#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g3g n GLU 2 N 0.00 -2.82 -1.67 1.61 1.02 -1.26 -4.87 120.64 112.65 1g3g n GLU 2 Ca 0.00 0.85 -0.32 0.00 -0.02 0.00 0.00 57.16 57.67 1g3g n GLU 2 Cb 0.00 -5.56 0.05 0.00 -0.02 0.00 0.00 31.44 25.91 1g3g n GLU 2 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1g3g n ASN 3 N -2.13 6.68 0.30 1.62 3.02 -1.26 -4.70 115.26 118.79 1g3g n ASN 3 Ca -0.17 -3.78 0.19 0.00 -0.03 0.00 0.00 54.58 50.79 1g3g n ASN 3 Cb 0.64 -0.77 1.02 0.00 -0.61 0.00 0.00 39.78 40.07 1g3g n ASN 3 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 1g3g h ILE 4 N 1.55 0.22 -2.09 2.41 2.10 -2.12 -3.48 117.51 116.11 1g3g h ILE 4 Ca 0.52 0.00 0.00 0.00 1.08 0.00 0.00 64.86 66.46 1g3g h ILE 4 Cb 0.96 0.92 0.00 0.00 -1.09 0.00 0.00 36.82 37.61 1g3g h ILE 4 CO 1.29 0.00 -0.51 0.41 -1.08 0.00 0.00 178.15 178.25 1g3g n THR 5 N -3.38 -3.29 -3.82 2.19 -1.04 -1.26 -4.95 114.28 98.73 1g3g n THR 5 Ca -0.02 1.31 -0.30 0.00 -2.04 0.00 0.00 64.05 63.00 1g3g n THR 5 Cb 0.17 -1.83 -0.14 0.00 -1.82 0.00 0.00 70.33 66.71 1g3g n THR 5 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 1g3g s GLN 6 N -4.75 1.35 -0.78 -2.82 2.00 -1.26 -5.07 119.66 108.33 1g3g s GLN 6 Ca 0.00 -1.92 -0.26 0.00 -2.00 0.00 0.00 55.36 51.18 1g3g s GLN 6 Cb 0.00 -2.63 -0.17 0.00 0.80 0.00 0.00 33.01 31.02 1g3g s GLN 6 CO 0.00 -1.08 2.50 -2.30 -0.50 0.00 0.00 175.29 173.91 1g3g n PRO 7 N 3.85 0.45 -0.07 1.67 -0.02 -1.26 -4.72 135.00 134.91 1g3g n PRO 7 Ca 0.05 -0.10 -0.03 0.00 -2.02 0.00 0.00 63.50 61.40 1g3g n PRO 7 Cb 0.37 -2.43 -0.15 0.00 -0.02 0.00 0.00 33.50 31.27 1g3g n PRO 7 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 1g3g n THR 8 N 7.61 0.87 -2.41 3.45 5.66 -1.26 -5.00 114.28 123.20 1g3g n THR 8 Ca 0.53 -0.70 -0.18 0.00 -3.05 0.00 0.00 64.05 60.65 1g3g n THR 8 Cb 0.28 -0.31 -0.00 0.00 -1.55 0.00 0.00 70.33 68.74 1g3g n THR 8 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1g3g n GLN 9 N -2.54 -1.75 -1.45 1.09 6.02 -1.26 -4.68 117.38 112.80 1g3g n GLN 9 Ca -0.22 0.86 0.15 0.00 -0.01 0.00 0.00 57.00 57.78 1g3g n GLN 9 Cb 0.92 -5.38 -0.08 0.00 1.02 0.00 0.00 30.24 26.72 1g3g n GLN 9 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1g3g n GLN 10 N -2.83 -3.44 -4.61 -1.09 6.02 -1.26 -5.02 117.38 105.15 1g3g n GLN 10 Ca -0.20 2.80 -0.28 0.00 -0.01 0.00 0.00 57.00 59.31 1g3g n GLN 10 Cb 0.66 -3.90 -0.09 0.00 1.02 0.00 0.00 30.24 27.93 1g3g n GLN 10 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1g3g s SER 11 N -6.96 3.33 -0.15 1.08 0.15 -1.26 -5.15 113.70 104.74 1g3g s SER 11 Ca 0.00 -1.59 -0.04 0.00 0.70 0.00 0.00 55.95 55.02 1g3g s SER 11 Cb 0.00 0.34 0.07 0.00 -1.71 0.00 0.00 66.02 64.72 1g3g s SER 11 CO 0.00 -0.81 0.20 -0.89 1.20 0.00 0.00 173.24 172.94 1g3g s THR 12 N -3.05 -0.30 -1.03 6.45 2.01 -1.26 -5.07 115.64 113.39 1g3g s THR 12 Ca 0.20 0.10 -0.03 0.00 0.31 0.00 0.00 61.69 62.27 1g3g s THR 12 Cb 0.04 -0.50 0.30 0.00 0.01 0.00 0.00 72.50 72.35 1g3g s THR 12 CO 0.11 -0.04 1.40 0.00 -0.69 0.00 0.00 174.62 175.40 1g3g n GLN 13 N 5.32 4.27 -3.70 4.92 3.00 -1.26 -4.97 117.38 124.96 1g3g n GLN 13 Ca -0.05 -4.57 -0.38 0.00 -0.01 0.00 0.00 57.00 51.98 1g3g n GLN 13 Cb 0.50 -2.48 -0.11 0.00 0.00 0.00 0.00 30.24 28.14 1g3g n GLN 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1g3g s ALA 14 N -2.75 3.15 -0.86 -1.58 0.00 -1.26 -4.99 121.76 113.47 1g3g s ALA 14 Ca 0.32 -2.05 0.01 0.00 0.00 0.00 0.00 51.96 50.24 1g3g s ALA 14 Cb 0.06 -2.43 0.33 0.00 0.00 0.00 0.00 23.12 21.07 1g3g s ALA 14 CO 0.09 -1.54 1.50 0.25 0.00 0.00 0.00 175.76 176.06 1g3g n THR 15 N 4.81 4.95 -0.01 0.00 -2.24 -1.26 -4.79 114.28 115.74 1g3g n THR 15 Ca -0.10 -5.81 0.03 0.00 -2.27 0.00 0.00 64.05 55.90 1g3g n THR 15 Cb 0.43 -1.49 0.40 0.00 -2.10 0.00 0.00 70.33 67.58 1g3g n THR 15 CO 0.00 0.00 0.00 0.06 -0.57 0.00 0.00 175.07 174.56 1g3g h GLN 16 N 3.73 0.55 -0.25 -0.78 3.07 -2.01 -1.68 115.11 117.73 1g3g h GLN 16 Ca 0.39 -0.04 -0.12 0.00 0.09 0.00 0.00 58.65 58.96 1g3g h GLN 16 Cb 0.39 -0.12 -0.01 0.00 0.08 0.00 0.00 27.48 27.82 1g3g h GLN 16 CO 1.05 0.39 -0.36 0.07 0.09 0.00 0.00 178.83 180.06 1g3g h ARG 17 N 0.57 0.56 -0.89 0.06 0.11 -2.00 -3.02 114.38 109.77 1g3g h ARG 17 Ca 0.15 -0.27 0.07 0.00 0.10 0.00 0.00 59.98 60.03 1g3g h ARG 17 Cb -0.02 -0.00 -0.06 0.00 1.11 0.00 0.00 29.97 30.99 1g3g h ARG 17 CO -0.03 0.84 0.55 0.35 0.10 0.00 0.00 179.97 181.79 1g3g h PHE 18 N 0.47 1.02 -0.30 4.08 3.57 -1.69 0.11 116.94 124.20 1g3g h PHE 18 Ca 0.05 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.50 1g3g h PHE 18 Cb 0.85 -0.33 -0.02 0.00 2.79 0.00 0.00 35.95 39.25 1g3g h PHE 18 CO 0.03 0.50 -0.13 -0.07 -2.23 0.00 0.00 178.31 176.41 1g3g h LEU 19 N 0.99 0.49 -0.10 0.59 3.38 -1.43 -2.60 115.31 116.63 1g3g h LEU 19 Ca 0.39 -0.13 -0.14 0.00 0.09 0.00 0.00 57.88 58.09 1g3g h LEU 19 Cb 0.21 -0.13 0.01 0.00 0.09 0.00 0.00 40.66 40.83 1g3g h LEU 19 CO -0.19 0.66 -0.50 0.40 0.09 0.00 0.00 178.44 178.91 1g3g h ILE 20 N 0.47 1.37 -0.53 1.22 1.08 -1.17 -3.19 117.51 116.75 1g3g h ILE 20 Ca 0.09 -1.83 0.06 0.00 -0.39 0.00 0.00 64.86 62.79 1g3g h ILE 20 Cb 0.51 2.21 -0.03 0.00 -3.07 0.00 0.00 36.82 36.44 1g3g h ILE 20 CO 0.03 0.55 0.36 -0.08 -0.69 0.00 0.00 178.15 178.31 1g3g h GLU 21 N 0.10 0.47 -0.08 2.37 4.81 -0.70 -0.49 114.58 121.06 1g3g h GLU 21 Ca -0.03 -0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.19 1g3g