#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gic s ASP 2 N 0.00 5.65 -0.22 0.00 1.01 -1.26 -5.07 116.67 116.77 1gic s ASP 2 Ca 0.00 0.11 -0.04 0.00 0.71 0.00 0.00 52.55 53.32 1gic s ASP 2 Cb 0.00 -1.24 -0.01 0.00 1.01 0.00 0.00 42.92 42.68 1gic s ASP 2 CO 0.00 -0.83 -0.03 -0.89 0.21 0.00 0.00 175.17 173.63 1gic s THR 3 N -2.58 3.54 -0.05 -1.27 2.01 -1.26 -5.03 115.64 111.00 1gic s THR 3 Ca 0.51 -0.44 0.04 0.00 0.31 0.00 0.00 61.69 62.12 1gic s THR 3 Cb -0.10 -2.61 -0.00 0.00 0.01 0.00 0.00 72.50 69.80 1gic s THR 3 CO 0.37 0.42 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.91 1gic s ILE 4 N 1.42 1.48 -0.12 1.82 -1.09 -1.26 -3.49 121.20 119.94 1gic s ILE 4 Ca 0.05 -0.73 0.02 0.00 -2.23 0.00 0.00 60.65 57.76 1gic s ILE 4 Cb -0.14 -1.27 0.01 0.00 -1.58 0.00 0.00 42.46 39.48 1gic s ILE 4 CO -0.02 0.42 -0.17 -0.69 -1.23 0.00 0.00 174.94 173.26 1gic s VAL 5 N 0.11 1.69 0.05 2.92 1.01 -0.85 -0.87 120.40 124.45 1gic s VAL 5 Ca -0.06 -0.75 -0.00 0.00 0.00 0.00 0.00 61.98 61.17 1gic s VAL 5 Cb -0.12 -1.53 -0.03 0.00 0.00 0.00 0.00 36.38 34.69 1gic s VAL 5 CO 0.03 0.48 -0.04 0.00 0.00 0.00 0.00 175.10 175.57 1gic s ALA 6 N 1.01 0.45 -0.29 5.51 0.00 -0.22 -1.01 121.76 127.21 1gic s ALA 6 Ca -0.05 -1.03 0.02 0.00 0.00 0.00 0.00 51.96 50.89 1gic s ALA 6 Cb -0.15 0.22 0.06 0.00 0.00 0.00 0.00 23.12 23.25 1gic s ALA 6 CO -0.03 -0.29 -0.05 0.08 0.00 0.00 0.00 175.76 175.47 1gic s VAL 7 N -3.11 2.45 0.06 0.00 1.01 0.35 -1.17 120.40 120.00 1gic s VAL 7 Ca 0.00 -1.67 -0.09 0.00 0.00 0.00 0.00 61.98 60.22 1gic s VAL 7 Cb 0.02 -2.49 -0.06 0.00 0.00 0.00 0.00 36.38 33.86 1gic s VAL 7 CO -0.07 -0.15 0.38 -1.83 0.00 0.00 0.00 175.10 173.44 1gic s GLU 8 N 1.12 3.73 -0.55 2.72 -1.05 -0.43 -1.24 118.70 123.00 1gic s GLU 8 Ca -0.05 0.14 0.01 0.00 -0.15 0.00 0.00 54.97 54.92 1gic s GLU 8 Cb -0.20 -3.02 0.14 0.00 -0.44 0.00 0.00 34.13 30.62 1gic s GLU 8 CO -0.04 0.58 0.32 -0.51 0.95 0.00 0.00 175.26 176.56 1gic s LEU 9 N -1.87 4.71 -0.36 1.83 1.02 0.85 -1.65 118.68 123.22 1gic s LEU 9 Ca 0.32 -2.91 -0.17 0.00 0.02 0.00 0.00 54.13 51.39 1gic s LEU 9 Cb -0.14 -1.73 -0.00 0.00 0.02 0.00 0.00 46.19 44.34 1gic s LEU 9 CO 0.18 -0.29 0.47 -0.62 0.02 0.00 0.00 176.35 176.10 1gic s ASP 10 N 0.17 6.27 0.00 2.29 -1.08 -0.15 -1.75 116.67 122.41 1gic s ASP 10 Ca 0.17 -0.17 0.25 0.00 -0.52 0.00 0.00 52.55 52.28 1gic s ASP 10 Cb -0.23 -2.25 0.47 0.00 -1.46 0.00 0.00 42.92 39.45 1gic s ASP 10 CO -0.02 -0.46 1.39 0.35 0.52 0.00 0.00 175.17 176.95 1gic n THR 11 N 5.39 0.00 -4.04 1.71 -2.24 -0.95 -1.32 114.28 112.84 1gic n THR 11 Ca -0.06 -0.03 -0.31 0.00 -2.27 0.00 0.00 64.05 61.38 1gic n THR 11 Cb 0.49 0.38 -0.16 0.00 -2.10 0.00 0.00 70.33 68.94 1gic n THR 11 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1gic s TYR 12 N -2.88 2.46 -0.43 4.78 5.04 -1.24 -4.54 117.35 120.54 1gic s TYR 12 Ca 0.14 -1.50 -0.29 0.00 -2.44 0.00 0.00 57.07 52.98 1gic s TYR 12 Cb 0.18 -1.71 0.01 0.00 0.35 0.00 0.00 41.96 40.79 1gic s TYR 12 CO 0.68 -0.74 1.37 -2.14 -1.34 0.00 0.00 175.55 173.38 1gic s PRO 13 N 1.39 3.58 -1.05 4.97 0.02 -1.26 -4.93 135.00 137.71 1gic s PRO 13 Ca 0.02 0.85 -0.05 0.00 0.02 0.00 0.00 61.00 61.84 1gic s PRO 13 Cb -0.14 -4.01 0.28 0.00 0.02 0.00 0.00 34.50 30.65 1gic s PRO 13 CO -0.10 -1.56 1.21 0.09 -0.33 0.00 0.00 177.00 176.30 1gic n ASN 14 N 8.73 5.65 -0.34 2.53 4.13 -1.26 -4.86 115.26 129.84 1gic n ASN 14 Ca 0.16 -3.23 0.24 0.00 1.68 0.00 0.00 54.58 53.43 1gic n ASN 14 Cb 0.48 -1.26 0.52 0.00 -1.54 0.00 0.00 39.78 37.98 1gic n ASN 14 CO 0.00 0.00 0.00 0.74 0.28 0.00 0.00 177.26 178.28 1gic h THR 15 N 3.57 0.48 0.00 3.41 2.02 -1.87 -0.54 112.91 119.98 1gic h THR 15 Ca 0.19 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 67.24 1gic h THR 15 Cb 0.75 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.24 1gic h THR 15 CO 1.12 0.07 0.00 -0.90 0.37 0.00 0.00 175.52 176.18 1gic n ASP 16 N -4.64 0.00 -0.20 4.18 5.75 -1.26 -2.21 116.55 118.16 1gic n ASP 16 Ca 0.27 0.43 0.06 0.00 -0.01 0.00 0.00 54.79 55.54 1gic n ASP 16 Cb 0.93 -0.47 0.11 0.00 -1.03 0.00 0.00 41.12 40.66 1gic n ASP 16 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1gic n ILE 17 N -1.47 1.54 -0.08 2.12 0.13 -0.26 -4.97 119.36 116.38 1gic n ILE 17 Ca 0.04 -1.66 0.00 0.00 -1.10 0.00 0.00 62.75 60.04 1gic n ILE 17 Cb 0.17 0.09 0.00 0.00 -0.84 0.00 0.00 39.64 39.06 1gic n ILE 17 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1gic n GLY 18 N -0.81 0.58 3.75 4.50 0.00 -0.94 -4.69 105.19 107.58 1gic n GLY 18 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 1gic n GLY 18 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1gic s ASP 19 N -2.63 5.43 0.79 1.61 1.01 -0.91 -4.95 116.67 117.02 1gic s ASP 19 Ca 0.00 2.61 -0.14 0.00 0.71 0.00 0.00 52.55 55.73 1gic s ASP 19 Cb 0.00 -2.62 0.07 0.00 1.01 0.00 0.00 42.92 41.38 1gic s ASP 19 CO 0.00 -1.45 1.21 -0.81 0.21 0.00 0.00 175.17 174.33 1gic n PRO 20 N -1.01 0.28 0.00 8.23 -0.04 -1.26 -4.27 135.00 136.92 1gic n PRO 20 Ca 0.10 0.17 0.00 0.00 -0.04 0.00 0.00 63.50 63.73 1gic n PRO 20 Cb 0.46 -2.45 0.00 0.00 -0.04 0.00 0.00 33.50 31.47 1gic n PRO 20 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1gic n SER 21 N -3.13 1.99 -3.68 3.54 3.41 -1.26 -4.57 113.62 109.92 1gic n SER 21 Ca 0.14 -1.46 -0.11 0.00 -0.26 0.00 0.00 58.87 57.18 1gic n SER 21 Cb 0.50 -0.36 -0.05 0.00 -0.26 0.00 0.00 64.21 64.03 1gic n SER 21 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 1gic s TYR 22 N 0.10 -0.16 0.25 7.33 -0.85 -1.26 -4.93 117.35 117.83 1gic s TYR 22 Ca 0.00 -0.11 -0.28 0.00 -0.52 0.00 0.00 57.07 56.16 1gic s TYR 22 Cb 0.00 0.19 -0.15 0.00 0.38 0.00 0.00 41.96 42.38 1gic s TYR 22 CO 0.00 -0.64 0.80 -2.30 -1.52 0.00 0.00 175.55 171.89 1gic n PRO 23 N -0.01 0.76 -3.69 -3.49 -0.02 -1.26 -4.63 135.00 122.66 1gic n PRO 23 Ca -0.17 0.27 -0.09 0.00 -2.02 0.00 0.00 63.50 61.49 1gic n PRO 23 Cb 0.63 -1.48 -0.03 0.00 -0.02 0.00 0.00 33.50 32.60 1gic n PRO 23 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1gic s HIS 24 N -1.03 -0.26 0.12 6.00 -3.43 -0.43 -1.33 115.29 114.93 1gic s HIS 24 Ca 0.61 -0.08 0.07 0.00 -0.80 0.00 0.00 55.06 54.86 1gic s HIS 24 Cb -0.80 0.54 -0.04 0.00 -1.43 0.00 0.00 32.58 30.84 1gic s HIS 24 CO 0.58 -1.00 -0.09 0.96 -2.00 0.00 0.00 174.74 173.19 1gic s ILE 25 N -3.85 3.40 0.12 -5.38 -4.36 -0.80 -0.98 121.20 109.35 1gic s ILE 25 Ca 0.08 -1.31 -0.18 0.00 -0.26 0.00 0.00 60.65 58.98 1gic s ILE 25 Cb -0.03 -2.61 0.04 0.00 1.25 0.00 0.00 42.46 41.12 1gic s ILE 25 CO -0.03 0.08 0.45 -0.83 0.24 0.00 0.00 174.94 174.85 1gic s GLY 26 N -2.32 -0.36 -0.31 6.27 0.00 -0.66 -1.49 107.32 108.46 1gic s GLY 26 Ca 0.22 0.13 -0.11 0.00 0.00 0.00 0.00 44.72 44.96 1gic s GLY 26 CO 0.14 -0.15 0.20 -0.42 0.00 0.00 0.00 173.10 172.88 1gic s ILE 27 N -3.61 5.18 -0.28 0.90 -1.09 -0.57 -1.31 121.20 120.43 1gic s ILE 27 Ca 0.01 -0.06 -0.07 0.00 -2.23 0.00 0.00 60.65 58.30 1gic s ILE 27 Cb 0.01 -3.56 -0.00 0.00 -1.58 0.00 0.00 42.46 37.33 1gic s ILE 27 CO -0.11 0.13 0.08 -1.81 -1.23 0.00 0.00 174.94 172.00 1gic s ASP 28 N 1.72 5.11 -0.42 3.58 1.01 -0.31 -0.24 116.67 127.11 1gic s ASP 28 Ca 0.06 -0.57 -0.04 0.00 0.71 0.00 0.00 52.55 52.72 1gic s ASP 28 Cb -0.17 -1.89 0.11 0.00 1.01 0.00 0.00 42.92 41.99 1gic s ASP 28 CO 0.10 -0.15 0.23 -0.63 0.21 0.00 0.00 175.17 174.93 1gic s ILE 29 N 1.53 3.44 0.00 0.77 -1.09 -1.26 -1.05 121.20 123.53 1gic s ILE 29 Ca 0.04 -2.02 0.00 0.00 -2.23 0.00 0.00 60.65 56.44 1gic s ILE 29 Cb -0.17 -3.34 0.00 0.00 -1.58 0.00 0.00 42.46 37.37 1gic s ILE 29 CO 0.03 -0.71 0.00 0.29 -1.23 0.00 0.00 174.94 173.32 1gic n LYS 30 N 4.64 -1.18 -3.83 2.79 5.02 -0.05 -4.94 118.16 120.61 1gic n LYS 30 Ca -0.03 0.29 -0.10 0.00 -2.02 0.00 0.00 58.31 56.45 1gic n LYS 30 Cb 0.41 -4.57 -0.08 0.00 -0.02 0.00 0.00 35.03 30.77 1gic n LYS 30 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1gic s SER 31 N -2.04 0.02 0.48 4.39 0.15 -1.26 -4.93 113.70 110.50 1gic s SER 31 Ca 0.00 -0.38 0.27 0.00 0.70 0.00 0.00 55.95 56.54 