#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gky s ARG 2 N 0.00 4.21 0.59 1.43 0.52 -1.26 -4.89 118.95 119.55 1gky s ARG 2 Ca 0.00 0.88 -0.20 0.00 -0.52 0.00 0.00 55.73 55.89 1gky s ARG 2 Cb 0.00 -3.61 -0.04 0.00 0.52 0.00 0.00 34.95 31.81 1gky s ARG 2 CO 0.00 -0.41 1.18 -2.30 0.02 0.00 0.00 175.30 173.79 1gky n PRO 3 N 5.61 1.24 -4.21 3.54 -0.02 -1.26 -4.70 135.00 135.19 1gky n PRO 3 Ca 0.04 0.47 -0.34 0.00 -2.02 0.00 0.00 63.50 61.64 1gky n PRO 3 Cb 0.48 -2.39 -0.15 0.00 -0.02 0.00 0.00 33.50 31.43 1gky n PRO 3 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1gky s ILE 4 N -1.39 2.94 -0.25 4.25 1.01 -0.21 -0.81 121.20 126.74 1gky s ILE 4 Ca 0.76 -0.66 -0.15 0.00 0.00 0.00 0.00 60.65 60.60 1gky s ILE 4 Cb -0.42 -2.29 -0.04 0.00 0.01 0.00 0.00 42.46 39.73 1gky s ILE 4 CO 0.46 0.48 0.38 -0.69 0.00 0.00 0.00 174.94 175.57 1gky s VAL 5 N 1.12 5.18 -0.13 2.92 1.01 0.16 -1.01 120.40 129.64 1gky s VAL 5 Ca 0.01 0.60 -0.03 0.00 0.00 0.00 0.00 61.98 62.55 1gky s VAL 5 Cb -0.14 -3.70 -0.03 0.00 0.00 0.00 0.00 36.38 32.50 1gky s VAL 5 CO -0.03 0.18 -0.02 -0.63 0.00 0.00 0.00 175.10 174.60 1gky s ILE 6 N 1.89 4.11 0.25 2.22 1.01 0.31 -1.59 121.20 129.39 1gky s ILE 6 Ca 0.16 -0.30 0.01 0.00 0.00 0.00 0.00 60.65 60.52 1gky s ILE 6 Cb -0.15 -2.77 -0.04 0.00 0.01 0.00 0.00 42.46 39.50 1gky s ILE 6 CO 0.09 0.53 0.14 -0.94 0.00 0.00 0.00 174.94 174.77 1gky s SER 7 N -0.09 0.89 0.00 3.58 1.04 -0.54 -2.62 113.70 115.96 1gky s SER 7 Ca 0.03 -1.47 0.00 0.00 0.48 0.00 0.00 55.95 54.99 1gky s SER 7 Cb -0.13 0.35 0.00 0.00 0.10 0.00 0.00 66.02 66.34 1gky s SER 7 CO 0.02 -0.85 0.00 0.61 0.98 0.00 0.00 173.24 174.00 1gky n GLY 8 N -0.43 3.69 3.75 7.32 0.00 -1.26 -0.75 105.19 117.51 1gky n GLY 8 Ca 0.02 -0.90 -0.38 0.00 0.00 0.00 0.00 46.02 44.76 1gky n GLY 8 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1gky s PRO 9 N -2.41 3.17 0.50 1.61 0.04 -1.26 -4.97 135.00 131.68 1gky s PRO 9 Ca 0.00 2.16 -0.21 0.00 0.04 0.00 0.00 61.00 62.99 1gky s PRO 9 Cb 0.00 -2.24 -0.07 0.00 0.04 0.00 0.00 34.50 32.24 1gky s PRO 9 CO 0.00 -1.14 1.15 -1.12 0.04 0.00 0.00 177.00 175.93 1gky s SER 10 N -1.04 5.93 0.00 6.66 0.01 -1.26 -3.47 113.70 120.53 1gky s SER 10 Ca 0.72 2.25 0.00 0.00 1.31 0.00 0.00 55.95 60.22 1gky s SER 10 Cb -0.39 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.25 1gky s SER 10 CO 0.45 -1.08 0.00 0.61 0.41 0.00 0.00 173.24 173.64 1gky n GLY 11 N 0.31 0.81 0.14 3.44 0.00 -1.26 -4.96 105.19 103.66 1gky n GLY 11 Ca 0.09 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.26 1gky n GLY 11 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1gky n THR 12 N -1.41 0.00 -0.97 2.61 -2.24 -1.23 -4.87 114.28 106.17 1gky n THR 12 Ca 0.00 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 1gky n THR 12 Cb 0.00 -0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.19 1gky n THR 12 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1gky n GLY 13 N 1.27 0.43 0.30 3.38 0.00 -1.26 -4.86 105.19 104.43 1gky n GLY 13 Ca 0.15 -0.81 -0.00 0.00 0.00 0.00 0.00 46.02 45.36 1gky n GLY 13 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1gky h LYS 14 N 0.26 0.67 -0.02 1.61 3.64 -1.89 -2.53 116.57 118.31 1gky h LYS 14 Ca 0.00 -0.11 -0.13 0.00 -1.27 0.00 0.00 60.65 59.14 1gky h LYS 14 Cb 0.00 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.69 1gky h LYS 14 CO 0.00 0.59 -0.59 0.66 -2.27 0.00 0.00 179.45 177.84 1gky h SER 15 N 0.66 0.08 -0.35 4.20 4.64 -1.98 -2.59 113.55 118.20 1gky h SER 15 Ca 0.15 -0.04 -0.15 0.00 -0.47 0.00 0.00 61.79 61.28 1gky h SER 15 Cb 0.20 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.26 1gky h SER 15 CO -0.01 0.65 -0.34 0.74 -0.87 0.00 0.00 176.83 177.01 1gky h THR 16 N 0.05 1.27 -0.50 2.95 2.02 -1.88 -0.47 112.91 116.36 1gky h THR 16 Ca -0.01 -1.50 0.04 0.00 0.77 0.00 0.00 66.41 65.71 1gky h THR 16 Cb 1.06 1.33 -0.04 0.00 -1.74 0.00 0.00 68.15 68.76 1gky h THR 16 CO 0.08 0.50 0.26 -0.07 0.37 0.00 0.00 175.52 176.67 1gky h LEU 17 N 0.74 0.39 -0.46 2.58 3.38 -1.21 -1.17 115.31 119.56 1gky h LEU 17 Ca 0.07 0.02 -0.17 0.00 0.09 0.00 0.00 57.88 57.89 1gky h LEU 17 Cb 0.91 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.60 1gky h LEU 17 CO 0.08 0.27 -0.68 -0.07 0.09 0.00 0.00 178.44 178.13 1gky h LEU 18 N 0.51 0.47 -0.56 1.67 -0.00 -1.32 -2.34 115.31 113.74 1gky h LEU 18 Ca 0.22 -0.29 0.06 0.00 -0.00 0.00 0.00 57.88 57.87 1gky h LEU 18 Cb 0.11 -0.14 -0.06 0.00 -0.00 0.00 0.00 40.66 40.58 1gky h LEU 18 CO -0.14 1.01 0.26 0.50 -0.00 0.00 0.00 178.44 180.08 1gky h LYS 19 N 0.29 0.48 -0.71 1.13 1.63 -0.73 -0.32 116.57 118.33 1gky h LYS 19 Ca -0.02 -0.03 -0.02 0.00 -0.85 0.00 0.00 60.65 59.73 1gky h LYS 19 Cb 1.24 -0.11 -0.03 0.00 -0.60 0.00 0.00 32.23 32.73 1gky h LYS 19 CO 0.12 0.32 0.38 0.87 -3.45 0.00 0.00 179.45 177.68 1gky h LYS 20 N 0.49 1.01 0.39 1.90 1.57 -1.00 -1.60 116.57 119.33 1gky h LYS 20 Ca 0.26 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.91 1gky h LYS 20 Cb 0.22 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 1gky h LYS 20 CO -0.21 0.77 -0.32 1.25 -0.57 0.00 0.00 179.45 180.36 1gky h LEU 21 N 0.99 -0.85 -2.08 2.94 6.46 -0.92 -0.41 115.31 121.44 1gky h LEU 21 Ca 0.25 0.07 -0.01 0.00 -0.12 0.00 0.00 57.88 58.06 1gky h LEU 21 Cb 0.06 0.27 -0.00 0.00 -0.73 0.00 0.00 40.66 40.27 1gky h LEU 21 CO -0.04 -0.47 -0.07 -0.26 -0.62 0.00 0.00 178.44 176.98 1gky h PHE 22 N -0.72 0.00 -0.03 1.25 0.04 -0.98 -0.18 116.94 116.32 1gky h PHE 22 Ca -0.03 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.66 1gky h PHE 22 Cb 0.63 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.78 1gky h PHE 22 CO -0.16 0.07 -0.29 0.00 -0.60 0.00 0.00 178.31 177.33 1gky h ALA 23 N 1.93 0.08 0.01 2.45 0.00 -0.63 -2.93 119.26 120.17 1gky h ALA 23 Ca -0.00 -0.45 -0.21 0.00 0.00 0.00 0.00 54.91 54.25 1gky h ALA 23 Cb 0.29 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1gky h ALA 23 CO 0.01 0.13 -0.93 1.49 0.00 0.00 0.00 179.25 179.95 1gky h GLU 24 N -0.32 0.25 -2.15 0.00 4.81 -0.92 -3.38 114.58 112.87 1gky h GLU 24 Ca -0.03 -0.29 -0.57 0.00 -0.13 0.00 0.00 59.36 58.35 1gky h GLU 24 Cb 0.98 0.09 -0.41 0.00 0.63 0.00 0.00 28.75 30.03 1gky h GLU 24 CO 0.06 1.02 -0.81 0.66 -0.73 0.00 0.00 179.01 179.21 1gky n TYR 25 N -3.66 2.45 0.24 0.92 4.01 -0.09 -4.91 117.16 116.12 