#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 -1.97 -2.65 1.61 1.02 -1.26 -4.46 120.64 112.93 1g3g n GLU 2 Ca 0.00 1.05 -0.05 0.00 -0.02 0.00 0.00 57.16 58.14 1g3g n GLU 2 Cb 0.00 -5.81 -0.04 0.00 -0.02 0.00 0.00 31.44 25.57 1g3g n GLU 2 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1g3g n ASN 3 N -2.80 -1.37 -2.54 1.62 2.85 -1.26 -4.96 115.26 106.81 1g3g n ASN 3 Ca -0.05 1.33 -0.26 0.00 -0.11 0.00 0.00 54.58 55.49 1g3g n ASN 3 Cb 0.58 -5.01 -0.00 0.00 1.24 0.00 0.00 39.78 36.59 1g3g n ASN 3 CO 0.00 0.00 0.00 2.30 -2.11 0.00 0.00 177.26 177.45 1g3g n ILE 4 N 1.71 2.38 -1.46 -1.44 -5.35 -1.26 -5.05 119.36 108.89 1g3g n ILE 4 Ca -0.37 -4.94 0.00 0.00 -0.27 0.00 0.00 62.75 57.17 1g3g n ILE 4 Cb 0.58 -1.21 0.00 0.00 -1.74 0.00 0.00 39.64 37.27 1g3g n ILE 4 CO 0.00 0.00 0.00 0.41 -1.76 0.00 0.00 176.55 175.20 1g3g n THR 5 N -0.44 -4.76 -3.60 7.28 -1.04 -1.26 -4.88 114.28 105.58 1g3g n THR 5 Ca 0.37 2.10 -0.34 0.00 -2.04 0.00 0.00 64.05 64.13 1g3g n THR 5 Cb 0.64 -2.93 -0.07 0.00 -1.82 0.00 0.00 70.33 66.15 1g3g n THR 5 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1g3g n GLN 6 N 0.08 2.66 -2.26 -2.82 6.02 -1.26 -5.08 117.38 114.72 1g3g n GLN 6 Ca 0.00 -4.51 -0.36 0.00 -0.01 0.00 0.00 57.00 52.11 1g3g n GLN 6 Cb 0.00 -2.38 -0.01 0.00 1.02 0.00 0.00 30.24 28.87 1g3g n GLN 6 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 1g3g s PRO 7 N -1.65 3.60 0.25 -1.09 0.04 -1.26 -4.95 135.00 129.95 1g3g s PRO 7 Ca 0.29 1.71 -0.06 0.00 0.04 0.00 0.00 61.00 62.98 1g3g s PRO 7 Cb -0.03 -2.25 0.26 0.00 0.04 0.00 0.00 34.50 32.52 1g3g s PRO 7 CO -0.10 -0.67 1.93 1.79 0.04 0.00 0.00 177.00 179.99 1g3g h THR 8 N 1.61 1.25 -0.10 1.26 1.35 -2.05 -3.42 112.91 112.82 1g3g h THR 8 Ca -0.50 -0.46 0.19 0.00 -0.55 0.00 0.00 66.41 65.09 1g3g h THR 8 Cb 1.25 -0.22 -0.18 0.00 -1.73 0.00 0.00 68.15 67.28 1g3g h THR 8 CO 0.59 0.25 -0.02 -1.10 -0.25 0.00 0.00 175.52 174.98 1g3g s GLN 9 N -6.12 0.07 -0.97 4.72 -0.21 -1.26 -5.08 119.66 110.82 1g3g s GLN 9 Ca -0.13 -0.00 -0.26 0.00 0.02 0.00 0.00 55.36 54.99 1g3g s GLN 9 Cb 0.18 0.01 -0.17 0.00 1.00 0.00 0.00 33.01 34.03 1g3g s GLN 9 CO 0.82 -0.11 2.21 -0.65 -2.12 0.00 0.00 175.29 175.43 1g3g s GLN 10 N 2.30 1.50 -0.14 2.91 -0.21 -1.26 -4.82 119.66 119.93 1g3g s GLN 10 Ca 0.20 -0.12 -0.08 0.00 0.02 0.00 0.00 55.36 55.38 1g3g s GLN 10 Cb 0.03 -4.93 0.05 0.00 1.00 0.00 0.00 33.01 29.16 1g3g s GLN 10 CO -0.18 -4.89 0.35 -1.54 -2.12 0.00 0.00 175.29 166.91 1g3g s SER 11 N 9.27 -0.42 -1.03 5.90 