1gic s SER 31 Cb 0.00 0.31 0.73 0.00 -1.71 0.00 0.00 66.02 65.35 1gic s SER 31 CO 0.00 -0.60 1.75 0.58 1.20 0.00 0.00 173.24 176.17 1gic h VAL 32 N 3.29 0.00 -1.18 4.45 2.07 -1.84 -3.40 116.25 119.64 1gic h VAL 32 Ca -0.32 -0.81 -0.48 0.00 0.82 0.00 0.00 66.70 65.90 1gic h VAL 32 Cb 1.19 1.81 -0.08 0.00 -1.52 0.00 0.00 31.29 32.70 1gic h VAL 32 CO 0.49 0.00 1.19 -0.13 0.02 0.00 0.00 177.57 179.14 1gic s ARG 33 N -3.38 3.14 0.18 1.57 0.52 -1.26 -4.94 118.95 114.77 1gic s ARG 33 Ca 0.05 -0.63 -0.31 0.00 -0.52 0.00 0.00 55.73 54.32 1gic s ARG 33 Cb 0.07 -5.07 -0.17 0.00 0.52 0.00 0.00 34.95 30.30 1gic s ARG 33 CO 0.62 -2.63 0.80 0.43 0.02 0.00 0.00 175.30 174.54 1gic n SER 34 N 10.90 -0.18 0.16 0.23 7.64 -1.26 -4.82 113.62 126.29 1gic n SER 34 Ca 0.31 1.15 0.02 0.00 1.01 0.00 0.00 58.87 61.36 1gic n SER 34 Cb 0.50 -1.05 0.23 0.00 -1.01 0.00 0.00 64.21 62.87 1gic n SER 34 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 1gic h LYS 35 N 1.87 0.00 -3.03 1.43 1.79 -0.98 -3.45 116.57 114.20 1gic h LYS 35 Ca -0.36 0.00 -0.14 0.00 -2.18 0.00 0.00 60.65 57.97 1gic h LYS 35 Cb 1.40 0.00 -0.23 0.00 -1.58 0.00 0.00 32.23 31.82 1gic h LYS 35 CO 0.61 0.51 -0.34 0.21 -1.08 0.00 0.00 179.45 179.36 1gic s LYS 36 N -3.52 0.46 0.11 3.15 2.47 -1.25 -4.98 119.74 116.18 1gic s LYS 36 Ca -0.00 0.20 0.00 0.00 -1.56 0.00 0.00 55.97 54.61 1gic s LYS 36 Cb 0.11 0.21 -0.04 0.00 -1.46 0.00 0.00 37.83 36.66 1gic s LYS 36 CO 0.73 -0.09 -0.02 0.95 0.16 0.00 0.00 175.35 177.08 1gic s THR 37 N -0.37 0.44 -0.02 3.43 -4.23 -1.26 -1.51 115.64 112.13 1gic s THR 37 Ca -0.05 -1.91 -0.04 0.00 -1.18 0.00 0.00 61.69 58.51 1gic s THR 37 Cb -0.03 -1.80 0.00 0.00 1.34 0.00 0.00 72.50 72.00 1gic s THR 37 CO 0.02 -0.74 0.10 0.00 -0.54 0.00 0.00 174.62 173.45 1gic s ALA 38 N -3.80 -0.22 0.24 3.99 0.00 -0.55 -4.96 121.76 116.46 1gic s ALA 38 Ca 0.16 0.02 -0.30 0.00 0.00 0.00 0.00 51.96 51.83 1gic s ALA 38 Cb 0.07 -0.03 -0.10 0.00 0.00 0.00 0.00 23.12 23.05 1gic s ALA 38 CO -0.03 -0.12 1.46 0.21 0.00 0.00 0.00 175.76 177.28 1gic s LYS 39 N -0.65 4.25 -0.09 0.00 2.36 -1.26 -1.89 119.74 122.45 1gic s LYS 39 Ca -0.07 2.33 0.03 0.00 -2.55 0.00 0.00 55.97 55.70 1gic s LYS 39 Cb -0.04 -3.11 0.01 0.00 -1.05 0.00 0.00 37.83 33.64 1gic s LYS 39 CO 0.00 -0.45 -0.17 -0.46 1.55 0.00 0.00 175.35 175.82 1gic s TRP 40 N 0.10 2.01 -0.99 4.03 -0.00 -0.44 -4.79 118.94 118.85 1gic s TRP 40 Ca 0.61 -0.86 -0.14 0.00 -0.00 0.00 0.00 56.10 55.71 1gic s TRP 40 Cb -0.42 -1.41 0.19 0.00 -0.00 0.00 0.00 33.47 31.83 1gic s TRP 40 CO 0.43 -0.40 1.09 -0.80 -0.00 0.00 0.00 176.95 177.26 1gic s ASN 41 N 0.68 6.90 0.28 5.86 0.02 -1.26 -4.44 114.94 122.98 1gic s ASN 41 Ca -0.13 -2.73 -0.29 0.00 -1.02 0.00 0.00 52.86 48.69 1gic s ASN 41 Cb -0.16 -2.31 -0.10 0.00 0.02 0.00 0.00 41.25 38.70 1gic s ASN 41 CO 0.03 -0.71 1.37 -0.32 0.02 0.00 0.00 177.10 177.49 1gic s MET 42 N 0.97 4.32 -0.41 -0.60 1.75 -1.26 -4.97 119.30 119.09 1gic s MET 42 Ca 0.30 2.24 -0.01 0.00 -1.25 0.00 0.00 55.69 56.97 1gic s MET 42 Cb -0.07 -3.10 0.11 0.00 2.84 0.00 0.00 34.83 34.62 1gic s MET 42 CO -0.07 -0.30 0.19 -0.65 -0.65 0.00 0.00 175.02 173.54 1gic s GLN 43 N -1.04 1.92 -0.07 4.11 -0.21 -1.26 -5.08 119.66 118.03 1gic s GLN 43 Ca 0.54 -1.90 -0.37 0.00 0.02 0.00 0.00 55.36 53.65 1gic s GLN 43 Cb -0.40 -3.50 -0.15 0.00 1.00 0.00 0.00 33.01 29.95 1gic s GLN 43 CO 0.48 -1.05 1.59 -1.71 -2.12 0.00 0.00 175.29 172.48 1gic n ASN 44 N 4.41 2.33 0.00 5.90 5.15 -1.26 -1.64 115.26 130.14 1gic n ASN 44 Ca -0.00 1.08 0.00 0.00 -0.60 0.00 0.00 54.58 55.06 1gic n ASN 44 Cb 0.41 -1.22 0.00 0.00 -0.53 0.00 0.00 39.78 38.44 1gic n ASN 44 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1gic n GLY 45 N 3.51 0.51 3.66 8.20 0.00 -0.13 -4.97 105.19 115.97 1gic n GLY 45 Ca 0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 1gic n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gic s LYS 46 N -0.18 2.58 -0.12 1.61 -0.14 -0.65 -4.94 119.74 117.89 1gic s LYS 46 Ca 0.00 -0.77 -0.29 0.00 -1.36 0.00 0.00 55.97 53.55 1gic s LYS 46 Cb 0.00 -2.55 -0.01 0.00 -1.68 0.00 0.00 37.83 33.59 1gic s LYS 46 CO 0.00 0.57 0.98 0.08 -0.76 0.00 0.00 175.35 176.22 1gic s VAL 47 N -1.19 4.80 0.49 3.17 1.01 -1.26 -4.22 120.40 123.20 1gic s VAL 47 Ca 0.22 1.99 0.03 0.00 0.00 0.00 0.00 61.98 64.22 1gic s VAL 47 Cb -0.11 -4.29 -0.02 0.00 0.00 0.00 0.00 36.38 31.96 1gic s VAL 47 CO 0.14 0.00 0.08 -0.83 0.00 0.00 0.00 175.10 174.50 1gic s GLY 48 N 1.10 2.78 -0.02 4.51 0.00 -0.26 -4.60 107.32 110.82 1gic s GLY 48 Ca 0.47 -0.97 0.02 0.00 0.00 0.00 0.00 44.72 44.24 1gic s GLY 48 CO 0.17 -2.12 -0.07 -1.59 0.00 0.00 0.00 173.10 169.49 1gic s THR 49 N -2.81 0.66 -0.05 0.90 2.01 -0.17 -1.53 115.64 114.66 1gic s THR 49 Ca 0.18 -0.29 0.06 0.00 0.31 0.00 0.00 61.69 61.94 1gic s THR 49 Cb 0.02 -0.60 -0.02 0.00 0.01 0.00 0.00 72.50 71.92 1gic s THR 49 CO 0.10 0.21 -0.22 0.00 -0.69 0.00 0.00 174.62 174.02 1gic s ALA 50 N 0.21 2.30 -0.08 7.40 0.00 -0.57 -1.20 121.76 129.82 1gic s ALA 50 Ca -0.03 -1.05 0.04 0.00 0.00 0.00 0.00 51.96 50.92 1gic s ALA 50 Cb -0.08 -0.73 0.00 0.00 0.00 0.00 0.00 23.12 22.31 1gic s ALA 50 CO 0.00 0.47 -0.20 -1.01 0.00 0.00 0.00 175.76 175.02 1gic s HIS 51 N -0.39 2.18 -0.03 0.00 3.76 0.68 -2.50 115.29 118.99 1gic s HIS 51 Ca 0.03 -0.83 0.05 0.00 -0.15 0.00 0.00 55.06 54.16 1gic s HIS 51 Cb -0.12 -1.48 -0.01 0.00 1.11 0.00 0.00 32.58 32.08 1gic s HIS 51 CO 0.02 -0.34 -0.19 0.42 -0.85 0.00 0.00 174.74 173.80 1gic s ILE 52 N 0.34 1.52 -0.00 0.60 1.09 -0.02 -1.08 121.20 123.65 1gic s ILE 52 Ca -0.15 -0.79 -0.05 0.00 -1.10 0.00 0.00 60.65 58.56 1gic s ILE 52 Cb -0.16 -1.29 -0.00 0.00 -1.06 0.00 0.00 42.46 39.95 1gic s ILE 52 CO 0.06 0.43 0.09 0.27 -0.10 0.00 0.00 174.94 175.70 1gic s ILE 53 N -0.16 0.07 -0.08 2.92 -4.36 0.04 -1.19 121.20 118.43 1gic s ILE 53 Ca 0.00 -0.61 -0.24 0.00 -0.26 0.00 0.00 60.65 59.54 1gic s ILE 53 Cb -0.10 -0.34 0.05 0.00 1.25 0.00 0.00 42.46 43.32 1gic s ILE 53 CO 0.01 -0.33 0.56 -0.47 0.24 0.00 0.00 174.94 174.95 1gic s TYR 54 N -1.12 -0.53 -0.06 1.37 5.04 -0.75 -1.21 117.35 120.10 1gic s TYR 54 Ca -0.12 1.02 -0.14 0.00 -2.44 0.00 0.00 57.07 55.38 1gic s TYR 54 Cb -0.07 0.28 0.03 0.00 0.35 0.00 0.00 41.96 42.55 1gic s TYR 54 CO 0.01 -0.48 0.34 0.54 -1.34 0.00 0.00 175.55 174.62 1gic s ASN 55 N -0.85 -0.27 0.17 4.32 4.22 -1.26 -1.77 114.94 119.50 1gic s ASN 55 Ca -0.09 0.32 0.22 0.00 -2.14 0.00 0.00 52.86 51.17 1gic s ASN 55 Cb -0.02 0.46 0.88 0.00 1.28 0.00 0.00 41.25 43.85 1gic s ASN 55 CO 0.06 -0.34 1.66 -1.54 -2.04 0.00 0.00 177.10 174.90 1gic n SER 56 N 1.81 0.46 -0.04 3.54 3.41 0.32 -0.64 113.62 122.49 1gic n SER 56 Ca -0.19 0.60 -0.12 0.00 -0.26 0.00 0.00 58.87 58.91 1gic n SER 56 Cb 0.57 -0.70 -0.10 0.00 -0.26 0.00 0.00 64.21 63.71 1gic n SER 56 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1gic h VAL 57 N 0.00 1.36 0.00 -3.33 2.07 -1.89 -3.37 116.25 111.10 1gic h VAL 57 Ca 0.00 -1.81 -0.20 0.00 0.82 0.00 0.00 66.70 65.51 1gic h VAL 57 Cb 0.38 2.48 -0.03 0.00 -1.52 0.00 0.00 31.29 32.60 1gic h VAL 57 CO 0.00 0.43 -1.00 0.44 0.02 0.00 0.00 177.57 177.45 1gic h ASP 58 N -0.90 0.00 -6.06 0.57 3.32 -1.97 -3.48 116.42 107.90 1gic h ASP 58 Ca -0.00 0.00 -0.42 0.00 0.02 0.00 0.00 57.03 56.63 1gic h ASP 58 Cb 0.73 0.00 0.05 0.00 0.22 0.00 0.00 39.33 40.33 1gic h ASP 58 CO 0.01 0.91 -0.78 0.29 -1.72 0.00 0.00 179.24 177.94 1gic n LYS 59 N -3.29 -5.72 -4.34 3.56 5.02 0.19 -4.93 118.16 108.66 1gic n LYS 59 Ca -0.02 0.67 -0.31 0.00 -2.02 0.00 0.00 58.31 56.63 1gic n LYS 59 Cb 0.92 -5.45 -0.16 0.00 -0.02 0.00 0.00 35.03 30.31 1gic n LYS 59 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1gic s ARG 60 N -6.13 2.63 -0.27 1.97 3.52 -1.26 -1.06 118.95 118.35 1gic s ARG 60 Ca 0.27 -0.70 -0.12 0.00 -0.13 0.00 0.00 55.73 55.06 1gic s ARG 60 Cb -0.13 -2.24 -0.05 0.00 -1.56 0.00 0.00 34.95 30.97 1gic s ARG 60 CO 0.80 -0.12 0.22 -1.17 -0.81 0.00 0.00 175.30 174.21 1gic s LEU 61 N 1.12 4.05 0.10 -0.88 2.96 -0.17 -4.19 118.68 121.67 