1gky n TYR 25 Ca -0.05 -3.94 0.09 0.00 -0.16 0.00 0.00 57.90 53.84 1gky n TYR 25 Cb 0.84 -0.48 0.60 0.00 -0.31 0.00 0.00 39.34 39.99 1gky n TYR 25 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1gky h PRO 26 N 3.56 0.00 -0.08 -0.72 0.13 -1.71 -1.92 132.00 131.26 1gky h PRO 26 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 1gky h PRO 26 Cb 0.70 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.83 1gky h PRO 26 CO 0.71 0.18 0.00 -0.25 -0.23 0.00 0.00 178.00 178.41 1gky n ASP 27 N -3.88 2.69 -0.04 1.44 8.00 -1.26 -4.30 116.55 119.19 1gky n ASP 27 Ca -0.02 -1.88 0.03 0.00 0.71 0.00 0.00 54.79 53.63 1gky n ASP 27 Cb 0.28 -0.04 -0.16 0.00 -0.02 0.00 0.00 41.12 41.17 1gky n ASP 27 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1gky n SER 28 N 1.08 0.09 -4.15 -2.24 7.64 -0.73 -4.84 113.62 110.47 1gky n SER 28 Ca 0.16 0.00 -0.19 0.00 1.01 0.00 0.00 58.87 59.85 1gky n SER 28 Cb 0.54 1.60 -0.13 0.00 -1.01 0.00 0.00 64.21 65.21 1gky n SER 28 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1gky s PHE 29 N -3.10 1.20 -0.02 1.43 0.08 -1.21 -0.93 117.98 115.43 1gky s PHE 29 Ca -0.09 -0.41 0.06 0.00 0.12 0.00 0.00 56.93 56.62 1gky s PHE 29 Cb 0.11 -0.70 -0.01 0.00 -0.57 0.00 0.00 43.02 41.85 1gky s PHE 29 CO 0.86 0.04 -0.20 0.20 -0.10 0.00 0.00 175.22 176.03 1gky s GLY 30 N -1.43 0.97 -0.04 4.36 0.00 -0.35 -4.86 107.32 105.96 1gky s GLY 30 Ca -0.00 -0.84 -0.16 0.00 0.00 0.00 0.00 44.72 43.71 1gky s GLY 30 CO 0.02 -0.66 0.44 -0.12 0.00 0.00 0.00 173.10 172.78 1gky s PHE 31 N -0.39 3.64 -0.14 1.90 5.36 -1.26 -1.92 117.98 125.18 1gky s PHE 31 Ca 0.06 0.96 -0.29 0.00 -0.96 0.00 0.00 56.93 56.70 1gky s PHE 31 Cb -0.08 -2.41 -0.03 0.00 -0.34 0.00 0.00 43.02 40.15 1gky s PHE 31 CO -0.00 0.44 1.53 0.45 -1.46 0.00 0.00 175.22 176.17 1gky s SER 32 N -0.36 6.66 -0.38 6.13 0.15 -0.41 -4.92 113.70 120.58 1gky s SER 32 Ca 0.25 1.89 -0.15 0.00 0.70 0.00 0.00 55.95 58.63 1gky s SER 32 Cb -0.16 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.62 1gky s SER 32 CO 0.12 -0.98 0.36 0.54 1.20 0.00 0.00 173.24 174.48 1gky s VAL 33 N 4.22 5.18 0.64 4.45 0.11 -1.26 -4.76 120.40 128.98 1gky s VAL 33 Ca 0.67 -0.22 -0.15 0.00 -2.93 0.00 0.00 61.98 59.35 1gky s VAL 33 Cb -0.27 -3.89 -0.01 0.00 -1.53 0.00 0.00 36.38 30.68 1gky s VAL 33 CO 0.25 -0.22 1.10 -0.44 -3.33 0.00 0.00 175.10 172.46 1gky s SER 34 N 1.75 5.31 0.18 3.54 0.01 -1.26 -4.61 113.70 118.61 1gky s SER 34 Ca 0.10 1.95 -0.13 0.00 1.31 0.00 0.00 55.95 59.18 1gky s SER 34 Cb -0.17 -2.55 -0.07 0.00 0.21 0.00 0.00 66.02 63.44 1gky s SER 34 CO 0.12 -1.49 0.55 -0.44 0.41 0.00 0.00 173.24 172.39 1gky s SER 35 N -2.63 6.75 0.01 2.44 0.01 -0.53 -0.50 113.70 119.24 1gky s SER 35 Ca 0.66 1.02 -0.19 0.00 1.31 0.00 0.00 55.95 58.75 1gky s SER 35 Cb -0.19 -2.27 0.04 0.00 0.21 0.00 0.00 66.02 63.81 1gky s SER 35 CO 0.40 0.04 0.42 0.28 0.41 0.00 0.00 173.24 174.79 1gky s THR 36 N -1.59 0.05 -2.28 1.44 -1.32 -0.81 -1.43 115.64 109.70 1gky s THR 36 Ca 0.41 -0.39 0.23 0.00 -1.21 0.00 0.00 61.69 60.74 1gky s THR 36 Cb -0.14 -0.84 0.08 0.00 -1.51 0.00 0.00 72.50 70.10 1gky s THR 36 CO 0.20 -0.21 1.19 0.35 -2.21 0.00 0.00 174.62 173.93 1gky n THR 37 N 0.86 0.00 -1.29 5.08 -2.24 -0.49 -1.63 114.28 114.56 1gky n THR 37 Ca -0.20 -0.31 -0.29 0.00 -2.27 0.00 0.00 64.05 60.98 1gky n THR 37 Cb 0.58 1.23 0.14 0.00 -2.10 0.00 0.00 70.33 70.18 1gky n THR 37 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1gky s ARG 38 N -2.34 1.08 0.18 -0.78 1.70 -1.26 -4.88 118.95 112.65 1gky s ARG 38 Ca 0.22 0.61 -0.30 0.00 -0.47 0.00 0.00 55.73 55.79 1gky s ARG 38 Cb 0.19 -1.81 -0.08 0.00 -0.57 0.00 0.00 34.95 32.69 1gky s ARG 38 CO 0.49 -2.31 1.11 0.99 -1.08 0.00 0.00 175.30 174.50 1gky s THR 39 N -3.03 3.83 0.70 4.99 2.01 -1.26 -4.86 115.64 118.02 1gky s THR 39 Ca 0.64 1.59 -0.16 0.00 0.31 0.00 0.00 61.69 64.06 1gky s THR 39 Cb -0.17 -4.01 0.00 0.00 0.01 0.00 0.00 72.50 68.33 1gky s THR 39 CO 0.56 0.28 1.08 -2.65 -0.69 0.00 0.00 174.62 173.20 1gky n PRO 40 N 2.32 0.68 -4.27 4.92 -0.02 -1.26 -5.05 135.00 132.32 1gky n PRO 40 Ca 0.03 0.29 -0.23 0.00 -2.02 0.00 0.00 63.50 61.56 1gky n PRO 40 Cb 0.46 -2.32 -0.07 0.00 -0.02 0.00 0.00 33.50 31.55 1gky n PRO 40 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1gky s ARG 41 N -3.35 2.28 0.12 -0.52 0.52 -1.26 -5.04 118.95 111.69 1gky s ARG 41 Ca 0.76 -1.47 -0.31 0.00 -0.52 0.00 0.00 55.73 54.19 1gky s ARG 41 Cb -0.36 -2.14 -0.10 0.00 0.52 0.00 0.00 34.95 32.87 1gky s ARG 41 CO 0.47 0.30 1.85 0.00 0.02 0.00 0.00 175.30 177.95 1gky s ALA 42 N -2.36 3.75 0.00 2.13 0.00 -1.26 -1.41 121.76 122.61 1gky s ALA 42 Ca 0.33 1.45 0.00 0.00 0.00 0.00 0.00 51.96 53.74 1gky s ALA 42 Cb -0.05 -3.78 0.00 0.00 0.00 0.00 0.00 23.12 19.29 1gky s ALA 42 CO 0.20 -1.27 0.00 0.41 0.00 0.00 0.00 175.76 175.10 1gky n GLY 43 N 4.28 2.75 3.74 0.00 0.00 -1.26 -5.07 105.19 109.64 1gky n GLY 43 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 1gky n GLY 43 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1gky s GLU 44 N -0.65 4.45 -0.21 1.61 2.02 -0.50 -5.04 118.70 120.38 1gky s GLU 44 Ca 0.00 0.97 -0.08 0.00 0.02 0.00 0.00 54.97 55.88 1gky s GLU 44 Cb 0.00 -3.39 -0.04 0.00 0.10 0.00 0.00 34.13 30.80 1gky s GLU 44 CO 0.00 0.21 0.07 0.08 0.02 0.00 0.00 175.26 175.64 1gky s VAL 45 N 0.25 4.71 0.26 2.63 1.01 -1.26 -4.85 120.40 123.16 1gky s VAL 45 Ca 0.38 -0.05 -0.30 0.00 0.00 0.00 0.00 61.98 62.00 1gky s VAL 45 Cb -0.19 -3.15 -0.10 0.00 0.00 0.00 0.00 36.38 32.93 1gky s VAL 45 CO 0.21 0.41 1.50 0.21 0.00 0.00 0.00 175.10 177.43 1gky s ASN 46 N 0.79 6.55 0.00 3.32 2.47 -1.26 -0.76 114.94 126.06 1gky s ASN 46 Ca 0.04 2.76 0.00 0.00 0.42 0.00 0.00 52.86 56.08 1gky s ASN 46 Cb -0.13 -2.63 0.00 0.00 -1.45 0.00 0.00 41.25 37.04 1gky s ASN 46 CO 0.02 -0.78 0.00 0.61 -3.72 0.00 0.00 177.10 173.23 1gky n GLY 47 N 2.26 2.98 0.59 1.21 0.00 0.13 -4.80 105.19 107.56 1gky n GLY 47 Ca 0.08 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.03 1gky n GLY 47 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1gky n LYS 48 N -2.00 0.26 0.09 1.61 5.02 0.06 -4.83 118.16 118.37 1gky n LYS 48 Ca 0.00 0.11 -0.22 0.00 -2.02 0.00 0.00 58.31 56.17 1gky n LYS 48 Cb 0.00 -0.95 -0.13 0.00 -0.02 0.00 0.00 35.03 33.92 1gky n LYS 48 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 