#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dig n SER 2 N 0.00 2.85 -0.40 1.61 2.88 -1.26 -4.85 113.62 114.45 2dig n SER 2 Ca 0.00 1.05 -0.07 0.00 -1.33 0.00 0.00 58.87 58.52 2dig n SER 2 Cb 0.00 -1.32 -0.04 0.00 -0.75 0.00 0.00 64.21 62.10 2dig n SER 2 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 2dig h SER 3 N 7.10 -1.86 0.00 -3.46 0.87 -2.07 -3.46 113.55 110.67 2dig h SER 3 Ca -0.47 0.32 0.00 0.00 -1.23 0.00 0.00 61.79 60.41 2dig h SER 3 Cb 1.29 0.88 0.00 0.00 -0.44 0.00 0.00 62.40 64.12 2dig h SER 3 CO 0.90 -0.26 0.00 0.61 -0.53 0.00 0.00 176.83 177.56 2dig n GLY 4 N -1.34 0.72 3.42 5.77 0.00 -1.26 -5.06 105.19 107.44 2dig n GLY 4 Ca 0.05 -0.61 -0.58 0.00 0.00 0.00 0.00 46.02 44.89 2dig n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dig n SER 5 N 0.00 -0.02 0.25 1.61 7.64 -1.26 -4.88 113.62 116.96 2dig n SER 5 Ca 0.00 1.13 -0.12 0.00 1.01 0.00 0.00 58.87 60.89 2dig n SER 5 Cb 0.00 -0.90 -0.06 0.00 -1.01 0.00 0.00 64.21 62.24 2dig n SER 5 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2dig h SER 6 N 2.92 -0.58 0.00 6.43 0.02 -2.04 -3.46 113.55 116.83 2dig h SER 6 Ca -0.50 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.42 2dig h SER 6 Cb 1.40 0.15 0.00 0.00 0.14 0.00 0.00 62.40 64.09 2dig h SER 6 CO 0.64 -0.18 0.00 0.61 -1.14 0.00 0.00 176.83 176.76 2dig n GLY 7 N -0.18 -0.21 3.40 -3.77 0.00 -1.26 -5.12 105.19 98.05 2dig n GLY 7 Ca -0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.63 2dig n GLY 7 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2dig s MET 8 N -1.63 1.71 0.02 1.61 0.00 -1.26 -5.10 119.30 114.65 2dig s MET 8 Ca 0.00 -1.18 -0.30 0.00 0.00 0.00 0.00 55.69 54.21 2dig s MET 8 Cb 0.00 -2.01 -0.06 0.00 0.00 0.00 0.00 34.83 32.76 2dig s MET 8 CO 0.00 0.49 1.43 -1.25 0.00 0.00 0.00 175.02 175.69 2dig s PRO 9 N -1.68 4.28 -0.38 3.16 0.04 -1.26 -4.93 135.00 134.22 2dig s PRO 9 Ca 0.14 2.03 0.05 0.00 0.04 0.00 0.00 61.00 63.26 2dig s PRO 9 Cb -0.10 -3.53 0.45 0.00 0.04 0.00 0.00 34.50 31.35 2dig s PRO 9 CO 0.05 -0.58 1.27 0.43 0.04 0.00 0.00 177.00 178.22 2dig n SER 10 N 5.20 5.20 -4.84 6.66 7.64 -1.26 -5.01 113.62 127.20 2dig n SER 10 Ca 0.13 -3.75 -0.35 0.00 1.01 0.00 0.00 58.87 55.91 2dig n SER 10 Cb 0.43 -0.45 -0.06 0.00 -1.01 0.00 0.00 64.21 63.12 2dig n SER 10 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 2dig s ARG 11 N -3.62 3.31 0.27 1.43 3.52 -1.26 -4.97 118.95 117.63 2dig s ARG 11 Ca 0.51 -0.29 0.13 0.00 -0.13 0.00 0.00 55.73 55.96 2dig s ARG 11 Cb 0.42 -3.05 0.94 