1.04 -1.26 -5.09 113.70 122.11 1g3g s SER 11 Ca 0.84 0.75 -0.23 0.00 0.48 0.00 0.00 55.95 57.79 1g3g s SER 11 Cb -0.08 0.63 0.03 0.00 0.10 0.00 0.00 66.02 66.70 1g3g s SER 11 CO 0.13 -0.18 1.59 -0.89 0.98 0.00 0.00 173.24 174.87 1g3g s THR 12 N 1.29 3.84 0.13 2.02 2.01 -1.26 -4.05 115.64 119.61 1g3g s THR 12 Ca -0.09 -0.81 0.00 0.00 0.31 0.00 0.00 61.69 61.10 1g3g s THR 12 Cb -0.09 -4.85 0.00 0.00 0.01 0.00 0.00 72.50 67.57 1g3g s THR 12 CO -0.11 -1.73 0.00 1.67 -0.69 0.00 0.00 174.62 173.77 1g3g n GLN 13 N 8.81 0.00 -1.90 4.92 -0.06 -1.26 -5.10 117.38 122.79 1g3g n GLN 13 Ca 0.36 0.00 -0.43 0.00 -2.00 0.00 0.00 57.00 54.94 1g3g n GLN 13 Cb 0.50 0.00 -0.03 0.00 -4.06 0.00 0.00 30.24 26.65 1g3g n GLN 13 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1g3g s ALA 14 N -1.56 3.04 0.05 1.69 0.00 -1.26 -4.61 121.76 119.11 1g3g s ALA 14 Ca 0.00 0.57 0.00 0.00 0.00 0.00 0.00 51.96 52.53 1g3g s ALA 14 Cb 0.00 -3.96 0.00 0.00 0.00 0.00 0.00 23.12 19.16 1g3g s ALA 14 CO 0.00 -2.34 0.00 -2.37 0.00 0.00 0.00 175.76 171.05 1g3g n THR 15 N 6.99 0.00 0.04 0.00 5.66 -1.26 -4.85 114.28 120.86 1g3g n THR 15 Ca 0.23 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 61.13 1g3g n THR 15 Cb 0.45 -0.29 0.03 0.00 -1.55 0.00 0.00 70.33 68.97 1g3g n THR 15 CO 0.00 0.00 0.00 0.06 -3.05 0.00 0.00 175.07 172.08 1g3g h GLN 16 N 0.00 0.44 -0.43 1.09 3.07 -2.02 -3.16 115.11 114.10 1g3g h GLN 16 Ca 0.00 -0.35 -0.08 0.00 0.09 0.00 0.00 58.65 58.31 1g3g h GLN 16 Cb 0.00 0.07 -0.02 0.00 0.08 0.00 0.00 27.48 27.61 1g3g h GLN 16 CO 0.00 0.98 -0.07 -0.09 0.09 0.00 0.00 178.83 179.73 1g3g h ARG 17 N 0.31 0.75 -0.39 0.06 2.43 -1.92 -2.97 114.38 112.65 1g3g h ARG 17 Ca -0.03 -0.23 0.04 0.00 -0.81 0.00 0.00 59.98 58.95 1g3g h ARG 17 Cb 1.27 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 30.71 1g3g h ARG 17 CO 0.12 0.81 0.17 0.35 -1.51 0.00 0.00 179.97 179.91 1g3g h PHE 18 N 0.69 0.32 -0.66 2.20 3.57 -1.88 0.62 116.94 121.80 1g3g h PHE 18 Ca 0.12 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.65 1g3g h PHE 18 Cb 0.53 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 39.15 1g3g h PHE 18 CO 0.03 0.15 0.43 1.25 -2.23 0.00 0.00 178.31 177.94 1g3g h LEU 19 N 0.36 0.74 -0.10 0.59 6.46 -1.56 0.41 115.31 122.20 1g3g h LEU 19 Ca 0.17 -0.01 -0.07 0.00 -0.12 0.00 0.00 57.88 57.85 1g3g h LEU 19 Cb 0.11 -0.18 0.00 0.00 -0.73 0.00 0.00 40.66 39.86 1g3g h LEU 19 CO -0.14 0.53 -0.19 0.40 -0.62 0.00 0.00 178.44 178.41 1g3g h ILE 20 N 0.87 1.39 -0.59 4.05 1.08 -1.28 -2.99 117.51 120.04 1g3g h ILE 20 Ca 0.25 -1.47 0.04 0.00 -0.39 0.00 0.00 64.86 63.30 1g3g h ILE 20 Cb -0.07 2.09 -0.05 0.00 -3.07 0.00 0.00 36.82 35.73 1g3g h ILE 20 CO -0.07 0.42 0.33 -0.08 -0.69 0.00 0.00 178.15 178.06 1g3g h GLU 21 N -0.12 0.62 -0.45 2.37 4.22 0.42 -1.52 114.58 120.12 1g3g h GLU 21 Ca 0.01 -0.04 0.02 0.00 0.08 0.00 0.00 59.36 59.43 1g3g h GLU 21 Cb 0.77 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.86 1g3g h GLU 21 CO 0.04 0.41 0.30 -0.22 -2.18 0.00 0.00 179.01 177.36 1g3g h LYS 22 N 0.64 0.52 -0.25 1.92 3.64 -0.95 -2.15 116.57 119.93 1g3g h LYS 22 Ca 0.25 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.61 1g3g h LYS 22 Cb 0.11 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.80 1g3g h LYS 22 CO -0.14 0.34 0.16 0.35 -2.27 0.00 0.00 179.45 177.88 1g3g h PHE 23 N 0.53 0.29 -0.04 1.91 3.57 -1.12 -2.31 116.94 119.77 1g3g h PHE 23 Ca 0.18 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.61 1g3g h PHE 23 Cb 0.06 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.69 1g3g h PHE 23 CO -0.00 0.18 -0.33 0.66 -2.23 0.00 0.00 178.31 176.59 1g3g h SER 24 N 0.32 0.08 -3.17 0.41 4.64 -1.28 -3.41 113.55 111.14 1g3g h SER 24 Ca 0.09 -0.02 -0.57 0.00 -0.47 0.00 0.00 61.79 60.82 1g3g h SER 24 Cb -0.02 -0.02 -0.05 0.00 -0.31 0.00 0.00 62.40 61.99 1g3g h SER 24 CO -0.03 0.41 0.90 -1.58 -0.87 0.00 0.00 176.83 175.66 1g3g s GLN 25 N -4.30 4.04 -0.20 4.77 0.74 -0.86 -5.01 119.66 118.85 1g3g s GLN 25 Ca -0.04 1.25 -0.13 0.00 0.05 0.00 0.00 55.36 56.49 1g3g s GLN 25 Cb 0.14 -3.80 -0.05 0.00 1.10 0.00 0.00 33.01 30.41 1g3g s GLN 25 CO 0.73 -0.95 0.28 -1.83 -0.55 0.00 0.00 175.29 172.97 1g3g s GLU 26 N 3.82 4.18 -0.16 1.67 1.03 -1.26 -4.89 118.70 123.09 1g3g s GLU 26 Ca 0.51 0.01 -0.29 0.00 0.03 0.00 0.00 54.97 55.23 1g3g s GLU 26 Cb -0.16 -3.49 -0.01 0.00 -0.80 0.00 0.00 34.13 29.67 1g3g s GLU 26 CO 0.18 0.11 1.20 -0.65 -1.33 0.00 0.00 175.26 174.77 1g3g s GLN 27 N 0.86 4.26 0.17 -4.83 -1.52 -1.26 -5.01 119.66 112.34 1g3g s GLN 27 Ca 0.14 1.59 -0.26 0.00 -1.95 0.00 0.00 55.36 54.88 1g3g s GLN 27 Cb -0.13 -3.70 -0.08 0.00 -0.22 0.00 0.00 33.01 28.88 1g3g s GLN 27 CO 0.05 -0.64 0.80 0.42 -0.25 0.00 0.00 175.29 175.67 1g3g s ILE 28 N 3.19 4.35 -1.31 1.08 -1.09 -1.26 -4.98 121.20 121.18 1g3g s ILE 28 Ca 0.52 1.76 -0.06 0.00 -2.23 0.00 0.00 60.65 60.65 1g3g s ILE 28 Cb -0.21 -4.17 0.13 0.00 -1.58 0.00 0.00 42.46 36.64 1g3g s ILE 28 CO 0.14 0.51 2.27 0.61 -1.23 0.00 0.00 174.94 177.24 1g3g n GLY 29 N 1.64 5.14 0.12 6.18 0.00 -1.26 -4.55 105.19 112.46 1g3g n GLY 29 Ca -0.05 -2.07 0.05 0.00 0.00 0.00 0.00 46.02 43.96 1g3g n GLY 29 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1g3g h GLU 30 N 4.83 0.00 0.00 1.61 4.11 -1.96 -3.32 114.58 119.85 1g3g h GLU 30 Ca 0.64 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.07 1g3g h GLU 30 Cb 0.