h GLU 21 Cb 1.14 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 30.41 1g3g h GLU 21 CO 0.10 0.31 0.06 -0.22 -0.73 0.00 0.00 179.01 178.53 1g3g h LYS 22 N 0.48 0.00 -0.36 1.92 3.64 -1.45 -2.29 116.57 118.51 1g3g h LYS 22 Ca 0.23 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.65 1g3g h LYS 22 Cb 0.30 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.08 1g3g h LYS 22 CO -0.06 0.00 0.13 0.35 -2.27 0.00 0.00 179.45 177.59 1g3g h PHE 23 N 0.00 0.23 0.00 1.91 3.04 -1.18 -0.47 116.94 120.47 1g3g h PHE 23 Ca 0.04 0.02 -0.01 0.00 3.98 0.00 0.00 57.97 61.99 1g3g h PHE 23 Cb 0.16 -0.05 -0.00 0.00 2.56 0.00 0.00 35.95 38.62 1g3g h PHE 23 CO 0.00 0.09 -0.05 1.03 -2.02 0.00 0.00 178.31 177.37 1g3g h SER 24 N 0.28 0.00 -3.50 0.41 0.87 -1.54 -3.46 113.55 106.61 1g3g h SER 24 Ca 0.16 0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 60.57 1g3g h SER 24 Cb 0.14 0.00 0.07 0.00 -0.44 0.00 0.00 62.40 62.17 1g3g h SER 24 CO -0.17 0.05 -0.33 1.67 -0.53 0.00 0.00 176.83 177.52 1g3g n GLN 25 N -3.28 -3.04 -2.24 2.24 0.00 -0.19 -5.02 117.38 105.86 1g3g n GLN 25 Ca -0.01 0.37 -0.33 0.00 -0.00 0.00 0.00 57.00 57.03 1g3g n GLN 25 Cb 0.21 -3.98 -0.01 0.00 0.00 0.00 0.00 30.24 26.46 1g3g n GLN 25 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.06 175.06 1g3g s GLU 26 N -4.81 3.53 -0.33 3.69 2.56 -1.26 -5.04 118.70 117.05 1g3g s GLU 26 Ca 0.06 1.23 -0.06 0.00 0.00 0.00 0.00 54.97 56.20 1g3g s GLU 26 Cb -0.02 -2.06 0.04 0.00 2.00 0.00 0.00 34.13 34.08 1g3g s GLU 26 CO 0.32 -0.64 0.08 -1.14 -0.56 0.00 0.00 175.26 173.32 1g3g s GLN 27 N -3.81 2.65 0.11 4.30 -0.44 -1.26 -5.01 119.66 116.19 1g3g s GLN 27 Ca 0.64 -1.15 -0.22 0.00 -2.50 0.00 0.00 55.36 52.13 1g3g s GLN 27 Cb -0.15 -3.39 -0.07 0.00 -1.64 0.00 0.00 33.01 27.75 1g3g s GLN 27 CO 0.31 -0.63 0.67 0.42 0.50 0.00 0.00 175.29 176.56 1g3g s ILE 28 N 1.39 4.58 0.00 -2.34 -1.09 -1.26 -4.77 121.20 117.71 1g3g s ILE 28 Ca -0.02 1.45 0.00 0.00 -2.23 0.00 0.00 60.65 59.85 1g3g s ILE 28 Cb -0.19 -4.01 0.00 0.00 -1.58 0.00 0.00 42.46 36.68 1g3g s ILE 28 CO 0.02 0.53 0.00 0.61 -1.23 0.00 0.00 174.94 174.87 1g3g n GLY 29 N 1.71 0.02 0.22 6.18 0.00 -1.26 -4.86 105.19 107.20 1g3g n GLY 29 Ca -0.08 -0.01 0.10 0.00 0.00 0.00 0.00 46.02 46.03 1g3g n GLY 29 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1g3g h GLU 30 N 0.00 0.00 0.00 1.61 4.81 -1.95 -3.01 114.58 116.03 1g3g h GLU 30 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1g3g h GLU 30 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1g3g h GLU 30 CO 0.00 0.22 -1.02 0.09 -0.73 0.00 0.00 179.01 177.57 1g3g n ASN 31 N -3.33 1.30 -4.60 1.04 3.02 -1.26 -4.23 115.26 107.19 1g3g n ASN 31 Ca 0.01 -0.43 -0.43 0.00 -0.03 0.00 0.00 54.58 53.70 1g3g n ASN 31 Cb 0.45 1.26 -0.02 0.00 -0.61 0.00 0.00 39.78 40.86 1g3g n ASN 31 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1g3g s ILE 32 N -2.46 3.93 0.10 2.41 -1.09 -1.14 -2.49 121.20 120.46 1g3g s ILE 32 Ca 0.00 0.96 -0.20 0.00 -2.23 0.00 0.00 60.65 59.18 1g3g s ILE 32 Cb 0.08 -4.20 -0.05 0.00 -1.58 0.00 0.00 42.46 36.72 1g3g s ILE 32 CO 0.50 -0.73 1.34 1.62 -1.23 0.00 0.00 174.94 176.44 1g3g h VAL 33 N 6.41 0.00 -2.38 2.92 3.04 -1.67 -3.44 116.25 121.13 1g3g h VAL 33 Ca -0.27 0.00 0.13 0.00 -1.01 0.00 0.00 66.70 65.55 1g3g h VAL 33 Cb 1.10 0.00 -0.11 0.00 -2.01 0.00 0.00 31.29 30.27 1g3g h VAL 33 CO 1.08 0.00 0.46 0.00 -1.01 0.00 0.00 177.57 178.10 1g3g s ARG 35 N -3.27 2.69 -0.18 0.00 3.52 0.79 0.15 118.95 122.66 1g3g s ARG 35 Ca 0.08 -0.71 -0.21 0.00 -0.13 0.00 0.00 55.73 54.76 1g3g s ARG 35 Cb -0.01 -2.36 -0.03 0.00 -1.56 0.00 0.00 34.95 30.99 1g3g s ARG 35 CO -0.03 -0.21 0.62 0.08 -0.81 0.00 0.00 175.30 174.95 1g3g s VAL 36 N 1.34 5.04 -0.26 7.11 1.01 0.28 0.15 120.40 135.07 1g3g s VAL 36 Ca 0.04 1.19 0.01 0.00 0.00 0.00 0.00 61.98 63.23 1g3g s VAL 36 Cb -0.13 -3.94 0.07 0.00 0.00 0.00 0.00 36.38 32.37 1g3g s VAL 36 CO -0.11 0.15 -0.04 -0.63 0.00 0.00 0.00 175.10 174.46 1g3g s ILE 37 N 1.67 1.67 -0.62 2.22 1.01 0.49 0.09 121.20 127.73 1g3g s ILE 37 Ca 0.29 -1.43 -0.21 0.00 0.00 0.00 0.00 60.65 59.30 1g3g s ILE 37 Cb -0.16 -1.97 0.08 0.00 0.01 0.00 0.00 42.46 40.42 1g3g s ILE 37 CO 0.11 -0.19 0.85 0.00 0.00 0.00 0.00 174.94 175.72 1g3g h THR 39 N 5.95 1.22 -0.61 0.00 1.03 -1.87 -3.28 112.91 115.36 1g3g h THR 39 Ca -0.29 -2.74 0.18 0.00 -0.01 0.00 0.00 66.41 63.55 1g3g h THR 39 Cb 1.08 2.60 -0.02 0.00 -1.07 0.00 0.00 68.15 70.74 1g3g h THR 39 CO 1.13 0.70 0.56 0.74 -0.01 0.00 0.00 175.52 178.64 1g3g h THR 40 N 0.00 0.41 -0.09 0.00 2.02 -1.90 -3.45 112.91 109.90 1g3g h THR 40 Ca -0.01 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.17 1g3g h THR 40 Cb 1.56 0.58 0.00 0.00 -1.74 0.00 0.00 68.15 68.54 1g3g h THR 40 CO 0.09 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.59 1g3g n GLY 41 N -1.58 1.24 0.30 2.16 0.00 -1.24 -4.96 105.19 101.11 1g3g n GLY 41 Ca 0.12 -0.10 -0.18 0.00 0.00 0.00 0.00 46.02 45.86 1g3g n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1g3g n GLN 42 N -0.35 0.43 -4.26 1.61 10.64 -1.26 -5.01 117.38 119.17 1g3g n GLN 42 Ca 0.00 0.16 -0.20 0.00 -1.83 0.00 0.00 57.00 55.13 1g3g n GLN 42 Cb 0.06 -1.25 -0.16 0.00 -0.86 0.00 0.00 30.24 28.04 1g3g n GLN 42 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.06 175.65 1g3g s ILE 43 N -2.36 0.64 0.58 -0.39 1.01 -1.26 -5.11 121.20 114.30 1g3g s ILE 43 Ca -0.26 -0.23 -0.21 