00 54.13 53.48 2dqg s LEU 11 Cb 0.12 -1.02 -0.04 0.00 0.50 0.00 0.00 46.19 45.75 2dqg s LEU 11 CO 0.87 0.01 -0.09 0.68 -1.32 0.00 0.00 176.35 176.50 2dqg s VAL 12 N 0.97 0.92 0.14 1.68 -7.23 -0.65 -4.98 120.40 111.25 2dqg s VAL 12 Ca -0.08 -1.80 -0.07 0.00 -1.81 0.00 0.00 61.98 58.22 2dqg s VAL 12 Cb -0.15 -1.54 -0.06 0.00 0.56 0.00 0.00 36.38 35.19 2dqg s VAL 12 CO -0.01 -0.68 0.41 -0.54 -0.31 0.00 0.00 175.10 173.97 2dqg s LYS 13 N -3.26 3.69 0.45 4.82 -0.14 -1.26 -1.45 119.74 122.60 2dqg s LYS 13 Ca 0.09 0.05 -0.23 0.00 -1.36 0.00 0.00 55.97 54.52 2dqg s LYS 13 Cb 0.00 -2.86 -0.09 0.00 -1.68 0.00 0.00 37.83 33.20 2dqg s LYS 13 CO -0.01 0.47 1.03 -2.30 -0.76 0.00 0.00 175.35 173.78 2dqg n PRO 14 N 0.28 1.35 0.00 -1.68 -0.02 -1.26 -2.21 135.00 131.46 2dqg n PRO 14 Ca -0.03 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 2dqg n PRO 14 Cb 0.52 -2.11 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 2dqg n PRO 14 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2dqg n SER 15 N 0.25 0.00 -4.23 2.55 2.88 0.33 -4.90 113.62 110.49 2dqg n SER 15 Ca 0.10 0.00 -0.27 0.00 -1.33 0.00 0.00 58.87 57.36 2dqg n SER 15 Cb 0.41 -0.09 0.17 0.00 -0.75 0.00 0.00 64.21 63.95 2dqg n SER 15 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dqg s GLN 16 N 0.00 0.82 -0.27 -1.46 -2.07 -0.94 -3.78 119.66 111.96 2dqg s GLN 16 Ca 0.00 -0.82 -0.10 0.00 -1.82 0.00 0.00 55.36 52.62 2dqg s GLN 16 Cb 0.00 -2.03 -0.05 0.00 -1.09 0.00 0.00 33.01 29.85 2dqg s GLN 16 CO 0.00 -2.18 0.16 0.99 -1.32 0.00 0.00 175.29 172.94 2dqg s THR 17 N -3.65 5.11 -0.13 3.63 2.01 -1.26 -1.99 115.64 119.36 2dqg s THR 17 Ca 0.73 0.10 -0.21 0.00 0.31 0.00 0.00 61.69 62.62 2dqg s THR 17 Cb -0.03 -3.42 -0.03 0.00 0.01 0.00 0.00 72.50 69.03 2dqg s THR 17 CO 0.50 0.28 0.62 -0.22 -0.69 0.00 0.00 174.62 175.12 2dqg s LEU 18 N 1.61 4.24 -0.01 4.42 2.96 0.08 -4.89 118.68 127.09 2dqg s LEU 18 Ca 0.07 0.96 0.03 0.00 -0.22 0.00 0.00 54.13 54.97 2dqg s LEU 18 Cb -0.15 -2.92 -0.01 0.00 0.50 0.00 0.00 46.19 43.61 2dqg s LEU 18 CO 0.09 -0.15 -0.11 -0.44 -1.32 0.00 0.00 176.35 174.42 2dqg s SER 19 N 0.90 1.31 0.06 3.68 0.01 -1.26 0.09 113.70 118.49 2dqg s SER 19 Ca 0.31 -0.20 0.03 0.00 1.31 0.00 0.00 55.95 57.40 2dqg s SER 19 Cb -0.16 -0.19 -0.03 0.00 0.21 0.00 0.00 66.02 65.84 2dqg s SER 19 CO 0.13 0.12 -0.10 -0.76 0.41 0.00 0.00 173.24 173.05 2dqg s LEU 20 N -0.16 2.29 -0.01 2.44 1.43 -0.43 -4.46 118.68 119.79 2dqg s LEU 20 Ca 0.03 -0.62 0.07 0.00 -1.03 0.00 0.00 54.13 52.57 2dqg s LEU 20 Cb -0.05 -0.28 -0.02 0.00 0.03 0.00 0.00 46.19 45.86 2dqg s LEU 20 CO -0.00 -0.19 -0.22 -0.89 0.23 0.00 0.00 176.35 175.28 2dqg s THR 21 N -1.59 2.42 -0.22 5.49 2.01 0.03 -1.60 115.64 122.18 2dqg s THR 21 Ca -0.05 -1.08 0.01 0.00 0.31 0.00 0.00 61.69 60.88 2dqg s THR 21 Cb -0.08 -1.91 0.03 0.00 0.01 0.00 0.00 72.50 70.55 2dqg s THR 21 CO 0.01 0.51 -0.15 0.00 -0.69 0.00 0.00 174.62 174.30 2dqg s SER 23 N 1.23 6.58 -0.10 0.00 0.01 0.02 -1.99 113.70 119.46 2dqg s SER 23 Ca -0.00 0.69 -0.00 0.00 1.31 0.00 0.00 55.95 57.94 2dqg s SER 23 Cb -0.16 -2.25 -0.03 0.00 0.21 0.00 0.00 66.02 63.80 2dqg s SER 23 CO -0.09 0.03 -0.08 -0.69 0.41 0.00 0.00 173.24 172.81 2dqg s VAL 24 N 0.63 3.55 0.00 3.43 1.01 -1.09 -1.70 120.40 126.25 2dqg s VAL 24 Ca 0.22 -0.51 0.01 0.00 0.00 0.00 0.00 61.98 61.70 2dqg s VAL 24 Cb -0.14 -2.48 -0.01 0.00 0.00 0.00 0.00 36.38 33.75 2dqg s VAL 24 CO 0.08 0.56 -0.04 -0.89 0.00 0.00 0.00 175.10 174.81 2dqg s THR 25 N -0.34 0.30 0.00 3.92 2.01 -0.40 -4.83 115.64 116.30 2dqg s THR 25 Ca 0.05 -0.31 0.00 0.00 0.31 0.00 0.00 61.69 61.73 2dqg s THR 25 Cb -0.12 -0.28 0.00 0.00 0.01 0.00 0.00 72.50 72.10 2dqg s THR 25 CO 0.02 -0.01 0.00 0.61 -0.69 0.00 0.00 174.62 174.55 2dqg n GLY 26 N 2.72 2.63 3.64 4.40 0.00 -1.24 -0.95 105.19 116.39 2dqg n GLY 26 Ca -0.15 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.83 2dqg n GLY 26 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2dqg s ASP 27 N -1.58 -0.23 0.38 1.61 2.15 -1.26 -4.63 116.67 113.10 2dqg s ASP 27 Ca 0.00 -0.21 -0.25 0.00 0.43 0.00 0.00 52.55 52.52 2dqg s ASP 27 Cb 0.00 0.40 -0.09 0.00 -0.30 0.00 0.00 42.92 42.93 2dqg s ASP 27 CO 0.00 -0.71 1.06 -0.55 -0.17 0.00 0.00 175.17 174.81 2dqg s SER 28 N -2.74 6.82 0.27 -0.34 0.15 -1.26 -4.94 113.70 111.67 2dqg s SER 28 Ca 0.10 2.09 -0.03 0.00 0.70 0.00 0.00 55.95 58.80 2dqg s SER 28 Cb -0.01 -2.59 0.36 0.00 -1.71 0.00 0.00 66.02 62.07 2dqg s SER 28 CO -0.03 -0.45 1.89 0.40 1.20 0.00 0.00 173.24 176.25 2dqg h ILE 29 N 2.33 1.23 0.00 6.45 1.08 -1.91 -2.24 117.51 124.44 2dqg h ILE 29 Ca -0.48 -0.59 0.00 0.00 -0.39 0.00 0.00 64.86 63.40 2dqg h ILE 29 Cb 1.22 0.22 0.00 0.00 -3.07 0.00 0.00 36.82 35.19 2dqg h ILE 29 CO 0.63 0.26 0.00 0.35 -0.69 0.00 0.00 178.15 178.70 2dqg n THR 30 N -4.34 0.00 -1.06 -0.27 -2.24 -1.26 -2.87 114.28 102.23 2dqg n THR 30 Ca 0.08 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.89 2dqg n THR 30 Cb 0.11 -0.90 0.28 0.00 -2.10 0.00 0.00 70.33 67.72 2dqg n THR 30 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2dqg n SER 31 N -1.00 4.10 -3.61 3.42 7.64 -0.84 -4.94 113.62 118.39 2dqg n SER 31 Ca 0.05 -3.16 -0.01 0.00 1.01 0.00 0.00 58.87 56.76 2dqg n SER 31 Cb 0.02 -0.62 0.00 0.00 -1.01 0.00 0.00 64.21 62.61 2dqg n SER 31 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2dqg s ASP 32 N -1.71 -0.06 0.01 6.43 3.68 -1.14 -5.04 116.67 118.84 2dqg s ASP 32 Ca 0.47 -0.37 -0.07 0.00 2.13 0.00 0.00 52.55 54.71 2dqg s ASP 32 Cb 0.38 0.34 -0.05 0.00 -1.45 0.00 0.00 42.92 42.15 2dqg s ASP 32 CO 0.09 -0.66 0.27 -0.31 0.13 0.00 0.00 175.17 174.70 2dqg s TYR 33 N -2.53 3.58 -0.00 -5.34 1.51 -1.26 -4.28 117.35 109.02 2dqg s TYR 33 Ca 0.18 0.59 0.06 0.00 -1.01 0.00 0.00 57.07 56.89 2dqg s TYR 33 Cb 0.00 -2.00 -0.02 0.00 -0.11 0.00 0.00 41.96 39.83 2dqg s TYR 33 CO 0.01 0.61 -0.19 -1.58 -1.11 0.00 0.00 175.55 173.29 2dqg s TRP 34 N -1.29 1.70 0.36 2.71 0.52 -0.86 -1.45 118.94 120.63 2dqg s TRP 34 Ca 0.27 -0.33 0.04 0.00 0.02 0.00 0.00 56.10 56.10 2dqg s TRP 34 Cb -0.13 -1.08 -0.05 0.00 -1.15 0.00 0.00 33.47 31.06 2dqg s TRP 34 CO 0.16 -0.01 0.08 -1.12 0.02 0.00 0.00 176.95 176.08 2dqg s SER 35 N -0.57 2.55 -0.04 2.95 0.01 0.88 -0.85 113.70 118.64 2dqg s SER 35 Ca 0.07 -1.49 0.01 0.00 1.31 0.00 0.00 55.95 55.85 2dqg s SER 35 Cb -0.07 0.15 0.02 0.00 0.21 0.00 0.00 66.02 66.33 2dqg s SER 35 CO -0.00 -0.73 -0.04 0.26 0.41 0.00 0.00 173.24 173.14 2dqg s TRP 36 N -3.26 0.63 -0.01 2.43 0.52 -0.51 -2.16 118.94 116.58 2dqg s TRP 36 Ca 0.31 -0.15 0.01 0.00 0.02 0.00 0.00 56.10 56.29 2dqg s TRP 36 Cb 0.06 -0.57 0.00 0.00 -1.15 0.00 0.00 33.47 31.82 2dqg s TRP 36 CO 0.14 -0.15 -0.05 0.42 0.02 0.00 0.00 176.95 177.34 2dqg s ILE 37 N 0.79 0.41 0.12 2.03 1.09 0.41 -1.37 121.20 124.68 2dqg s ILE 37 Ca -0.10 -0.17 0.08 0.00 -1.10 0.00 0.00 60.65 59.36 2dqg s