1gic s LEU 61 Ca -0.02 0.09 0.06 0.00 -0.22 0.00 0.00 54.13 54.04 1gic s LEU 61 Cb -0.14 -2.18 -0.03 0.00 0.50 0.00 0.00 46.19 44.33 1gic s LEU 61 CO -0.06 -0.05 -0.15 -0.44 -1.32 0.00 0.00 176.35 174.33 1gic s SER 62 N 1.55 2.01 -0.00 3.68 0.01 -0.35 -1.63 113.70 118.97 1gic s SER 62 Ca 0.09 -0.73 -0.02 0.00 1.31 0.00 0.00 55.95 56.60 1gic s SER 62 Cb -0.15 -0.08 -0.01 0.00 0.21 0.00 0.00 66.02 65.99 1gic s SER 62 CO 0.09 -0.09 0.03 0.00 0.41 0.00 0.00 173.24 173.69 1gic s ALA 63 N -1.71 -0.06 -0.02 1.44 0.00 -0.46 -0.78 121.76 120.16 1gic s ALA 63 Ca 0.05 -0.19 0.02 0.00 0.00 0.00 0.00 51.96 51.85 1gic s ALA 63 Cb -0.07 0.04 0.00 0.00 0.00 0.00 0.00 23.12 23.09 1gic s ALA 63 CO 0.03 -0.10 -0.08 0.08 0.00 0.00 0.00 175.76 175.69 1gic s VAL 64 N -0.77 0.67 -0.06 0.00 1.01 -0.24 -1.74 120.40 119.28 1gic s VAL 64 Ca -0.08 -0.30 0.04 0.00 0.00 0.00 0.00 61.98 61.63 1gic s VAL 64 Cb -0.05 -0.61 0.00 0.00 0.00 0.00 0.00 36.38 35.72 1gic s VAL 64 CO -0.00 0.22 -0.16 -0.69 0.00 0.00 0.00 175.10 174.47 1gic s VAL 65 N 0.21 1.38 0.15 2.92 1.01 -0.60 -0.23 120.40 125.24 1gic s VAL 65 Ca -0.03 -0.66 -0.09 0.00 0.00 0.00 0.00 61.98 61.21 1gic s VAL 65 Cb -0.08 -1.21 -0.01 0.00 0.00 0.00 0.00 36.38 35.09 1gic s VAL 65 CO 0.00 0.40 0.26 -0.94 0.00 0.00 0.00 175.10 174.83 1gic s SER 66 N 0.27 0.06 0.05 3.32 1.04 -0.34 -1.79 113.70 116.32 1gic s SER 66 Ca -0.09 -0.85 0.07 0.00 0.48 0.00 0.00 55.95 55.56 1gic s SER 66 Cb -0.13 0.42 -0.03 0.00 0.10 0.00 0.00 66.02 66.38 1gic s SER 66 CO 0.03 -0.86 -0.19 -0.31 0.98 0.00 0.00 173.24 172.89 1gic s TYR 67 N -3.95 1.62 0.29 5.02 2.02 -1.26 -1.00 117.35 120.09 1gic s TYR 67 Ca 0.16 -0.38 -0.30 0.00 -0.37 0.00 0.00 57.07 56.18 1gic s TYR 67 Cb 0.04 -0.94 -0.12 0.00 -0.40 0.00 0.00 41.96 40.53 1gic s TYR 67 CO -0.02 0.10 1.48 -0.35 -1.57 0.00 0.00 175.55 175.19 1gic n PRO 68 N 1.69 2.39 -3.51 -1.71 -0.04 -1.26 -2.82 135.00 129.75 1gic n PRO 68 Ca -0.18 0.85 -0.22 0.00 -0.04 0.00 0.00 63.50 63.91 1gic n PRO 68 Cb 0.54 -2.55 0.05 0.00 -0.04 0.00 0.00 33.50 31.50 1gic n PRO 68 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1gic n ASN 69 N 1.76 -4.32 -3.65 3.54 3.02 -1.26 -5.00 115.26 109.34 1gic n ASN 69 Ca 0.08 -0.82 -0.10 0.00 -0.03 0.00 0.00 54.58 53.72 1gic n ASN 69 Cb 0.35 -4.38 -0.02 0.00 -0.61 0.00 0.00 39.78 35.12 1gic n ASN 69 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1gic s ALA 70 N -3.48 -1.30 0.29 5.41 0.00 -1.13 -5.15 121.76 116.40 1gic s ALA 70 Ca 0.29 0.03 -0.07 0.00 0.00 0.00 0.00 51.96 52.22 1gic s ALA 70 Cb -0.07 0.87 -0.06 0.00 0.00 0.00 0.00 23.12 23.86 1gic s ALA 70 CO 0.79 -0.87 0.58 -0.51 0.00 0.00 0.00 175.76 175.75 1gic s ASP 71 N -2.84 6.51 0.54 0.00 1.01 -1.26 -4.68 116.67 115.94 1gic s ASP 71 Ca 0.07 0.83 -0.06 0.00 0.71 0.00 0.00 52.55 54.09 1gic s ASP 71 Cb -0.03 -2.19 -0.02 0.00 1.01 0.00 0.00 42.92 41.69 1gic s ASP 71 CO -0.04 -0.19 0.85 -0.94 0.21 0.00 0.00 175.17 175.07 1gic s SER 72 N -2.93 6.00 -0.08 0.27 1.04 -1.26 -4.67 113.70 112.07 1gic s SER 72 Ca 0.46 0.89 0.04 0.00 0.48 0.00 0.00 55.95 57.82 1gic s SER 72 Cb -0.11 -2.06 -0.01 0.00 0.10 0.00 0.00 66.02 63.94 1gic s SER 72 CO 0.28 -0.79 -0.19 0.00 0.98 0.00 0.00 173.24 173.51 1gic s ALA 73 N -2.88 2.41 0.07 5.32 0.00 -0.74 -4.97 121.76 120.97 1gic s ALA 73 Ca 0.51 -0.98 0.04 0.00 0.00 0.00 0.00 51.96 51.52 1gic s ALA 73 Cb -0.10 -0.90 -0.03 0.00 0.00 0.00 0.00 23.12 22.09 1gic s ALA 73 CO 0.46 0.40 -0.12 0.95 0.00 0.00 0.00 175.76 177.45 1gic s THR 74 N -0.13 0.93 -0.07 0.00 -4.23 -1.26 -1.55 115.64 109.34 1gic s THR 74 Ca -0.03 -1.30 -0.06 0.00 -1.18 0.00 0.00 61.69 59.12 1gic s THR 74 Cb -0.14 -1.00 0.02 0.00 1.34 0.00 0.00 72.50 72.72 1gic s THR 74 CO 0.04 -0.32 0.17 0.54 -0.54 0.00 0.00 174.62 174.51 1gic s VAL 75 N -1.50 -0.00 0.04 2.29 0.11 -0.71 -4.78 120.40 115.86 1gic s VAL 75 Ca -0.03 0.01 0.03 0.00 -2.93 0.00 0.00 61.98 59.06 1gic s VAL 75 Cb -0.09 -0.25 -0.02 0.00 -1.53 0.00 0.00 36.38 34.49 1gic s VAL 75 CO 0.01 0.00 -0.09 -0.44 -3.33 0.00 0.00 175.10 171.26 1gic s SER 76 N 0.16 1.04 -0.10 3.54 0.01 -1.26 -1.36 113.70 115.73 1gic s SER 76 Ca -0.01 -0.51 -0.08 0.00 1.31 0.00 0.00 55.95 56.66 1gic s SER 76 Cb -0.02 0.00 0.03 0.00 0.21 0.00 0.00 66.02 66.25 1gic s SER 76 CO -0.00 -0.14 0.26 -0.47 0.41 0.00 0.00 173.24 173.30 1gic s TYR 77 N -1.21 -0.31 -0.25 2.43 5.04 -0.65 -4.94 117.35 117.46 1gic s TYR 77 Ca -0.07 0.75 -0.25 0.00 -2.44 0.00 0.00 57.07 55.07 1gic s TYR 77 Cb -0.09 0.09 -0.00 0.00 0.35 0.00 0.00 41.96 42.31 1gic s TYR 77 CO 0.01 -0.18 0.83 -0.51 -1.34 0.00 0.00 175.55 174.36 1gic s ASP 78 N 0.53 6.82 -0.18 4.32 1.01 -1.26 -1.00 116.67 126.91 1gic s ASP 78 Ca -0.03 1.01 -0.16 0.00 0.71 0.00 0.00 52.55 54.08 1gic s ASP 78 Cb -0.05 -2.44 0.05 0.00 1.01 0.00 0.00 42.92 41.50 1gic s ASP 78 CO -0.03 -0.53 0.48 0.54 0.21 0.00 0.00 175.17 175.85 1gic s VAL 79 N 2.86 -0.00 -0.57 -1.27 0.11 -0.22 -4.99 120.40 116.32 1gic s VAL 79 Ca 0.35 0.01 -0.17 0.00 -2.93 0.00 0.00 61.98 59.24 1gic s VAL 79 Cb -0.15 -0.68 0.13 0.00 -1.53 0.00 0.00 36.38 34.14 1gic s VAL 79 CO 0.08 0.00 0.56 -0.62 -3.33 0.00 0.00 175.10 171.80 1gic s ASP 80 N 0.44 6.22 0.63 3.54 2.15 -1.26 -4.33 116.67 124.06 1gic s ASP 80 Ca -0.01 -1.75 0.39 0.00 0.43 0.00 0.00 52.55 51.60 1gic s ASP 80 Cb -0.04 -2.23 2.16 0.00 -0.30 0.00 0.00 42.92 42.51 1gic s ASP 80 CO -0.02 -0.91 2.31 -0.07 -0.17 0.00 0.00 175.17 176.32 1gic h LEU 81 N 9.11 0.00 -1.80 -1.34 4.07 -1.98 -0.05 115.31 123.32 1gic h LEU 81 Ca -0.28 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.66 1gic h LEU 81 Cb 1.09 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.83 1gic h LEU 81 CO 1.04 0.01 -0.12 0.44 -1.08 0.00 0.00 178.44 178.73 1gic h ASP 82 N 0.00 0.00 0.10 -0.43 3.32 -1.91 -1.80 116.42 115.71 1gic h ASP 82 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1gic h ASP 82 Cb 0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.58 1gic h ASP 82 CO 0.00 0.12 -0.21 0.59 -1.72 0.00 0.00 179.24 178.02 1gic n ASN 83 N -3.49 1.51 -0.07 6.45 3.02 -0.03 -4.48 115.26 118.17 1gic n ASN 83 Ca -0.01 -1.25 -0.12 0.00 -0.03 0.00 0.00 54.58 53.17 1gic n ASN 83 Cb 0.27 0.15 -0.06 0.00 -0.61 0.00 0.00 39.78 39.53 1gic n ASN 83 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1gic n VAL 84 N -0.15 0.77 -3.94 2.41 0.31 -0.76 -5.06 118.33 111.91 1gic n VAL 84 Ca 0.13 -0.26 -0.30 0.00 -0.01 0.00 0.00 64.34 63.91 1gic n VAL 84 Cb 0.40 -1.24 -0.04 0.00 -0.91 0.00 0.00 33.84 32.04 1gic n VAL 84 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1gic s LEU 85 N -6.15 4.28 1.08 7.52 1.43 -0.75 -4.99 118.68 121.09 1gic s LEU 85 Ca -0.19 0.21 -0.12 0.00 -1.03 0.00 0.00 54.13 53.00 1gic s LEU 85 Cb 0.06 -2.88 0.23 0.00 0.03 0.00 0.00 46.19 43.63 1gic s LEU 85 CO 0.29 0.14 1.03 -0.81 0.23 0.00 0.00 176.35 177.23 1gic n PRO 86 N 0.13 -1.68 -0.11 1.29 -0.04 -1.26 -4.80 135.00 128.53 1gic n PRO 86 Ca -0.06 -0.45 -0.13 0.00 -0.04 0.00 0.00 63.50 62.83 1gic n PRO 86 Cb 0.52 -2.23 -0.03 0.00 -0.04 0.00 0.00 33.50 31.71 1gic n PRO 86 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1gic h GLU 87 N -2.37 0.76 -5.74 0.54 4.81 -1.95 -3.42 114.58 107.21 1gic h GLU 87 Ca -0.54 -0.37 -0.67 0.00 -0.13 0.00 0.00 59.36 57.65 1gic h GLU 87 Cb 1.31 -0.00 -0.11 0.00 0.63 0.00 0.00 28.75 30.58 1gic h GLU 87 CO 0.46 0.99 -0.55 -1.58 -0.73 0.00 0.00 179.01 177.60 1gic s TRP 88 N -4.48 3.39 0.24 0.92 0.52 -1.26 -1.73 118.94 116.53 1gic s TRP 88 Ca -0.12 0.35 -0.03 0.00 0.02 0.00 0.00 56.10 56.32 1gic s TRP 88 Cb 0.09 -1.89 -0.03 0.00 -1.15 0.00 0.00 33.47 30.50 1gic s TRP 88 CO 0.84 0.57 0.25 0.54 0.02 0.00 0.00 176.95 179.17 1gic s VAL 89 N -0.83 0.00 0.11 4.03 0.11 -0.24 -4.42 120.40 119.16 1gic s VAL 89 Ca 0.13 -1.83 0.11 0.00 -2.93 0.00 0.00 61.98 57.46 1gic s VAL 89 Cb -0.12 -2.44 -0.04 0.00 -1.53 0.00 0.00 36.38 32.25 1gic s VAL 89 CO 0.03 0.00 -0.26 -0.13 -3.33 0.00 0.00 175.10 171.40 1gic s ARG 90 N -3.97 1.45 0.13 1.54 0.52 -0.00 -0.62 118.95 118.00 1gic s ARG 90 