1gky h ASP 49 N -0.48 0.82 -5.04 4.39 5.19 -1.35 -3.45 116.42 116.49 1gky h ASP 49 Ca -0.08 -0.84 -0.05 0.00 -0.62 0.00 0.00 57.03 55.44 1gky h ASP 49 Cb 0.68 -0.26 -0.14 0.00 0.18 0.00 0.00 39.33 39.79 1gky h ASP 49 CO -0.05 1.59 0.02 -0.31 -3.12 0.00 0.00 179.24 177.36 1gky s TYR 50 N -2.90 -0.34 -0.37 4.55 2.02 -1.25 -4.46 117.35 114.60 1gky s TYR 50 Ca -0.10 0.14 -0.12 0.00 -0.37 0.00 0.00 57.07 56.62 1gky s TYR 50 Cb 0.05 0.35 0.02 0.00 -0.40 0.00 0.00 41.96 41.97 1gky s TYR 50 CO 0.92 -0.72 0.22 -0.80 -1.57 0.00 0.00 175.55 173.60 1gky s ASN 51 N -2.57 5.82 -0.32 2.29 0.02 0.34 0.22 114.94 120.74 1gky s ASN 51 Ca 0.00 -0.87 -0.22 0.00 -1.02 0.00 0.00 52.86 50.75 1gky s ASN 51 Cb 0.00 -2.06 -0.00 0.00 0.02 0.00 0.00 41.25 39.21 1gky s ASN 51 CO -0.10 -0.37 0.70 -0.36 0.02 0.00 0.00 177.10 177.00 1gky s PHE 52 N 1.60 3.19 0.21 2.20 0.08 -1.26 -1.93 117.98 122.07 1gky s PHE 52 Ca 0.03 0.61 0.09 0.00 0.12 0.00 0.00 56.93 57.79 1gky s PHE 52 Cb -0.19 -3.13 -0.05 0.00 -0.57 0.00 0.00 43.02 39.08 1gky s PHE 52 CO 0.08 -0.56 -0.18 0.14 -0.10 0.00 0.00 175.22 174.60 1gky s VAL 53 N 2.79 2.01 0.98 -0.44 -7.23 -0.65 -4.97 120.40 112.89 1gky s VAL 53 Ca 0.28 -2.17 -0.12 0.00 -1.81 0.00 0.00 61.98 58.16 1gky s VAL 53 Cb -0.14 -2.06 0.18 0.00 0.56 0.00 0.00 36.38 34.91 1gky s VAL 53 CO 0.13 -0.43 1.10 -0.94 -0.31 0.00 0.00 175.10 174.65 1gky s SER 54 N -3.14 2.80 0.26 4.85 1.04 -1.26 -4.26 113.70 114.00 1gky s SER 54 Ca 0.22 1.22 -0.03 0.00 0.48 0.00 0.00 55.95 57.85 1gky s SER 54 Cb -0.04 -1.89 0.32 0.00 0.10 0.00 0.00 66.02 64.51 1gky s SER 54 CO 0.09 -3.02 1.80 0.58 0.98 0.00 0.00 173.24 173.67 1gky h VAL 55 N -1.82 1.24 -0.64 5.02 2.07 -1.95 -1.11 116.25 119.06 1gky h VAL 55 Ca -0.53 -0.84 -0.09 0.00 0.82 0.00 0.00 66.70 66.06 1gky h VAL 55 Cb 1.32 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 31.65 1gky h VAL 55 CO 0.57 0.32 0.06 0.44 0.02 0.00 0.00 177.57 178.98 1gky h ASP 56 N 0.91 1.06 -0.47 0.57 3.32 -1.99 0.70 116.42 120.52 1gky h ASP 56 Ca 0.20 -0.28 -0.06 0.00 0.02 0.00 0.00 57.03 56.91 1gky h ASP 56 Cb 0.29 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 1gky h ASP 56 CO -0.00 1.08 0.05 -0.08 -1.72 0.00 0.00 179.24 178.56 1gky h GLU 57 N 1.01 0.79 -0.69 3.56 4.57 -1.88 -1.80 114.58 120.15 1gky h GLU 57 Ca 0.19 -0.23 -0.06 0.00 -1.18 0.00 0.00 59.36 58.08 1gky h GLU 57 Cb 0.50 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 28.98 1gky h GLU 57 CO 0.02 0.82 0.20 0.35 -1.18 0.00 0.00 179.01 179.22 1gky h PHE 58 N 0.65 1.10 -0.41 0.92 3.04 -0.87 0.13 116.94 121.50 1gky h PHE 58 Ca 0.14 -0.11 -0.04 0.00 3.98 0.00 0.00 57.97 61.94 1gky h PHE 58 Cb 0.43 -0.32 -0.02 0.00 2.56 0.00 0.00 35.95 38.60 1gky h PHE 58 CO 0.03 0.88 0.10 0.87 -2.02 0.00 0.00 178.31 178.17 1gky h LYS 59 N 1.02 0.60 -0.43 1.11 1.57 -0.81 -1.22 116.57 118.42 1gky h LYS 59 Ca 0.22 -0.10 -0.14 0.00 -1.87 0.00 0.00 60.65 58.76 1gky h LYS 59 Cb 0.31 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 1gky h LYS 59 CO -0.01 0.55 -0.28 1.03 -0.57 0.00 0.00 179.45 180.18 1gky h SER 60 N 0.59 0.98 -0.79 0.86 0.87 -0.31 -1.59 113.55 114.17 1gky h SER 60 Ca 0.14 -0.43 0.01 0.00 -1.23 0.00 0.00 61.79 60.28 1gky h SER 60 Cb 0.23 -0.27 -0.04 0.00 -0.44 0.00 0.00 62.40 61.87 1gky h SER 60 CO -0.00 1.20 0.52 0.24 -0.53 0.00 0.00 176.83 178.25 1gky h MET 61 N 0.77 1.01 0.54 2.24 2.86 -0.33 -0.34 114.93 121.69 1gky h MET 61 Ca 0.09 -0.06 -0.02 0.00 -2.06 0.00 0.00 59.70 57.65 1gky h MET 61 Cb 0.86 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 32.29 1gky h MET 61 CO 0.08 0.67 -0.36 0.82 1.06 0.00 0.00 176.91 179.18 1gky h ILE 62 N 1.04 0.27 -0.02 -1.22 2.04 -0.83 -1.71 117.51 117.08 1gky h ILE 62 Ca 0.30 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.16 1gky h ILE 62 Cb -0.08 0.27 -0.00 0.00 -0.74 0.00 0.00 36.82 36.26 1gky h ILE 62 CO -0.08 0.00 0.02 0.11 0.00 0.00 0.00 178.15 178.20 1gky h LYS 63 N -0.86 0.00 -0.62 2.37 1.57 -1.12 -1.86 116.57 116.05 1gky h LYS 63 Ca -0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1gky h LYS 63 Cb 0.71 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.02 1gky h LYS 63 CO 0.05 0.00 0.00 0.09 -0.57 0.00 0.00 179.45 179.02 1gky n ASN 64 N -4.29 3.69 -3.73 0.86 3.02 -0.15 -4.96 115.26 109.70 1gky n ASN 64 Ca -0.02 -2.31 -0.23 0.00 -0.03 0.00 0.00 54.58 51.98 1gky n ASN 64 Cb 0.11 -0.49 0.04 0.00 -0.61 0.00 0.00 39.78 38.83 1gky n ASN 64 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1gky n ASN 65 N 0.83 -2.37 -0.13 6.41 4.13 -0.70 -4.92 115.26 118.51 1gky n ASN 65 Ca 0.20 -0.78 0.13 0.00 1.68 0.00 0.00 54.58 55.80 1gky n ASN 65 Cb 0.69 -4.15 0.38 0.00 -1.54 0.00 0.00 39.78 35.16 1gky n ASN 65 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1gky n GLU 66 N -4.40 0.50 -4.04 3.52 1.02 -0.66 -4.89 120.64 111.69 1gky n GLU 66 Ca -0.20 -0.27 -0.34 0.00 -0.02 0.00 0.00 57.16 56.33 1gky n GLU 66 Cb 0.64 -1.49 -0.06 0.00 -0.02 0.00 0.00 31.44 30.50 1gky n GLU 66 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 1gky s PHE 67 N -2.68 3.39 0.10 -0.32 0.08 -1.26 -1.19 117.98 116.10 1gky s PHE 67 Ca 0.20 0.29 -0.13 0.00 0.12 0.00 0.00 56.93 57.41 1gky s PHE 67 Cb 0.19 -1.79 -0.14 0.00 -0.57 0.00 0.00 43.02 40.70 1gky s PHE 67 CO 0.57 0.60 1.32 0.82 -0.10 0.00 0.00 175.22 178.43 1gky h ILE 68 N 3.27 1.28 -2.52 0.64 2.04 -1.10 -3.44 117.51 117.69 1gky h ILE 68 Ca -0.50 -1.90 0.02 0.00 1.00 0.00 0.00 64.86 63.48 1gky h ILE 68 Cb 1.19 1.91 -0.15 0.00 -0.74 0.00 0.00 36.82 39.03 1gky h ILE 68 CO 0.63 0.61 0.32 -1.83 0.00 0.00 0.00 178.15 177.88 1gky s GLU 69 N -3.83 1.05 0.05 2.37 4.04 -1.22 -4.93 118.70 116.23 1gky s GLU 69 Ca -0.11 -0.27 -0.19 0.00 0.04 0.00 0.00 54.97 54.44 1gky s GLU 69 Cb 0.09 0.49 0.04 0.00 0.02 0.00 0.00 34.13 34.76 1gky s GLU 69 CO 0.90 -0.43 0.45 1.67 -1.84 0.00 0.00 175.26 176.00 1gky s TRP 70 N -2.99 -0.32 0.29 4.83 1.48 -1.26 -2.06 118.94 118.92 1gky s TRP 70 Ca 0.00 0.28 -0.09 0.00 -1.06 0.00 0.00 56.10 55.23 1gky s TRP 70 Cb -0.01 0.27 0.00 0.00 -1.16 0.00 0.00 33.47 32.57 1gky s TRP 70 CO -0.07 -0.61 0.50 0.00 -4.06 0.00 0.00 176.95 172.70 1gky s ALA 71 N -2.60 0.11 0.03 2.67 0.00 0.64 -4.98 121.76 117.63 1gky s ALA 71 Ca -0.04 -1.11 0.07 0.00 0.00 0.00 0.00 51.96 50.87 1gky s ALA 71 Cb -0.01 1.07 -0.03 0.00 0.00 0.00 0.00 