0.00 -1.56 0.00 0.00 34.95 31.69 2dig s ARG 11 CO -0.04 0.71 1.20 1.17 -0.81 0.00 0.00 175.30 177.54 2dig n LYS 12 N 1.54 -0.05 -4.38 5.12 4.81 -1.26 -3.94 118.16 120.01 2dig n LYS 12 Ca -0.16 1.07 -0.24 0.00 -0.87 0.00 0.00 58.31 58.11 2dig n LYS 12 Cb 0.54 -1.88 -0.17 0.00 0.02 0.00 0.00 35.03 33.54 2dig n LYS 12 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 2dig s PHE 13 N -5.27 1.36 0.24 5.64 0.08 -1.26 -5.06 117.98 113.71 2dig s PHE 13 Ca -0.08 -0.53 -0.22 0.00 0.12 0.00 0.00 56.93 56.23 2dig s PHE 13 Cb 0.25 -1.04 -0.09 0.00 -0.57 0.00 0.00 43.02 41.57 2dig s PHE 13 CO 0.60 -0.31 0.78 0.00 -0.10 0.00 0.00 175.22 176.18 2dig s ALA 14 N 0.92 3.37 -0.13 5.36 0.00 -1.25 -4.97 121.76 125.05 2dig s ALA 14 Ca -0.10 0.27 -0.37 0.00 0.00 0.00 0.00 51.96 51.76 2dig s ALA 14 Cb -0.15 -2.92 -0.14 0.00 0.00 0.00 0.00 23.12 19.91 2dig s ALA 14 CO 0.01 0.29 1.75 -0.25 0.00 0.00 0.00 175.76 177.55 2dig n ASP 15 N 0.79 2.80 0.00 0.00 8.00 -1.26 0.27 116.55 127.14 2dig n ASP 15 Ca -0.02 1.04 0.00 0.00 0.71 0.00 0.00 54.79 56.52 2dig n ASP 15 Cb 0.51 -1.26 0.00 0.00 -0.02 0.00 0.00 41.12 40.35 2dig n ASP 15 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dig n GLY 16 N 4.06 3.09 3.75 0.44 0.00 0.30 -4.99 105.19 111.85 2dig n GLY 16 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.84 2dig n GLY 16 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2dig n GLU 17 N -2.00 2.54 -2.99 1.61 2.13 0.14 -4.27 120.64 117.81 2dig n GLU 17 Ca 0.00 0.89 -0.43 0.00 0.66 0.00 0.00 57.16 58.28 2dig n GLU 17 Cb 0.00 -2.59 -0.05 0.00 0.27 0.00 0.00 31.44 29.06 2dig n GLU 17 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2dig s VAL 18 N -0.98 4.65 0.48 6.31 1.01 -1.26 -1.15 120.40 129.46 2dig s VAL 18 Ca 0.55 0.15 0.02 0.00 0.00 0.00 0.00 61.98 62.70 2dig s VAL 18 Cb -0.50 -4.36 -0.02 0.00 0.00 0.00 0.00 36.38 31.50 2dig s VAL 18 CO 0.62 -0.83 0.04 0.68 0.00 0.00 0.00 175.10 175.60 2dig s VAL 19 N 3.27 1.03 -0.13 2.92 -7.23 0.12 -4.91 120.40 115.48 2dig s VAL 19 Ca 0.26 -2.00 -0.12 0.00 -1.81 0.00 0.00 61.98 58.31 2dig s VAL 19 Cb -0.14 -2.22 -0.05 0.00 0.56 0.00 0.00 36.38 34.53 2dig s VAL 19 CO 0.19 0.00 0.26 -0.13 -0.31 0.00 0.00 175.10 175.11 2dig s ARG 20 N -3.83 4.00 -0.12 4.82 1.81 0.97 -0.02 118.95 126.58 2dig s ARG 20 Ca 0.11 0.07 0.01 0.00 -1.72 0.00 0.00 55.73 54.20 2dig s ARG 20 Cb 0.02 -3.33 0.02 0.00 -0.45 0.00 0.00 34.95 31.20 2dig s ARG 20 CO 0.06 0.45 -0.14 0.20 -0.68 0.00 0.00 175.30 175.19 2dig s GLY 21 N -0.18 1.03 -0.53 -3.53 