Ca 0.35 -1.30 0.09 0.00 -0.52 0.00 0.00 55.73 54.35 1gic s ARG 90 Cb 0.04 -1.88 -0.04 0.00 0.52 0.00 0.00 34.95 33.59 1gic s ARG 90 CO 0.14 0.45 -0.19 0.14 0.02 0.00 0.00 175.30 175.85 1gic s VAL 91 N -1.02 2.74 0.16 3.52 -7.23 -1.26 -2.09 120.40 115.21 1gic s VAL 91 Ca 0.13 -1.59 -0.09 0.00 -1.81 0.00 0.00 61.98 58.62 1gic s VAL 91 Cb -0.10 -2.26 0.03 0.00 0.56 0.00 0.00 36.38 34.62 1gic s VAL 91 CO 0.05 0.07 0.47 0.61 -0.31 0.00 0.00 175.10 175.99 1gic n GLY 92 N 0.74 1.23 3.19 2.32 0.00 -0.24 -1.18 105.19 111.24 1gic n GLY 92 Ca -0.16 -1.09 -0.26 0.00 0.00 0.00 0.00 46.02 44.51 1gic n GLY 92 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1gic s LEU 93 N 0.00 2.03 0.09 0.99 1.43 -0.50 -0.68 118.68 122.03 1gic s LEU 93 Ca 0.10 -0.34 0.04 0.00 -1.03 0.00 0.00 54.13 52.89 1gic s LEU 93 Cb -0.02 -0.97 -0.03 0.00 0.03 0.00 0.00 46.19 45.19 1gic s LEU 93 CO 0.05 0.23 -0.10 -0.55 0.23 0.00 0.00 176.35 176.20 1gic s SER 94 N -0.41 1.38 0.16 2.29 0.15 -0.62 -0.50 113.70 116.15 1gic s SER 94 Ca 0.06 -0.76 -0.23 0.00 0.70 0.00 0.00 55.95 55.72 1gic s SER 94 Cb -0.08 0.01 0.07 0.00 -1.71 0.00 0.00 66.02 64.31 1gic s SER 94 CO -0.01 -0.24 0.60 0.00 1.20 0.00 0.00 173.24 174.79 1gic s ALA 95 N -2.21 -1.59 0.20 5.45 0.00 -1.00 -0.53 121.76 122.08 1gic s ALA 95 Ca 0.03 0.48 -0.19 0.00 0.00 0.00 0.00 51.96 52.28 1gic s ALA 95 Cb -0.04 0.88 0.03 0.00 0.00 0.00 0.00 23.12 23.99 1gic s ALA 95 CO 0.00 -0.77 0.57 -1.54 0.00 0.00 0.00 175.76 174.03 1gic s SER 96 N -2.74 -0.32 0.26 0.00 1.04 -1.07 -2.62 113.70 108.25 1gic s SER 96 Ca 0.01 -0.42 0.03 0.00 0.48 0.00 0.00 55.95 56.05 1gic s SER 96 Cb -0.01 0.61 -0.05 0.00 0.10 0.00 0.00 66.02 66.67 1gic s SER 96 CO -0.13 -1.09 0.05 0.42 0.98 0.00 0.00 173.24 173.47 1gic s THR 97 N -3.86 0.86 0.00 2.02 -4.23 -0.50 -0.80 115.64 109.13 1gic s THR 97 Ca 0.08 -2.01 0.00 0.00 -1.18 0.00 0.00 61.69 58.58 1gic s THR 97 Cb -0.02 -2.57 0.00 0.00 1.34 0.00 0.00 72.50 71.25 1gic s THR 97 CO -0.03 -0.12 0.00 0.61 -0.54 0.00 0.00 174.62 174.55 1gic n GLY 98 N -0.50 3.19 0.11 3.99 0.00 -1.26 -1.23 105.19 109.49 1gic n GLY 98 Ca -0.02 -0.28 -0.15 0.00 0.00 0.00 0.00 46.02 45.57 1gic n GLY 98 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1gic h LEU 99 N 0.00 0.29-10.33 0.99 5.85 -1.97 -0.06 115.31 110.09 1gic h LEU 99 Ca 0.00 -0.71 -0.49 0.00 0.84 0.00 0.00 57.88 57.52 1gic h LEU 99 Cb 0.00 -0.09 0.04 0.00 0.37 0.00 0.00 40.66 40.98 1gic h LEU 99 CO 0.00 0.96 0.14 -0.31 -0.34 0.00 0.00 178.44 178.88 1gic s TYR 100 N -3.40 3.50 0.24 1.25 2.02 -1.26 -4.86 117.35 114.85 1gic s TYR 100 Ca -0.15 0.80 -0.11 0.00 -0.37 0.00 0.00 57.07 57.23 1gic s TYR 100 Cb 0.02 -2.40 -0.01 0.00 -0.40 0.00 0.00 41.96 39.17 1gic s TYR 100 CO 0.75 -0.40 0.44 -1.59 -1.57 0.00 0.00 175.55 173.18 1gic s LYS 101 N -4.81 1.52 0.05 -0.62 -2.85 -1.24 -4.47 119.74 107.32 1gic s LYS 101 Ca 0.49 -1.30 -0.27 0.00 -1.00 0.00 0.00 55.97 53.89 1gic s LYS 101 Cb -0.10 0.45 0.09 0.00 -2.06 0.00 0.00 37.83 36.21 1gic s LYS 101 CO 0.45 -0.62 0.89 -1.83 0.10 0.00 0.00 175.35 174.35 1gic s GLU 102 N -4.02 0.95 0.37 1.78 -1.05 -1.12 -3.62 118.70 111.99 1gic s GLU 102 Ca 0.24 -0.41 -0.24 0.00 -0.15 0.00 0.00 54.97 54.41 1gic s GLU 102 Cb 0.00 0.40 -0.10 0.00 -0.44 0.00 0.00 34.13 33.99 1gic s GLU 102 CO 0.10 -0.42 0.97 0.95 0.95 0.00 0.00 175.26 177.80 1gic s THR 103 N -3.20 4.15 -0.53 1.83 -4.23 -0.25 -4.78 115.64 108.63 1gic s THR 103 Ca 0.07 1.61 0.07 0.00 -1.18 0.00 0.00 61.69 62.26 1gic s THR 103 Cb -0.01 -3.81 0.28 0.00 1.34 0.00 0.00 72.50 70.30 1gic s THR 103 CO -0.06 -0.02 0.73 0.59 -0.54 0.00 0.00 174.62 175.32 1gic n ASN 104 N 0.06 2.69 -4.70 3.99 3.02 -1.26 -3.82 115.26 115.24 1gic n ASN 104 Ca 0.04 -3.26 -0.40 0.00 -0.03 0.00 0.00 54.58 50.93 1gic n ASN 104 Cb 0.51 -0.63 -0.05 0.00 -0.61 0.00 0.00 39.78 39.00 1gic n ASN 104 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1gic s THR 105 N -2.58 5.01 -0.23 3.41 2.01 -1.07 -1.82 115.64 120.36 1gic s THR 105 Ca 0.41 1.48 -0.08 0.00 0.31 0.00 0.00 61.69 63.80 1gic s THR 105 Cb 0.21 -4.06 -0.04 0.00 0.01 0.00 0.00 72.50 68.62 1gic s THR 105 CO -0.07 0.19 0.09 -0.63 -0.69 0.00 0.00 174.62 173.51 1gic s ILE 106 N 1.17 4.66 -0.12 1.82 -1.09 -0.17 -0.80 121.20 126.67 1gic s ILE 106 Ca 0.37 -0.06 0.20 0.00 -2.23 0.00 0.00 60.65 58.93 1gic s ILE 106 Cb -0.17 -3.16 -0.24 0.00 -1.58 0.00 0.00 42.46 37.30 1gic s ILE 106 CO 0.17 0.36 0.48 0.18 -1.23 0.00 0.00 174.94 174.89 1gic n LEU 107 N 4.53 0.25 -3.50 2.97 4.77 -0.16 -1.61 117.00 124.25 1gic n LEU 107 Ca -0.16 0.11 -0.15 0.00 -0.03 0.00 0.00 56.01 55.78 1gic n LEU 107 Cb 0.52 0.16 -0.04 0.00 -2.33 0.00 0.00 43.42 41.72 1gic n LEU 107 CO 0.33 0.16 0.37 -0.94 -1.33 0.00 0.00 177.39 175.98 1gic s SER 108 N -5.14 -0.55 -0.18 -1.43 1.04 -1.23 -4.43 113.70 101.78 1gic s SER 108 Ca -0.07 0.28 -0.14 0.00 0.48 0.00 0.00 55.95 56.51 1gic s SER 108 Cb 0.10 0.54 0.05 0.00 0.10 0.00 0.00 66.02 66.82 1gic s SER 108 CO 0.86 -0.77 0.47 0.86 0.98 0.00 0.00 173.24 175.63 1gic s TRP 109 N -2.51 -0.61 0.02 5.02 -0.00 -0.35 -1.71 118.94 118.81 1gic s TRP 109 Ca -0.05 1.36 -0.02 0.00 -0.00 0.00 0.00 56.10 57.40 1gic s TRP 109 Cb -0.01 0.26 -0.02 0.00 -0.00 0.00 0.00 33.47 33.71 1gic s TRP 109 CO -0.02 -0.32 0.01 -1.54 -0.00 0.00 0.00 176.95 175.09 1gic s SER 110 N 0.85 0.20 -0.08 5.86 1.04 0.27 -0.30 113.70 121.53 1gic s SER 110 Ca -0.05 -0.47 -0.13 0.00 0.48 0.00 0.00 55.95 55.78 1gic s SER 110 Cb -0.05 0.14 0.03 0.00 0.10 0.00 0.00 66.02 66.23 1gic s SER 110 CO -0.07 -0.34 0.33 0.12 0.98 0.00 0.00 173.24 174.26 1gic s PHE 111 N -1.65 -0.29 -0.02 5.02 5.36 -0.61 -1.49 117.98 124.30 1gic s PHE 111 Ca -0.14 0.64 -0.01 0.00 -0.96 0.00 0.00 56.93 56.46 1gic s PHE 111 Cb -0.08 0.12 0.02 0.00 -0.34 0.00 0.00 43.02 42.74 1gic s PHE 111 CO -0.01 -0.27 0.05 0.99 -1.46 0.00 0.00 175.22 174.51 1gic s THR 112 N -0.48 -0.03 -0.03 0.12 2.01 -0.59 -1.63 115.64 115.01 1gic s THR 112 Ca -0.06 0.12 0.02 0.00 0.31 0.00 0.00 61.69 62.08 1gic s THR 112 Cb -0.04 -0.09 0.01 0.00 0.01 0.00 0.00 72.50 72.39 1gic s THR 112 CO 0.02 0.05 -0.09 -0.55 -0.69 0.00 0.00 174.62 173.36 1gic s SER 113 N 0.64 1.21 -0.01 3.53 0.15 -0.05 -1.28 113.70 117.90 1gic s SER 113 Ca -0.05 -0.19 0.01 0.00 0.70 0.00 0.00 55.95 56.42 1gic s SER 113 Cb -0.07 -0.37 0.00 0.00 -1.71 0.00 0.00 66.02 63.87 1gic s SER 113 CO -0.02 0.05 -0.02 -0.54 1.20 0.00 0.00 173.24 173.91 1gic s LYS 114 N 0.30 0.20 -0.25 5.44 1.02 0.07 -1.79 119.74 124.73 1gic s LYS 114 Ca -0.05 -0.05 0.01 0.00 0.02 0.00 0.00 55.97 55.91 1gic s LYS 114 Cb -0.10 -0.24 0.04 0.00 -0.52 0.00 0.00 37.83 37.02 1gic s LYS 114 CO 0.01 0.01 -0.11 -0.51 -0.92 0.00 0.00 175.35 173.83 1gic s LEU 115 N 0.18 3.17 -0.36 3.17 1.43 -0.70 -1.35 118.68 124.22 1gic s LEU 115 Ca -0.01 -1.12 -0.11 0.00 -1.03 0.00 0.00 54.13 51.85 1gic s LEU 115 Cb -0.04 -1.58 0.02 0.00 0.03 0.00 0.00 46.19 44.63 1gic s LEU 115 CO -0.00 -0.15 0.19 -0.54 0.23 0.00 0.00 176.35 176.08 1gic s LYS 116 N 1.20 2.94 0.63 1.70 1.02 0.00 -0.87 119.74 126.36 1gic s LYS 116 Ca -0.04 -1.00 -0.07 0.00 0.02 0.00 0.00 55.97 54.88 1gic s LYS 116 Cb -0.18 -3.69 0.01 0.00 -0.52 0.00 0.00 37.83 33.45 1gic s LYS 116 CO -0.06 -0.64 0.96 0.45 -0.92 0.00 0.00 175.35 175.15 1gic s SER 117 N 1.57 5.50 0.19 2.83 0.15 -0.07 0.37 113.70 124.24 1gic s SER 117 Ca 0.03 0.81 -0.22 0.00 0.70 0.00 0.00 55.95 57.27 1gic s SER 117 Cb -0.19 -1.73 0.12 0.00 -1.71 0.00 0.00 66.02 62.52 1gic s SER 117 CO 0.07 -1.17 1.57 -0.55 1.20 0.00 0.00 173.24 174.35 1gic h ASN 118 N -0.34 -1.35 -2.71 5.45 7.08 -1.82 -3.25 115.58 118.64 1gic h ASN 118 Ca -0.45 0.26 -0.55 0.00 -3.08 0.00 0.00 56.30 52.47 1gic h ASN 118 Cb 1.26 0.66 -0.08 0.00 -2.08 0.00 0.00 38.32 38.08 1gic h ASN 118 CO 0.62 -0.31 0.99 -0.44 -2.08 0.00 0.00 177.43 176.21 1gic s SER 119 N -5.23 6.27 1.04 6.14 0.01 -1.26 -4.95 113.70 115.73 1gic s SER 119 Ca -0.14 -0.26 -0.13 0.00 1.31 0.00 0.00 55.95 56.72 1gic s SER 119 Cb 0.16 -2.55 0.14 0.00 0.21 0.00 0.00 66.02 