ILE 37 Cb -0.13 -0.39 -0.04 0.00 -1.06 0.00 0.00 42.46 40.85 2dqg s ILE 37 CO -0.00 0.14 -0.20 0.00 -0.10 0.00 0.00 174.94 174.78 2dqg s ARG 38 N 0.20 1.17 -0.20 2.79 1.70 -0.91 0.76 118.95 124.46 2dqg s ARG 38 Ca -0.02 -1.25 -0.02 0.00 -0.47 0.00 0.00 55.73 53.97 2dqg s ARG 38 Cb -0.06 -1.36 0.00 0.00 -0.57 0.00 0.00 34.95 32.97 2dqg s ARG 38 CO -0.00 0.30 -0.11 0.21 -1.08 0.00 0.00 175.30 174.62 2dqg s LYS 39 N -2.23 3.24 0.41 3.89 2.20 0.53 -1.47 119.74 126.31 2dqg s LYS 39 Ca 0.10 -0.70 -0.18 0.00 -0.36 0.00 0.00 55.97 54.82 2dqg s LYS 39 Cb -0.08 -2.81 -0.10 0.00 -1.51 0.00 0.00 37.83 33.32 2dqg s LYS 39 CO 0.05 -0.16 0.89 -0.06 -0.36 0.00 0.00 175.35 175.71 2dqg s PHE 40 N 1.30 3.36 0.53 4.03 0.08 0.49 -1.06 117.98 126.71 2dqg s PHE 40 Ca 0.04 1.45 0.29 0.00 0.12 0.00 0.00 56.93 58.82 2dqg s PHE 40 Cb -0.14 -2.73 0.99 0.00 -0.57 0.00 0.00 43.02 40.57 2dqg s PHE 40 CO -0.06 -0.10 1.21 -2.30 -0.10 0.00 0.00 175.22 173.88 2dqg n PRO 41 N -0.75 0.01 -0.40 0.24 -0.02 -1.26 -0.79 135.00 132.03 2dqg n PRO 41 Ca 0.06 0.92 0.06 0.00 -2.02 0.00 0.00 63.50 62.52 2dqg n PRO 41 Cb 0.54 -2.25 0.23 0.00 -0.02 0.00 0.00 33.50 32.00 2dqg n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dqg n GLY 42 N -1.67 1.80 2.06 -1.23 0.00 -1.26 -4.87 105.19 100.03 2dqg n GLY 42 Ca 0.26 -0.54 -0.03 0.00 0.00 0.00 0.00 46.02 45.71 2dqg n GLY 42 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2dqg n ASN 43 N 0.62 -1.88 -4.40 1.61 4.05 0.03 -5.03 115.26 110.26 2dqg n ASN 43 Ca 0.16 0.01 -0.36 0.00 0.45 0.00 0.00 54.58 54.84 2dqg n ASN 43 Cb 0.62 -1.13 -0.13 0.00 1.23 0.00 0.00 39.78 40.37 2dqg n ASN 43 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 177.26 173.61 2dqg s ARG 44 N -3.94 3.56 0.05 1.20 3.52 -1.18 -4.95 118.95 117.20 2dqg s ARG 44 Ca 0.00 -0.54 -0.11 0.00 -0.13 0.00 0.00 55.73 54.96 2dqg s ARG 44 Cb 0.00 -3.15 -0.06 0.00 -1.56 0.00 0.00 34.95 30.18 2dqg s ARG 44 CO 0.00 -0.13 0.38 -0.51 -0.81 0.00 0.00 175.30 174.23 2dqg s LEU 45 N 1.39 4.38 -0.04 -0.88 1.43 -1.26 -0.38 118.68 123.33 2dqg s LEU 45 Ca 0.05 0.80 -0.01 0.00 -1.03 0.00 0.00 54.13 53.94 2dqg s LEU 45 Cb -0.15 -2.83 0.03 0.00 0.03 0.00 0.00 46.19 43.27 2dqg s LEU 45 CO 0.01 0.22 0.03 -0.70 0.23 0.00 0.00 176.35 176.15 2dqg s GLU 46 N -1.67 0.11 -0.38 1.70 2.12 -0.54 -5.00 118.70 115.04 2dqg s GLU 46 Ca 0.30 0.24 -0.28 0.00 0.36 0.00 0.00 54.97 55.59 2dqg s GLU 46 Cb -0.14 -0.53 0.02 0.00 0.26 0.00 0.00 34.13 33.74 2dqg s GLU 46 CO 0.16 -0.26 1.05 -0.47 -0.54 0.00 0.00 175.26 175.20 2dqg s TYR 47 N 1.70 3.03 -0.03 5.30 6.14 -1.26 -2.15 117.35 130.07 2dqg s TYR 47 Ca -0.01 0.91 -0.22 0.00 0.64 0.00 0.00 57.07 58.40 2dqg s TYR 47 Cb -0.13 -3.90 -0.26 0.00 0.42 0.00 0.00 41.96 38.10 2dqg s TYR 47 CO -0.03 -0.94 1.01 0.52 0.64 0.00 0.00 175.55 176.75 2dqg h MET 48 N 8.56 0.30 0.00 4.97 2.86 -1.60 -3.41 114.93 126.61 2dqg h MET 48 Ca -0.22 -0.37 0.00 0.00 -2.06 0.00 0.00 59.70 57.05 2dqg h MET 48 Cb 1.07 0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.84 2dqg h MET 48 CO 1.05 1.09 0.00 0.41 1.06 0.00 0.00 176.91 180.52 2dqg n GLY 49 N 1.26 -0.50 3.33 8.32 0.00 -1.19 -0.81 105.19 115.60 2dqg n GLY 49 Ca -0.11 -1.27 -0.10 0.00 0.00 0.00 0.00 46.02 44.54 2dqg n GLY 49 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2dqg s TYR 50 N -2.00 -0.01 -0.12 1.61 1.13 -0.88 -1.42 117.35 115.66 2dqg s TYR 50 Ca 0.00 -0.34 0.02 0.00 -1.41 0.00 0.00 