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.62 1g3g h GLU 30 CO 1.51 0.20 -0.90 0.09 0.07 0.00 0.00 179.01 179.98 1g3g n ASN 31 N -2.91 1.05 -4.57 3.06 3.02 -1.26 -3.08 115.26 110.57 1g3g n ASN 31 Ca -0.03 -0.55 -0.40 0.00 -0.03 0.00 0.00 54.58 53.57 1g3g n ASN 31 Cb 0.69 1.18 -0.03 0.00 -0.61 0.00 0.00 39.78 41.02 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 -2.40 3.48 0.08 2.41 -1.09 -1.25 -2.59 121.20 119.84 1g3g s ILE 32 Ca 0.02 0.37 -0.15 0.00 -2.23 0.00 0.00 60.65 58.66 1g3g s ILE 32 Cb 0.09 -3.98 -0.03 0.00 -1.58 0.00 0.00 42.46 36.96 1g3g s ILE 32 CO 0.52 -0.85 0.93 0.55 -1.23 0.00 0.00 174.94 174.86 1g3g n VAL 33 N 7.18 -0.33 -3.64 2.92 3.14 -0.96 -4.44 118.33 122.20 1g3g n VAL 33 Ca 0.19 1.44 -0.08 0.00 -2.96 0.00 0.00 64.34 62.94 1g3g n VAL 33 Cb 0.50 -1.81 -0.02 0.00 -1.06 0.00 0.00 33.84 31.45 1g3g n VAL 33 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1g3g s ARG 35 N -3.62 1.64 -0.11 0.00 3.00 0.15 0.13 118.95 120.16 1g3g s ARG 35 Ca 0.07 -0.63 -0.21 0.00 -1.00 0.00 0.00 55.73 53.96 1g3g s ARG 35 Cb -0.03 -2.16 -0.04 0.00 0.00 0.00 0.00 34.95 32.73 1g3g s ARG 35 CO -0.03 -0.43 0.60 0.08 0.00 0.00 0.00 175.30 175.52 1g3g s VAL 36 N 1.55 5.10 -0.26 7.11 1.01 -0.05 0.14 120.40 134.99 1g3g s VAL 36 Ca -0.00 1.20 0.02 0.00 0.00 0.00 0.00 61.98 63.20 1g3g s VAL 36 Cb -0.16 -3.93 0.07 0.00 0.00 0.00 0.00 36.38 32.36 1g3g s VAL 36 CO -0.08 0.26 -0.06 -0.63 0.00 0.00 0.00 175.10 174.59 1g3g s ILE 37 N 0.88 1.89 -0.42 2.22 1.01 0.51 -0.92 121.20 126.38 1g3g s ILE 37 Ca 0.31 -1.56 -0.13 0.00 0.00 0.00 0.00 60.65 59.28 1g3g s ILE 37 Cb -0.16 -2.12 0.05 0.00 0.01 0.00 0.00 42.46 40.23 1g3g s ILE 37 CO 0.14 -0.15 0.29 0.00 0.00 0.00 0.00 174.94 175.22 1g3g n THR 39 N 5.08 0.19 0.17 0.00 5.66 -1.26 -4.39 114.28 119.73 1g3g n THR 39 Ca -0.11 -0.20 0.18 0.00 -3.05 0.00 0.00 64.05 60.86 1g3g n THR 39 Cb 0.45 -0.18 0.80 0.00 -1.55 0.00 0.00 70.33 69.84 1g3g n THR 39 CO 0.00 0.00 0.00 0.71 -3.05 0.00 0.00 175.07 172.73 1g3g h THR 40 N 0.00 0.49 0.00 1.09 1.35 -1.91 -3.44 112.91 110.49 1g3g h THR 40 Ca -0.08 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.78 1g3g h THR 