0.00 -0.48 -0.14 107.32 103.48 2dig s GLY 21 Ca 0.17 -0.74 -0.28 0.00 0.00 0.00 0.00 44.72 43.87 2dig s GLY 21 CO 0.05 0.34 1.51 -1.60 0.00 0.00 0.00 173.10 173.40 2dig s ARG 22 N 1.14 3.24 0.13 2.90 3.52 -1.13 -2.63 118.95 126.12 2dig s ARG 22 Ca -0.04 0.60 -0.21 0.00 -0.13 0.00 0.00 55.73 55.96 2dig s ARG 22 Cb -0.14 -4.16 -0.13 0.00 -1.56 0.00 0.00 34.95 28.96 2dig s ARG 22 CO -0.04 -2.01 0.41 1.87 -0.81 0.00 0.00 175.30 174.73 2dig n TRP 23 N 10.01 -0.28 0.97 5.12 -0.00 -1.09 -4.73 117.44 127.43 2dig n TRP 23 Ca 0.15 0.71 0.05 0.00 -0.00 0.00 0.00 57.50 58.41 2dig n TRP 23 Cb 0.49 -1.43 0.32 0.00 -0.00 0.00 0.00 31.31 30.69 2dig n TRP 23 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 2dig n PRO 24 N 0.76 0.49 -1.99 5.87 -0.04 -1.26 -2.70 135.00 136.12 2dig n PRO 24 Ca 0.13 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.61 2dig n PRO 24 Cb 0.17 -1.35 0.03 0.00 -0.04 0.00 0.00 33.50 32.31 2dig n PRO 24 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2dig n GLY 25 N -0.02 1.29 3.86 0.55 0.00 -1.26 -5.11 105.19 104.49 2dig n GLY 25 Ca 0.08 -0.89 -0.03 0.00 0.00 0.00 0.00 46.02 45.17 2dig n GLY 25 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dig s SER 26 N -2.62 -0.02 -0.29 1.61 0.15 -1.10 -5.05 113.70 106.39 2dig s SER 26 Ca 0.30 -0.66 0.08 0.00 0.70 0.00 0.00 55.95 56.37 2dig s SER 26 Cb 0.36 0.52 0.47 0.00 -1.71 0.00 0.00 66.02 65.65 2dig s SER 26 CO -0.12 -1.02 1.37 -1.54 1.20 0.00 0.00 173.24 173.13 2dig n SER 27 N -1.12 2.97 -4.27 5.45 3.41 -1.26 -4.54 113.62 114.26 2dig n SER 27 Ca -0.04 -3.82 -0.25 0.00 -0.26 0.00 0.00 58.87 54.50 2dig n SER 27 Cb 0.60 -0.57 -0.13 0.00 -0.26 0.00 0.00 64.21 63.85 2dig n SER 27 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2dig s LEU 28 N -3.35 2.23 -0.11 1.04 1.43 -1.26 -5.05 118.68 113.61 2dig s LEU 28 Ca 0.45 -0.61 -0.05 0.00 -1.03 0.00 0.00 54.13 52.90 2dig s LEU 28 Cb 0.40 -0.94 -0.04 0.00 0.03 0.00 0.00 46.19 45.65 2dig s LEU 28 CO -0.02 0.11 0.06 -0.31 0.23 0.00 0.00 176.35 176.43 2dig s TYR 29 N -0.98 3.35 0.25 0.29 1.51 -1.26 -2.67 117.35 117.83 2dig s TYR 29 Ca 0.07 0.31 0.06 0.00 -1.01 0.00 0.00 57.07 56.50 2dig s TYR 29 Cb -0.09 -1.89 -0.05 0.00 -0.11 0.00 0.00 41.96 39.81 2dig s TYR 29 CO 0.03 0.53 -0.07 0.71 -1.11 0.00 0.00 175.55 175.64 2dig s TYR 30 N -0.76 1.79 -0.29 2.71 2.02 -1.08 -4.88 117.35 116.86 2dig s TYR 30 Ca 0.12 -0.72 -0.29 0.00 -0.37 0.00 0.00 57.07 55.82 2dig s TYR 30 Cb -0.12 -0.98 -0.01 0.00 -0.40 0.00 0.00 41.96 40.45 2dig s TYR 30 CO 