0.00 0.00 0.00 0.00 60.65 59.95 1g3g s ILE 43 Cb 0.09 -0.61 -0.04 0.00 0.01 0.00 0.00 42.46 41.91 1g3g s ILE 43 CO 0.37 0.23 1.33 -2.65 0.00 0.00 0.00 174.94 174.21 1g3g n PRO 44 N 3.69 1.51 -1.48 2.79 -0.02 -1.26 -3.96 135.00 136.28 1g3g n PRO 44 Ca -0.22 0.56 -0.48 0.00 -2.02 0.00 0.00 63.50 61.35 1g3g n PRO 44 Cb 0.53 -2.55 -0.03 0.00 -0.02 0.00 0.00 33.50 31.43 1g3g n PRO 44 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1g3g n ILE 45 N -1.30 1.80 -4.28 4.25 5.41 -1.26 -4.76 119.36 119.22 1g3g n ILE 45 Ca 0.12 -0.45 -0.17 0.00 1.00 0.00 0.00 62.75 63.25 1g3g n ILE 45 Cb 0.46 -0.36 -0.14 0.00 -0.71 0.00 0.00 39.64 38.88 1g3g n ILE 45 CO 0.00 0.00 0.00 -0.60 0.00 0.00 0.00 176.55 175.95 1g3g s ARG 46 N -1.06 0.62 -0.24 0.38 6.06 0.11 -5.02 118.95 119.81 1g3g s ARG 46 Ca 0.65 -0.32 -0.06 0.00 -2.50 0.00 0.00 55.73 53.50 1g3g s ARG 46 Cb -0.88 -0.59 -0.02 0.00 0.06 0.00 0.00 34.95 33.52 1g3g s ARG 46 CO 0.57 0.16 0.03 0.16 -2.50 0.00 0.00 175.30 173.72 1g3g s ASP 47 N -0.30 4.82 -0.23 -2.12 1.47 -1.26 0.99 116.67 120.04 1g3g s ASP 47 Ca 0.02 -0.27 -0.12 0.00 1.18 0.00 0.00 52.55 53.36 1g3g s ASP 47 Cb -0.04 -1.85 -0.05 0.00 -0.34 0.00 0.00 42.92 40.65 1g3g s ASP 47 CO -0.00 -0.02 0.21 -0.76 0.68 0.00 0.00 175.17 175.27 1g3g s LEU 48 N 1.54 4.13 0.31 2.11 1.02 0.40 -4.95 118.68 123.23 1g3g s LEU 48 Ca 0.06 0.20 0.08 0.00 0.02 0.00 0.00 54.13 54.49 1g3g s LEU 48 Cb -0.15 -2.19 -0.04 0.00 0.02 0.00 0.00 46.19 43.83 1g3g s LEU 48 CO 0.01 0.04 0.11 -0.44 0.02 0.00 0.00 176.35 176.09 1g3g s SER 49 N 1.04 4.74 0.32 2.29 0.01 -1.26 0.28 113.70 121.12 1g3g s SER 49 Ca 0.10 -0.68 0.07 0.00 1.31 0.00 0.00 55.95 56.76 1g3g s SER 49 Cb -0.14 -0.84 -0.06 0.00 0.21 0.00 0.00 66.02 65.19 1g3g s SER 49 CO 0.05 -0.19 -0.05 0.00 0.41 0.00 0.00 173.24 173.47 1g3g s ALA 50 N -2.36 2.65 -0.84 1.44 0.00 -1.04 -4.38 121.76 117.23 1g3g s ALA 50 Ca 0.35 -2.04 0.01 0.00 0.00 0.00 0.00 51.96 50.29 1g3g s ALA 50 Cb -0.04 0.17 0.27 0.00 0.00 0.00 0.00 23.12 23.52 1g3g s ALA 50 CO 0.22 -0.06 1.02 -0.25 0.00 0.00 0.00 175.76 176.70 1g3g n ASP 51 N -0.71 4.82 -0.11 0.00 9.92 -1.26 -4.68 116.55 124.53 1g3g n ASP 51 Ca -0.05 -3.39 -0.10 0.00 -0.53 0.00 0.00 54.79 50.73 1g3g n ASP 51 Cb 0.64 -0.95 -0.02 0.00 -0.64 0.00 0.00 41.12 40.15 1g3g n ASP 51 CO 0.00 0.00 0.00 0.40 0.13 0.00 0.00 177.20 177.73 1g3g h ILE 52 N 3.41 1.19 -0.67 0.53 2.04 -1.97 -1.35 117.51 120.68 1g3g h ILE 52 Ca 0.19 -0.61 -0.00 0.00 1.00 0.00 0.00 64.86 65.44 1g3g h ILE 52 Cb 0.67 0.98 -0.03 0.00 -0.74 0.00 0.00 36.82 37.69 1g3g h ILE 52 CO 1.02 0.21 0.42 0.28 0.00 0.00 0.00 178.15 180.08 1g3g h SER 53 N 0.38 0.79 -0.24 1.72 0.02 -1.96 -1.12 113.55 113.14 1g3g h SER 53 Ca 0.11 -0.04 -0.07 0.00 -0.84 0.00 0.00 61.79 60.95 1g3g h SER 53 Cb 0.21 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.55 1g3g h SER 53 CO -0.01 0.60 -0.13 1.56 -1.14 0.00 0.00 176.83 177.71 1g3g h GLN 54 N 0.92 0.52 -0.42 3.45 1.08 -1.87 -2.80 115.11 115.99 1g3g h GLN 54 Ca 0.24 -0.23 -0.01 0.00 -1.45 0.00 0.00 58.65 57.20 1g3g h GLN 54 Cb -0.06 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.34 1g3g h GLN 54 CO -0.05 0.79 0.21 0.28 -0.95 0.00 0.00 178.83 179.11 1g3g h VAL 55 N 0.24 1.17 -0.40 -0.54 2.07 -0.83 0.69 116.25 118.64 1g3g h VAL 55 Ca 0.05 -0.48 0.04 0.00 0.82 0.00 0.00 66.70 67.13 1g3g h VAL 55 Cb 0.64 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 31.10 1g3g h VAL 55 CO 0.04 0.19 0.27 0.25 0.02 0.00 0.00 177.57 178.33 1g3g h LEU 56 N 0.54 0.35 0.07 2.57 5.85 -1.22 -2.89 115.31 120.58 1g3g h LEU 56 Ca 0.15 -0.00 -0.22 0.00 0.84 0.00 0.00 57.88 58.64 1g3g h LEU 56 Cb 0.10 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 1g3g h LEU 56 CO -0.02 0.24 -1.17 0.50 -0.34 0.00 0.00 178.44 177.65 1g3g h LYS 57 N 0.40 0.15 -5.88 1.25 3.64 -1.16 -3.46 116.57 111.51 1g3g h LYS 57 Ca 0.17 -0.25 -0.68 0.00 -1.27 0.00 0.00 60.65 58.61 1g3g h LYS 57 Cb 0.16 0.09 -0.30 0.00 -0.41 0.00 0.00 32.23 31.78 1g3g h LYS 57 CO -0.04 1.12 -0.85 -1.21 -2.27 0.00 0.00 179.45 176.20 1g3g s GLU 58 N -2.41 2.72 0.15 1.90 2.02 0.24 -5.02 118.70 118.30 1g3g s GLU 58 Ca -0.22 -0.84 0.05 0.00 0.02 0.00 0.00 54.97 53.98 1g3g s GLU 58 Cb 0.04 -2.27 -0.07 0.00 0.10 0.00 0.00 34.13 31.92 1g3g s GLU 58 CO 0.71 0.37 1.34 0.87 0.02 0.00 0.00 175.26 178.57 1g3g h LYS 59 N 6.13 0.09 -0.19 1.61 6.56 -1.83 -3.23 116.57 125.70 1g3g h LYS 59 Ca -0.31 -0.12 -0.11 0.00 -1.06 0.00 0.00 60.65 59.05 1g3g h LYS 59 Cb 1.19 0.04 -0.01 0.00 -0.57 0.00 0.00 32.23 32.87 1g3g h LYS 59 CO 0.49 0.95 -0.34 0.07 -2.06 0.00 0.00 179.45 178.56 1g3g h ARG 60 N 0.04 0.40 -5.55 3.15 0.11 -1.93 -3.41 114.38 107.20 1g3g h ARG 60 Ca -0.03 -0.17 -0.29 0.00 0.10 0.00 0.00 59.98 59.58 1g3g h ARG 60 Cb 1.61 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 32.68 1g3g h ARG 60 CO 0.13 0.70 0.98 -1.12 0.10 0.00 0.00 179.97 180.76 1g3g s SER 61 N -6.85 4.31 -0.32 0.08 0.01 -1.22 -4.58 113.70 105.13 1g3g s SER 61 Ca -0.06 0.57 0.00 0.00 1.31 0.00 0.00 55.95 57.77 1g3g s SER 61 Cb 0.13 -2.52 0.30 0.00 0.21 0.00 0.00 66.02 64.14 1g3g s SER 61 CO 0.79 -3.22 1.34 0.00 0.41 0.00 0.00 173.24 172.56 1g3g n ILE 62 N 8.24 0.00 -3.02 1.44 0.13 -1.26 -4.20 119.36 120.69 1g3g n ILE 62 Ca 0.40 -0.59 -0.05 0.00 -1.10 0.00 0.00 62.75 61.41 1g3g n ILE 62 Cb 0.50 1.04 -0.01 0.00 -0.84 0.00 0.00 39.64 40.33 1g3g n ILE 62 CO 0.00 0.00 0.00 -0.75 2.80 0.00 0.00 176.55 178.60 1g3g s LYS 63 N 0.04 0.94 -0.03 9.51 2.20 -1.26 -4.77 119.74 126.36 1g3g s LYS 63 Ca 0.23 -0.81 0.01 0.00 -0.36 0.00 0.00 55.97 55.04 1g3g s LYS 63 Cb 0.25 -0.13 0.02 0.00 -1.51 0.00 0.00 37.83 36.45 1g3g s LYS 63 CO -0.13 -1.27 -0.02 0.21 -0.36 0.00 0.00 175.35 173.77 1g3g s LYS 64 N 1.23 0.55 -0.01 4.03 2.20 -1.18 -5.04 119.74 121.52 1g3g s LYS 64 Ca 0.24 -0.03 0.02 0.00 -0.36 0.00 0.00 55.97 55.84 1g3g s LYS 64 Cb -0.03 -0.63 0.00 0.00 -1.51 0.00 0.00 37.83 35.66 1g3g s LYS 64 CO -0.06 -0.09 -0.06 0.08 -0.36 0.00 0.00 175.35 174.86 1g3g s VAL 65 N 0.87 0.48 -0.11 4.02 1.01 -1.26 0.63 120.40 126.04 1g3g s VAL 65 Ca -0.10 -0.23 -0.06 0.00 0.00 0.00 0.00 61.98 61.59 1g3g s VAL 65 Cb -0.13 -0.43 -0.04 0.00 0.00 0.00 0.00 36.38 35.78 1g3g s VAL 65 CO -0.01 0.15 0.13 0.26 0.00 0.00 0.00 175.10 175.63 1g3g s TRP 66 N 0.07 3.56 -0.09 5.22 0.51 0.58 -4.89 118.94 123.90 1g3g s TRP 66 Ca -0.00 0.50 0.02 0.00 -2.12 0.00 0.00 56.10 54.49 1g3g s TRP 66 Cb -0.05 -1.92 0.01 0.00 -0.81 0.00 0.00 33.47 30.70 1g3g s TRP 66 CO -0.00 0.71 -0.15 0.99 -0.51 0.00 0.00 176.95 177.99 1g3g s THR 67 N -1.02 1.44 -0.29 2.01 2.01 -1.26 0.21 115.64 118.73 1g3g s THR 67 Ca 0.15 -0.63 -0.11 0.00 0.31 0.00 0.00 61.69 61.41 1g3g s THR 67 Cb -0.12 -1.31 -0.04 0.00 0.01 0.00 0.00 72.50 71.05 1g3g s THR 67 CO 0.04 0.43 0.19 -0.36 -0.69 0.00 0.00 174.62 174.22 1g3g s PHE 68 N 0.81 3.20 -5.00 4.92 0.08 0.35 0.31 117.98 122.65 1g3g s PHE 68 Ca -0.11 -0.07 0.00 0.00 0.12 0.00 0.00 56.93 56.87 1g3g s PHE 68 Cb -0.16 -2.38 0.00 0.00 -0.57 0.00 0.00 43.02 39.91 1g3g s PHE 68 CO 0.01 -0.25 0.00 0.41 -0.10 0.00 0.00 175.22 175.29 1g3g n GLY 69 N 5.05 -0.49 3.56 4.36 0.00 -1.22 -0.45 105.19 115.99 1g3g n GLY 69 Ca -0.14 -1.04 -0.37 0.00 0.00 0.00 0.00 46.02 44.47 1g3g n GLY 69 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1g3g s ARG 70 N -2.00 3.21 0.05 1.61 1.70 -1.25 -3.63 118.95 118.63 1g3g s ARG 70 Ca 0.00 -0.66 -0.13 0.00 -0.47 0.00 0.00 55.73 54.47 1g3g s ARG 70 Cb 0.00 -5.04 0.02 0.00 -0.57 0.00 0.00 34.95 29.35 1g3g s ARG 70 CO 0.00 -2.53 0.29 -0.80 -1.08 0.00 0.00 175.30 171.18 1g3g s ASN 71 N 5.77 -0.10 0.02 -2.89 0.01 -1.26 -4.69 114.94 111.80 1g3g s ASN 71 Ca 0.52 -0.23 0.01 0.00 -0.71 0.00 0.00 52.86 52.45 1g3g s ASN 71 Cb -0.04 0.35 0.04 0.00 0.41 0.00 0.00 41.25 42.02 1g3g s ASN 71 CO -0.02 -0.62 0.92 -2.65 -1.51 0.00 0.00 177.10 173.22 1g3g n PRO 72 N 0.55 0.01 0.00 -0.60 -0.02 -1.26 -4.05 135.00 129.62 1g3g n PRO 72 Ca -0.18 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.70 1g3g n PRO 72 Cb 0.60 -1.63 0.00 0.00 -0.02 0.00 0.00 33.50 32.45 1g3g n PRO 72 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1g3g n ALA 73 N -1.41 0.00 0.01 3.55 0.00 -1.26 -4.38 120.51 117.02 1g3g n ALA 73 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 1g3g n ALA 73 Cb 0.11 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.56 1g3g n ALA 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1g3g n ASP 75 N -2.47 1.94 -3.82 0.00 -0.08 0.91 -4.46 116.55 108.57 1g3g n ASP 75 Ca -0.00 0.30 -0.12 0.00 -1.51 0.00 0.00 54.79 53.46 1g3g n ASP 75 Cb 0.02 -0.84 -0.12 0.00 2.34 0.00 0.00 41.12 42.52 1g3g n ASP 75 CO 0.00 0.00 0.00 -0.47 0.12 0.00 0.00 177.20 176.85 1g3g s TYR 76 N -2.46 -0.14 -0.48 -0.67 6.14 -1.16 -4.89 117.35 113.70 1g3g s TYR 76 Ca -0.33 0.32 -0.19 0.00 0.64 0.00 0.00 57.07 57.51 1g3g s TYR 76 Cb 0.10 0.04 0.04 0.00 0.42 0.00 0.00 41.96 42.56 1g3g s TYR 76 CO 0.57 -0.15 0.61 -1.58 0.64 0.00 0.00 175.55 175.65 1g3g s HIS 77 N -0.31 3.06 0.42 4.97 5.65 -1.26 -3.95 115.29 123.88 1g3g s HIS 77 Ca -0.04 -0.38 0.05 0.00 0.25 0.00 0.00 55.06 54.94 1g3g s HIS 77 Cb -0.03 -3.41 -0.06 0.00 -1.18 0.00 0.00 32.58 27.90 1g3g s HIS 77 CO 0.01 -0.95 0.02 -0.48 -0.65 0.00 0.00 174.74 172.69 1g3g s LEU 78 N 2.64 2.57 0.00 8.88 0.05 -1.24 -4.91 118.68 126.67 1g3g s LEU 78 Ca 0.17 -1.46 -0.06 0.00 0.05 0.00 0.00 54.13 52.83 1g3g s LEU 78 Cb -0.17 -0.73 0.09 0.00 -2.05 0.00 0.00 46.19 43.33 1g3g s LEU 78 CO 0.14 -0.61 0.21 0.61 -0.55 0.00 0.00 176.35 176.15 1g3g n GLY 79 N -1.00 -3.39 3.13 -3.48 0.00 -1.26 -4.56 105.19 94.63 1g3g n GLY 79 Ca -0.08 -1.11 -0.37 0.00 0.00 0.00 0.00 46.02 44.45 1g3g n GLY 79 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1g3g s ASN 80 N -2.16 5.33 -0.26 1.61 0.01 -1.26 -4.42 114.94 113.80 1g3g s ASN 80 Ca 0.16 -2.18 -0.02 0.00 -0.71 0.00 0.00 52.86 50.12 1g3g s ASN 80 Cb -0.03 -1.86 0.03 0.00 0.41 0.00 0.00 41.25 39.80 1g3g s ASN 80 CO 0.13 -0.53 -0.04 -0.63 -1.51 0.00 0.00 177.10 174.52 1g3g s ILE 81 N 0.94 2.95 0.61 0.60 1.01 -1.26 -4.99 121.20 121.06 1g3g s ILE 81 Ca 0.10 -1.09 0.30 0.00 0.00 0.00 0.00 60.65 59.95 1g3g s ILE 81 Cb -0.23 -2.55 0.36 0.00 0.01 0.00 0.00 42.46 40.06 1g3g s ILE 81 CO -0.04 0.12 2.01 0.28 0.00 0.00 0.00 174.94 177.31 1g3g h SER 82 N 8.02 0.00 0.00 3.58 0.02 -2.00 -3.17 113.55 120.00 1g3g h SER 82 Ca -0.30 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.65 1g3g h SER 82 Cb 1.10 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.64 1g3g h SER 82 CO 0.56 0.00 0.00 0.54 -1.14 0.00 0.00 176.83 176.79 1g3g n ARG 83 N -3.52 0.00 -3.75 3.45 5.12 -1.26 -4.96 116.66 111.74 1g3g n ARG 83 Ca 0.03 0.00 -0.38 0.00 -1.93 0.00 0.00 57.85 55.57 1g3g n ARG 83 Cb 0.44 0.00 -0.12 0.00 -1.16 0.00 0.00 32.46 31.61 1g3g n ARG 83 CO 0.00 0.00 