57.07 55.34 2dqg s TYR 50 Cb 0.00 0.16 0.01 0.00 -1.10 0.00 0.00 41.96 41.03 2dqg s TYR 50 CO 0.00 -0.71 -0.20 0.54 -2.51 0.00 0.00 175.55 172.68 2dqg s VAL 51 N -3.86 1.83 0.68 -3.49 0.11 -0.03 -1.91 120.40 113.73 2dqg s VAL 51 Ca 0.07 -0.85 -0.04 0.00 -2.93 0.00 0.00 61.98 58.22 2dqg s VAL 51 Cb 0.02 -1.63 0.07 0.00 -1.53 0.00 0.00 36.38 33.31 2dqg s VAL 51 CO -0.08 0.51 0.97 -0.94 -3.33 0.00 0.00 175.10 172.22 2dqg s SER 52 N 0.80 4.77 0.53 3.54 1.04 -0.37 -2.02 113.70 122.00 2dqg s SER 52 Ca -0.09 0.22 0.27 0.00 0.48 0.00 0.00 55.95 56.84 2dqg s SER 52 Cb -0.16 -0.86 1.43 0.00 0.10 0.00 0.00 66.02 66.53 2dqg s SER 52 CO -0.00 -1.58 1.96 2.19 0.98 0.00 0.00 173.24 176.79 2dqg h PHE 53 N -0.48 0.00 -0.00 5.02 -0.00 -1.89 0.33 116.94 119.91 2dqg h PHE 53 Ca -0.43 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.54 2dqg h PHE 53 Cb 1.30 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.25 2dqg h PHE 53 CO 0.19 0.00 -0.03 -1.13 -0.00 0.00 0.00 178.31 177.34 2dqg n SER 54 N -4.34 0.28 0.00 -0.68 3.41 -1.26 -4.88 113.62 106.15 2dqg n SER 54 Ca 0.13 -0.78 0.00 0.00 -0.26 0.00 0.00 58.87 57.96 2dqg n SER 54 Cb 0.73 -0.08 0.00 0.00 -0.26 0.00 0.00 64.21 64.60 2dqg n SER 54 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dqg n GLY 55 N 1.15 1.30 3.76 5.00 0.00 0.11 -5.03 105.19 111.48 2dqg n GLY 55 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 2dqg n GLY 55 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dqg s SER 56 N -2.97 5.36 0.21 1.61 1.04 -1.26 -4.73 113.70 112.96 2dqg s SER 56 Ca 0.00 2.28 0.09 0.00 0.48 0.00 0.00 55.95 58.80 2dqg s SER 56 Cb 0.00 -2.59 -0.05 0.00 0.10 0.00 0.00 66.02 63.49 2dqg s SER 56 CO 0.00 -1.47 -0.17 0.42 0.98 0.00 0.00 173.24 173.00 2dqg s THR 57 N -1.73 1.95 -0.08 2.02 -4.23 -1.26 -1.24 115.64 111.07 2dqg s THR 57 Ca 0.75 -2.14 -0.02 0.00 -1.18 0.00 0.00 61.69 59.10 2dqg s THR 57 Cb -0.27 -2.03 0.03 0.00 1.34 0.00 0.00 72.50 71.57 2dqg s THR 57 CO 0.32 -0.43 0.02 -0.31 -0.54 0.00 0.00 174.62 173.67 2dqg s TYR 58 N -2.49 0.54 0.05 3.99 2.02 -0.80 -5.02 117.35 115.63 2dqg s TYR 58 Ca 0.22 -0.14 0.07 0.00 -0.37 0.00 0.00 57.07 56.85 2dqg s TYR 58 Cb -0.04 -0.74 -0.03 0.00 -0.40 0.00 0.00 41.96 40.75 2dqg s TYR 58 CO 0.09 -0.33 -0.17 0.71 -1.57 0.00 0.00 175.55 174.28 2dqg s TYR 59 N 2.02 2.59 -0.12 2.71 2.02 -1.26 -2.07 117.35 123.23 2dqg s TYR 59 Ca 0.04 -0.24 -0.29 0.00 -0.37 0.00 0.00 57.07 56.21 2dqg s TYR 59 Cb -0.13 -1.46 -0.03 0.00 -0.40 0.00 0.00 41.96 39.95 2dqg s TYR 59 CO -0.05 0.29 1.39 1.21 -1.57 0.00 0.00 175.55 176.82 2dqg s ASN 60 N -1.56 6.85 0.51 2.29 3.84 0.01 -4.88 114.94 121.99 2dqg s ASN 60 Ca 0.16 1.88 0.33 0.00 0.21 0.00 0.00 52.86 55.44 2dqg s ASN 60 Cb -0.11 -2.54 1.46 0.00 -0.55 0.00 0.00 41.25 39.52 2dqg s ASN 60 CO 0.06 -0.81 1.78 -0.65 -2.79 0.00 0.00 177.10 174.69 2dqg h PRO 61 N 8.62 0.08 -0.39 0.43 0.11 -1.94 0.25 132.00 139.17 2dqg h PRO 61 Ca -0.31 -0.01 0.11 0.00 0.11 0.00 0.00 66.00 65.91 2dqg h PRO 61 Cb 1.13 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 2dqg h PRO 61 CO 0.96 0.06 0.39 0.66 -0.21 0.00 0.00 178.00 179.86 2dqg h SER 62 N 0.09 0.00 -0.00 -2.05 4.64 -1.97 0.23 113.55 114.49 2dqg h SER 62 Ca 0.60 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.92 2dqg h SER 62 Cb 2.