23.12 24.16 1gky s ALA 71 CO -0.03 -0.84 -0.19 -0.65 0.00 0.00 0.00 175.76 174.05 1gky s GLN 72 N -3.52 2.11 -0.07 0.00 -0.21 -1.26 -1.28 119.66 115.42 1gky s GLN 72 Ca 0.25 -0.95 -0.03 0.00 0.02 0.00 0.00 55.36 54.65 1gky s GLN 72 Cb -0.01 -2.19 0.04 0.00 1.00 0.00 0.00 33.01 31.86 1gky s GLN 72 CO 0.13 0.55 0.13 0.12 -2.12 0.00 0.00 175.29 174.10 1gky s PHE 73 N -0.87 -0.12 -1.46 0.91 5.36 -0.50 -4.87 117.98 116.43 1gky s PHE 73 Ca 0.14 0.51 -0.10 0.00 -0.96 0.00 0.00 56.93 56.52 1gky s PHE 73 Cb -0.10 -0.30 0.06 0.00 -0.34 0.00 0.00 43.02 42.33 1gky s PHE 73 CO 0.04 -0.24 0.96 0.43 -1.46 0.00 0.00 175.22 174.95 1gky n SER 74 N 5.23 -4.32 0.00 6.13 7.64 -1.26 -1.34 113.62 125.70 1gky n SER 74 Ca -0.06 -0.75 0.00 0.00 1.01 0.00 0.00 58.87 59.07 1gky n SER 74 Cb 0.50 -4.10 0.00 0.00 -1.01 0.00 0.00 64.21 59.60 1gky n SER 74 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1gky n GLY 75 N -1.71 0.43 3.53 0.23 0.00 -1.26 -5.01 105.19 101.39 1gky n GLY 75 Ca -0.03 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.75 1gky n GLY 75 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1gky s ASN 76 N -2.09 3.91 0.06 1.61 0.01 -0.45 -5.05 114.94 112.93 1gky s ASN 76 Ca 0.00 -0.89 0.01 0.00 -0.71 0.00 0.00 52.86 51.27 1gky s ASN 76 Cb 0.00 -0.48 -0.04 0.00 0.41 0.00 0.00 41.25 41.14 1gky s ASN 76 CO 0.00 0.03 0.14 -0.31 -1.51 0.00 0.00 177.10 175.45 1gky s TYR 77 N -2.39 3.35 -0.00 2.20 1.51 -1.26 -1.41 117.35 119.35 1gky s TYR 77 Ca 0.30 0.18 -0.01 0.00 -1.01 0.00 0.00 57.07 56.53 1gky s TYR 77 Cb -0.06 -1.70 -0.00 0.00 -0.11 0.00 0.00 41.96 40.09 1gky s TYR 77 CO 0.16 0.56 0.02 0.71 -1.11 0.00 0.00 175.55 175.89 1gky s TYR 78 N -1.41 0.04 -0.07 2.71 1.51 -0.40 -1.39 117.35 118.32 1gky s TYR 78 Ca 0.31 -0.07 -0.30 0.00 -1.01 0.00 0.00 57.07 56.01 1gky s TYR 78 Cb -0.13 -0.04 0.10 0.00 -0.11 0.00 0.00 41.96 41.79 1gky s TYR 78 CO 0.23 -0.06 0.85 0.20 -1.11 0.00 0.00 175.55 175.66 1gky s GLY 79 N -0.36 -0.43 -0.16 0.71 0.00 -0.51 -0.26 107.32 106.31 1gky s GLY 79 Ca -0.04 1.48 -0.17 0.00 0.00 0.00 0.00 44.72 46.00 1gky s GLY 79 CO -0.00 0.79 0.42 -0.56 0.00 0.00 0.00 173.10 173.75 1gky s SER 80 N -1.56 6.56 0.21 1.64 0.01 -0.88 -1.45 113.70 118.23 1gky s SER 80 Ca -0.03 0.66 -0.00 0.00 1.31 0.00 0.00 55.95 57.89 1gky s SER 80 Cb -0.00 -2.25 -0.04 0.00 0.21 0.00 0.00 66.02 63.93 1gky s SER 80 CO 0.01 -0.02 0.40 0.42 0.41 0.00 0.00 173.24 174.46 1gky s THR 81 N 0.87 5.20 0.16 1.44 -4.23 -1.26 -0.56 115.64 117.26 1gky s THR 81 Ca 0.22 -0.41 -0.15 0.00 -1.18 0.00 0.00 61.69 60.17 1gky s THR 81 Cb -0.15 -3.75 0.04 0.00 1.34 0.00 0.00 72.50 69.98 1gky s THR 81 CO 0.08 -0.21 1.78 0.58 -0.54 0.00 0.00 174.62 176.32 1gky h VAL 82 N 1.47 0.98 -0.38 2.29 2.07 -1.44 -2.91 116.25 118.33 1gky h VAL 82 Ca -0.48 -0.15 -0.13 0.00 0.82 0.00 0.00 66.70 66.75 1gky h VAL 82 Cb 1.19 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.46 1gky h VAL 82 CO 0.67 0.08 -0.29 0.00 0.02 0.00 0.00 177.57 178.05 1gky h ALA 83 N 1.22 0.76 -0.48 1.67 0.00 -1.95 -1.21 119.26 119.27 1gky h ALA 83 Ca 0.18 -0.41 -0.05 0.00 0.00 0.00 0.00 54.91 54.63 1gky h ALA 83 Cb 0.08 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1gky h ALA 83 CO -0.12 0.66 0.10 1.03 0.00 0.00 0.00 179.25 180.92 1gky h SER 84 N 0.70 0.74 -0.18 0.00 0.87 -1.89 -1.57 113.55 112.22 1gky h SER 84 Ca 0.08 -0.24 -0.02 0.00 -1.23 0.00 0.00 61.79 60.38 1gky h SER 84 Cb 0.84 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 62.60 1gky h SER 84 CO 0.07 0.79 0.05 0.58 -0.53 0.00 0.00 176.83 177.79 1gky h VAL 85 N 0.65 1.19 -0.29 2.23 2.07 -1.31 -2.79 116.25 118.00 1gky h VAL 85 Ca 0.15 -0.61 0.05 0.00 0.82 0.00 0.00 66.70 67.11 1gky h VAL 85 Cb 0.35 1.25 -0.04 0.00 -1.52 0.00 0.00 31.29 31.33 1gky h VAL 85 CO 0.00 0.19 0.01 0.50 0.02 0.00 0.00 177.57 178.29 1gky h LYS 86 N 0.11 0.09 -0.91 1.57 3.64 -1.18 -1.96 116.57 117.94 1gky h LYS 86 Ca 0.06 -0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.49 1gky h LYS 86 Cb 0.24 -0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 31.98 1gky h LYS 86 CO -0.00 0.06 0.57 0.37 -2.27 0.00 0.00 179.45 178.18 1gky h GLN 87 N 0.10 1.01 -0.31 1.90 4.15 -1.14 -0.98 115.11 119.84 1gky h GLN 87 Ca 0.14 -0.06 -0.03 0.00 0.77 0.00 0.00 58.65 59.46 1gky h GLN 87 Cb 0.17 -0.23 -0.01 0.00 0.21 0.00 0.00 27.48 27.62 1gky h GLN 87 CO -0.22 0.67 0.06 0.28 -1.93 0.00 0.00 178.83 177.69 1gky h VAL 88 N 1.04 1.23 -0.22 2.39 2.07 -1.21 -1.55 116.25 119.99 1gky h VAL 88 Ca 0.40 -0.77 -0.01 0.00 0.82 0.00 0.00 66.70 67.14 1gky h VAL 88 Cb 0.17 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 1gky h VAL 88 CO -0.17 0.25 0.11 0.77 0.02 0.00 0.00 177.57 178.55 1gky h SER 89 N 0.33 0.28 0.41 0.57 4.64 -0.91 -1.94 113.55 116.94 1gky h SER 89 Ca 0.09 -0.11 -0.03 0.00 -0.47 0.00 0.00 61.79 61.28 1gky h SER 89 Cb 0.32 -0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 62.33 1gky h SER 89 CO 0.00 0.31 -0.12 0.07 -0.87 0.00 0.00 176.83 176.22 1gky h LYS 90 N 0.24 0.00 0.00 4.77 2.10 -1.13 0.38 116.57 122.92 1gky h LYS 90 Ca 0.08 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.72 1gky h LYS 90 Cb 0.10 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.43 1gky h LYS 90 CO -0.01 0.12 -0.04 0.77 -2.00 0.00 0.00 179.45 178.30 1gky h SER 91 N 0.00 0.00 0.00 7.07 0.02 -0.49 -3.46 113.55 116.69 1gky h SER 91 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1gky h SER 91 Cb 0.36 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.90 1gky h SER 91 CO 0.02 0.04 0.00 0.61 -1.14 0.00 0.00 176.83 176.35 1gky n GLY 92 N -0.74 0.76 3.89 -3.77 0.00 0.13 -5.09 105.19 100.37 1gky n GLY 92 Ca -0.02 -0.41 -0.20 0.00 0.00 0.00 0.00 46.02 45.38 1gky n GLY 92 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gky s LYS 93 N -0.78 2.69 -0.09 1.61 1.02 -1.07 -5.00 119.74 118.12 1gky s LYS 93 Ca 0.00 -1.36 -0.27 0.00 0.02 0.00 0.00 55.97 54.36 1gky s LYS 93 Cb 0.00 -2.49 -0.02 0.00 -0.52 0.00 0.00 37.83 34.79 1gky s LYS 93 CO 0.00 -0.05 0.89 0.99 -0.92 0.00 0.00 175.35 176.26 1gky s THR 94 N -2.36 4.89 0.06 2.17 2.01 -0.11 -4.32 115.64 117.98 1gky s THR 94 Ca 0.45 1.81 -0.29 0.00 0.31 0.00 0.00 61.69 63.98 1gky s THR 94 Cb -0.06 -4.21 -0.05 0.00 0.01 0.00 0.00 72.50 68.20 1gky s THR 94 CO 0.28 0.10 0.91 0.00 -0.69 0.00 0.00 174.62 175.22 1gky