0.00 -0.48 -1.93 0.00 0.00 177.63 175.22 1g3g s LEU 84 N 0.00 4.29 0.00 0.55 0.05 -1.26 -4.51 118.68 117.80 1g3g s LEU 84 Ca 0.00 -1.09 0.00 0.00 0.05 0.00 0.00 54.13 53.09 1g3g s LEU 84 Cb 0.00 -1.88 0.00 0.00 -2.05 0.00 0.00 46.19 42.26 1g3g s LEU 84 CO 0.00 -0.32 0.00 -1.20 -0.55 0.00 0.00 176.35 174.28 1g3g n SER 85 N 4.82 0.00 -3.76 1.48 7.64 -1.26 -4.93 113.62 117.62 1g3g n SER 85 Ca -0.13 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.75 1g3g n SER 85 Cb 0.45 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.65 1g3g n SER 85 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1g3g n ASN 86 N 0.00 0.00 -3.94 6.43 3.02 -1.20 -3.74 115.26 115.84 1g3g n ASN 86 Ca 0.00 0.00 -0.16 0.00 -0.03 0.00 0.00 54.58 54.39 1g3g n ASN 86 Cb 0.00 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.11 1g3g n ASN 86 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 1g3g n LYS 87 N 0.00 0.01 0.03 3.52 2.85 -1.26 -3.45 118.16 119.88 1g3g n LYS 87 Ca 0.00 -0.58 0.11 0.00 -1.05 0.00 0.00 58.31 56.79 1g3g n LYS 87 Cb 0.00 -1.93 -0.08 0.00 -0.65 0.00 0.00 35.03 32.37 1g3g n LYS 87 CO 0.00 0.00 0.00 1.58 -0.05 0.00 0.00 177.40 178.93 1g3g n HIS 88 N 8.03 0.37 -3.59 5.58 -0.00 0.40 -4.39 115.22 121.61 1g3g n HIS 88 Ca 0.21 0.11 -0.06 0.00 0.46 0.00 0.00 57.72 58.43 1g3g n HIS 88 Cb 0.38 -0.62 -0.04 0.00 -0.12 0.00 0.00 29.99 29.59 1g3g n HIS 88 CO 0.00 0.00 0.00 0.12 0.46 0.00 0.00 176.34 176.92 1g3g s PHE 89 N -3.39 -0.22 0.11 1.57 5.36 0.92 -2.79 117.98 119.54 1g3g s PHE 89 Ca -0.03 0.31 0.03 0.00 -0.96 0.00 0.00 56.93 56.28 1g3g s PHE 89 Cb 0.13 0.49 -0.04 0.00 -0.34 0.00 0.00 43.02 43.25 1g3g s PHE 89 CO 0.85 -0.24 -0.08 -0.65 -1.46 0.00 0.00 175.22 173.64 1g3g s GLN 90 N -1.57 0.90 -0.07 10.12 -0.21 0.37 0.13 119.66 129.34 1g3g s GLN 90 Ca 0.04 -1.34 0.04 0.00 0.02 0.00 0.00 55.36 54.12 1g3g s GLN 90 Cb -0.01 -0.38 0.00 0.00 1.00 0.00 0.00 33.01 33.62 1g3g s GLN 90 CO -0.03 0.03 -0.18 0.42 -2.12 0.00 0.00 175.29 173.40 1g3g s ILE 91 N -3.34 1.56 0.00 1.08 1.01 0.56 0.13 121.20 122.21 1g3g s ILE 91 Ca 0.12 -0.75 0.01 0.00 0.00 0.00 0.00 60.65 60.03 1g3g s ILE 91 Cb 0.03 -1.37 -0.04 0.00 0.01 0.00 0.00 42.46 41.10 1g3g s ILE 91 CO -0.02 0.45 0.01 -0.76 0.00 0.00 0.00 174.94 174.62 1g3g s LEU 92 N 0.33 3.57 -0.09 2.97 1.43 0.54 0.21 118.68 127.64 1g3g s LEU 92 Ca -0.12 0.01 0.03 0.00 -1.03 0.00 0.00 54.13 53.01 1g3g s LEU 92 Cb -0.15 -2.06 0.01 0.00 0.03 0.00 0.00 46.19 44.02 1g3g s LEU 92 CO 0.05 0.27 -0.16 -0.22 0.23 0.00 0.00 176.35 176.52 1g3g s LEU 93 N -1.62 1.77 0.00 1.79 1.98 0.21 0.83 118.68 123.63 1g3g s LEU 93 Ca 0.20 -0.39 0.00 0.00 -2.89 0.00 0.00 54.13 51.05 1g3g s LEU 93 Cb -0.12 -1.03 0.00 0.00 0.66 0.00 0.00 46.19 45.70 1g3g s LEU 93 CO 0.11 0.06 0.00 0.61 -1.89 0.00 0.00 176.35 175.24 1g3g n GLY 94 N 3.85 -0.39 2.82 7.98 0.00 -1.14 -3.11 105.19 115.20 1g3g n GLY 94 Ca -0.21 -0.74 -0.01 0.00 0.00 0.00 0.00 46.02 45.06 1g3g n GLY 94 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1g3g n GLU 95 N 0.00 -1.30 0.00 1.61 0.00 -1.26 -2.20 120.64 117.49 1g3g n GLU 95 Ca 0.00 1.46 0.00 0.00 0.00 0.00 0.00 57.16 58.62 1g3g n GLU 95 Cb 0.00 -5.19 0.00 0.00 0.00 0.00 0.00 31.44 26.25 1g3g n GLU 95 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1g3g n ASP 96 N -1.44 0.00 -1.19 4.31 9.92 -1.26 -1.61 116.55 125.27 1g3g n ASP 96 Ca 0.02 0.00 -0.01 0.00 -0.53 0.00 0.00 54.79 54.26 1g3g n ASP 96 Cb 0.48 0.00 -0.02 0.00 -0.64 0.00 0.00 41.12 40.94 1g3g n ASP 96 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1g3g n GLY 97 N 0.00 0.75 0.31 0.44 0.00 -1.26 -5.11 105.19 100.32 1g3g n GLY 97 Ca 0.00 -0.39 -0.02 0.00 0.00 0.00 0.00 46.02 45.60 1g3g n GLY 97 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1g3g n ASN 98 N 0.23 1.60 -4.23 1.61 2.85 -0.63 -4.91 115.26 111.78 1g3g n ASN 98 Ca -0.10 -1.17 -0.16 0.00 -0.11 0.00 0.00 54.58 53.04 1g3g n ASN 98 Cb 0.90 0.01 -0.11 0.00 1.24 0.00 0.00 39.78 41.83 1g3g n ASN 98 CO 0.00 0.00 0.00 -0.22 -2.11 0.00 0.00 177.26 174.93 1g3g s LEU 99 N 0.00 2.45 0.05 1.20 0.20 -1.25 -2.86 118.68 118.46 1g3g s LEU 99 Ca 0.01 -0.88 0.04 0.00 0.69 0.00 0.00 54.13 53.99 1g3g s LEU 99 Cb -0.00 -0.42 -0.03 0.00 -0.43 0.00 0.00 46.19 45.31 1g3g s LEU 99 CO 0.01 -0.24 -0.11 -0.76 -0.29 0.00 0.00 176.35 174.96 1g3g s LEU 100 N -2.70 2.25 -0.13 -0.68 1.02 0.24 -1.17 118.68 117.50 1g3g s LEU 100 Ca 0.11 -0.55 0.00 0.00 0.02 0.00 0.00 54.13 53.71 1g3g s LEU 100 Cb -0.02 -0.34 -0.01 0.00 0.02 0.00 0.00 46.19 45.84 1g3g s LEU 100 CO 0.02 -0.12 -0.14 -0.76 0.02 0.00 0.00 176.35 175.36 1g3g s LEU 101 N -1.55 2.64 -0.32 1.79 1.02 0.26 0.20 118.68 122.72 1g3g s LEU 101 Ca -0.05 -0.37 -0.05 0.00 0.02 0.00 0.00 54.13 53.67 1g3g s LEU 101 Cb -0.09 -1.59 0.03 0.00 0.02 0.00 0.00 46.19 44.56 1g3g s LEU 101 CO 0.01 0.15 0.07 0.21 0.02 0.00 0.00 176.35 176.81 1g3g s ASN 102 N 0.46 5.15 -0.40 2.29 2.47 0.34 0.20 114.94 125.46 1g3g s ASN 102 Ca -0.10 -1.06 -0.25 0.00 0.42 0.00 0.00 52.86 51.86 1g3g s ASN 102 Cb -0.16 -1.83 0.02 0.00 -1.45 0.00 0.00 41.25 37.83 1g3g s ASN 102 CO 0.05 -0.28 0.91 -1.81 -3.72 0.00 0.00 177.10 172.25 1g3g s ASP 103 N 1.39 6.60 -0.27 -4.21 1.01 -1.23 0.14 116.67 120.10 1g3g s ASP 103 Ca -0.01 0.38 0.02 0.00 0.71 0.00 0.00 52.55 53.65 1g3g s ASP 103 Cb -0.19 -2.45 0.07 0.00 1.01 0.00 0.00 42.92 41.36 1g3g s ASP 103 CO 0.02 -0.92 -0.05 0.27 0.21 0.00 