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.27 2dqg h SER 62 CO -0.09 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.05 2dqg n LEU 63 N -3.83 0.06 -3.94 5.97 4.77 0.87 -4.91 117.00 115.99 2dqg n LEU 63 Ca 0.07 -0.02 -0.31 0.00 -0.03 0.00 0.00 56.01 55.71 2dqg n LEU 63 Cb 0.56 -0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.62 2dqg n LEU 63 CO 0.29 0.01 -0.07 0.29 -1.33 0.00 0.00 177.39 176.58 2dqg n LYS 64 N -0.85 -2.43 -2.08 3.23 4.76 0.82 -1.18 118.16 120.43 2dqg n LYS 64 Ca 0.19 0.28 -0.17 0.00 -2.87 0.00 0.00 58.31 55.74 2dqg n LYS 64 Cb 0.10 -4.94 -0.03 0.00 -1.84 0.00 0.00 35.03 28.32 2dqg n LYS 64 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 2dqg n SER 65 N -2.38 -4.99 -0.24 4.39 7.64 -1.26 -4.87 113.62 111.90 2dqg n SER 65 Ca 0.06 0.11 0.12 0.00 1.01 0.00 0.00 58.87 60.17 2dqg n SER 65 Cb 0.49 -4.06 0.15 0.00 -1.01 0.00 0.00 64.21 59.79 2dqg n SER 65 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2dqg n ARG 66 N -2.59 0.68 -3.59 1.43 1.74 -0.33 -4.95 116.66 109.06 2dqg n ARG 66 Ca -0.19 -0.49 -0.29 0.00 -0.77 0.00 0.00 57.85 56.11 2dqg n ARG 66 Cb 0.62 -1.49 -0.04 0.00 -1.02 0.00 0.00 32.46 30.54 2dqg n ARG 66 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 2dqg s ILE 67 N -2.66 5.14 -0.15 0.55 2.07 -1.26 -0.80 121.20 124.09 2dqg s ILE 67 Ca 0.18 -0.13 -0.11 0.00 -1.41 0.00 0.00 60.65 59.18 2dqg s ILE 67 Cb 0.18 -3.70 0.05 0.00 0.13 0.00 0.00 42.46 39.12 2dqg s ILE 67 CO 0.62 -0.15 0.39 -0.55 -1.91 0.00 0.00 174.94 173.34 2dqg s SER 68 N -2.95 -0.45 -0.15 4.50 0.15 -0.38 -4.99 113.70 109.42 2dqg s SER 68 Ca 0.41 0.81 -0.00 0.00 0.70 0.00 0.00 55.95 57.87 2dqg s SER 68 Cb -0.11 0.75 0.04 0.00 -1.71 0.00 0.00 66.02 64.98 2dqg s SER 68 CO 0.28 -0.17 -0.07 -0.63 1.20 0.00 0.00 173.24 173.85 2dqg s ILE 69 N 0.89 1.17 0.33 6.45 1.01 -1.26 -0.79 121.20 129.00 2dqg s ILE 69 Ca -0.06 -0.57 0.07 0.00 0.00 0.00 0.00 60.65 60.09 2dqg s ILE 69 Cb -0.06 -1.28 -0.07 0.00 0.01 0.00 0.00 42.46 41.07 2dqg s ILE 69 CO -0.07 0.22 -0.03 0.42 0.00 0.00 0.00 174.94 175.48 2dqg s THR 70 N 1.62 1.75 0.13 2.92 -4.23 -1.18 -4.94 115.64 111.71 2dqg s THR 70 Ca 0.02 -2.09 0.09 0.00 -1.18 0.00 0.00 61.69 58.53 2dqg s THR 70 Cb -0.14 -2.68 -0.04 0.00 1.34 0.00 0.00 72.50 70.98 2dqg s THR 70 CO -0.08 -0.16 -0.22 -0.13 -0.54 0.00 0.00 174.62 173.50 2dqg s ARG 71 N -3.73 1.24 -0.36 3.99 0.52 -1.26 -0.80 118.95 118.54 2dqg s ARG 71 Ca 0.33 -1.29 0.00 0.00 -0.52 0.00 0.00 55.73 54.25 2dqg s ARG 71 Cb 0.06 -1.51 0.12 0.00 0.52 0.00 0.00 34.95 34.14 2dqg s ARG 71 CO 0.15 0.34 0.17 0.34 0.02 0.00 0.00 175.30 176.32 2dqg s ASP 72 N -2.18 3.69 0.12 0.23 -1.08 -0.35 -5.00 116.67 112.10 2dqg s ASP 72 Ca 0.11 -2.07 -0.28 0.00 -0.52 0.00 0.00 52.55 49.79 2dqg s ASP 72 Cb -0.09 -0.82 -0.07 0.00 -1.46 0.00 0.00 42.92 40.49 2dqg s ASP 72 CO 0.06 -0.35 1.61 0.74 0.52 0.00 0.00 175.17 177.75 2dqg h THR 73 N 5.79 0.26 -0.80 1.71 2.02 -1.97 -0.18 112.91 119.73 2dqg h THR 73 Ca -0.06 0.00 0.19 0.00 0.77 0.00 0.00 66.41 67.30 2dqg h THR 73 Cb 0.98 0.26 -0.12 0.00 -1.74 0.00 0.00 68.15 67.52 2dqg h THR 73 CO 0.44 0.00 0.24 0.77 0.37 0.00 0.00 175.52 177.34 2dqg h SER 74 N -0.52 0.10 0.34 4.18 4.64 -1.96 0.21 113.55 120.54 2dqg h SER 74 Ca 0.05 0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 2dqg h SER 74 Cb 0.59 0.19 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 2dqg h SER 74 CO -0.27 -0.04 -0.16 0.29 -0.87 0.00 0.00 176.83 175.78 2dqg n LYS 75 N -5.13 0.71 -3.78 4.77 5.02 -1.04 -4.96 118.16 113.75 2dqg n LYS 75 Ca 