s ILE 96 N 0.29 3.32 -0.17 0.00 -1.09 -0.81 -1.04 121.20 121.70 1gky s ILE 96 Ca 0.46 -0.56 -0.00 0.00 -2.23 0.00 0.00 60.65 58.32 1gky s ILE 96 Cb -0.22 -2.43 0.00 0.00 -1.58 0.00 0.00 42.46 38.24 1gky s ILE 96 CO 0.27 0.51 -0.14 -0.76 -1.23 0.00 0.00 174.94 173.59 1gky s LEU 97 N 0.47 2.49 -0.44 2.97 1.02 -0.18 -1.29 118.68 123.72 1gky s LEU 97 Ca -0.07 -0.48 -0.07 0.00 0.02 0.00 0.00 54.13 53.53 1gky s LEU 97 Cb -0.15 -1.58 0.11 0.00 0.02 0.00 0.00 46.19 44.59 1gky s LEU 97 CO 0.04 0.05 0.27 -0.62 0.02 0.00 0.00 176.35 176.12 1gky s ASP 98 N 1.00 5.50 0.21 2.29 2.15 -1.26 -0.53 116.67 126.04 1gky s ASP 98 Ca -0.02 -1.89 0.01 0.00 0.43 0.00 0.00 52.55 51.08 1gky s ASP 98 Cb -0.15 -1.93 -0.05 0.00 -0.30 0.00 0.00 42.92 40.50 1gky s ASP 98 CO -0.03 -0.61 0.08 0.27 -0.17 0.00 0.00 175.17 174.71 1gky s ILE 99 N 1.28 0.41 0.68 4.11 -4.36 -1.08 -5.01 121.20 117.23 1gky s ILE 99 Ca 0.06 -1.98 -0.08 0.00 -0.26 0.00 0.00 60.65 58.38 1gky s ILE 99 Cb -0.24 -2.41 0.15 0.00 1.25 0.00 0.00 42.46 41.21 1gky s ILE 99 CO -0.02 -0.17 0.93 -0.90 0.24 0.00 0.00 174.94 175.02 1gky n ASP 100 N -0.32 0.41 -0.33 4.36 5.75 -1.26 -4.30 116.55 120.86 1gky n ASP 100 Ca -0.02 -1.54 -0.03 0.00 -0.01 0.00 0.00 54.79 53.19 1gky n ASP 100 Cb 0.65 -0.68 0.09 0.00 -1.03 0.00 0.00 41.12 40.16 1gky n ASP 100 CO 0.00 0.00 0.00 -0.03 -0.11 0.00 0.00 177.20 177.06 1gky h MET 101 N 0.00 1.16 -0.96 0.11 1.85 -1.98 -0.65 114.93 114.45 1gky h MET 101 Ca -0.30 -0.07 0.06 0.00 -0.61 0.00 0.00 59.70 58.78 1gky h MET 101 Cb 0.91 -0.26 -0.06 0.00 0.43 0.00 0.00 31.60 32.62 1gky h MET 101 CO 0.25 0.77 0.61 0.37 -0.40 0.00 0.00 176.91 178.51 1gky h GLN 102 N 1.19 1.09 -0.47 0.39 4.15 -2.00 -1.77 115.11 117.70 1gky h GLN 102 Ca 0.33 -0.07 -0.05 0.00 0.77 0.00 0.00 58.65 59.63 1gky h GLN 102 Cb -0.12 -0.25 -0.02 0.00 0.21 0.00 0.00 27.48 27.31 1gky h GLN 102 CO -0.08 0.72 0.10 0.78 -1.93 0.00 0.00 178.83 178.42 1gky h GLY 103 N 1.12 0.82 0.66 2.39 0.00 -1.65 -1.23 103.07 105.18 1gky h GLY 103 Ca 0.41 -0.53 0.03 0.00 0.00 0.00 0.00 47.33 47.25 1gky h GLY 103 CO -0.17 0.49 -0.06 -2.08 0.00 0.00 0.00 176.54 174.73 1gky h VAL 104 N 0.64 0.81 -0.86 4.60 2.07 -0.49 -1.46 116.25 121.56 1gky h VAL 104 Ca 0.15 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.75 1gky h VAL 104 Cb 0.35 0.81 -0.07 0.00 -1.52 0.00 0.00 31.29 30.86 1gky h VAL 104 CO 0.00 0.00 0.51 0.11 0.02 0.00 0.00 177.57 178.22 1gky h LYS 105 N -0.03 0.86 -0.34 1.57 1.57 -1.20 0.32 116.57 119.33 1gky h LYS 105 Ca 0.08 -0.05 -0.06 0.00 -1.87 0.00 0.00 60.65 58.75 1gky h LYS 105 Cb 0.15 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 1gky h LYS 105 CO -0.17 0.57 -0.00 0.77 -0.57 0.00 0.00 179.45 180.05 1gky h SER 106 N 0.89 0.59 0.77 0.86 0.02 -0.68 -2.93 113.55 113.06 1gky h SER 106 Ca 0.40 -0.31 -0.12 0.00 -0.84 0.00 0.00 61.79 60.92 1gky h SER 106 Cb 0.29 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.66 1gky h SER 106 CO -0.22 0.76 -0.56 0.58 -1.14 0.00 0.00 176.83 176.25 1gky h VAL 107 N 0.40 1.24 -0.91 2.27 2.07 -0.93 -1.89 116.25 118.51 1gky h VAL 107 Ca 0.09 -2.01 0.12 0.00 0.82 0.00 0.00 66.70 65.73 1gky h VAL 107 Cb 0.46 2.13 -0.07 0.00 -1.52 0.00 0.00 31.29 32.29 1gky h VAL 107 CO 0.02 0.54 0.58 0.11 0.02 0.00 0.00 177.57 178.84 1gky h LYS 108 N 0.00 0.79 -0.00 1.57 1.57 -0.87 -1.52 116.57 118.10 1gky h LYS 108 Ca -0.01 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1gky h LYS 108 Cb 1.09 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.22 1gky h LYS 108 CO 0.07 0.52 0.00 0.00 -0.57 0.00 0.00 179.45 179.48 1gky n ALA 109 N -2.41 2.56 -3.81 3.86 0.00 -0.71 -4.34 120.51 115.66 1gky n ALA 109 Ca 0.17 -0.08 -0.33 0.00 0.00 0.00 0.00 53.44 53.20 1gky n ALA 109 Cb 0.39 -1.17 -0.11 0.00 0.00 0.00 0.00 19.45 18.55 1gky n ALA 109 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1gky s ILE 110 N -1.99 3.30 0.31 0.00 1.01 -0.57 -4.96 121.20 118.30 1gky s ILE 110 Ca 0.17 -3.52 0.03 0.00 0.00 0.00 0.00 60.65 57.32 1gky s ILE 110 Cb 0.08 -3.17 0.29 0.00 0.01 0.00 0.00 42.46 39.67 1gky s ILE 110 CO 0.13 -0.92 1.89 -0.65 0.00 0.00 0.00 174.94 175.39 1gky h PRO 111 N 6.33 0.92 -1.13 2.79 0.11 -1.81 -2.66 132.00 136.54 1gky h PRO 111 Ca 0.03 -0.06 0.32 0.00 0.11 0.00 0.00 66.00 66.41 1gky h PRO 111 Cb 0.87 -0.21 -0.10 0.00 0.11 0.00 0.00 31.00 31.67 1gky h PRO 111 CO 0.73 0.61 0.74 0.93 -0.21 0.00 0.00 178.00 180.79 1gky h GLU 112 N 0.94 0.26 -0.02 1.05 3.07 -1.94 -1.33 114.58 116.62 1gky h GLU 112 Ca 0.42 -0.02 -0.12 0.00 -0.50 0.00 0.00 59.36 59.14 1gky h GLU 112 Cb 0.37 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.21 1gky h GLU 112 CO -0.18 0.17 -0.57 -0.07 -1.40 0.00 0.00 179.01 176.96 1gky h LEU 113 N 0.27 0.05 -1.18 1.33 4.07 -1.82 -3.47 115.31 114.56 1gky h LEU 113 Ca 0.66 -0.03 -0.40 0.00 0.08 0.00 0.00 57.88 58.18 1gky h LEU 113 Cb 1.88 -0.02 0.10 0.00 1.08 0.00 0.00 40.66 43.70 1gky h LEU 113 CO -0.31 0.61 -0.74 -3.20 -1.08 0.00 0.00 178.44 173.72 1gky n ASN 114 N -3.87 -4.36 -4.81 -0.43 5.15 -0.50 -4.55 115.26 101.89 1gky n ASN 114 Ca -0.01 -0.65 -0.31 0.00 -0.60 0.00 0.00 54.58 53.01 1gky n ASN 114 Cb 0.58 -4.67 0.06 0.00 -0.53 0.00 0.00 39.78 35.22 1gky n ASN 114 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1gky s ALA 115 N -3.37 2.61 0.04 5.20 0.00 -1.26 -4.45 121.76 120.52 1gky s ALA 115 Ca 0.40 0.12 0.01 0.00 0.00 0.00 0.00 51.96 52.48 1gky s ALA 115 Cb -0.18 -3.19 -0.04 0.00 0.00 0.00 0.00 23.12 19.70 1gky s ALA 115 CO 0.76 -1.32 0.11 1.03 0.00 0.00 0.00 175.76 176.35 1gky s ARG 116 N -5.01 3.09 -0.12 0.00 0.52 0.01 -4.97 118.95 112.48 1gky s ARG 116 Ca 0.59 -0.54 0.01 0.00 -0.52 0.00 0.00 55.73 55.27 1gky s ARG 116 Cb -0.15 -2.86 0.02 0.00 0.52 0.00 0.00 34.95 32.48 1gky s ARG 116 CO 0.55 0.61 -0.14 -0.06 0.02 0.00 0.00 175.30 176.28 1gky s PHE 117 N -1.33 1.98 -0.11 -0.53 0.40 -1.26 -0.66 117.98 116.46 1gky s PHE 117 Ca 0.28 -0.98 0.02 0.00 -0.60 0.00 0.00 56.93 55.65 1gky s PHE 117 Cb -0.12 -1.45 0.01 0.00 0.51 0.00 0.00 43.02 41.97 1gky s PHE 117 CO 0.20 -0.52 -0.19 -1.17 0.70 0.00 0.00 175.22 174.24 1gky s LEU 118 N 1.15 1.90 -0.12 -0.37 2.96 -0.62 -0.46 118.68 123.13 1gky s LEU 118 Ca -0.03 -0.49 -0.00 0.00 -0.22 0.00 0.00 54.13 53.38 1gky s LEU 118 Cb -0.14 -1.23 -0.02 0.00 0.50 0.00 0.00 46.19 45.29 1gky s LEU 118 