40 Cb 0.79 0.80 0.00 0.00 -1.73 0.00 0.00 68.15 68.01 1g3g h THR 40 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 1g3g n GLY 41 N -1.44 0.38 1.62 5.82 0.00 -1.26 -4.91 105.19 105.39 1g3g n GLY 41 Ca 0.03 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.46 1g3g n GLY 41 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1g3g n GLN 42 N 0.00 0.00 -4.17 1.61 6.02 -1.26 -5.02 117.38 114.55 1g3g n GLN 42 Ca 0.00 0.00 -0.17 0.00 -0.01 0.00 0.00 57.00 56.82 1g3g n GLN 42 Cb 0.00 0.00 -0.15 0.00 1.02 0.00 0.00 30.24 31.11 1g3g n GLN 42 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1g3g s ILE 43 N -0.81 0.46 0.57 5.09 1.09 -1.26 -5.08 121.20 121.26 1g3g s ILE 43 Ca 0.00 -0.20 -0.21 0.00 -1.10 0.00 0.00 60.65 59.15 1g3g s ILE 43 Cb 0.00 -0.43 -0.04 0.00 -1.06 0.00 0.00 42.46 40.93 1g3g s ILE 43 CO 0.00 0.16 1.28 -2.65 -0.10 0.00 0.00 174.94 173.62 1g3g n PRO 44 N 3.30 1.46 -1.26 2.79 -0.02 -1.26 -3.66 135.00 136.34 1g3g n PRO 44 Ca -0.17 0.54 -0.43 0.00 -2.02 0.00 0.00 63.50 61.42 1g3g n PRO 44 Cb 0.55 -2.49 -0.03 0.00 -0.02 0.00 0.00 33.50 31.52 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 -1.27 1.77 -3.97 4.25 5.41 -1.26 -4.72 119.36 119.56 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 0.45 0.00 -0.16 0.00 -0.71 0.00 0.00 39.64 39.22 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 -0.90 0.38 -0.26 0.38 6.06 -0.09 -5.01 118.95 119.50 1g3g s ARG 46 Ca 0.58 0.04 -0.16 0.00 -2.50 0.00 0.00 55.73 53.68 1g3g s ARG 46 Cb -0.83 -0.52 -0.03 0.00 0.06 0.00 0.00 34.95 33.62 1g3g s ARG 46 CO 0.51 -0.11 0.41 -0.51 -2.50 0.00 0.00 175.30 173.10 1g3g s ASP 47 N 0.93 6.31 -0.20 -2.12 1.11 -1.26 -0.88 116.67 120.57 1g3g s ASP 47 Ca -0.10 0.37 -0.10 0.00 0.18 0.00 0.00 52.55 52.90 1g3g s ASP 47 Cb -0.13 -2.23 -0.05 0.00 1.07 0.00 0.00 42.92 41.58 1g3g s ASP 47 CO -0.01 -0.21 0.12 -0.76 1.18 0.00 0.00 175.17 175.49 1g3g s LEU 48 N 2.10 4.17 0.31 1.23 1.43 0.36 -4.98 118.68 123.29 1g3g s LEU 48 Ca 0.17 0.21 0.10 0.00 -1.03 0.00 0.00 54.13 53.58 1g3g s LEU 48 Cb -0.16 -2.08 -0.06 0.00 0.03 0.00 0.00 46.19 43.93 1g3g s LEU 48 CO 0.10 0.18 -0.13 -0.44 0.23 0.00 0.00 176.35 176.28 1g3g s SER 49 N 0.38 3.53 0.29 2.29 0.01 -1.26 -0.56 113.70 118.37 1g3g s SER 49 Ca 0.08 -1.13 0.05 0.00 1.31 0.00 0.00 55.95 56.26 1g3g s SER 49 Cb -0.11 -0.30 -0.06 0.00 0.21 0.00 0.00 66.02 65.76 1g3g s SER 49 CO -0.02 -0.13 -0.01 0.00 0.41 0.00 0.00 173.24 173.49 1g3g s ALA 50 N -2.63 2.26 -0.69 1.44 0.00 -1.07 -4.38 121.76 116.69 