0.17 -0.31 -0.31 0.00 -2.02 0.00 0.00 58.31 55.84 2dqg n LYS 75 Cb 0.54 -1.49 0.03 0.00 -0.02 0.00 0.00 35.03 34.08 2dqg n LYS 75 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2dqg n ASN 76 N -0.87 -3.92 -3.51 4.39 2.85 0.75 -4.86 115.26 110.08 2dqg n ASN 76 Ca 0.13 -1.03 -0.15 0.00 -0.11 0.00 0.00 54.58 53.42 2dqg n ASN 76 Cb 0.30 -3.17 -0.05 0.00 1.24 0.00 0.00 39.78 38.10 2dqg n ASN 76 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2dqg s GLN 77 N -6.24 1.11 0.35 1.20 -2.07 -1.08 -2.65 119.66 110.28 2dqg s GLN 77 Ca 0.35 -0.14 0.06 0.00 -1.82 0.00 0.00 55.36 53.81 2dqg s GLN 77 Cb -0.13 0.51 -0.07 0.00 -1.09 0.00 0.00 33.01 32.23 2dqg s GLN 77 CO 0.88 -0.41 0.02 1.52 -1.32 0.00 0.00 175.29 175.98 2dqg s TYR 78 N -2.40 2.20 0.28 9.60 1.13 -0.84 -1.21 117.35 126.12 2dqg s TYR 78 Ca -0.05 -0.80 0.02 0.00 -1.41 0.00 0.00 57.07 54.83 2dqg s TYR 78 Cb -0.01 -1.47 -0.04 0.00 -1.10 0.00 0.00 41.96 39.34 2dqg s TYR 78 CO -0.01 0.23 0.12 0.71 -2.51 0.00 0.00 175.55 174.10 2dqg s TYR 79 N -3.01 1.55 -0.05 -3.49 2.02 0.01 -0.78 117.35 113.60 2dqg s TYR 79 Ca 0.35 -1.27 0.00 0.00 -0.37 0.00 0.00 57.07 55.78 2dqg s TYR 79 Cb 0.08 -0.87 0.02 0.00 -0.40 0.00 0.00 41.96 40.80 2dqg s TYR 79 CO 0.16 -0.43 -0.03 -1.17 -1.57 0.00 0.00 175.55 172.51 2dqg s LEU 80 N -3.34 1.16 -0.10 -1.29 2.96 -0.63 -3.09 118.68 114.36 2dqg s LEU 80 Ca 0.37 -0.12 0.03 0.00 -0.22 0.00 0.00 54.13 54.19 2dqg s LEU 80 Cb 0.06 -0.45 0.00 0.00 0.50 0.00 0.00 46.19 46.31 2dqg s LEU 80 CO 0.15 -0.09 -0.21 -1.81 -1.32 0.00 0.00 176.35 173.07 2dqg s ASP 81 N 1.17 2.78 -0.19 3.68 1.01 0.03 -1.31 116.67 123.82 2dqg s ASP 81 Ca -0.07 -0.50 -0.00 0.00 0.71 0.00 0.00 52.55 52.68 2dqg s ASP 81 Cb -0.14 -1.27 0.05 0.00 1.01 0.00 0.00 42.92 42.57 2dqg s ASP 81 CO -0.01 0.12 -0.04 -0.22 0.21 0.00 0.00 175.17 175.23 2dqg s LEU 82 N 0.47 1.88 0.53 1.23 2.96 0.11 -1.25 118.68 124.61 2dqg s LEU 82 Ca -0.17 -0.87 -0.11 0.00 -0.22 0.00 0.00 54.13 52.76 2dqg s LEU 82 Cb -0.17 -0.96 -0.05 0.00 0.50 0.00 0.00 46.19 45.51 2dqg s LEU 82 CO 0.07 -0.22 0.93 0.20 -1.32 0.00 0.00 176.35 176.01 2dqg s ASN 83 N 1.59 6.39 -1.27 3.68 0.01 0.02 -0.74 114.94 124.62 2dqg s ASN 83 Ca -0.02 1.32 -0.28 0.00 -0.71 0.00 0.00 52.86 53.18 2dqg s ASN 83 Cb -0.17 -2.42 0.04 0.00 0.41 0.00 0.00 41.25 39.12 2dqg s ASN 83 CO -0.07 -0.66 0.52 -1.20 -1.51 0.00 0.00 177.10 174.18 2dqg n SER 84 N -2.11 -2.95 -4.76 -1.22 7.64 -1.09 -4.90 113.62 104.24 2dqg n SER 84 Ca 0.05 -1.29 -0.33 0.00 1.01 0.00 0.00 58.87 58.30 2dqg n SER 84 Cb 0.54 -1.56 0.06 0.00 -1.01 0.00 0.00 64.21 62.24 2dqg n SER 84 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 2dqg s VAL 85 N -3.73 3.01 0.35 0.44 -7.23 -0.84 -4.54 120.40 107.86 2dqg s VAL 85 Ca 0.39 0.48 0.03 0.00 -1.81 0.00 0.00 61.98 61.07 2dqg s VAL 85 Cb -0.22 -3.00 -0.04 0.00 0.56 0.00 0.00 36.38 33.68 2dqg s VAL 85 CO 0.97 -0.28 0.12 0.42 -0.31 0.00 0.00 175.10 176.02 2dqg s THR 86 N -2.25 0.67 0.19 5.32 -4.23 -1.26 0.12 115.64 114.20 2dqg s THR 86 Ca 0.69 -2.00 0.31 0.00 -1.18 0.00 0.00 61.69 59.50 2dqg s THR 86 Cb -0.23 -2.52 0.31 0.00 1.34 0.00 0.00 72.50 71.40 2dqg s THR 86 CO 0.42 0.00 1.93 0.71 -0.54 0.00 0.00 174.62 177.14 2dqg h THR 87 N 2.02 0.00 0.00 3.99 1.35 -1.98 0.15 112.91 118.44 2dqg h THR 87 Ca -0.36 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.50 2dqg h THR 87 Cb 1.26 0.68 0.00 0.00 -1.73 0.00 0.00 68.15 68.36 2dqg