0.03 0.23 1.43 -2.00 -1.57 0.00 0.00 175.55 173.66 2dig s GLU 31 N -3.74 3.82 0.10 -0.62 2.12 -1.26 -1.38 118.70 117.74 2dig s GLU 31 Ca 0.27 1.35 0.03 0.00 0.36 0.00 0.00 54.97 56.98 2dig s GLU 31 Cb 0.03 -3.96 -0.04 0.00 0.26 0.00 0.00 34.13 30.43 2dig s GLU 31 CO 0.10 -1.25 -0.08 0.14 -0.54 0.00 0.00 175.26 173.62 2dig s VAL 32 N 4.83 0.83 0.09 3.70 -7.23 0.96 -4.60 120.40 118.99 2dig s VAL 32 Ca 0.62 -1.74 0.02 0.00 -1.81 0.00 0.00 61.98 59.08 2dig s VAL 32 Cb -0.19 -1.46 -0.04 0.00 0.56 0.00 0.00 36.38 35.25 2dig s VAL 32 CO 0.26 -0.68 0.13 -0.70 -0.31 0.00 0.00 175.10 173.80 2dig s GLU 33 N -3.17 3.05 -0.18 4.82 2.12 -0.77 0.14 118.70 124.70 2dig s GLU 33 Ca 0.08 -0.64 -0.23 0.00 0.36 0.00 0.00 54.97 54.53 2dig s GLU 33 Cb 0.00 -2.81 -0.02 0.00 0.26 0.00 0.00 34.13 31.56 2dig s GLU 33 CO -0.02 0.56 0.75 0.42 -0.54 0.00 0.00 175.26 176.43 2dig s ILE 34 N -1.48 4.94 -0.27 -3.70 -1.09 -0.30 -1.44 121.20 117.86 2dig s ILE 34 Ca 0.31 1.44 -0.15 0.00 -2.23 0.00 0.00 60.65 60.03 2dig s ILE 34 Cb -0.12 -4.06 -0.13 0.00 -1.58 0.00 0.00 42.46 36.57 2dig s ILE 34 CO 0.24 0.06 -0.27 0.18 -1.23 0.00 0.00 174.94 173.92 2dig n LEU 35 N 5.16 1.96 -3.82 2.97 4.77 0.15 -0.54 117.00 127.65 2dig n LEU 35 Ca 0.02 0.35 -0.06 0.00 -0.03 0.00 0.00 56.01 56.29 2dig n LEU 35 Cb 0.49 -0.84 0.00 0.00 -2.33 0.00 0.00 43.42 40.74 2dig n LEU 35 CO 0.46 0.54 0.60 -0.44 -1.33 0.00 0.00 177.39 177.22 2dig s SER 36 N -7.40 -0.11 -0.10 -1.43 0.01 -1.07 -4.75 113.70 98.85 2dig s SER 36 Ca -0.37 -0.76 -0.02 0.00 1.31 0.00 0.00 55.95 56.11 2dig s SER 36 Cb 0.14 0.68 0.03 0.00 0.21 0.00 0.00 66.02 67.08 2dig s SER 36 CO 0.51 -1.31 0.00 -2.28 0.41 0.00 0.00 173.24 170.57 2dig s HIS 37 N -2.97 0.80 -1.05 2.43 2.46 -1.26 -0.44 115.29 115.25 2dig s HIS 37 Ca 0.14 -0.34 -0.15 0.00 0.47 0.00 0.00 55.06 55.18 2dig s HIS 37 Cb -0.04 -0.88 0.17 0.00 -0.13 0.00 0.00 32.58 31.70 2dig s HIS 37 CO 0.07 -0.40 1.21 -0.51 -2.47 0.00 0.00 174.74 172.65 2dig s ASP 38 N 1.93 6.90 0.51 9.88 1.11 -0.26 -4.85 116.67 131.89 2dig s ASP 38 Ca 0.04 -2.68 0.31 0.00 0.18 0.00 0.00 52.55 50.40 2dig s ASP 38 Cb -0.13 -2.36 1.43 0.00 1.07 0.00 0.00 42.92 42.93 2dig s ASP 38 CO -0.06 -0.79 1.81 0.77 1.18 0.00 0.00 175.17 178.08 2dig h SER 39 N 7.79 0.11 -0.66 0.27 4.64 -1.93 0.50 113.55 124.28 2dig h SER 39 Ca 0.22 0.02 0.10 0.00 -0.47 0.00 0.00 61.79 61.66 2dig h SER 39 Cb 0.95 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 62.92 2dig h SER 39 CO 1.11 0.02 -0.40 0.74 -0.87 0.00 0.00 176.83 177.44 