1g3g s ALA 50 Ca 0.31 -1.93 -0.10 0.00 0.00 0.00 0.00 51.96 50.24 1g3g s ALA 50 Cb -0.00 0.38 0.18 0.00 0.00 0.00 0.00 23.12 23.68 1g3g s ALA 50 CO 0.15 -0.18 0.59 -0.51 0.00 0.00 0.00 175.76 175.81 1g3g s ASP 51 N -3.43 6.10 0.12 0.00 1.01 -1.26 -4.70 116.67 114.51 1g3g s ASP 51 Ca 0.31 -2.56 -0.16 0.00 0.71 0.00 0.00 52.55 50.85 1g3g s ASP 51 Cb 0.06 -2.07 -0.02 0.00 1.01 0.00 0.00 42.92 41.90 1g3g s ASP 51 CO 0.12 -0.55 1.64 0.40 0.21 0.00 0.00 175.17 177.00 1g3g h ILE 52 N 5.21 1.21 -0.90 0.77 2.04 -1.99 -2.03 117.51 121.82 1g3g h ILE 52 Ca -0.01 -0.70 0.04 0.00 1.00 0.00 0.00 64.86 65.19 1g3g h ILE 52 Cb 1.02 0.96 -0.05 0.00 -0.74 0.00 0.00 36.82 38.01 1g3g h ILE 52 CO 0.78 0.25 0.59 0.28 0.00 0.00 0.00 178.15 180.04 1g3g h SER 53 N 0.47 0.95 -0.21 1.72 0.02 -1.99 0.21 113.55 114.72 1g3g h SER 53 Ca 0.12 -0.01 -0.13 0.00 -0.84 0.00 0.00 61.79 60.94 1g3g h SER 53 Cb 0.26 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.57 1g3g h SER 53 CO -0.00 0.64 -0.32 1.56 -1.14 0.00 0.00 176.83 177.57 1g3g h GLN 54 N 1.10 0.72 -0.11 3.45 1.08 -1.83 -2.98 115.11 116.54 1g3g h GLN 54 Ca 0.36 -0.34 -0.21 0.00 -1.45 0.00 0.00 58.65 57.02 1g3g h GLN 54 Cb 0.06 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.49 1g3g h GLN 54 CO -0.12 0.94 -0.78 0.28 -0.95 0.00 0.00 178.83 178.21 1g3g h VAL 55 N 0.61 1.32 -0.94 -0.54 2.07 -0.58 0.88 116.25 119.07 1g3g h VAL 55 Ca 0.07 -2.08 0.07 0.00 0.82 0.00 0.00 66.70 65.58 1g3g h VAL 55 Cb 0.85 2.07 -0.06 0.00 -1.52 0.00 0.00 31.29 32.62 1g3g h VAL 55 CO 0.07 0.64 0.61 0.25 0.02 0.00 0.00 177.57 179.17 1g3g h LEU 56 N 0.41 0.95 0.00 2.57 5.85 -0.55 -2.70 115.31 121.84 1g3g h LEU 56 Ca -0.05 0.01 -0.31 0.00 0.84 0.00 0.00 57.88 58.37 1g3g h LEU 56 Cb 1.39 -0.19 -0.06 0.00 0.37 0.00 0.00 40.66 42.17 1g3g h LEU 56 CO 0.15 0.60 -2.05 0.29 -0.34 0.00 0.00 178.44 177.09 1g3g n LYS 57 N -4.50 0.66 -3.52 1.25 5.02 -1.13 -5.00 118.16 110.93 1g3g n LYS 57 Ca 0.15 0.12 -0.20 0.00 -2.02 0.00 0.00 58.31 56.35 1g3g n LYS 57 Cb 0.21 -1.64 0.08 0.00 -0.02 0.00 0.00 35.03 33.65 1g3g n LYS 57 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1g3g n GLU 58 N -2.85 -6.86 -0.05 1.97 1.02 0.30 -4.92 120.64 109.26 1g3g n GLU 58 Ca -0.24 0.82 -0.06 0.00 -0.02 0.00 0.00 57.16 57.65 1g3g n GLU 58 Cb 1.08 -5.81 -0.05 0.00 -0.02 0.00 0.00 31.44 26.64 1g3g n GLU 58 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1g3g n LYS 59 N -4.43 1.05 -4.48 3.49 5.02 -1.21 -5.05 118.16 112.55 1g3g n LYS 59 Ca -0.19 0.04 -0.24 