63.99 1gic s SER 119 CO 0.69 -1.67 0.66 1.07 0.41 0.00 0.00 173.24 174.39 1gic n THR 120 N 6.46 0.00 -2.87 1.44 5.66 -1.23 -3.60 114.28 120.15 1gic n THR 120 Ca 0.05 -0.23 -0.09 0.00 -3.05 0.00 0.00 64.05 60.72 1gic n THR 120 Cb 0.49 -0.81 0.03 0.00 -1.55 0.00 0.00 70.33 68.49 1gic n THR 120 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 175.07 173.43 1gic n HIS 121 N -4.30 -1.07 -3.03 1.09 8.25 -1.26 -4.98 115.22 109.92 1gic n HIS 121 Ca 0.06 0.37 -0.18 0.00 -0.26 0.00 0.00 57.72 57.71 1gic n HIS 121 Cb 0.55 -2.54 -0.03 0.00 1.12 0.00 0.00 29.99 29.10 1gic n HIS 121 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1gic n GLU 122 N -2.22 0.68 -4.50 -0.41 1.02 -1.24 -5.10 120.64 108.89 1gic n GLU 122 Ca -0.00 -2.64 -0.32 0.00 -0.02 0.00 0.00 57.16 54.17 1gic n GLU 122 Cb 0.53 -1.35 -0.11 0.00 -0.02 0.00 0.00 31.44 30.49 1gic n GLU 122 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 1gic s THR 123 N -0.33 3.65 0.01 2.62 -1.32 -1.26 -0.89 115.64 118.12 1gic s THR 123 Ca 0.34 -0.71 0.04 0.00 -1.21 0.00 0.00 61.69 60.14 1gic s THR 123 Cb 0.17 -2.57 -0.03 0.00 -1.51 0.00 0.00 72.50 68.56 1gic s THR 123 CO -0.16 0.44 -0.10 0.20 -2.21 0.00 0.00 174.62 172.78 1gic s ASN 124 N -1.29 4.38 0.02 8.08 0.02 -0.05 -4.97 114.94 121.12 1gic s ASN 124 Ca 0.16 -0.22 -0.14 0.00 -1.02 0.00 0.00 52.86 51.64 1gic s ASN 124 Cb -0.11 -0.94 0.02 0.00 0.02 0.00 0.00 41.25 40.24 1gic s ASN 124 CO 0.06 0.28 0.31 0.00 0.02 0.00 0.00 177.10 177.77 1gic s ALA 125 N -0.96 -0.73 -0.05 0.60 0.00 -1.26 -1.73 121.76 117.63 1gic s ALA 125 Ca 0.16 0.15 -0.02 0.00 0.00 0.00 0.00 51.96 52.25 1gic s ALA 125 Cb -0.11 0.21 0.04 0.00 0.00 0.00 0.00 23.12 23.26 1gic s ALA 125 CO 0.07 -0.35 0.10 -1.17 0.00 0.00 0.00 175.76 174.40 1gic s LEU 126 N -1.75 0.64 -0.04 0.00 0.20 -0.74 -5.01 118.68 111.98 1gic s LEU 126 Ca -0.09 0.19 -0.03 0.00 0.69 0.00 0.00 54.13 54.89 1gic s LEU 126 Cb -0.03 0.13 0.02 0.00 -0.43 0.00 0.00 46.19 45.89 1gic s LEU 126 CO 0.00 -0.17 0.10 -2.28 -0.29 0.00 0.00 176.35 173.71 1gic s HIS 127 N 1.45 -0.11 0.02 5.38 2.46 -1.26 -0.87 115.29 122.37 1gic s HIS 127 Ca -0.05 0.32 0.01 0.00 0.47 0.00 0.00 55.06 55.80 1gic s HIS 127 Cb -0.12 -0.05 -0.02 0.00 -0.13 0.00 0.00 32.58 32.26 1gic s HIS 127 CO -0.05 -0.10 -0.04 -0.59 -2.47 0.00 0.00 174.74 171.50 1gic s PHE 128 N 0.62 0.31 -0.02 3.88 -0.12 -0.65 -5.00 117.98 117.01 1gic s PHE 128 Ca -0.05 -0.40 0.00 0.00 -0.05 0.00 0.00 56.93 56.44 1gic s PHE 128 Cb -0.07 -0.21 0.02 0.00 -0.63 0.00 0.00 43.02 42.14 1gic s PHE 128 CO -0.03 -0.12 -0.00 1.41 -0.05 0.00 0.00 175.22 176.43 1gic s MET 129 N -1.13 0.23 -0.22 1.99 1.75 -1.26 -1.57 119.30 119.08 1gic s MET 129 Ca -0.11 0.06 0.01 0.00 -1.25 0.00 0.00 55.69 54.41 1gic s MET 129 Cb -0.08 -0.38 0.05 0.00 2.84 0.00 0.00 34.83 37.26 1gic s MET 129 CO -0.00 -0.10 -0.10 -0.06 -0.65 0.00 0.00 175.02 174.11 1gic s PHE 130 N 0.79 2.66 -1.37 4.11 0.08 0.58 -4.94 117.98 119.90 1gic s PHE 130 Ca -0.08 -1.84 0.12 0.00 0.12 0.00 0.00 56.93 55.26 1gic s PHE 130 Cb -0.11 -1.71 0.06 0.00 -0.57 0.00 0.00 43.02 40.69 1gic s PHE 130 CO -0.02 -0.79 0.82 0.09 -0.10 0.00 0.00 175.22 175.22 1gic n ASN 131 N 4.61 1.77 -3.70 1.36 3.02 -1.26 -1.21 115.26 119.85 1gic n ASN 131 Ca -0.14 -1.39 -0.12 0.00 -0.03 0.00 0.00 54.58 52.90 1gic n ASN 131 Cb 0.45 0.17 -0.10 0.00 -0.61 0.00 0.00 39.78 39.69 1gic n ASN 131 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1gic s GLN 132 N -1.20 0.53 -0.04 3.52 -0.44 -1.26 -4.79 119.66 115.97 1gic s GLN 132 Ca 0.13 0.74 0.02 0.00 -2.50 0.00 0.00 55.36 53.75 1gic s GLN 132 Cb 0.10 0.18 -0.03 0.00 -1.64 0.00 0.00 33.01 31.62 1gic s GLN 132 CO 0.21 -0.10 -0.07 -0.06 0.50 0.00 0.00 175.29 175.76 1gic s PHE 133 N 0.67 2.90 0.39 1.67 0.08 -0.29 -5.01 117.98 118.39 1gic s PHE 133 Ca -0.03 -0.02 0.08 0.00 0.12 0.00 0.00 56.93 57.08 1gic s PHE 133 Cb -0.05 -1.66 -0.04 0.00 -0.57 0.00 0.00 43.02 40.70 1gic s PHE 133 CO -0.05 0.34 0.22 -1.54 -0.10 0.00 0.00 175.22 174.09 1gic s SER 134 N -1.03 4.68 0.45 1.36 1.04 -1.26 -3.94 113.70 114.99 1gic s SER 134 Ca 0.14 -0.89 0.19 0.00 0.48 0.00 0.00 55.95 55.87 1gic s SER 134 Cb -0.11 -0.58 1.16 0.00 0.10 0.00 0.00 66.02 66.59 1gic s SER 134 CO 0.04 -0.50 1.91 0.11 0.98 0.00 0.00 173.24 175.78 1gic h LYS 135 N 1.35 0.29 -3.03 4.02 1.79 -1.83 -3.23 116.57 115.94 1gic h LYS 135 Ca -0.43 -0.02 -0.61 0.00 -2.18 0.00 0.00 60.65 57.42 1gic h LYS 135 Cb 1.26 -0.07 -0.40 0.00 -1.58 0.00 0.00 32.23 31.44 1gic h LYS 135 CO 0.65 0.19 -0.74 0.34 -1.08 0.00 0.00 179.45 178.81 1gic s ASP 136 N -5.88 3.66 -0.97 0.86 2.15 -1.26 -4.77 116.67 110.46 1gic s ASP 136 Ca -0.07 -2.52 -0.13 0.00 0.43 0.00 0.00 52.55 50.25 1gic s ASP 136 Cb 0.21 -1.00 0.21 0.00 -0.30 0.00 0.00 42.92 42.05 1gic s ASP 136 CO 0.77 -0.28 1.00 -1.58 -0.17 0.00 0.00 175.17 174.91 1gic s GLN 137 N 0.49 3.83 0.24 4.34 2.00 -1.23 -4.92 119.66 124.41 1gic s GLN 137 Ca 0.17 -2.56 0.21 0.00 -2.00 0.00 0.00 55.36 51.17 1gic s GLN 137 Cb -0.24 -4.62 0.95 0.00 0.80 0.00 0.00 33.01 29.90 1gic s GLN 137 CO -0.01 -1.42 1.63 1.63 -0.50 0.00 0.00 175.29 176.62 1gic n LYS 138 N 4.27 0.15 -0.35 1.67 5.02 -1.26 -2.34 118.16 125.31 1gic n LYS 138 Ca 0.21 0.49 0.06 0.00 -2.02 0.00 0.00 58.31 57.05 1gic n LYS 138 Cb 0.45 -1.85 0.22 0.00 -0.02 0.00 0.00 35.03 33.83 1gic n LYS 138 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1gic n ASP 139 N -2.14 2.98 -4.14 4.39 5.68 -1.26 -4.85 116.55 117.21 1gic n ASP 139 Ca 0.01 -2.23 -0.26 0.00 -0.50 0.00 0.00 54.79 51.81 1gic n ASP 139 Cb 0.14 -0.43 -0.16 0.00 -1.14 0.00 0.00 41.12 39.54 1gic n ASP 139 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 1gic s LEU 140 N -1.27 1.93 -0.40 -2.12 1.43 -0.99 -0.83 118.68 116.44 1gic s LEU 140 Ca 0.31 -0.35 -0.19 0.00 -1.03 0.00 0.00 54.13 52.87 1gic s LEU 140 Cb 0.19 -0.98 0.01 0.00 0.03 0.00 0.00 46.19 45.45 1gic s LEU 140 CO 0.16 0.16 0.54 -0.63 0.23 0.00 0.00 176.35 176.81 1gic s ILE 141 N -0.01 4.97 -0.10 -0.59 1.01 -0.09 -4.87 121.20 121.52 1gic s ILE 141 Ca -0.03 0.07 -0.16 0.00 0.00 0.00 0.00 60.65 60.53 1gic s ILE 141 Cb -0.11 -4.07 -0.05 0.00 0.01 0.00 0.00 42.46 38.25 1gic s ILE 141 CO 0.02 -0.40 0.42 -0.76 0.00 0.00 0.00 174.94 174.21 1gic s LEU 142 N 2.47 4.32 0.22 2.97 1.43 -1.26 -1.25 118.68 127.58 1gic s LEU 142 Ca 0.18 0.78 0.11 0.00 -1.03 0.00 0.00 54.13 54.18 1gic s LEU 142 Cb -0.15 -2.60 -0.05 0.00 0.03 0.00 0.00 46.19 43.42 1gic s LEU 142 CO 0.15 0.10 -0.21 -1.10 0.23 0.00 0.00 176.35 175.52 1gic s GLN 143 N 0.17 1.62 7.18 1.70 -0.21 0.10 -4.96 119.66 125.25 1gic s GLN 143 Ca 0.23 -1.59 0.00 0.00 0.02 0.00 0.00 55.36 54.02 1gic s GLN 143 Cb -0.15 -1.84 0.00 0.00 1.00 0.00 0.00 33.01 32.02 1gic s GLN 143 CO 0.10 0.38 0.00 0.41 -2.12 0.00 0.00 175.29 174.05 1gic n GLY 144 N -0.06 3.28 0.35 3.09 0.00 -1.26 -1.50 105.19 109.10 1gic n GLY 144 Ca -0.10 -0.22 0.10 0.00 0.00 0.00 0.00 46.02 45.80 1gic n GLY 144 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1gic n ASP 145 N 3.59 1.05 -4.77 1.61 8.00 -0.01 -4.92 116.55 121.10 1gic n ASP 145 Ca 0.00 -1.60 -0.41 0.00 0.71 0.00 0.00 54.79 53.49 1gic n ASP 145 Cb 0.00 -0.06 -0.02 0.00 -0.02 0.00 0.00 41.12 41.02 1gic n ASP 145 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1gic s ALA 146 N -1.87 3.51 0.05 2.24 0.00 -1.16 -4.24 121.76 120.30 1gic s ALA 146 Ca 0.31 1.31 -0.03 0.00 0.00 0.00 0.00 51.96 53.55 1gic s ALA 146 Cb 0.16 -3.50 -0.03 0.00 0.00 0.00 0.00 23.12 19.75 1gic s ALA 146 CO 0.25 -0.71 0.02 0.95 0.00 0.00 0.00 175.76 176.26 1gic s THR 147 N -1.09 0.19 0.32 0.00 -4.23 -0.38 -4.78 115.64 105.67 1gic s THR 147 Ca 0.50 -1.58 0.05 0.00 -1.18 0.00 0.00 61.69 59.48 1gic s THR 147 Cb -0.41 -1.35 -0.06 0.00 1.34 0.00 0.00 72.50 72.02 1gic s THR 147 CO 0.54 -0.87 -0.00 0.42 -0.54 0.00 0.00 174.62 174.17 1gic s THR 148 N -3.63 1.50 0.00 3.99 -4.23 -1.26 -0.78 115.64 111.23 1gic s THR 148 Ca 0.04 -2.05 0.00 0.00 -1.18 0.00 0.00 61.69 58.50 1gic s THR 148 Cb 0.05 -2.67 0.00 0.00 1.34 0.00 0.00 72.50 