h THR 87 CO 0.59 0.00 0.00 -0.33 -0.25 0.00 0.00 175.52 175.53 2dqg h GLU 88 N 0.00 0.00 -0.29 4.72 3.07 -1.94 -2.39 114.58 117.75 2dqg h GLU 88 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2dqg h GLU 88 Cb 0.07 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.98 2dqg h GLU 88 CO 0.00 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 177.36 2dqg n ASP 89 N -2.46 2.53 -4.68 1.42 8.00 0.52 -4.89 116.55 116.99 2dqg n ASP 89 Ca 0.01 -1.86 -0.42 0.00 0.71 0.00 0.00 54.79 53.23 2dqg n ASP 89 Cb 0.23 -0.19 -0.03 0.00 -0.02 0.00 0.00 41.12 41.11 2dqg n ASP 89 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2dqg s THR 90 N -1.63 3.68 -0.04 -3.53 2.01 -0.90 -4.83 115.64 110.40 2dqg s THR 90 Ca 0.35 0.99 -0.30 0.00 0.31 0.00 0.00 61.69 63.04 2dqg s THR 90 Cb 0.20 -3.64 0.11 0.00 0.01 0.00 0.00 72.50 69.18 2dqg s THR 90 CO 0.28 -0.04 1.33 0.00 -0.69 0.00 0.00 174.62 175.51 2dqg s ALA 91 N 3.00 -2.48 -0.29 7.40 0.00 -0.84 -4.40 121.76 124.15 2dqg s ALA 91 Ca 0.66 0.39 -0.15 0.00 0.00 0.00 0.00 51.96 52.87 2dqg s ALA 91 Cb -0.31 0.65 -0.03 0.00 0.00 0.00 0.00 23.12 23.42 2dqg s ALA 91 CO 0.26 -1.12 0.37 0.99 0.00 0.00 0.00 175.76 176.27 2dqg s THR 92 N -2.11 5.17 -0.04 0.00 2.01 -0.22 -1.08 115.64 119.36 2dqg s THR 92 Ca 0.23 0.42 -0.13 0.00 0.31 0.00 0.00 61.69 62.53 2dqg s THR 92 Cb 0.02 -3.73 -0.05 0.00 0.01 0.00 0.00 72.50 68.75 2dqg s THR 92 CO -0.03 0.09 0.33 -0.31 -0.69 0.00 0.00 174.62 174.01 2dqg s TYR 93 N 2.06 3.68 0.01 4.92 1.51 0.11 -0.34 117.35 129.30 2dqg s TYR 93 Ca 0.14 0.85 0.04 0.00 -1.01 0.00 0.00 57.07 57.09 2dqg s TYR 93 Cb -0.16 -2.20 -0.01 0.00 -0.11 0.00 0.00 41.96 39.48 2dqg s TYR 93 CO 0.11 0.65 -0.13 0.71 -1.11 0.00 0.00 175.55 175.78 2dqg s TYR 94 N -0.97 1.11 0.05 2.71 1.51 0.23 -0.26 117.35 121.73 2dqg s TYR 94 Ca 0.21 -0.27 0.05 0.00 -1.01 0.00 0.00 57.07 56.04 2dqg s TYR 94 Cb -0.15 -0.69 -0.04 0.00 -0.11 0.00 0.00 41.96 40.97 2dqg s TYR 94 CO 0.10 0.00 -0.07 0.00 -1.11 0.00 0.00 175.55 174.47 2dqg s ALA 96 N -1.11 -1.71 0.73 0.00 0.00 -0.92 -0.48 121.76 118.27 2dqg s ALA 96 Ca 0.20 0.92 -0.11 0.00 0.00 0.00 0.00 51.96 52.97 2dqg s ALA 96 Cb -0.11 0.41 0.03 0.00 0.00 0.00 0.00 23.12 23.45 2dqg s ALA 96 CO 0.11 -0.60 1.07 0.54 0.00 0.00 0.00 175.76 176.89 2dqg s ASN 97 N -2.09 5.03 0.26 0.00 6.03 -0.51 -0.08 114.94 123.57 2dqg s ASN 97 Ca -0.02 1.70 -0.04 0.00 -1.03 0.00 0.00 52.86 53.47 2dqg s ASN 97 Cb -0.01 -2.51 0.35 0.00 -3.03 0.00 0.00 41.25 36.06 2dqg s ASN 97 CO -0.04 -1.68 1.89 -0.25 -2.03 0.00 0.00 177.10 174.99 2dqg h TRP 98 N -0.88 1.19 0.00 1.54 7.01 -1.58 -1.67 115.95 121.56 2dqg h TRP 98 Ca -0.44 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 60.59 2dqg h TRP 98 Cb 1.22 -0.39 -0.00 0.00 -2.10 0.00 0.00 29.16 27.88 2dqg h TRP 98 CO 0.60 0.65 -0.03 -0.44 -2.79 0.00 0.00 178.44 176.44 2dqg h ASP 99 N 1.20 0.00 0.00 2.65 3.45 -1.92 -3.46 116.42 118.33 2dqg h ASP 99 Ca 0.41 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.87 2dqg h ASP 99 Cb 0.08 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.85 2dqg h ASP 99 CO -0.15 0.03 0.00 0.61 -1.57 0.00 0.00 179.24 178.16 2dqg n GLY 100 N -1.34 0.75 0.12 2.75 0.00 -0.63 -4.94 105.19 101.90 2dqg n GLY 100 Ca -0.03 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.01 2dqg n GLY 100 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2dqg h ASP 101 N 0.00 0.00 -3.29 1.61 5.19 -1.90 -3.44 