2dig h THR 40 N 0.10 0.10 -0.13 2.95 2.02 -1.95 -2.49 112.91 113.50 2dig h THR 40 Ca 0.55 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.73 2dig h THR 40 Cb 1.99 0.10 0.00 0.00 -1.74 0.00 0.00 68.15 68.50 2dig h THR 40 CO -0.08 0.00 0.00 -0.24 0.37 0.00 0.00 175.52 175.57 2dig n SER 41 N -5.42 2.51 -2.46 4.18 2.88 -0.58 -4.97 113.62 109.76 2dig n SER 41 Ca 0.04 -2.26 -0.18 0.00 -1.33 0.00 0.00 58.87 55.14 2dig n SER 41 Cb 0.36 -0.18 -0.01 0.00 -0.75 0.00 0.00 64.21 63.62 2dig n SER 41 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dig n GLN 42 N -0.34 -2.04 -3.52 -1.46 1.13 0.17 -4.94 117.38 106.38 2dig n GLN 42 Ca 0.08 0.86 -0.39 0.00 -1.94 0.00 0.00 57.00 55.61 2dig n GLN 42 Cb 0.42 -5.52 -0.10 0.00 0.11 0.00 0.00 30.24 25.15 2dig n GLN 42 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2dig s LEU 43 N -5.94 4.19 0.02 1.08 1.43 -0.97 -3.32 118.68 115.17 2dig s LEU 43 Ca 0.02 -0.07 -0.21 0.00 -1.03 0.00 0.00 54.13 52.84 2dig s LEU 43 Cb -0.01 -2.21 -0.06 0.00 0.03 0.00 0.00 46.19 43.95 2dig s LEU 43 CO 0.02 -0.15 0.60 -0.31 0.23 0.00 0.00 176.35 176.75 2dig s TYR 44 N 1.84 3.72 -0.46 0.29 1.51 0.13 -1.10 117.35 123.27 2dig s TYR 44 Ca 0.09 1.24 -0.17 0.00 -1.01 0.00 0.00 57.07 57.22 2dig s TYR 44 Cb -0.16 -2.60 0.05 0.00 -0.11 0.00 0.00 41.96 39.13 2dig s TYR 44 CO 0.11 0.40 0.48 0.99 -1.11 0.00 0.00 175.55 176.42 2dig s THR 45 N -0.41 5.06 0.13 -0.71 2.01 0.41 -0.67 115.64 121.45 2dig s THR 45 Ca 0.31 -0.58 0.08 0.00 0.31 0.00 0.00 61.69 61.81 2dig s THR 45 Cb -0.19 -4.14 -0.04 0.00 0.01 0.00 0.00 72.50 68.14 2dig s THR 45 CO 0.18 -0.58 -0.11 0.68 -0.69 0.00 0.00 174.62 174.10 2dig s VAL 46 N 2.15 3.24 0.07 3.82 -7.23 -1.14 0.34 120.40 121.65 2dig s VAL 46 Ca 0.11 -1.41 0.08 0.00 -1.81 0.00 0.00 61.98 58.95 2dig s VAL 46 Cb -0.20 -2.54 -0.03 0.00 0.56 0.00 0.00 36.38 34.17 2dig s VAL 46 CO 0.11 0.05 -0.20 -0.75 -0.31 0.00 0.00 175.10 174.00 2dig s LYS 47 N -2.37 1.90 0.58 4.82 2.20 -0.52 -1.81 119.74 124.53 2dig s LYS 47 Ca 0.22 -1.09 0.10 0.00 -0.36 0.00 0.00 55.97 54.84 2dig s LYS 47 Cb -0.10 -2.12 0.09 0.00 -1.51 0.00 0.00 37.83 34.18 2dig s LYS 47 CO 0.14 0.51 0.78 0.71 -0.36 0.00 0.00 175.35 177.13 2dig s TYR 48 N -0.99 1.39 0.07 4.03 1.51 0.14 -1.85 117.35 121.64 2dig s TYR 48 Ca 0.15 -0.74 0.28 0.00 -1.01 0.00 0.00 57.07 55.76 2dig s TYR 48 Cb -0.10 -2.20 1.07 0.00 -0.11 0.00 0.00 41.96 40.62 2dig s TYR 48 CO 0.06 -1.15 1.88 1.57 -1.11 0.00 0.00 175.55 176.81 2dig h LYS 49 N 0.19 0.00 -0.37 -0.62 -0.00 -1.88 -2.56 