71.23 1gic s THR 148 CO -0.09 -0.14 0.00 0.61 -0.54 0.00 0.00 174.62 174.46 1gic n GLY 149 N -0.68 3.01 0.00 3.99 0.00 -0.60 -4.44 105.19 106.47 1gic n GLY 149 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1gic n GLY 149 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1gic n THR 150 N -2.00 0.00 -2.23 2.61 -1.04 -1.25 -2.28 114.28 108.09 1gic n THR 150 Ca 0.00 1.30 -0.28 0.00 -2.04 0.00 0.00 64.05 63.03 1gic n THR 150 Cb 0.00 -1.90 0.01 0.00 -1.82 0.00 0.00 70.33 66.62 1gic n THR 150 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 1gic n ASP 151 N -2.03 5.20 -0.69 8.00 2.03 -1.26 -4.75 116.55 123.05 1gic n ASP 151 Ca 0.00 -3.74 -0.08 0.00 0.52 0.00 0.00 54.79 51.49 1gic n ASP 151 Cb 0.00 -0.51 -0.02 0.00 -0.72 0.00 0.00 41.12 39.87 1gic n ASP 151 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1gic n GLY 152 N -0.58 0.60 3.69 0.27 0.00 -0.96 -4.97 105.19 103.23 1gic n GLY 152 Ca 0.43 -0.65 -0.24 0.00 0.00 0.00 0.00 46.02 45.56 1gic n GLY 152 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1gic s ASN 153 N -2.81 4.38 -0.27 1.61 0.01 -1.26 -1.14 114.94 115.46 1gic s ASN 153 Ca 0.00 -0.96 -0.09 0.00 -0.71 0.00 0.00 52.86 51.10 1gic s ASN 153 Cb 0.00 -0.57 -0.04 0.00 0.41 0.00 0.00 41.25 41.05 1gic s ASN 153 CO 0.00 -0.34 0.13 -0.22 -1.51 0.00 0.00 177.10 175.17 1gic s LEU 154 N -3.80 3.77 -0.45 0.60 2.96 -0.63 -1.55 118.68 119.57 1gic s LEU 154 Ca 0.37 -0.14 -0.16 0.00 -0.22 0.00 0.00 54.13 53.99 1gic s LEU 154 Cb 0.00 -2.02 0.05 0.00 0.50 0.00 0.00 46.19 44.72 1gic s LEU 154 CO 0.21 -0.06 0.38 -1.61 -1.32 0.00 0.00 176.35 173.95 1gic s GLU 155 N 1.68 2.99 0.34 1.98 0.41 0.04 -1.00 118.70 125.14 1gic s GLU 155 Ca 0.07 -1.18 0.15 0.00 -0.41 0.00 0.00 54.97 53.59 1gic s GLU 155 Cb -0.16 -4.07 0.57 0.00 -1.78 0.00 0.00 34.13 28.70 1gic s GLU 155 CO 0.07 -0.93 1.70 -0.07 -0.49 0.00 0.00 175.26 175.54 1gic h LEU 156 N 8.77 0.00 -8.84 1.80 3.38 -1.62 -1.02 115.31 117.79 1gic h LEU 156 Ca -0.28 0.00 -0.42 0.00 0.09 0.00 0.00 57.88 57.27 1gic h LEU 156 Cb 1.11 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.72 1gic h LEU 156 CO 0.83 0.47 -0.73 0.42 0.09 0.00 0.00 178.44 179.52 1gic s THR 157 N -3.69 1.58 0.20 0.22 -4.23 -1.26 -3.20 115.64 105.26 1gic s THR 157 Ca -0.01 -2.17 -0.32 0.00 -1.18 0.00 0.00 61.69 58.01 1gic s THR 157 Cb 0.12 -2.01 -0.13 0.00 1.34 0.00 0.00 72.50 71.82 1gic s THR 157 CO 0.72 -0.62 1.57 0.54 -0.54 0.00 0.00 174.62 176.29 1gic n ARG 158 N -0.34 2.32 -3.79 3.99 1.74 -1.26 -4.76 116.66 114.56 1gic n ARG 158 Ca -0.08 0.83 -0.14 0.00 -0.77 0.00 0.00 57.85 57.69 1gic n ARG 158 Cb 0.61 -2.59 -0.15 0.00 -1.02 0.00 0.00 32.46 29.30 1gic n ARG 158 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1gic s VAL 159 N 0.64 -0.04 0.97 1.55 0.11 -1.26 -0.92 120.40 121.45 1gic s VAL 159 Ca 0.74 0.13 -0.12 0.00 -2.93 0.00 0.00 61.98 59.80 1gic s VAL 159 Cb -0.62 -0.13 0.17 0.00 -1.53 0.00 0.00 36.38 34.28 1gic s VAL 159 CO 0.41 0.05 1.09 -0.94 -3.33 0.00 0.00 175.10 172.38 1gic s SER 160 N 0.75 2.84 0.45 3.54 1.04 0.67 -4.85 113.70 118.15 1gic s SER 160 Ca -0.06 1.26 0.14 0.00 0.48 0.00 0.00 55.95 57.77 1gic s SER 160 Cb -0.08 -1.92 1.08 0.00 0.10 0.00 0.00 66.02 65.19 1gic s SER 160 CO -0.03 -3.00 2.02 0.28 0.98 0.00 0.00 173.24 173.49 1gic h SER 161 N -1.80 0.29 -0.26 7.02 0.02 -2.01 0.23 113.55 117.04 1gic h SER 161 Ca -0.53 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.42 1gic h SER 161 Cb 1.32 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.80 1gic h SER 161 CO 0.57 0.19 0.00 -0.46 -1.14 0.00 0.00 176.83 175.99 1gic n ASN 162 N -4.47 2.49 0.00 3.07 6.94 -1.26 -4.90 115.26 117.13 1gic n ASN 162 Ca 0.07 -2.25 0.00 0.00 -0.02 0.00 0.00 54.58 52.38 1gic n ASN 162 Cb 0.30 -0.45 0.00 0.00 -2.36 0.00 0.00 39.78 37.27 1gic n ASN 162 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1gic n GLY 163 N 0.50 0.70 3.64 4.83 0.00 0.80 -5.04 105.19 110.62 1gic n GLY 163 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 1gic n GLY 163 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1gic s SER 164 N -2.38 6.70 0.36 1.61 0.01 -1.25 -4.71 113.70 114.05 1gic s SER 164 Ca 0.00 0.86 -0.28 0.00 1.31 0.00 0.00 55.95 57.84 1gic s SER 164 Cb 0.00 -2.37 -0.11 0.00 0.21 0.00 0.00 66.02 63.74 1gic s SER 164 CO 0.00 -0.38 1.47 -0.81 0.41 0.00 0.00 173.24 173.92 1gic n PRO 165 N 5.57 2.59 -4.01 12.44 -0.04 -1.26 -0.24 135.00 150.05 1gic n PRO 165 Ca 0.01 0.91 -0.28 0.00 -0.04 0.00 0.00 63.50 64.10 1gic n PRO 165 Cb 0.49 -2.62 -0.05 0.00 -0.04 0.00 0.00 33.50 31.28 1gic n PRO 165 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1gic s GLN 166 N -1.90 3.15 0.75 0.54 -1.52 -0.10 -4.84 119.66 115.74 1gic s GLN 166 Ca 0.55 -0.68 -0.10 0.00 -1.95 0.00 0.00 55.36 53.17 1gic s GLN 166 Cb -0.49 -2.82 0.05 0.00 -0.22 0.00 0.00 33.01 29.53 1gic s GLN 166 CO 0.62 0.53 1.11 0.20 -0.25 0.00 0.00 175.29 177.50 1gic s GLY 167 N -2.90 1.62 -1.57 3.09 0.00 -1.26 -4.38 107.32 101.92 1gic s GLY 167 Ca 0.32 -0.63 -0.11 0.00 0.00 0.00 0.00 44.72 44.30 1gic s GLY 167 CO 0.25 -0.21 0.67 1.44 0.00 0.00 0.00 173.10 175.25 1gic n SER 168 N -3.11 -2.32 -4.59 1.64 7.64 -0.04 -4.84 113.62 108.01 1gic n SER 168 Ca 0.07 -0.98 -0.27 0.00 1.01 0.00 0.00 58.87 58.71 1gic n SER 168 Cb 0.60 -3.01 -0.09 0.00 -1.01 0.00 0.00 64.21 60.70 1gic n SER 168 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1gic s SER 169 N -3.72 4.34 -0.25 6.43 0.15 -1.22 -4.95 113.70 114.48 1gic s SER 169 Ca 0.44 -0.55 -0.19 0.00 0.70 0.00 0.00 55.95 56.35 1gic s SER 169 Cb -0.24 -0.77 0.07 0.00 -1.71 0.00 0.00 66.02 63.37 1gic s SER 169 CO 0.90 0.10 0.64 0.54 1.20 0.00 0.00 173.24 176.62 1gic s VAL 170 N -1.73 -0.00 0.06 4.45 0.11 -1.26 -1.41 120.40 120.61 1gic s VAL 170 Ca 0.25 0.01 -0.21 0.00 -2.93 0.00 0.00 61.98 59.10 1gic s VAL 170 Cb -0.09 -0.91 0.05 0.00 -1.53 0.00 0.00 36.38 33.90 1gic s VAL 170 CO 0.16 0.00 0.50 -0.83 -3.33 0.00 0.00 175.10 171.60 1gic s GLY 171 N 0.91 -0.40 0.02 6.54 0.00 -1.08 -0.83 107.32 112.48 1gic s GLY 171 Ca -0.04 0.48 -0.02 0.00 0.00 0.00 0.00 44.72 45.14 1gic s GLY 171 CO -0.08 0.19 0.02 0.50 0.00 0.00 0.00 173.10 173.74 1gic s ARG 172 N -2.65 0.41 -0.14 2.90 0.52 -0.56 -2.36 118.95 117.06 1gic s ARG 172 Ca -0.04 -0.63 0.01 0.00 -0.52 0.00 0.00 55.73 54.54 1gic s ARG 172 Cb -0.00 0.15 0.02 0.00 0.52 0.00 0.00 34.95 35.64 1gic s ARG 172 CO -0.03 -0.08 -0.15 0.00 0.02 0.00 0.00 175.30 175.06 1gic s ALA 173 N -1.78 1.86 -0.00 2.13 0.00 0.34 -0.73 121.76 123.58 1gic s ALA 173 Ca -0.13 -0.89 0.06 0.00 0.00 0.00 0.00 51.96 51.00 1gic s ALA 173 Cb -0.07 -1.01 -0.03 0.00 0.00 0.00 0.00 23.12 22.02 1gic s ALA 173 CO -0.02 -0.30 -0.17 -0.51 0.00 0.00 0.00 175.76 174.77 1gic s LEU 174 N 1.34 2.63 0.33 0.00 2.01 -0.38 -1.42 118.68 123.19 1gic s LEU 174 Ca 0.02 -0.32 -0.28 0.00 0.01 0.00 0.00 54.13 53.55 1gic s LEU 174 Cb -0.13 -1.53 -0.10 0.00 0.01 0.00 0.00 46.19 44.44 1gic s LEU 174 CO -0.08 0.30 1.23 0.12 1.01 0.00 0.00 176.35 178.92 1gic s PHE 175 N -0.82 3.18 0.21 0.29 5.36 -0.33 -0.91 117.98 124.96 1gic s PHE 175 Ca 0.13 1.51 -0.09 0.00 -0.96 0.00 0.00 56.93 57.53 1gic s PHE 175 Cb -0.11 -3.53 0.30 0.00 -0.34 0.00 0.00 43.02 39.34 1gic s PHE 175 CO 0.03 -1.44 1.75 -0.92 -1.46 0.00 0.00 175.22 173.18 1gic h TYR 176 N 3.33 0.42 -3.54 10.12 5.03 -1.32 -3.43 116.97 127.59 1gic h TYR 176 Ca -0.48 0.03 -0.52 0.00 2.58 0.00 0.00 58.73 60.33 1gic h TYR 176 Cb 1.22 -0.09 -0.02 0.00 1.55 0.00 0.00 36.73 39.39 1gic h TYR 176 CO 0.56 0.11 0.34 0.00 -1.32 0.00 0.00 178.16 177.84 1gic s ALA 177 N -6.08 3.25 0.34 1.82 0.00 -1.26 -5.03 121.76 114.80 1gic s ALA 177 Ca -0.13 0.54 -0.26 0.00 0.00 0.00 0.00 51.96 52.11 1gic s ALA 177 Cb 0.17 -3.25 -0.14 0.00 0.00 0.00 0.00 23.12 19.91 1gic s ALA 177 CO 0.75 -0.03 0.76 -2.30 0.00 0.00 0.00 175.76 174.94 1gic n PRO 178 N 2.88 0.85 -4.83 0.00 -0.02 -1.26 -4.80 135.00 127.82 1gic n PRO 178 Ca 0.02 0.30 -0.33 0.00 -2.02 0.00 0.00 63.50 61.47 1gic n PRO 178 Cb 0.49 -1.61 -0.14 0.00 -0.02 