116.42 114.59 2dqg h ASP 101 Ca 0.00 0.00 -0.66 0.00 -0.62 0.00 0.00 57.03 55.75 2dqg h ASP 101 Cb 0.00 0.00 -0.30 0.00 0.18 0.00 0.00 39.33 39.21 2dqg h ASP 101 CO 0.00 0.53 -0.77 -0.31 -3.12 0.00 0.00 179.24 175.57 2dqg s TYR 102 N -2.95 2.90 0.13 4.55 2.02 -1.26 -5.03 117.35 117.70 2dqg s TYR 102 Ca 0.02 -1.16 0.08 0.00 -0.37 0.00 0.00 57.07 55.63 2dqg s TYR 102 Cb 0.08 -2.04 -0.04 0.00 -0.40 0.00 0.00 41.96 39.56 2dqg s TYR 102 CO 0.77 -0.63 -0.20 -1.58 -1.57 0.00 0.00 175.55 172.35 2dqg s TRP 103 N 1.40 1.80 0.38 2.71 0.52 -1.26 -1.43 118.94 123.06 2dqg s TRP 103 Ca 0.05 -0.44 -0.05 0.00 0.02 0.00 0.00 56.10 55.68 2dqg s TRP 103 Cb -0.14 -0.95 0.08 0.00 -1.15 0.00 0.00 33.47 31.32 2dqg s TRP 103 CO -0.06 0.26 0.51 0.41 0.02 0.00 0.00 176.95 178.08 2dqg n GLY 104 N 0.76 -0.88 0.16 0.98 0.00 0.37 -4.47 105.19 102.10 2dqg n GLY 104 Ca -0.17 -1.75 0.12 0.00 0.00 0.00 0.00 46.02 44.23 2dqg n GLY 104 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 2dqg h GLN 105 N 0.00 0.00 0.00 1.61 3.07 -1.89 -3.46 115.11 114.44 2dqg h GLN 105 Ca -0.17 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.57 2dqg h GLN 105 Cb 0.48 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.04 2dqg h GLN 105 CO 0.13 0.00 0.00 0.41 0.09 0.00 0.00 178.83 179.46 2dqg n GLY 106 N 1.21 -1.41 2.89 0.06 0.00 -1.26 -5.05 105.19 101.64 2dqg n GLY 106 Ca 0.04 -1.35 -0.14 0.00 0.00 0.00 0.00 46.02 44.57 2dqg n GLY 106 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2dqg s THR 107 N -2.40 -0.10 0.10 2.61 -1.32 0.64 -4.91 115.64 110.26 2dqg s THR 107 Ca 0.00 0.22 -0.30 0.00 -1.21 0.00 0.00 61.69 60.40 2dqg s THR 107 Cb 0.00 -0.24 -0.06 0.00 -1.51 0.00 0.00 72.50 70.68 2dqg s THR 107 CO 0.00 0.09 1.20 -0.22 -2.21 0.00 0.00 174.62 173.48 2dqg s LEU 108 N 1.43 4.40 -0.17 9.08 2.96 -1.26 -0.72 118.68 134.40 2dqg s LEU 108 Ca -0.06 2.08 0.00 0.00 -0.22 0.00 0.00 54.13 55.93 2dqg s LEU 108 Cb -0.12 -3.59 0.04 0.00 0.50 0.00 0.00 46.19 43.02 2dqg s LEU 108 CO -0.06 -0.44 -0.09 -0.69 -1.32 0.00 0.00 176.35 173.76 2dqg s VAL 109 N 0.74 1.35 -0.21 1.68 1.01 -0.24 -4.57 120.40 120.15 2dqg s VAL 109 Ca 0.57 -0.72 -0.08 0.00 0.00 0.00 0.00 61.98 61.75 2dqg s VAL 109 Cb -0.30 -1.43 -0.04 0.00 0.00 0.00 0.00 36.38 34.60 2dqg s VAL 109 CO 0.31 0.22 0.08 -0.89 0.00 0.00 0.00 175.10 174.82 2dqg s THR 110 N 1.54 4.77 -0.26 3.92 2.01 0.18 -1.99 115.64 125.80 2dqg s THR 110 Ca 0.01 -0.03 -0.14 0.00 0.31 0.00 0.00 61.69 61.84 2dqg s THR 110 Cb -0.15 -3.19 -0.04 0.00 0.01 0.00 0.00 72.50 69.13 2dqg s THR 110 CO -0.08 0.40 0.32 -0.69 -0.69 0.00 0.00 174.62 173.88 2dqg s VAL 111 N 0.86 5.22 -0.03 3.82 1.01 -1.26 -1.64 120.40 128.38 2dqg s VAL 111 Ca 0.04 0.48 -0.20 0.00 0.00 0.00 0.00 61.98 62.30 2dqg s VAL 111 Cb -0.13 -3.65 0.04 0.00 0.00 0.00 0.00 36.38 32.63 2dqg s VAL 111 CO 0.03 0.20 0.45 -0.55 0.00 0.00 0.00 175.10 175.22 2dqg s SER 112 N 1.56 -0.37 0.00 3.32 0.15 -0.53 -4.54 113.70 113.29 2dqg s SER 112 Ca 0.13 0.35 0.07 0.00 0.70 0.00 0.00 55.95 57.20 2dqg s SER 112 Cb -0.16 0.42 0.43 0.00 -1.71 0.00 0.00 66.02 65.01 2dqg s SER 112 CO 0.10 -0.49 0.87 0.00 1.20 0.00 0.00 173.24 174.91 2dqg n ALA 113 N 1.23 1.79 0.31 5.45 0.00 -1.26 -4.14 120.51 123.89 2dqg n ALA 113 Ca -0.20 -0.05 0.04 0.00 0.00 0.00 0.00 53.44 53.23 2dqg n ALA 113 Cb 0.56 -1.12 0.03 0.00 0.00 0.00 0.00 19.45 18.93 2dqg n ALA 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50