0.00 175.17 174.70 1g3g s ILE 104 N 3.56 1.87 0.18 0.77 -4.36 -1.23 0.13 121.20 122.11 1g3g s ILE 104 Ca 0.37 -1.60 0.02 0.00 -0.26 0.00 0.00 60.65 59.18 1g3g s ILE 104 Cb -0.11 -2.13 -0.05 0.00 1.25 0.00 0.00 42.46 41.42 1g3g s ILE 104 CO 0.22 -0.20 0.00 -0.44 0.24 0.00 0.00 174.94 174.76 1g3g s SER 105 N 1.21 1.22 -0.01 4.36 0.01 -1.12 -0.06 113.70 119.31 1g3g s SER 105 Ca -0.03 -1.18 -0.15 0.00 1.31 0.00 0.00 55.95 55.91 1g3g s SER 105 Cb -0.19 0.12 -0.08 0.00 0.21 0.00 0.00 66.02 66.07 1g3g s SER 105 CO -0.07 -0.57 0.75 0.74 0.41 0.00 0.00 173.24 174.50 1g3g h THR 106 N 2.68 0.00 0.00 1.44 2.02 -1.83 -3.43 112.91 113.79 1g3g h THR 106 Ca -0.37 -0.34 -0.15 0.00 0.77 0.00 0.00 66.41 66.32 1g3g h THR 106 Cb 1.21 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 67.59 1g3g h THR 106 CO 0.63 0.00 -1.58 -0.46 0.37 0.00 0.00 175.52 174.48 1g3g n ASN 107 N -4.38 3.01 -3.71 4.18 0.23 -1.26 -5.05 115.26 108.27 1g3g n ASN 107 Ca -0.07 -0.02 -0.13 0.00 -0.53 0.00 0.00 54.58 53.84 1g3g n ASN 107 Cb 0.21 0.47 -0.13 0.00 -2.08 0.00 0.00 39.78 38.25 1g3g n ASN 107 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 1g3g s GLY 108 N -4.29 -0.12 -0.03 4.83 0.00 -1.26 -5.05 107.32 101.40 1g3g s GLY 108 Ca -0.07 0.94 0.07 0.00 0.00 0.00 0.00 44.72 45.66 1g3g s GLY 108 CO 0.32 1.39 -0.24 -1.59 0.00 0.00 0.00 173.10 172.98 1g3g s THR 109 N 1.52 1.91 0.10 0.90 2.01 -1.26 -4.03 115.64 116.80 1g3g s THR 109 Ca -0.07 -1.02 0.09 0.00 0.31 0.00 0.00 61.69 61.01 1g3g s THR 109 Cb -0.11 -1.60 -0.04 0.00 0.01 0.00 0.00 72.50 70.77 1g3g s THR 109 CO -0.08 0.54 -0.23 0.26 -0.69 0.00 0.00 174.62 174.41 1g3g s TRP 110 N -0.39 2.01 -0.22 4.92 0.51 0.46 0.63 118.94 126.86 1g3g s TRP 110 Ca 0.04 -0.40 0.01 0.00 -2.12 0.00 0.00 56.10 53.63 1g3g s TRP 110 Cb -0.11 -1.11 0.05 0.00 -0.81 0.00 0.00 33.47 31.49 1g3g s TRP 110 CO 0.01 0.24 -0.09 -1.17 -0.51 0.00 0.00 176.95 175.43 1g3g s LEU 111 N -1.86 2.60 -1.64 2.99 2.96 -0.34 0.14 118.68 123.52 1g3g s LEU 111 Ca 0.10 -1.08 -0.11 0.00 -0.22 0.00 0.00 54.13 52.81 1g3g s LEU 111 Cb -0.10 -1.28 0.11 0.00 0.50 0.00 0.00 46.19 45.42 1g3g s LEU 111 CO 0.05 -0.18 0.50 0.59 -1.32 0.00 0.00 176.35 175.98 1g3g n ASN 112 N 4.63 -1.43 -0.01 3.68 3.02 -0.53 -0.04 115.26 124.57 1g3g n ASN 112 Ca -0.14 -1.11 -0.00 0.00 -0.03 0.00 0.00 54.58 53.30 1g3g n ASN 112 Cb 0.45 -2.36 -0.00 0.00 -0.61 0.00 0.00 39.78 37.26 1g3g n ASN 112 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1g3g n GLY 113 N -1.72 0.37 2.55 7.41 0.00 -1.26 -5.02 105.19 107.52 1g3g n GLY 113 Ca -0.09 -0.96 -0.29 0.00 0.00 0.00 0.00 46.02 44.68 1g3g n GLY 113 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1g3g s GLN 114 N -3.29 0.39 0.01 1.61 0.74 0.94 -5.11 119.66 114.95 1g3g s GLN 114 Ca 0.00 -0.88 -0.39 0.00 0.05 0.00 0.00 55.36 54.15 1g3g s GLN 114 Cb 0.00 -1.34 -0.18 0.00 1.10 0.00 0.00 33.01 32.59 1g3g s GLN 114 CO 0.00 -1.07 1.26 1.17 -0.55 0.00 0.00 175.29 176.09 1g3g n LYS 115 N 4.80 0.61 -4.10 1.67 4.81 -1.26 -1.20 118.16 123.49 1g3g n LYS 115 Ca 0.00 0.22 -0.27 0.00 -0.87 0.00 0.00 58.31 57.39 1g3g n LYS 115 Cb 0.40 -1.80 -0.04 0.00 0.02 0.00 0.00 35.03 33.62 1g3g n LYS 115 CO 0.00 0.00 0.00 1.33 1.17 0.00 0.00 177.40 179.90 1g3g n VAL 116 N 2.25 0.00 -3.42 3.15 0.24 0.20 -4.83 118.33 115.93 1g3g n VAL 116 Ca 0.20 -2.10 -0.37 0.00 -2.04 0.00 0.00 64.34 60.04 1g3g n VAL 116 Cb 0.13 0.23 -0.06 0.00 -1.47 0.00 0.00 33.84 32.67 1g3g n VAL 116 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1g3g s GLU 117 N -3.82 3.98 0.93 7.34 2.02 -1.26 -4.38 118.70 123.51 1g3g s GLU 117 Ca 0.11 0.48 -0.11 0.00 0.02 0.00 0.00 54.97 55.47 1g3g s GLU 117 Cb -0.01 -3.11 0.15 0.00 0.10 0.00 0.00 34.13 31.27 1g3g s GLU 117 CO 0.07 0.60 1.11 0.21 0.02 0.00 0.00 175.26 177.27 1g3g s LYS 118 N -1.47 0.95 -1.26 1.61 2.20 -1.26 -2.98 119.74 117.53 1g3g s LYS 118 Ca 0.30 1.25 -0.16 0.00 -0.36 0.00 0.00 55.97 57.00 1g3g s LYS 118 Cb -0.16 -1.74 0.16 0.00 -1.51 0.00 0.00 37.83 34.57 1g3g s LYS 118 CO 0.17 -2.58 0.40 0.27 -0.36 0.00 0.00 175.35 173.25 1g3g n ASN 119 N -4.17 -1.28 -4.21 1.43 0.23 0.35 -4.85 115.26 102.77 1g3g n ASN 119 Ca 0.09 -0.80 -0.37 0.00 -0.53 0.00 0.00 54.58 52.97 1g3g n ASN 119 Cb 0.53 -1.13 -0.12 0.00 -2.08 0.00 0.00 39.78 36.98 1g3g n ASN 119 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 1g3g s SER 120 N -2.54 5.25 0.43 0.53 1.04 -1.16 -4.91 113.70 112.35 1g3g s SER 120 Ca 0.56 -1.46 -0.24 0.00 0.48 0.00 0.00 55.95 55.28 1g3g s SER 120 Cb -0.33 -1.84 -0.10 0.00 0.10 0.00 0.00 66.02 63.86 1g3g s SER 120 CO 0.69 -0.40 1.13 0.59 0.98 0.00 0.00 173.24 176.22 1g3g n ASN 121 N 4.73 1.81 -4.15 7.02 4.13 -1.25 -3.56 115.26 123.98 1g3g n ASN 121 Ca -0.10 1.05 -0.20 0.00 1.68 0.00 0.00 54.58 57.01 1g3g n ASN 121 Cb 0.43 -1.42 -0.13 0.00 -1.54 0.00 0.00 39.78 37.12 1g3g n ASN 121 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 1g3g s GLN 122 N -2.15 0.96 -0.11 3.52 -1.52 0.55 -4.83 119.66 116.08 1g3g s GLN 122 Ca 0.63 -0.77 -0.30 0.00 -1.95 0.00 0.00 55.36 52.98 1g3g s GLN 122 Cb -0.53 -0.98 -0.03 0.00 -0.22 0.00 0.00 33.01 31.26 1g3g s GLN 122 CO 0.56 0.24 1.36 -1.17 -0.25 0.00 0.00 175.29 176.03 1g3g s LEU 123 N -1.13 4.24 0.34 2.90 0.20 -1.26 0.89 118.68 124.86 1g3g s LEU 123 Ca 0.02 1.88 -0.26 0.00 0.69 0.00 0.00 54.13 56.46 1g3g s LEU 123 Cb -0.08 -3.54 -0.13 0.00 -0.43 0.00 0.00 46.19 42.00 1g3g