0.00 0.00 33.50 32.23 1gic n PRO 178 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1gic s VAL 179 N -1.22 3.08 -0.79 -1.45 1.01 0.21 -4.91 120.40 116.32 1gic s VAL 179 Ca 0.62 -0.69 -0.22 0.00 0.00 0.00 0.00 61.98 61.69 1gic s VAL 179 Cb -0.69 -2.24 0.09 0.00 0.00 0.00 0.00 36.38 33.54 1gic s VAL 179 CO 0.58 0.56 1.09 -2.28 0.00 0.00 0.00 175.10 175.05 1gic s HIS 180 N -0.27 2.79 -0.90 5.22 2.46 -1.26 -1.08 115.29 122.24 1gic s HIS 180 Ca 0.02 -0.84 0.26 0.00 0.47 0.00 0.00 55.06 54.97 1gic s HIS 180 Cb -0.13 -4.35 0.67 0.00 -0.13 0.00 0.00 32.58 28.64 1gic s HIS 180 CO 0.03 -1.65 1.54 0.44 -2.47 0.00 0.00 174.74 172.63 1gic n ILE 181 N 5.90 0.12 -3.49 0.89 -6.64 -0.71 -4.90 119.36 110.53 1gic n ILE 181 Ca 0.10 -0.08 -0.11 0.00 -1.77 0.00 0.00 62.75 60.88 1gic n ILE 181 Cb 0.47 -0.07 -0.03 0.00 -1.44 0.00 0.00 39.64 38.58 1gic n ILE 181 CO 0.00 0.00 0.00 -1.66 -1.77 0.00 0.00 176.55 173.12 1gic s TRP 182 N -3.04 -0.43 -0.22 4.28 1.48 -1.25 -4.81 118.94 114.95 1gic s TRP 182 Ca 0.11 0.19 -0.26 0.00 -1.06 0.00 0.00 56.10 55.07 1gic s TRP 182 Cb 0.17 0.46 0.09 0.00 -1.16 0.00 0.00 33.47 33.02 1gic s TRP 182 CO 0.66 -0.80 0.81 -1.83 -4.06 0.00 0.00 176.95 171.72 1gic s GLU 183 N -3.76 0.78 0.44 3.25 4.04 -1.26 -4.79 118.70 117.40 1gic s GLU 183 Ca 0.02 0.70 0.25 0.00 0.04 0.00 0.00 54.97 55.97 1gic s GLU 183 Cb -0.00 0.38 1.26 0.00 0.02 0.00 0.00 34.13 35.79 1gic s GLU 183 CO -0.13 -0.14 1.75 0.77 -1.84 0.00 0.00 175.26 175.68 1gic h SER 184 N 4.25 0.31 -0.59 0.83 0.02 -2.02 -2.95 113.55 113.41 1gic h SER 184 Ca -0.28 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.75 1gic h SER 184 Cb 1.16 0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.73 1gic h SER 184 CO 0.15 0.02 0.00 -1.54 -1.14 0.00 0.00 176.83 174.32 1gic n SER 185 N -4.54 3.99 -4.76 3.07 3.41 -1.26 -4.98 113.62 108.56 1gic n SER 185 Ca 0.28 -2.22 -0.39 0.00 -0.26 0.00 0.00 58.87 56.27 1gic n SER 185 Cb 1.06 -0.46 -0.06 0.00 -0.26 0.00 0.00 64.21 64.49 1gic n SER 185 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1gic s ALA 186 N -1.41 3.32 -0.14 7.33 0.00 -1.12 -2.80 121.76 126.94 1gic s ALA 186 Ca 0.43 0.65 0.17 0.00 0.00 0.00 0.00 51.96 53.22 1gic s ALA 186 Cb 0.25 -3.23 -0.09 0.00 0.00 0.00 0.00 23.12 20.06 1gic s ALA 186 CO 0.25 0.13 0.94 -0.39 0.00 0.00 0.00 175.76 176.69 1gic h VAL 187 N 3.02 0.49 -3.23 0.00 -1.51 -0.34 -3.46 116.25 111.22 1gic h VAL 187 Ca -0.46 -1.91 -0.21 0.00 -1.23 0.00 0.00 66.70 62.89 1gic h VAL 187 Cb 1.20 2.02 -0.30 0.00 -2.13 0.00 0.00 31.29 32.09 1gic h VAL 187 CO 0.67 0.28 -0.55 -0.69 -1.23 0.00 0.00 177.57 176.05 1gic s VAL 188 N -2.98 -0.03 -0.04 7.19 1.01 -1.07 -4.85 120.40 119.63 1gic s VAL 188 Ca -0.02 0.12 0.02 0.00 0.00 0.00 0.00 61.98 62.10 1gic s VAL 188 Cb 0.09 -0.27 0.01 0.00 0.00 0.00 0.00 36.38 36.21 1gic s VAL 188 CO 0.80 0.05 -0.07 0.00 0.00 0.00 0.00 175.10 175.88 1gic s ALA 189 N 0.86 0.80 0.08 5.51 0.00 -1.26 -0.82 121.76 126.93 1gic s ALA 189 Ca -0.06 -0.20 -0.12 0.00 0.00 0.00 0.00 51.96 51.58 1gic s ALA 189 Cb -0.08 -0.39 0.01 0.00 0.00 0.00 0.00 23.12 22.67 1gic s ALA 189 CO -0.05 0.07 0.27 -1.54 0.00 0.00 0.00 175.76 174.51 1gic s SER 190 N 0.58 -0.04 0.08 0.00 1.04 -0.46 -0.52 113.70 114.38 1gic s SER 190 Ca -0.09 -0.42 -0.13 0.00 0.48 0.00 0.00 55.95 55.80 1gic s SER 190 Cb -0.12 0.37 0.02 0.00 0.10 0.00 0.00 66.02 66.39 1gic s SER 190 CO 0.01 -0.71 0.29 0.72 0.98 0.00 0.00 173.24 174.53 1gic s PHE 191 N -3.36 -0.05 -0.10 5.02 -0.12 -0.73 -0.75 117.98 117.89 1gic s PHE 191 Ca 0.01 -0.22 -0.12 0.00 -0.05 0.00 0.00 56.93 56.55 1gic s PHE 191 Cb 0.02 0.09 0.03 0.00 -0.63 0.00 0.00 43.02 42.53 1gic s PHE 191 CO -0.08 -0.56 0.32 -1.83 -0.05 0.00 0.00 175.22 173.01 1gic s GLU 192 N -3.26 0.42 0.05 1.99 -1.05 -0.40 -1.80 118.70 114.65 1gic s GLU 192 Ca -0.00 0.35 0.03 0.00 -0.15 0.00 0.00 54.97 55.19 1gic s GLU 192 Cb 0.02 0.20 -0.03 0.00 -0.44 0.00 0.00 34.13 33.88 1gic s GLU 192 CO -0.08 -0.07 -0.09 0.00 0.95 0.00 0.00 175.26 175.98 1gic s ALA 193 N -0.07 0.70 -0.10 -0.84 0.00 -0.34 -1.54 121.76 119.57 1gic s ALA 193 Ca -0.02 -0.84 -0.09 0.00 0.00 0.00 0.00 51.96 51.01 1gic s ALA 193 Cb -0.03 0.03 0.03 0.00 0.00 0.00 0.00 23.12 23.15 1gic s ALA 193 CO 0.01 -0.00 0.28 0.99 0.00 0.00 0.00 175.76 177.03 1gic s THR 194 N -1.50 -0.00 -0.01 0.00 2.01 -0.56 -0.84 115.64 114.75 1gic s THR 194 Ca -0.07 0.01 -0.17 0.00 0.31 0.00 0.00 61.69 61.77 1gic s THR 194 Cb -0.09 -0.39 0.03 0.00 0.01 0.00 0.00 72.50 72.06 1gic s THR 194 CO 0.00 0.01 0.37 0.72 -0.69 0.00 0.00 174.62 175.03 1gic s PHE 195 N 0.26 -0.25 0.03 4.92 -0.12 -1.04 -0.57 117.98 121.21 1gic s PHE 195 Ca -0.01 0.35 0.06 0.00 -0.05 0.00 0.00 56.93 57.28 1gic s PHE 195 Cb -0.03 0.15 -0.03 0.00 -0.63 0.00 0.00 43.02 42.48 1gic s PHE 195 CO -0.01 -0.45 -0.13 0.95 -0.05 0.00 0.00 175.22 175.53 1gic s THR 196 N -1.55 3.18 0.12 -4.49 -4.23 -0.69 -1.51 115.64 106.47 1gic s THR 196 Ca -0.11 -1.02 -0.01 0.00 -1.18 0.00 0.00 61.69 59.36 1gic s THR 196 Cb -0.04 -2.37 -0.04 0.00 1.34 0.00 0.00 72.50 71.39 1gic s THR 196 CO 0.04 0.34 0.04 0.72 -0.54 0.00 0.00 174.62 175.22 1gic s PHE 197 N -0.98 0.86 -0.18 3.99 -0.12 -0.58 -0.99 117.98 119.98 1gic s PHE 197 Ca 0.16 -1.19 -0.04 0.00 -0.05 0.00 0.00 56.93 55.81 1gic s PHE 197 Cb -0.11 -0.49 0.06 0.00 -0.63 0.00 0.00 43.02 41.85 1gic s PHE 197 CO 0.07 -0.46 0.07 -1.17 -0.05 0.00 0.00 175.22 173.68 1gic s LEU 198 N -3.05 0.63 -0.28 -1.99 0.20 0.02 -1.11 118.68 113.11 1gic s LEU 198 Ca 0.22 -0.70 -0.06 0.00 0.69 0.00 0.00 54.13 54.27 1gic s LEU 198 Cb 0.07 -0.36 0.01 0.00 -0.43 0.00 0.00 46.19 45.48 1gic s LEU 198 CO 0.00 -0.34 0.06 -0.63 -0.29 0.00 0.00 176.35 175.15 1gic s ILE 199 N 2.04 3.84 -0.02 6.68 1.01 -1.26 -2.61 121.20 130.88 1gic s ILE 199 Ca 0.01 -0.67 0.00 0.00 0.00 0.00 0.00 60.65 59.99 1gic s ILE 199 Cb -0.16 -2.95 0.03 0.00 0.01 0.00 0.00 42.46 39.38 1gic s ILE 199 CO -0.09 0.13 0.01 -1.59 0.00 0.00 0.00 174.94 173.40 1gic s LYS 200 N 1.49 0.12 -0.02 2.79 -2.85 -1.25 -0.96 119.74 119.06 1gic s LYS 200 Ca 0.03 0.12 0.01 0.00 -1.00 0.00 0.00 55.97 55.13 1gic s LYS 200 Cb -0.17 -0.34 -0.03 0.00 -2.06 0.00 0.00 37.83 35.23 1gic s LYS 200 CO 0.01 -0.14 -0.01 0.45 0.10 0.00 0.00 175.35 175.76 1gic s SER 201 N 0.97 5.04 -0.02 0.03 0.15 -1.26 -1.09 113.70 117.52 1gic s SER 201 Ca -0.09 -0.00 -0.21 0.00 0.70 0.00 0.00 55.95 56.35 1gic s SER 201 Cb -0.12 -1.31 -0.29 0.00 -1.71 0.00 0.00 66.02 62.58 1gic s SER 201 CO -0.02 0.30 0.97 1.55 1.20 0.00 0.00 173.24 177.24 1gic h PRO 202 N 4.54 0.36 -7.21 5.44 0.13 -1.98 -3.48 132.00 129.80 1gic h PRO 202 Ca -0.49 -0.52 -0.50 0.00 -0.87 0.00 0.00 66.00 63.61 1gic h PRO 202 Cb 1.18 0.18 0.08 0.00 0.13 0.00 0.00 31.00 32.57 1gic h PRO 202 CO 0.56 1.22 0.38 0.16 -0.23 0.00 0.00 178.00 180.08 1gic s ASP 203 N -6.95 5.48 0.62 1.44 1.47 -1.26 -4.90 116.67 112.57 1gic s ASP 203 Ca -0.13 1.88 0.25 0.00 1.18 0.00 0.00 52.55 55.73 1gic s ASP 203 Cb 0.02 -2.54 1.19 0.00 -0.34 0.00 0.00 42.92 41.26 1gic s ASP 203 CO 0.84 -1.38 1.65 0.77 0.68 0.00 0.00 175.17 177.73 1gic h SER 204 N 0.20 0.00 -2.99 2.11 4.64 -1.97 -3.30 113.55 112.24 1gic h SER 204 Ca -0.47 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.35 1gic h SER 204 Cb 1.23 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.92 1gic h SER 204 CO 0.56 0.00 -0.76 -1.00 -0.87 0.00 0.00 176.83 174.76 1gic s HIS 205 N -4.36 0.50 0.64 4.77 3.76 -1.26 -5.12 115.29 114.22 1gic s HIS 205 Ca -0.03 -0.75 -0.18 0.00 -0.15 0.00 0.00 55.06 53.96 1gic s HIS 205 Cb 0.11 -0.92 -0.03 0.00 1.11 0.00 0.00 32.58 32.86 1gic s HIS 205 CO 0.39 -0.69 1.10 -0.35 -0.85 0.00 0.00 174.74 174.34 1gic n PRO 206 N 5.20 0.94 -3.50 8.40 -0.04 -1.24 -4.18 135.00 140.57 1gic n PRO 206 Ca -0.06 0.37 -0.13 0.00 -0.04 0.00 0.00 63.50 63.64 1gic n PRO 206 Cb 0.45 -2.33 -0.04 0.00 -0.04 0.00 0.00 33.50 31.55 1gic n PRO 206 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1gic s ALA 207 N -1.49 -1.76 -0.05 0.55 0.00 -1.24 -4.25 121.76 113.53 