CO -0.04 0.07 -0.10 0.12 -1.32 0.00 0.00 176.35 175.08 1gky s PHE 119 N 0.77 2.87 -0.28 5.38 5.36 -0.79 -1.47 117.98 129.81 1gky s PHE 119 Ca -0.10 -0.39 -0.06 0.00 -0.96 0.00 0.00 56.93 55.42 1gky s PHE 119 Cb -0.16 -1.82 0.01 0.00 -0.34 0.00 0.00 43.02 40.71 1gky s PHE 119 CO 0.01 -0.03 0.05 0.42 -1.46 0.00 0.00 175.22 174.21 1gky s ILE 120 N 0.03 3.80 0.07 3.12 -1.09 0.07 -1.06 121.20 126.15 1gky s ILE 120 Ca -0.03 -0.71 -0.09 0.00 -2.23 0.00 0.00 60.65 57.60 1gky s ILE 120 Cb -0.14 -2.94 -0.06 0.00 -1.58 0.00 0.00 42.46 37.75 1gky s ILE 120 CO 0.04 0.12 0.38 0.00 -1.23 0.00 0.00 174.94 174.25 1gky s ALA 121 N 1.48 3.75 0.75 9.38 0.00 0.16 -4.23 121.76 133.05 1gky s ALA 121 Ca 0.03 -0.42 -0.15 0.00 0.00 0.00 0.00 51.96 51.42 1gky s ALA 121 Cb -0.17 -2.23 0.05 0.00 0.00 0.00 0.00 23.12 20.77 1gky s ALA 121 CO 0.01 0.58 1.21 -1.25 0.00 0.00 0.00 175.76 176.32 1gky s PRO 122 N -1.94 1.99 0.32 0.00 0.04 -1.26 -0.78 135.00 133.38 1gky s PRO 122 Ca 0.33 1.77 0.05 0.00 0.04 0.00 0.00 61.00 63.20 1gky s PRO 122 Cb -0.14 -1.81 0.70 0.00 0.04 0.00 0.00 34.50 33.29 1gky s PRO 122 CO 0.18 -1.95 1.86 -1.35 0.04 0.00 0.00 177.00 175.78 1gky h PRO 123 N -0.45 0.80 -1.87 0.56 0.11 -1.94 -3.44 132.00 125.77 1gky h PRO 123 Ca -0.47 -0.05 0.24 0.00 0.11 0.00 0.00 66.00 65.83 1gky h PRO 123 Cb 1.30 -0.18 -0.12 0.00 0.11 0.00 0.00 31.00 32.11 1gky h PRO 123 CO 0.49 0.53 0.66 -1.54 -0.21 0.00 0.00 178.00 177.93 1gky s SER 124 N -5.75 -0.15 0.21 -2.05 1.04 -1.26 -5.01 113.70 100.74 1gky s SER 124 Ca -0.11 -0.20 0.02 0.00 0.48 0.00 0.00 55.95 56.14 1gky s SER 124 Cb 0.22 0.31 0.18 0.00 0.10 0.00 0.00 66.02 66.83 1gky s SER 124 CO 0.80 -0.55 1.52 0.58 0.98 0.00 0.00 173.24 176.57 1gky h VAL 125 N 2.00 1.38 -0.99 5.02 2.07 -1.99 -2.81 116.25 120.93 1gky h VAL 125 Ca -0.24 -2.03 0.03 0.00 0.82 0.00 0.00 66.70 65.27 1gky h VAL 125 Cb 1.21 2.02 -0.05 0.00 -1.52 0.00 0.00 31.29 32.95 1gky h VAL 125 CO 0.27 0.60 0.65 -0.08 0.02 0.00 0.00 177.57 179.04 1gky h GLU 126 N 0.22 1.26 -0.65 1.57 4.57 -1.99 -1.30 114.58 118.25 1gky h GLU 126 Ca -0.01 -0.08 -0.07 0.00 -1.18 0.00 0.00 59.36 58.02 1gky h GLU 126 Cb 1.17 -0.28 -0.03 0.00 -0.16 0.00 0.00 28.75 29.45 1gky h GLU 126 CO 0.10 0.83 0.12 -0.44 -1.18 0.00 0.00 179.01 178.45 1gky h ASP 127 N 1.30 1.01 -0.63 1.04 3.32 -1.93 -2.05 116.42 118.47 1gky h ASP 127 Ca 0.38 -0.23 -0.07 0.00 0.02 0.00 0.00 57.03 57.14 1gky h ASP 127 Cb -0.07 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.19 1gky h ASP 127 CO -0.11 1.00 0.13 0.25 -1.72 0.00 0.00 179.24 178.79 1gky h LEU 128 N 1.00 0.98 -0.33 1.55 5.85 -1.20 -2.02 115.31 121.14 1gky h LEU 128 Ca 0.20 -0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.68 1gky h LEU 128 Cb 0.41 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 1gky h LEU 128 CO 0.01 0.97 0.22 0.50 -0.34 0.00 0.00 178.44 179.79 1gky h LYS 129 N 0.94 0.44 -0.58 1.25 3.64 -1.04 -1.11 116.57 120.10 1gky h LYS 129 Ca 0.20 -0.03 0.07 0.00 -1.27 0.00 0.00 60.65 59.61 1gky h LYS 129 Cb 0.39 -0.10 -0.06 0.00 -0.41 0.00 0.00 32.23 32.06 1gky h LYS 129 CO 0.01 0.29 0.27 0.87 -2.27 0.00 0.00 179.45 178.63 1gky h LYS 130 N 0.44 0.49 -0.50 1.90 6.56 -1.13 0.13 116.57 124.47 1gky h LYS 130 Ca 0.12 -0.03 -0.06 0.00 -1.06 0.00 0.00 60.65 59.62 1gky h LYS 130 Cb -0.04 -0.11 -0.02 0.00 -0.57 0.00 0.00 32.23 31.49 1gky h LYS 130 CO -0.03 0.33 0.07 0.00 -2.06 0.00 0.00 179.45 177.76 1gky h ARG 131 N 0.51 0.83 -0.49 3.15 3.08 -0.90 0.82 114.38 121.38 1gky h ARG 131 Ca 0.27 -0.23 -0.12 0.00 0.07 0.00 0.00 59.98 59.97 1gky h ARG 131 Cb 0.24 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.18 1gky h ARG 131 CO -0.22 0.84 -0.16 -0.07 -1.07 0.00 0.00 179.97 179.29 1gky h LEU 132 N 0.70 0.97 -0.60 3.04 3.38 -0.96 -1.00 115.31 120.84 1gky h LEU 132 Ca 0.15 -0.34 -0.14 0.00 0.09 0.00 0.00 57.88 57.64 1gky h LEU 132 Cb 0.42 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1gky h LEU 132 CO 0.01 1.12 -0.39 -0.33 0.09 0.00 0.00 178.44 178.94 1gky h GLU 133 N 0.84 0.67 0.00 1.13 5.08 -0.67 -2.93 114.58 118.71 1gky h GLU 133 Ca 0.12 -0.34 -0.02 0.00 -1.00 0.00 0.00 59.36 58.12 1gky h GLU 133 Cb 0.72 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.97 1gky h GLU 133 CO 0.06 0.95 -0.10 0.78 -1.00 0.00 0.00 179.01 179.69 1gky h GLY 134 N 0.98 0.00 1.84 -3.84 0.00 -0.13 -2.54 103.07 99.39 1gky h GLY 134 Ca 0.05 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.24 1gky h GLY 134 CO 0.08 0.00 -0.58 3.21 0.00 0.00 0.00 176.54 179.25 1gky h ARG 135 N 0.00 0.16 0.00 4.80 3.08 -1.01 -3.48 114.38 117.93 1gky h ARG 135 Ca -0.00 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 59.94 1gky h ARG 135 Cb 0.38 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.45 1gky h ARG 135 CO 0.01 0.69 0.00 0.41 -1.07 0.00 0.00 179.97 180.02 1gky n GLY 136 N 0.18 0.89 0.09 0.04 0.00 -0.96 -4.87 105.19 100.56 1gky n GLY 136 Ca -0.02 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.91 1gky n GLY 136 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1gky n THR 137 N -2.20 1.50 -2.95 2.61 -2.24 -1.26 -4.98 114.28 104.76 1gky n THR 137 Ca 0.00 -0.82 -0.22 0.00 -2.27 0.00 0.00 64.05 60.74 1gky n THR 137 Cb 0.00 -0.80 0.02 0.00 -2.10 0.00 0.00 70.33 67.44 1gky n THR 137 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1gky s GLU 138 N -2.57 2.96 0.33 -0.78 2.56 -1.26 -5.10 118.70 114.83 1gky s GLU 138 Ca -0.07 -0.60 0.08 0.00 0.00 0.00 0.00 54.97 54.38 1gky s GLU 138 Cb 0.07 -2.57 -0.03 0.00 2.00 0.00 0.00 34.13 33.61 1gky s GLU 138 CO 0.83 -0.34 0.26 -0.08 -0.56 0.00 0.00 175.26 175.37 1gky s THR 139 N -2.57 3.53 0.35 -1.70 -1.32 -1.26 -4.96 115.64 107.72 1gky s THR 139 Ca 0.50 -1.43 0.12 0.00 -1.21 0.00 0.00 61.69 59.67 1gky s THR 139 Cb -0.10 -3.17 0.34 0.00 -1.51 0.00 0.00 72.50 68.07 1gky s THR 139 CO 0.37 -0.19 1.77 -0.33 -2.21 0.00 0.00 174.62 174.03 1gky h GLU 140 N 1.33 0.54 -0.08 7.08 3.07 -1.99 -1.16 114.58 123.37 1gky h GLU 140 Ca -0.45 -0.03 -0.15 0.00 -0.50 0.00 0.00 59.36 58.23 1gky h GLU 140 Cb 1.25 -0.12 0.01 0.00 -0.84 0.00 0.00 28.75 29.05 1gky h GLU 140 CO 0.59 0.36 -0.54 0.93 -1.40 0.00 0.00 179.01 178.95 1gky h GLU 141 N 0.56 0.50 -0.04 2.33 3.07 -2.00 -2.66 114.58 116.35 1gky h GLU 141 Ca 0.59 -0.44 -0.16 0.00 -0.50 0.00 0.00 59.36 58.85 1gky h GLU 141 Cb 1.21 