s LEU 123 CO 0.01 -0.77 0.79 -0.11 -0.29 0.00 0.00 176.35 175.98 1g3g n LEU 124 N 6.38 0.89 -4.26 -0.68 7.94 -0.32 -4.84 117.00 122.11 1g3g n LEU 124 Ca 0.14 1.06 -0.20 0.00 -1.11 0.00 0.00 56.01 55.90 1g3g n LEU 124 Cb 0.44 -1.19 -0.12 0.00 0.53 0.00 0.00 43.42 43.08 1g3g n LEU 124 CO 0.58 -2.12 -0.48 -0.44 -1.11 0.00 0.00 177.39 173.82 1g3g s SER 125 N -0.78 2.23 -0.27 1.96 0.01 -1.26 -4.98 113.70 110.61 1g3g s SER 125 Ca 0.61 -0.75 -0.29 0.00 1.31 0.00 0.00 55.95 56.83 1g3g s SER 125 Cb -0.68 -0.10 -0.01 0.00 0.21 0.00 0.00 66.02 65.43 1g3g s SER 125 CO 0.58 -0.05 1.54 -1.10 0.41 0.00 0.00 173.24 174.62 1g3g s GLN 126 N -2.31 3.75 -1.33 12.44 -1.52 -1.26 -2.71 119.66 126.72 1g3g s GLN 126 Ca 0.08 1.45 -0.01 0.00 -1.95 0.00 0.00 55.36 54.93 1g3g s GLN 126 Cb -0.07 -4.01 0.00 0.00 -0.22 0.00 0.00 33.01 28.70 1g3g s GLN 126 CO 0.04 -1.34 0.15 0.41 -0.25 0.00 0.00 175.29 174.30 1g3g n GLY 127 N 4.71 -0.28 3.62 3.09 0.00 -1.24 -4.96 105.19 110.12 1g3g n GLY 127 Ca 0.18 -0.16 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 1g3g n GLY 127 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1g3g n ASP 128 N -1.24 -0.10 -3.76 1.61 2.03 -1.10 -4.64 116.55 109.35 1g3g n ASP 128 Ca -0.16 0.42 -0.13 0.00 0.52 0.00 0.00 54.79 55.45 1g3g n ASP 128 Cb 0.63 -1.42 -0.12 0.00 -0.72 0.00 0.00 41.12 39.48 1g3g n ASP 128 CO 0.00 0.00 0.00 -0.70 -1.92 0.00 0.00 177.20 174.58 1g3g s GLU 129 N -4.34 0.25 -0.15 -0.67 2.12 -1.26 -0.53 118.70 114.12 1g3g s GLU 129 Ca 0.66 0.42 -0.02 0.00 0.36 0.00 0.00 54.97 56.38 1g3g s GLU 129 Cb -0.24 0.03 -0.02 0.00 0.26 0.00 0.00 34.13 34.16 1g3g s GLU 129 CO 0.59 -0.09 -0.08 0.42 -0.54 0.00 0.00 175.26 175.56 1g3g s ILE 130 N 0.61 3.42 -0.02 -3.70 1.09 0.38 -1.46 121.20 121.53 1g3g s ILE 130 Ca -0.04 -0.52 -0.01 0.00 -1.10 0.00 0.00 60.65 58.98 1g3g s ILE 130 Cb -0.05 -2.48 -0.04 0.00 -1.06 0.00 0.00 42.46 38.83 1g3g s ILE 130 CO -0.04 0.50 0.10 -0.89 -0.10 0.00 0.00 174.94 174.52 1g3g s THR 131 N 0.50 4.92 0.05 2.92 2.01 0.37 0.55 115.64 126.95 1g3g s THR 131 Ca -0.06 -0.31 -0.02 0.00 0.31 0.00 0.00 61.69 61.61 1g3g s THR 131 Cb -0.15 -3.25 -0.03 0.00 0.01 0.00 0.00 72.50 69.08 1g3g s THR 131 CO 0.04 0.37 0.01 0.68 -0.69 0.00 0.00 174.62 175.02 1g3g s VAL 132 N -1.20 0.19 -0.75 3.82 -7.23 0.38 0.18 120.40 115.79 1g3g s VAL 132 Ca 0.23 -1.56 -0.04 0.00 -1.81 0.00 0.00 61.98 58.79 1g3g s VAL 132 Cb -0.12 -1.29 0.00 0.00 0.56 0.00 0.00 36.38 35.54 1g3g s VAL 132 CO 0.14 -0.86 0.65 0.61 -0.31 0.00 0.00 175.10 175.33 1g3g n GLY 133 N 0.34 0.10 3.83 2.32 0.00 -1.26 0.10 105.19 110.62 1g3g n GLY 133 Ca -0.16 -0.15 -0.32 0.00 0.00 0.00 0.00 46.02 45.39 1g3g n GLY 133 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1g3g s VAL 134 N -3.18 4.16 0.00 1.61 1.01 -1.26 -3.36 120.40 119.37 1g3g s VAL 134 Ca 0.29 0.86 0.00 0.00 0.00 0.00 0.00 61.98 63.13 1g3g s VAL 134 Cb -0.13 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 32.73 1g3g s VAL 134 CO 0.41 -0.76 0.00 0.61 0.00 0.00 0.00 175.10 175.36 1g3g n GLY 135 N -1.72 4.39 3.01 4.51 0.00 -1.26 -5.01 105.19 109.10 1g3g n GLY 135 Ca 0.07 -0.77 -0.28 0.00 0.00 0.00 0.00 46.02 45.05 1g3g n GLY 135 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1g3g s VAL 136 N 0.00 1.33 0.59 1.61 1.01 -1.26 -5.01 120.40 118.67 1g3g s VAL 136 Ca 0.00 -0.52 0.29 0.00 0.00 0.00 0.00 61.98 61.75 1g3g s VAL 136 Cb 0.00 -1.25 0.39 0.00 0.00 0.00 0.00 36.38 35.53 1g3g s VAL 136 CO 0.00 0.41 1.84 -0.33 0.00 0.00 0.00 175.10 177.02 1g3g h GLU 137 N 7.64 0.00 -0.35 2.72 5.08 -1.98 0.79 114.58 128.48 1g3g h GLU 137 Ca -0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.04 1g3g h GLU 137 Cb 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 1g3g h GLU 137 CO 0.47 0.00 0.00 0.45 -1.00 0.00 0.00 179.01 178.93 1g3g n SER 138 N -3.71 2.62 -0.66 1.42 2.88 -1.26 -4.16 113.62 110.74 1g3g n SER 138 Ca 0.11 -1.90 0.04 0.00 -1.33 0.00 0.00 58.87 55.79 1g3g n SER 138 Cb 0.78 -0.23 0.08 0.00 -0.75 0.00 0.00 64.21 64.09 1g3g n SER 138 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1g3g n ASP 139 N 0.94 1.13 -4.88 -3.46 9.92 0.27 -5.06 116.55 115.41 1g3g n ASP 139 Ca 0.18 -2.61 -0.37 0.00 -0.53 0.00 0.00 54.79 51.46 1g3g n ASP 139 Cb 0.46 -0.34 -0.06 0.00 -0.64 0.00 0.00 41.12 40.54 1g3g n ASP 139 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1g3g s ILE 140 N -1.28 5.42 -0.06 0.53 1.01 -1.13 -4.42 121.20 121.27 1g3g s ILE 140 Ca 0.23 0.25 0.06 0.00 0.00 0.00 0.00 60.65 61.19 1g3g s ILE 140 Cb 0.23 -3.47 -0.01 0.00 0.01 0.00 0.00 42.46 39.22 1g3g s ILE 140 CO -0.05 0.56 -0.25 -0.76 0.00 0.00 0.00 174.94 174.44 1g3g s LEU 141 N -1.20 2.07 0.14 2.97 1.02 0.28 -4.96 118.68 119.00 1g3g s LEU 141 Ca 0.19 -0.51 0.08 0.00 0.02 0.00 0.00 54.13 53.91 1g3g s LEU 141 Cb -0.13 -1.38 -0.04 0.00 0.02 0.00 0.00 46.19 44.67 1g3g s LEU 141 CO 0.08 0.24 -0.12 -0.55 0.02 0.00 0.00 176.35 176.02 1g3g s SER 142 N -0.14 4.18 -0.04 2.29 0.15 -1.26 0.15 113.70 119.03 1g3g s SER 142 Ca -0.04 -0.52 0.01 0.00 0.70 0.00 0.00 55.95 56.10 1g3g s SER 142 Cb -0.14 -0.70 0.02 0.00 -1.71 0.00 0.00 66.02 63.49 1g3g s SER 142 CO 0.04 0.15 -0.02 -0.76 1.20 0.00 0.00 173.24 173.84 1g3g s LEU 143 N -2.45 1.25 -0.00 3.45 1.43 0.19 -4.22 118.68 118.32 1g3g s LEU 143 Ca 0.22 -0.07 0.07 0.00 -1.03 0.00 0.00 54.13 53.31 1g3g s LEU 143 Cb -0.10 -0.33 -0.02 0.00 0.03 0.00 0.00 46.19 45.77 