1gic s ALA 207 Ca 0.79 1.06 0.09 0.00 0.00 0.00 0.00 51.96 53.90 1gic s ALA 207 Cb -0.39 0.23 -0.13 0.00 0.00 0.00 0.00 23.12 22.83 1gic s ALA 207 CO 0.44 -0.54 0.13 -0.25 0.00 0.00 0.00 175.76 175.53 1gic n ASP 208 N 0.26 2.75 0.00 0.00 8.00 0.02 -2.80 116.55 124.78 1gic n ASP 208 Ca -0.15 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.35 1gic n ASP 208 Cb 0.60 1.10 0.00 0.00 -0.02 0.00 0.00 41.12 42.80 1gic n ASP 208 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1gic n GLY 209 N 2.18 0.83 3.17 0.44 0.00 -1.22 -2.24 105.19 108.34 1gic n GLY 209 Ca -0.08 -1.79 -0.21 0.00 0.00 0.00 0.00 46.02 43.94 1gic n GLY 209 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gic s ILE 210 N -1.30 1.24 0.01 -0.61 1.01 -0.72 -2.61 121.20 118.21 1gic s ILE 210 Ca 0.00 -1.05 0.00 0.00 0.00 0.00 0.00 60.65 59.60 1gic s ILE 210 Cb 0.00 -1.11 -0.01 0.00 0.01 0.00 0.00 42.46 41.35 1gic s ILE 210 CO 0.00 0.05 -0.01 0.00 0.00 0.00 0.00 174.94 174.98 1gic s ALA 211 N -0.84 0.05 -0.17 9.38 0.00 0.31 -0.10 121.76 130.39 1gic s ALA 211 Ca 0.03 -0.24 -0.10 0.00 0.00 0.00 0.00 51.96 51.64 1gic s ALA 211 Cb -0.08 0.06 -0.05 0.00 0.00 0.00 0.00 23.12 23.05 1gic s ALA 211 CO 0.01 -0.06 0.17 0.12 0.00 0.00 0.00 175.76 176.00 1gic s PHE 212 N -0.59 3.46 0.09 0.00 5.36 -0.37 -1.58 117.98 124.34 1gic s PHE 212 Ca -0.06 0.43 -0.00 0.00 -0.96 0.00 0.00 56.93 56.34 1gic s PHE 212 Cb -0.04 -2.15 -0.04 0.00 -0.34 0.00 0.00 43.02 40.44 1gic s PHE 212 CO -0.00 0.38 -0.02 -0.59 -1.46 0.00 0.00 175.22 173.52 1gic s PHE 213 N 0.08 0.75 -0.04 10.12 -0.71 0.14 -0.49 117.98 127.82 1gic s PHE 213 Ca 0.11 -1.05 0.03 0.00 -1.04 0.00 0.00 56.93 54.98 1gic s PHE 213 Cb -0.12 -0.47 0.01 0.00 -1.21 0.00 0.00 43.02 41.23 1gic s PHE 213 CO 0.01 -0.33 -0.12 0.42 -1.34 0.00 0.00 175.22 173.86 1gic s ILE 214 N -3.84 1.04 0.33 -4.49 1.01 -0.18 -1.08 121.20 113.98 1gic s ILE 214 Ca 0.13 -0.47 -0.03 0.00 0.00 0.00 0.00 60.65 60.28 1gic s ILE 214 Cb 0.07 -0.93 -0.00 0.00 0.01 0.00 0.00 42.46 41.61 1gic s ILE 214 CO -0.05 0.32 0.44 -0.94 0.00 0.00 0.00 174.94 174.71 1gic s SER 215 N 0.35 0.82 0.67 3.58 1.04 -0.89 -2.01 113.70 117.26 1gic s SER 215 Ca -0.07 -1.44 -0.17 0.00 0.48 0.00 0.00 55.95 54.74 1gic s SER 215 Cb -0.12 0.63 0.00 0.00 0.10 0.00 0.00 66.02 66.64 1gic s SER 215 CO 0.02 -1.24 1.23 0.54 0.98 0.00 0.00 173.24 174.76 1gic s ASN 216 N -3.22 4.60 0.55 7.02 4.22 -1.23 -0.82 114.94 126.06 1gic s ASN 216 Ca 0.31 2.42 0.29 0.00 -2.14 0.00 0.00 52.86 53.74 1gic s ASN 216 Cb 0.00 -2.60 1.60 0.00 1.28 0.00 0.00 41.25 41.54 1gic s ASN 216 CO 0.19 -1.99 2.13 0.16 -2.04 0.00 0.00 177.10 175.55 1gic h ILE 217 N 0.25 0.50 -0.60 0.54 3.07 -1.84 -2.54 117.51 116.88 1gic h ILE 217 Ca -0.49 -0.37 0.00 0.00 1.55 0.00 0.00 64.86 65.55 1gic h ILE 217 Cb 1.30 1.25 0.00 0.00 -0.27 0.00 0.00 36.82 39.10 1gic h ILE 217 CO 0.52 0.08 0.00 -0.90 -1.05 0.00 0.00 178.15 176.80 1gic n ASP 218 N -3.63 3.88 -4.61 2.16 5.75 -1.26 -4.80 116.55 114.04 1gic n ASP 218 Ca -0.02 -2.21 -0.43 0.00 -0.01 0.00 0.00 54.79 52.12 1gic n ASP 218 Cb 0.19 -0.49 0.00 0.00 -1.03 0.00 0.00 41.12 39.79 1gic n ASP 218 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 1gic n SER 219 N 1.16 1.41 -4.11 -1.12 2.88 -0.96 -5.03 113.62 107.85 1gic n SER 219 Ca 0.22 1.10 -0.08 0.00 -1.33 0.00 0.00 58.87 58.78 1gic n SER 219 Cb 0.68 -1.34 -0.10 0.00 -0.75 0.00 0.00 64.21 62.70 1gic n SER 219 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1gic s SER 220 N -0.63 0.49 0.11 -3.46 1.04 -1.26 -5.09 113.70 104.90 1gic s SER 220 Ca 0.61 -1.06 -0.31 0.00 0.48 0.00 0.00 55.95 55.67 1gic s SER 220 Cb -0.61 0.22 -0.10 0.00 0.10 0.00 0.00 66.02 65.64 1gic s SER 220 CO 0.59 -0.63 1.75 -0.63 0.98 0.00 0.00 173.24 175.30 1gic s ILE 221 N -3.93 2.71 0.64 -1.02 1.01 -1.26 -4.95 121.20 114.39 1gic s ILE 221 Ca 0.12 0.23 -0.16 0.00 0.00 0.00 0.00 60.65 60.84 1gic s ILE 221 Cb 0.08 -3.15 -0.01 0.00 0.01 0.00 0.00 42.46 39.39 1gic s ILE 221 CO -0.07 0.00 1.13 -2.84 0.00 0.00 0.00 174.94 173.17 1gic s PRO 222 N 2.58 2.86 0.17 2.79 0.02 -1.26 -4.98 135.00 137.17 1gic s PRO 222 Ca 0.78 1.51 -0.31 0.00 0.02 0.00 0.00 61.00 63.00 1gic s PRO 222 Cb -0.44 -1.95 -0.09 0.00 0.02 0.00 0.00 34.50 32.05 1gic s PRO 222 CO 0.34 -1.23 1.38 0.45 -0.33 0.00 0.00 177.00 177.62 1gic s SER 223 N -2.27 6.81 -0.56 2.53 0.15 -1.26 -2.38 113.70 116.72 1gic s SER 223 Ca 0.70 2.42 0.00 0.00 0.70 0.00 0.00 55.95 59.77 1gic s SER 223 Cb -0.23 -2.60 0.00 0.00 -1.71 0.00 0.00 66.02 61.48 1gic s SER 223 CO 0.38 -0.63 0.00 0.61 1.20 0.00 0.00 173.24 174.80 1gic n GLY 224 N 2.94 0.77 1.39 9.45 0.00 -1.26 -4.75 105.19 113.74 1gic n GLY 224 Ca 0.09 -0.82 0.04 0.00 0.00 0.00 0.00 46.02 45.33 1gic n GLY 224 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1gic n SER 225 N 1.14 4.02 -3.27 1.61 3.41 -1.00 -4.85 113.62 114.68 1gic n SER 225 Ca -0.05 -2.60 -0.20 0.00 -0.26 0.00 0.00 58.87 55.76 1gic n SER 225 Cb 0.18 -0.62 0.15 0.00 -0.26 0.00 0.00 64.21 63.67 1gic n SER 225 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1gic n THR 226 N 0.39 0.00 -4.88 6.66 -2.24 -1.26 -0.92 114.28 112.03 1gic n THR 226 Ca 0.18 -0.53 0.00 0.00 -2.27 0.00 0.00 64.05 61.43 1gic n THR 226 Cb 0.86 -1.46 0.00 0.00 -2.10 0.00 0.00 70.33 67.63 1gic n THR 226 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1gic n GLY 227 N -1.59 2.55 0.16 3.38 0.00 -0.37 -3.13 105.19 106.19 1gic n GLY 227 Ca 0.11 -0.45 0.10 0.00 0.00 0.00 0.00 46.02 45.78 1gic n GLY 227 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1gic n ARG 228 N 12.67 0.13 -0.14 1.61 0.00 -1.26 -2.48 116.66 127.19 1gic n ARG 228 Ca 0.00 0.62 0.09 0.00 -0.00 0.00 0.00 57.85 58.56 1gic n ARG 228 Cb 0.00 -1.99 0.28 0.00 -0.00 0.00 0.00 32.46 30.75 1gic n ARG 228 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1gic n LEU 229 N -2.20 1.92 -1.57 2.89 4.32 -1.18 -4.95 117.00 116.23 1gic n LEU 229 Ca -0.01 -0.88 -0.08 0.00 -0.02 0.00 0.00 56.01 55.02 1gic n LEU 229 Cb 0.10 -0.18 -0.03 0.00 -1.62 0.00 0.00 43.42 41.70 1gic n LEU 229 CO 0.09 0.44 -0.09 0.18 -1.22 0.00 0.00 177.39 176.79 1gic n LEU 230 N 0.51 -0.65 -1.23 2.23 4.32 -1.03 -1.45 117.00 119.69 1gic n LEU 230 Ca 0.15 0.23 -0.14 0.00 -0.02 0.00 0.00 56.01 56.23 1gic n LEU 230 Cb 0.34 -1.53 -0.04 0.00 -1.62 0.00 0.00 43.42 40.57 1gic n LEU 230 CO 0.11 -0.34 -0.15 0.61 -1.22 0.00 0.00 177.39 176.41 1gic n GLY 231 N -0.30 0.90 0.02 -0.72 0.00 -0.09 -4.11 105.19 100.88 1gic n GLY 231 Ca -0.09 -0.36 -0.02 0.00 0.00 0.00 0.00 46.02 45.56 1gic n GLY 231 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1gic n LEU 232 N -1.70 1.67 -4.48 0.99 4.32 -0.53 -4.49 117.00 112.77 1gic n LEU 232 Ca -0.15 -0.01 -0.31 0.00 -0.02 0.00 0.00 56.01 55.53 1gic n LEU 232 Cb 0.51 -0.04 -0.12 0.00 -1.62 0.00 0.00 43.42 42.14 1gic n LEU 232 CO 0.20 0.35 -0.48 -0.36 -1.22 0.00 0.00 177.39 175.89 1gic s PHE 233 N -2.08 2.60 0.22 -1.77 0.08 -1.12 -4.82 117.98 111.10 1gic s PHE 233 Ca -0.04 -0.23 0.10 0.00 0.12 0.00 0.00 56.93 56.88 1gic s PHE 233 Cb 0.01 -1.46 0.23 0.00 -0.57 0.00 0.00 43.02 41.23 1gic s PHE 233 CO 0.11 0.29 1.53 -1.00 -0.10 0.00 0.00 175.22 176.05 1gic h PRO 234 N 4.36 0.00 -4.36 0.24 0.13 -1.92 -3.40 132.00 127.06 1gic h PRO 234 Ca -0.48 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.34 1gic h PRO 234 Cb 1.16 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.19 1gic h PRO 234 CO 0.48 0.70 -0.32 0.16 -0.23 0.00 0.00 178.00 178.79 1gic s ASP 235 N -6.78 0.99 -0.40 1.44 1.47 -1.26 -4.85 116.67 107.27 1gic s ASP 235 Ca -0.01 -1.52 0.05 0.00 1.18 0.00 0.00 52.55 52.26 1gic s ASP 235 Cb 0.12 0.60 0.57 0.00 -0.34 0.00 0.00 42.92 43.87 1gic s ASP 235 CO 0.77 -1.17 1.72 0.00 0.68 0.00 0.00 175.17 177.16 1gic n ALA 236 N -0.54 5.15 1.26 2.11 0.00 -1.26 -4.70 120.51 122.53 1gic n ALA 236 Ca 0.03 -3.11 0.13 0.00 0.00 0.00 0.00 53.44 50.49 1gic n ALA 236 Cb 0.62 -1.14 0.32 0.00 0.00 0.00 0.00 19.45 19.24 1gic n ALA 236 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59