0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 29.20 1gky h GLU 141 CO -0.35 1.07 -0.70 0.66 -1.40 0.00 0.00 179.01 178.29 1gky h SER 142 N 0.07 0.23 -0.56 1.42 4.64 -1.64 -2.98 113.55 114.73 1gky h SER 142 Ca -0.05 -0.15 -0.04 0.00 -0.47 0.00 0.00 61.79 61.09 1gky h SER 142 Cb 1.20 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 63.20 1gky h SER 142 CO 0.11 0.86 0.21 0.40 -0.87 0.00 0.00 176.83 177.54 1gky h ILE 143 N 0.13 1.23 -0.83 0.95 2.04 -1.36 -0.85 117.51 118.82 1gky h ILE 143 Ca -0.02 -0.73 0.01 0.00 1.00 0.00 0.00 64.86 65.12 1gky h ILE 143 Cb 1.25 0.65 -0.04 0.00 -0.74 0.00 0.00 36.82 37.93 1gky h ILE 143 CO 0.11 0.28 0.55 0.78 0.00 0.00 0.00 178.15 179.86 1gky h ASN 144 N 0.78 0.95 -0.17 1.72 -0.26 -1.41 0.38 115.58 117.56 1gky h ASN 144 Ca 0.19 -0.02 -0.15 0.00 -0.56 0.00 0.00 56.30 55.75 1gky h ASN 144 Cb 0.23 -0.24 -0.01 0.00 -1.06 0.00 0.00 38.32 37.24 1gky h ASN 144 CO -0.01 0.68 -0.45 0.50 -1.06 0.00 0.00 177.43 177.10 1gky h LYS 145 N 1.12 0.72 -0.36 0.81 3.64 -1.30 -2.09 116.57 119.11 1gky h LYS 145 Ca 0.31 -0.40 -0.09 0.00 -1.27 0.00 0.00 60.65 59.19 1gky h LYS 145 Cb -0.12 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.71 1gky h LYS 145 CO -0.07 1.02 -0.15 0.00 -2.27 0.00 0.00 179.45 177.98 1gky h ARG 146 N 0.58 0.66 -0.30 1.90 3.08 -0.03 -1.44 114.38 118.84 1gky h ARG 146 Ca 0.04 -0.23 -0.15 0.00 0.07 0.00 0.00 59.98 59.71 1gky h ARG 146 Cb 1.00 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.99 1gky h ARG 146 CO 0.09 0.79 -0.43 -0.07 -1.07 0.00 0.00 179.97 179.28 1gky h LEU 147 N 0.60 0.80 -1.02 3.04 3.38 -0.80 -0.21 115.31 121.09 1gky h LEU 147 Ca 0.10 -0.38 -0.05 0.00 0.09 0.00 0.00 57.88 57.65 1gky h LEU 147 Cb 0.60 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 1gky h LEU 147 CO 0.04 1.12 0.18 -1.28 0.09 0.00 0.00 178.44 178.59 1gky h SER 148 N 0.60 0.82 0.11 -0.43 0.87 -1.24 0.04 113.55 114.31 1gky h SER 148 Ca 0.04 -0.13 -0.15 0.00 -1.23 0.00 0.00 61.79 60.32 1gky h SER 148 Cb 0.99 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.73 1gky h SER 148 CO 0.09 0.77 -0.54 0.00 -0.53 0.00 0.00 176.83 176.62 1gky h ALA 149 N 1.34 0.76 -0.27 6.23 0.00 -1.04 -2.70 119.26 123.59 1gky h ALA 149 Ca 0.19 -0.51 -0.18 0.00 0.00 0.00 0.00 54.91 54.41 1gky h ALA 149 Cb 0.25 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1gky h ALA 149 CO -0.01 0.69 -0.55 0.00 0.00 0.00 0.00 179.25 179.38 1gky h ALA 150 N 1.05 0.42 -0.86 0.00 0.00 -0.66 -2.07 119.26 117.14 1gky h ALA 150 Ca 0.01 -0.51 0.08 0.00 0.00 0.00 0.00 54.91 54.48 1gky h ALA 150 Cb 1.07 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.73 1gky h ALA 150 CO 0.10 0.64 0.56 1.96 0.00 0.00 0.00 179.25 182.51 1gky h GLN 151 N 0.61 0.88 -0.40 0.00 4.20 -0.99 -1.94 115.11 117.47 1gky h GLN 151 Ca 0.01 -0.05 -0.08 0.00 0.06 0.00 0.00 58.65 58.59 1gky h GLN 151 Cb 1.16 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 28.73 1gky h GLN 151 CO 0.12 0.59 -0.06 0.00 -0.67 0.00 0.00 178.83 178.81 1gky h ALA 152 N 1.55 0.54 -0.83 3.87 0.00 -1.34 -2.34 119.26 120.72 1gky h ALA 152 Ca 0.38 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1gky h ALA 152 Cb 0.30 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 1gky h ALA 152 CO -0.15 0.38 0.45 0.93 0.00 0.00 0.00 179.25 180.86 1gky h GLU 153 N 0.56 1.15 -0.11 0.00 5.08 -0.91 -1.44 114.58 118.92 1gky h GLU 153 Ca 0.11 -0.13 -0.14 0.00 -1.00 0.00 0.00 59.36 58.19 1gky h GLU 153 Cb 0.56 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 1gky h GLU 153 CO 0.03 0.85 -0.54 -0.07 -1.00 0.00 0.00 179.01 178.28 1gky h LEU 154 N 1.16 0.34 -0.24 1.33 3.38 -1.24 0.02 115.31 120.06 1gky h LEU 154 Ca 0.29 -0.18 -0.16 0.00 0.09 0.00 0.00 57.88 57.93 1gky h LEU 154 Cb 0.03 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1gky h LEU 154 CO -0.05 0.81 -0.47 0.00 0.09 0.00 0.00 178.44 178.82 1gky h ALA 155 N 1.20 0.39 -0.46 1.53 0.00 -1.16 -2.77 119.26 117.99 1gky h ALA 155 Ca 0.00 -0.48 -0.05 0.00 0.00 0.00 0.00 54.91 54.38 1gky h ALA 155 Cb 1.02 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 1gky h ALA 155 CO 0.09 0.54 0.07 -0.92 0.00 0.00 0.00 179.25 179.03 1gky h TYR 156 N 0.49 0.73 -0.58 0.00 3.20 -1.14 -2.60 116.97 117.08 1gky h TYR 156 Ca 0.01 -0.07 -0.04 0.00 3.14 0.00 0.00 58.73 61.77 1gky h TYR 156 Cb 1.08 -0.21 -0.03 0.00 1.54 0.00 0.00 36.73 39.11 1gky h TYR 156 CO 0.08 0.65 0.21 0.00 -1.64 0.00 0.00 178.16 177.47 1gky h ALA 157 N 1.40 1.29 0.00 1.82 0.00 -0.76 -2.54 119.26 120.48 1gky h ALA 157 Ca 0.15 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1gky h ALA 157 Cb 0.32 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1gky h ALA 157 CO 0.00 0.52 0.00 0.39 0.00 0.00 0.00 179.25 180.16 1gky n GLU 158 N -4.32 0.32 0.00 0.00 1.02 -0.98 -1.51 120.64 115.17 1gky n GLU 158 Ca 0.05 0.07 0.14 0.00 -0.02 0.00 0.00 57.16 57.39 1gky n GLU 158 Cb 0.18 -1.50 0.57 0.00 -0.02 0.00 0.00 31.44 30.67 1gky n GLU 158 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1gky n THR 159 N -1.12 0.00 -0.70 2.62 -2.24 -0.95 -4.92 114.28 106.96 1gky n THR 159 Ca 0.08 -0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 1gky n THR 159 Cb 0.07 -0.35 0.00 0.00 -2.10 0.00 0.00 70.33 67.95 1gky n THR 159 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1gky n GLY 160 N 1.47 0.58 0.26 3.38 0.00 -0.57 -4.97 105.19 105.34 1gky n GLY 160 Ca 0.08 -0.66 0.12 0.00 0.00 0.00 0.00 46.02 45.56 1gky n GLY 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gky h ALA 161 N 0.00 1.37 -2.61 4.61 0.00 -1.71 -3.44 119.26 117.48 1gky h ALA 161 Ca 0.00 -0.11 -0.55 0.00 0.00 0.00 0.00 54.91 54.25 1gky h ALA 161 Cb 0.00 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 1gky h ALA 161 CO 0.00 0.15 -0.49 -1.01 0.00 0.00 0.00 179.25 177.90 1gky s HIS 162 N -4.30 3.40 0.10 0.00 3.76 -1.26 -4.89 115.29 112.09 1gky s HIS 162 Ca -0.03 0.09 0.20 0.00 -0.15 0.00 0.00 55.06 55.17 1gky s HIS 162 Cb 0.14 -1.63 0.68 0.00 1.11 0.00 0.00 32.58 32.87 1gky s HIS 162 CO 0.60 0.52 1.73 -0.44 -0.85 0.00 0.00 174.74 176.29 1gky h ASP 163 N 2.25 0.00 -3.98 1.40 3.32 -1.07 -3.46 116.42 114.89 1gky h ASP 163 Ca -0.48 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.51 1gky h ASP 163 Cb 1.19 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 40.53 1gky h ASP 163 CO 