116.57 111.32 2dig h LYS 49 Ca -0.30 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.35 2dig h LYS 49 Cb 1.29 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.52 2dig h LYS 49 CO 0.41 0.11 0.00 -3.47 -0.00 0.00 0.00 179.45 176.50 2dig n ASP 50 N -3.23 1.36 -2.14 7.07 2.03 -1.26 -4.87 116.55 115.51 2dig n ASP 50 Ca 0.01 -2.06 -0.14 0.00 0.52 0.00 0.00 54.79 53.11 2dig n ASP 50 Cb 0.38 -0.24 0.03 0.00 -0.72 0.00 0.00 41.12 40.58 2dig n ASP 50 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2dig n GLY 51 N 0.65 -0.03 3.30 0.27 0.00 -0.97 -5.02 105.19 103.39 2dig n GLY 51 Ca 0.07 -0.17 -0.32 0.00 0.00 0.00 0.00 46.02 45.60 2dig n GLY 51 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dig s THR 52 N -3.03 2.30 0.27 2.61 2.01 -1.26 -4.91 115.64 113.64 2dig s THR 52 Ca 0.26 -0.97 0.09 0.00 0.31 0.00 0.00 61.69 61.38 2dig s THR 52 Cb -0.11 -1.87 -0.04 0.00 0.01 0.00 0.00 72.50 70.49 2dig s THR 52 CO 0.32 0.56 0.02 -1.61 -0.69 0.00 0.00 174.62 173.22 2dig s GLU 53 N -0.08 2.34 0.21 4.92 8.01 -1.26 0.24 118.70 133.08 2dig s GLU 53 Ca -0.05 -1.41 -0.06 0.00 0.01 0.00 0.00 54.97 53.46 2dig s GLU 53 Cb -0.14 -2.19 0.02 0.00 -4.31 0.00 0.00 34.13 27.51 2dig s GLU 53 CO 0.04 0.35 0.38 1.28 0.01 0.00 0.00 175.26 177.32 2dig n LEU 54 N -0.93 0.00 -3.94 1.80 4.77 -0.75 -4.99 117.00 112.95 2dig n LEU 54 Ca -0.06 -1.45 -0.31 0.00 -0.03 0.00 0.00 56.01 54.16 2dig n LEU 54 Cb 0.59 1.86 -0.15 0.00 -2.33 0.00 0.00 43.42 43.38 2dig n LEU 54 CO 0.41 -0.43 -0.40 -1.61 -1.33 0.00 0.00 177.39 174.03 2dig s GLU 55 N -2.17 1.56 -0.07 3.23 2.02 -1.26 -2.90 118.70 119.10 2dig s GLU 55 Ca 0.11 -1.20 0.05 0.00 0.02 0.00 0.00 54.97 53.94 2dig s GLU 55 Cb -0.02 -2.67 -0.01 0.00 0.10 0.00 0.00 34.13 31.53 2dig s GLU 55 CO 0.08 -0.70 -0.22 -0.51 0.02 0.00 0.00 175.26 173.92 2dig s LEU 56 N 1.30 2.23 0.84 1.80 1.43 0.15 -4.83 118.68 121.60 2dig s LEU 56 Ca -0.01 -0.46 -0.10 0.00 -1.03 0.00 0.00 54.13 52.52 2dig s LEU 56 Cb -0.19 -1.43 0.10 0.00 0.03 0.00 0.00 46.19 44.70 2dig s LEU 56 CO -0.09 0.23 1.12 -0.54 0.23 0.00 0.00 176.35 177.30 2dig s LYS 57 N -0.06 1.65 0.48 1.70 1.02 -1.26 0.18 119.74 123.44 2dig s LYS 57 Ca -0.06 1.35 0.26 0.00 0.02 0.00 0.00 55.97 57.54 2dig s LYS 57 Cb -0.14 -1.81 1.30 0.00 -0.52 0.00 0.00 37.83 36.66 2dig s LYS 57 CO 0.05 -2.13 1.86 1.49 -0.92 0.00 0.00 175.35 175.69 2dig h GLU 58 N -1.49 0.18 0.01 1.68 4.81 -1.91 -0.12 114.58 117.74 2dig h GLU 58 Ca -0.43 -0.01 -0.13 0.00 -0.13 0.00 0.00 59.36 58.65 2dig h GLU 58 Cb 1.25 -0.04 0.01 0.00 0.63 0.00 0.00 28.75 30.60 2dig h GLU 58 CO 0.47 0.12 -0.52 -0.97 -0.73 0.00 0.00 179.01 177.37 2dig h ASN 59 N 0.19 0.44 -0.62 1.04 -1.24 -1.91 -3.22 115.58 110.26 2dig h ASN 59 Ca 0.47 -0.78 0.17 0.00 0.71 0.00 0.00 56.30 56.87 2dig h ASN 59 Cb 1.54 -0.14 -0.03 0.00 0.73 0.00 0.00 38.32 40.43 2dig h ASN 59 CO -0.10 1.17 0.44 0.44 -1.29 0.00 0.00 177.43 178.09 2dig h ASP 60 N -0.24 0.04 -3.24 1.15 3.32 -1.37 -3.40 116.42 112.69 2dig h ASP 60 Ca -0.07 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.41 2dig h ASP 60 Cb 1.26 -0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.76 2dig h ASP 60 CO 0.10 0.02 -0.05 -0.63 -1.72 0.00 0.00 179.24 176.96 2dig s ILE 61 N -5.04 4.84 0.11 0.35 1.01 -0.84 -2.83 121.20 118.80 2dig s ILE 61 Ca -0.05 1.17 0.04 0.00 0.00 0.00 0.00 60.65 61.81 2dig s ILE 61 Cb 0.20 -3.88 -0.04 0.00 0.01 0.00 0.00 42.46 38.75 2dig s ILE 61 CO 0.74 0.51 -0.11 -0.54 0.00 0.00 0.00 174.94 175.54 2dig s LYS 62 N -0.74 0.91 -0.04 2.79 -0.14 0.80 -4.93 119.74 118.38 2dig s LYS 62 Ca 0.29 -1.22 -0.16 0.00 -1.36 0.00 0.00 55.97 53.52 2dig s LYS 62 Cb -0.19 -0.60 0.03 0.00 -1.68 0.00 0.00 37.83 35.40 2dig s LYS 62 CO 0.17 0.09 0.35 0.45 -0.76 0.00 0.00 175.35 175.66 2dig s SER 63 N -2.57 -0.27 0.29 2.83 0.15 -1.26 -0.02 113.70 112.84 2dig s SER 63 Ca 0.08 0.27 -0.17 0.00 0.70 0.00 0.00 55.95 56.83 2dig s SER 63 Cb -0.02 0.42 0.06 0.00 -1.71 0.00 0.00 66.02 64.77 2dig s SER 63 CO 0.00 -0.40 0.84 0.61 1.20 0.00 0.00 173.24 175.49 2dig n GLY 64 N 1.55 0.87 3.77 9.45 0.00 -1.26 -5.05 105.19 114.53 2dig n GLY 64 Ca -0.20 -1.20 -0.38 0.00 0.00 0.00 0.00 46.02 44.25 2dig n GLY 64 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dig s PRO 65 N -2.07 3.88 -0.37 1.61 0.04 -1.26 -5.02 135.00 131.81 2dig s PRO 65 Ca 0.18 1.82 -0.02 0.00 0.04 0.00 0.00 61.00 63.02 2dig s PRO 65 Cb -0.04 -2.53 0.09 0.00 0.04 0.00 0.00 34.50 32.07 2dig s PRO 65 CO 0.09 -0.46 0.13 -1.12 0.04 0.00 0.00 177.00 175.67 2dig s SER 66 N -1.24 5.10 -0.32 6.66 0.01 -1.26 -5.04 113.70 117.61 2dig s SER 66 Ca 0.61 -1.81 -0.00 0.00 1.31 0.00 0.00 55.95 56.05 2dig s SER 66 Cb -0.30 -1.78 0.10 0.00 0.21 0.00 0.00 66.02 64.26 2dig s SER 66 CO 0.37 -0.44 0.10 -0.94 0.41 0.00 0.00 173.24 172.74 2dig s SER 67 N 1.55 4.07 0.00 2.44 1.04 -1.26 -5.38 113.70 116.16 2dig s SER 67 Ca 0.05 -1.72 0.00 0.00 0.48 0.00 0.00 55.95 54.75 2dig s SER 67 Cb -0.21 -0.92 0.00 0.00 0.10 0.00 0.00 66.02 64.98 2dig s SER 67 CO -0.04 -0.41 0.00 0.61 0.98 0.00 0.00 173.24 174.39