1g3g s LEU 143 CO 0.13 -0.08 -0.21 -0.69 0.23 0.00 0.00 176.35 175.74 1g3g s VAL 144 N 0.96 1.65 -0.05 -1.59 1.01 -0.96 0.14 120.40 121.56 1g3g s VAL 144 Ca -0.11 -0.95 0.02 0.00 0.00 0.00 0.00 61.98 60.95 1g3g s VAL 144 Cb -0.14 -1.38 -0.03 0.00 0.00 0.00 0.00 36.38 34.83 1g3g s VAL 144 CO -0.01 0.41 -0.11 -0.51 0.00 0.00 0.00 175.10 174.89 1g3g s ILE 145 N -0.55 3.38 -0.28 2.22 2.07 0.32 0.18 121.20 128.55 1g3g s ILE 145 Ca 0.08 -0.62 0.02 0.00 -1.41 0.00 0.00 60.65 58.73 1g3g s ILE 145 Cb -0.08 -2.36 0.06 0.00 0.13 0.00 0.00 42.46 40.21 1g3g s ILE 145 CO -0.00 0.58 -0.07 0.12 -1.91 0.00 0.00 174.94 173.66 1g3g s PHE 146 N -0.78 3.33 -0.20 3.50 2.19 0.39 -3.55 117.98 122.86 1g3g s PHE 146 Ca 0.12 -2.33 -0.09 0.00 0.33 0.00 0.00 56.93 54.95 1g3g s PHE 146 Cb -0.11 -2.10 -0.05 0.00 -1.31 0.00 0.00 43.02 39.45 1g3g s PHE 146 CO 0.01 -0.88 0.12 0.42 1.83 0.00 0.00 175.22 176.72 1g3g s ILE 147 N 1.10 5.19 0.06 3.12 1.09 -1.26 -0.15 121.20 130.35 1g3g s ILE 147 Ca -0.06 0.11 -0.30 0.00 -1.10 0.00 0.00 60.65 59.31 1g3g s ILE 147 Cb -0.20 -3.38 -0.05 0.00 -1.06 0.00 0.00 42.46 37.78 1g3g s ILE 147 CO -0.05 0.42 1.00 0.54 -0.10 0.00 0.00 174.94 176.76 1g3g s ASN 148 N 0.54 7.38 0.60 3.58 2.20 -1.26 -4.90 114.94 123.09 1g3g s ASN 148 Ca 0.06 1.77 0.37 0.00 -0.94 0.00 0.00 52.86 54.13 1g3g s ASN 148 Cb -0.12 -2.58 1.92 0.00 -2.00 0.00 0.00 41.25 38.47 1g3g s ASN 148 CO 0.00 -0.21 2.21 -0.78 -2.94 0.00 0.00 177.10 175.38 1g3g h ASP 149 N 6.25 0.00 -0.61 3.54 3.58 -1.97 -2.64 116.42 124.57 1g3g h ASP 149 Ca -0.42 0.00 0.03 0.00 0.42 0.00 0.00 57.03 57.06 1g3g h ASP 149 Cb 1.22 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 42.22 1g3g h ASP 149 CO 0.74 0.02 0.36 0.11 -2.88 0.00 0.00 179.24 177.60 1g3g h LYS 150 N 0.00 0.69 -0.58 0.28 6.56 -1.91 -0.78 116.57 120.83 1g3g h LYS 150 Ca -0.00 -0.04 0.02 0.00 -1.06 0.00 0.00 60.65 59.57 1g3g h LYS 150 Cb 0.20 -0.16 -0.04 0.00 -0.57 0.00 0.00 32.23 31.67 1g3g h LYS 150 CO 0.00 0.46 0.36 0.35 -2.06 0.00 0.00 179.45 178.56 1g3g h PHE 151 N 0.71 0.67 -0.52 -1.35 3.04 -1.64 -1.97 116.94 115.88 1g3g h PHE 151 Ca 0.25 0.02 -0.05 0.00 3.98 0.00 0.00 57.97 62.16 1g3g h PHE 151 Cb 0.05 -0.22 -0.02 0.00 2.56 0.00 0.00 35.95 38.31 1g3g h PHE 151 CO -0.06 0.39 0.11 0.87 -2.02 0.00 0.00 178.31 177.60 1g3g h LYS 152 N 0.71 0.81 -0.62 1.11 1.57 -1.51 -2.53 116.57 116.11 1g3g h LYS 152 Ca 0.23 -0.17 -0.04 0.00 -1.87 0.00 0.00 60.65 58.80 1g3g h LYS 152 Cb 0.00 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.17 1g3g h LYS 152 CO -0.09 0.74 0.24 0.37 -0.57 0.00 0.00 179.45 180.14 1g3g h GLN 153 N 0.77 0.91 -0.57 3.15 4.15 -0.46 -2.68 115.11 120.39 1g3g h GLN 153 Ca 0.17 -0.15 -0.00 0.00 0.77 0.00 0.00 58.65 59.44 1g3g h GLN 153 Cb 0.32 -0.16 -0.03 0.00 0.21 0.00 0.00 27.48 27.82 1g3g h GLN 153 CO 0.00 0.75 0.34 0.00 -1.93 0.00 0.00 178.83 177.99 1g3g h LEU 155 N 0.76 0.93 -0.91 0.00 7.12 -1.35 -1.34 115.31 120.52 1g3g h LEU 155 Ca 0.20 0.01 0.01 0.00 0.13 0.00 0.00 57.88 58.24 1g3g h LEU 155 Cb -0.01 -0.19 -0.05 0.00 -0.53 0.00 0.00 40.66 39.89 1g3g h LEU 155 CO -0.04 0.59 0.60 -0.08 -0.13 0.00 0.00 178.44 179.38 1g3g h GLU 156 N 1.05 1.18 0.00 1.25 4.22 -1.29 0.60 114.58 121.59 1g3g h GLU 156 Ca 0.40 -0.07 -0.10 0.00 0.08 0.00 0.00 59.36 59.67 1g3g h GLU 156 Cb 0.21 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 1g3g h GLU 156 CO -0.16 0.78 -0.50 0.37 -2.18 0.00 0.00 179.01 177.32 1g3g h GLN 157 N 1.21 0.00 -1.06 1.92 4.15 -1.14 -3.24 115.11 116.95 1g3g h GLN 157 Ca 0.34 0.00 -0.54 0.00 0.77 0.00 0.00 58.65 59.22 1g3g h GLN 157 Cb -0.11 0.00 -0.42 0.00 0.21 0.00 0.00 27.48 27.16 1g3g h GLN 157 CO -0.08 0.50 -0.82 0.09 -1.93 0.00 0.00 178.83 176.59 1g3g n ASN 158 N -3.65 4.48 -4.65 -0.69 3.02 -0.60 -5.04 115.26 108.14 1g3g n ASN 158 Ca -0.01 -3.59 -0.41 0.00 -0.03 0.00 0.00 54.58 50.54 1g3g n ASN 158 Cb 0.57 -0.41 -0.05 0.00 -0.61 0.00 0.00 39.78 39.29 1g3g n ASN 158 CO 0.00 0.00 0.00 -1.59 -2.62 0.00 0.00 177.26 173.05 1g3g s LYS 159 N -3.56 4.19 -0.14 3.52 0.00 0.20 -4.86 119.74 119.09 1g3g s LYS 159 Ca 0.47 0.88 -0.17 0.00 0.00 0.00 0.00 55.97 57.15 1g3g s LYS 159 Cb 0.40 -3.63 -0.04 0.00 0.00 0.00 0.00 37.83 34.56 1g3g s LYS 159 CO -0.06 -0.45 0.42 0.08 0.00 0.00 0.00 175.35 175.34 1g3g s VAL 160 N 2.62 5.22 -0.54 1.79 1.01 -1.26 -5.04 120.40 124.20 1g3g s VAL 160 Ca 0.34 0.82 0.04 0.00 0.00 0.00 0.00 61.98 63.18 1g3g s VAL 160 Cb -0.16 -3.76 0.14 0.00 0.00 0.00 0.00 36.38 32.61 1g3g s VAL 160 CO 0.08 0.33 0.32 -0.62 0.00 0.00 0.00 175.10 175.22 1g3g s ASP 161 N 0.63 4.02 0.86 3.32 -1.08 -1.26 -5.11 116.67 118.05 1g3g s ASP 161 Ca 0.23 -3.12 -0.12 0.00 -0.52 0.00 0.00 52.55 49.02 1g3g s ASP 161 Cb -0.14 -1.36 0.09 0.00 -1.46 0.00 0.00 42.92 40.05 1g3g s ASP 161 CO 0.08 -0.20 1.07 -2.11 0.52 0.00 0.00 175.17 174.53 1g3g n ARG 162 N 2.92 -0.08 -2.63 4.34 0.00 -1.26 -4.93 116.66 115.02 1g3g n ARG 162 Ca 0.12 0.05 -0.42 0.00 -0.00 0.00 0.00 57.85 57.60 1g3g n ARG 162 Cb 0.35 -2.32 -0.03 0.00 -0.00 0.00 0.00 32.46 30.46 1g3g n ARG 162 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.63 176.13 1g3g s ILE 163 N -2.31 4.65 -2.24 8.89 2.07 -1.26 -5.35 121.20 125.65 1g3g s ILE 163 Ca 0.69 1.91 0.30 0.00 -1.41 0.00 0.00 60.65 62.14 1g3g s ILE 163 Cb -0.27 -4.23 0.74 0.00 0.13 0.00 0.00 42.46 38.83 1g3g s ILE 163 CO 0.55 0.07 2.00 0.54 -1.91 0.00 0.00 174.94 176.19