0.67 0.33 0.04 -0.75 -1.72 0.00 0.00 179.24 177.82 1gky s LYS 164 N -3.53 0.75 -0.15 3.56 2.47 -0.97 -5.03 119.74 116.84 1gky s LYS 164 Ca 0.01 0.89 0.00 0.00 -1.56 0.00 0.00 55.97 55.31 1gky s LYS 164 Cb 0.10 0.37 -0.00 0.00 -1.46 0.00 0.00 37.83 36.84 1gky s LYS 164 CO 0.68 -0.09 -0.15 0.08 0.16 0.00 0.00 175.35 176.03 1gky s VAL 165 N 0.33 2.71 -0.16 4.02 1.01 -1.26 -1.88 120.40 125.17 1gky s VAL 165 Ca -0.00 -0.76 -0.02 0.00 0.00 0.00 0.00 61.98 61.20 1gky s VAL 165 Cb -0.04 -2.15 -0.02 0.00 0.00 0.00 0.00 36.38 34.17 1gky s VAL 165 CO 0.01 0.51 -0.08 -0.63 0.00 0.00 0.00 175.10 174.91 1gky s ILE 166 N 0.80 3.40 -0.30 2.22 1.01 -0.22 -4.97 121.20 123.14 1gky s ILE 166 Ca -0.05 -0.52 -0.20 0.00 0.00 0.00 0.00 60.65 59.88 1gky s ILE 166 Cb -0.15 -2.48 -0.01 0.00 0.01 0.00 0.00 42.46 39.82 1gky s ILE 166 CO 0.00 0.49 0.61 -0.69 0.00 0.00 0.00 174.94 175.35 1gky s VAL 167 N 0.66 4.96 -1.13 2.92 1.01 -1.26 0.36 120.40 127.92 1gky s VAL 167 Ca -0.04 0.86 -0.14 0.00 0.00 0.00 0.00 61.98 62.66 1gky s VAL 167 Cb -0.15 -3.97 0.18 0.00 0.00 0.00 0.00 36.38 32.45 1gky s VAL 167 CO 0.02 -0.10 1.30 0.21 0.00 0.00 0.00 175.10 176.54 1gky s ASN 168 N 1.62 7.03 -0.04 3.32 2.47 0.04 -4.66 114.94 124.72 1gky s ASN 168 Ca 0.24 -2.93 0.13 0.00 0.42 0.00 0.00 52.86 50.72 1gky s ASN 168 Cb -0.15 -2.36 0.39 0.00 -1.45 0.00 0.00 41.25 37.68 1gky s ASN 168 CO 0.11 -0.71 1.32 -0.90 -3.72 0.00 0.00 177.10 173.20 1gky n ASP 169 N 5.22 3.26 -3.37 -4.21 5.75 -1.26 -4.28 116.55 117.66 1gky n ASP 169 Ca 0.31 -2.21 0.02 0.00 -0.01 0.00 0.00 54.79 52.90 1gky n ASP 169 Cb 0.43 -0.32 -0.04 0.00 -1.03 0.00 0.00 41.12 40.16 1gky n ASP 169 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1gky s ASP 170 N -1.17 -0.35 0.16 -1.12 2.15 -1.26 -5.07 116.67 110.00 1gky s ASP 170 Ca 0.30 0.50 -0.16 0.00 0.43 0.00 0.00 52.55 53.61 1gky s ASP 170 Cb 0.18 1.36 0.08 0.00 -0.30 0.00 0.00 42.92 44.24 1gky s ASP 170 CO 0.16 -0.07 1.72 0.25 -0.17 0.00 0.00 175.17 177.06 1gky h LEU 171 N 7.01 -0.04 -0.71 -1.34 5.85 -1.97 -0.78 115.31 123.32 1gky h LEU 171 Ca -0.17 0.07 -0.14 0.00 0.84 0.00 0.00 57.88 58.48 1gky h LEU 171 Cb 1.13 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 42.25 1gky h LEU 171 CO 0.10 0.01 -0.50 0.44 -0.34 0.00 0.00 178.44 178.15 1gky h ASP 172 N 0.16 0.39 -0.16 1.25 3.32 -1.98 0.05 116.42 119.45 1gky h ASP 172 Ca 0.18 -0.19 -0.03 0.00 0.02 0.00 0.00 57.03 57.01 1gky h ASP 172 Cb 0.22 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 1gky h ASP 172 CO -0.25 0.83 -0.00 0.50 -1.72 0.00 0.00 179.24 178.59 1gky h LYS 173 N 0.28 0.28 -0.54 3.56 3.64 -1.93 -1.68 116.57 120.18 1gky h LYS 173 Ca 0.01 -0.09 -0.04 0.00 -1.27 0.00 0.00 60.65 59.26 1gky h LYS 173 Cb 0.99 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.76 1gky h LYS 173 CO 0.08 0.51 0.19 0.00 -2.27 0.00 0.00 179.45 177.97 1gky h ALA 174 N 0.76 1.31 -0.50 5.00 0.00 -1.00 -2.05 119.26 122.78 1gky h ALA 174 Ca 0.04 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.72 1gky h ALA 174 Cb 0.39 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1gky h ALA 174 CO 0.01 0.50 0.03 -0.92 0.00 0.00 0.00 179.25 178.87 1gky h TYR 175 N 0.79 0.94 -0.69 0.00 3.20 -0.87 0.16 116.97 120.49 1gky h TYR 175 Ca 0.18 -0.15 -0.01 0.00 3.14 0.00 0.00 58.73 61.89 1gky h TYR 175 Cb 0.20 -0.25 -0.03 0.00 1.54 0.00 0.00 36.73 38.19 1gky h TYR 175 CO 0.01 0.87 0.40 0.87 -1.64 0.00 0.00 178.16 178.68 1gky h LYS 176 N 0.74 0.95 -0.70 1.82 1.79 -1.11 -2.06 116.57 118.00 1gky h LYS 176 Ca 0.15 -0.10 -0.01 0.00 -2.18 0.00 0.00 60.65 58.51 1gky h LYS 176 Cb 0.48 -0.19 -0.03 0.00 -1.58 0.00 0.00 32.23 30.90 1gky h LYS 176 CO 0.02 0.69 0.40 0.93 -1.08 0.00 0.00 179.45 180.41 1gky h GLU 177 N 0.94 0.96 -0.36 3.15 5.08 -1.15 -1.83 114.58 121.37 1gky h GLU 177 Ca 0.25 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1gky h GLU 177 Cb -0.00 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.03 1gky h GLU 177 CO -0.04 0.70 0.23 1.25 -1.00 0.00 0.00 179.01 180.15 1gky h LEU 178 N 0.95 0.41 -0.63 1.33 5.85 -0.73 -0.86 115.31 121.64 1gky h LEU 178 Ca 0.25 -0.01 -0.14 0.00 0.84 0.00 0.00 57.88 58.82 1gky h LEU 178 Cb 0.00 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 1gky h LEU 178 CO -0.04 0.30 -0.40 0.11 -0.34 0.00 0.00 178.44 178.07 1gky h LYS 179 N 0.48 0.63 -0.25 1.25 1.57 -1.29 -1.13 116.57 117.83 1gky h LYS 179 Ca 0.13 -0.32 0.03 0.00 -1.87 0.00 0.00 60.65 58.62 1gky h LYS 179 Cb -0.05 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.23 1gky h LYS 179 CO -0.03 0.92 0.05 -0.44 -0.57 0.00 0.00 179.45 179.38 1gky h ASP 180 N 0.52 0.01 0.55 0.86 3.32 -1.13 -0.66 116.42 119.89 1gky h ASP 180 Ca 0.04 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.12 1gky h ASP 180 Cb 0.92 0.05 -0.02 0.00 0.22 0.00 0.00 39.33 40.50 1gky h ASP 180 CO 0.08 0.04 -0.45 0.15 -1.72 0.00 0.00 179.24 177.34 1gky h PHE 181 N 0.14 -1.21 0.25 4.55 3.57 -0.99 -2.67 116.94 120.58 1gky h PHE 181 Ca 0.11 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.62 1gky h PHE 181 Cb 0.11 0.46 -0.02 0.00 2.79 0.00 0.00 35.95 39.29 1gky h PHE 181 CO -0.16 -0.63 -0.27 0.82 -2.23 0.00 0.00 178.31 175.84 1gky h ILE 182 N -0.98 0.42 0.00 1.41 2.04 -1.05 -2.89 117.51 116.46 1gky h ILE 182 Ca -0.06 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.80 1gky h ILE 182 Cb 0.83 0.42 0.00 0.00 -0.74 0.00 0.00 36.82 37.33 1gky h ILE 182 CO -0.00 0.00 0.00 0.49 0.00 0.00 0.00 178.15 178.64 1gky n PHE 183 N -5.39 0.00 0.34 1.37 3.72 -0.27 -1.82 117.46 115.40 1gky n PHE 183 Ca -0.08 0.00 0.22 0.00 -0.05 0.00 0.00 57.45 57.53 1gky n PHE 183 Cb 0.30 -0.26 1.15 0.00 -0.94 0.00 0.00 39.48 39.74 1gky n PHE 183 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1gky h ALA 184 N 3.20 1.06 0.00 4.37 0.00 -1.25 -3.47 119.26 123.18 1gky h ALA 184 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1gky h ALA 184 Cb 0.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1gky h ALA 184 CO 0.00 -0.06 0.00 0.39 0.00 0.00 0.00 179.25 179.58 1gky n GLU 185 N -3.04 0.00 0.00 0.00 -0.58 -0.76 -5.14 120.64 111.12 1gky n GLU 185 Ca -0.03 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.71 1gky n GLU 185 Cb 0.12 -0.15 0.00 0.00 -0.57 0.00 0.00 31.44 30.84 1gky n GLU 185 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28