0.00 -2.02 0.00 0.00 58.31 55.90 1g3g n LYS 59 Cb 0.63 -1.20 -0.09 0.00 -0.02 0.00 0.00 35.03 34.35 1g3g n LYS 59 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1g3g s ARG 60 N -2.20 1.79 3.77 1.97 3.00 -1.26 -5.08 118.95 120.94 1g3g s ARG 60 Ca -0.10 -2.06 0.00 0.00 0.00 0.00 0.00 55.73 53.57 1g3g s ARG 60 Cb 0.03 -0.69 0.00 0.00 0.00 0.00 0.00 34.95 34.29 1g3g s ARG 60 CO 0.26 -0.36 0.00 0.43 0.00 0.00 0.00 175.30 175.63 1g3g n SER 61 N -1.02 -0.44 0.00 0.23 7.64 -1.26 -4.64 113.62 114.13 1g3g n SER 61 Ca -0.04 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.84 1g3g n SER 61 Cb 0.66 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.86 1g3g n SER 61 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1g3g n ILE 62 N 0.00 0.00 -3.01 0.44 0.00 -1.26 -4.98 119.36 110.55 1g3g n ILE 62 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 62.75 62.58 1g3g n ILE 62 Cb 0.00 -0.15 -0.01 0.00 0.00 0.00 0.00 39.64 39.48 1g3g n ILE 62 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72 1g3g n LYS 63 N -2.60 0.80 -5.04 9.51 3.00 -1.26 -2.71 118.16 119.86 1g3g n LYS 63 Ca 0.00 -2.66 -0.32 0.00 -0.00 0.00 0.00 58.31 55.33 1g3g n LYS 63 Cb 0.00 -1.35 -0.15 0.00 0.00 0.00 0.00 35.03 33.53 1g3g n LYS 63 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 1g3g s LYS 64 N -0.65 2.90 -0.01 1.64 2.20 -1.16 -5.01 119.74 119.65 1g3g s LYS 64 Ca 0.33 -0.79 0.01 0.00 -0.36 0.00 0.00 55.97 55.16 1g3g s LYS 64 Cb 0.23 -2.38 -0.00 0.00 -1.51 0.00 0.00 37.83 34.17 1g3g s LYS 64 CO -0.14 0.34 -0.04 0.08 -0.36 0.00 0.00 175.35 175.23 1g3g s VAL 65 N -0.01 0.31 -0.14 4.02 1.01 -1.26 0.54 120.40 124.88 1g3g s VAL 65 Ca -0.06 -0.16 -0.07 0.00 0.00 0.00 0.00 61.98 61.69 1g3g s VAL 65 Cb -0.15 -0.28 -0.04 0.00 0.00 0.00 0.00 36.38 35.91 1g3g s VAL 65 CO 0.05 0.10 0.13 0.26 0.00 0.00 0.00 175.10 175.63 1g3g s TRP 66 N -0.01 3.54 -0.05 5.22 0.51 0.53 -4.88 118.94 123.79 1g3g s TRP 66 Ca 0.01 0.47 0.01 0.00 -2.12 0.00 0.00 56.10 54.46 1g3g s TRP 66 Cb -0.02 -1.98 0.02 0.00 -0.81 0.00 0.00 33.47 30.67 1g3g s TRP 66 CO -0.00 0.62 -0.07 0.99 -0.51 0.00 0.00 176.95 177.98 1g3g s THR 67 N -0.71 0.74 -0.29 2.01 2.01 -1.26 0.22 115.64 118.36 1g3g s THR 67 Ca 0.13 -0.24 -0.11 0.00 0.31 0.00 0.00 61.69 61.79 1g3g s THR 67 Cb -0.12 -0.73 -0.04 0.00 0.01 0.00 0.00 72.50 71.62 1g3g s THR 67 CO 0.03 0.27 0.18 -0.36 -0.69 0.00 0.00 174.62 174.05 1g3g s PHE 68 N 0.89 3.20 -5.00 4.92 0.40 0.25 0.30 117.98 122.94 1g3g s PHE 68 Ca -0.11 -0.08 0.00 0.00 -0.60 0.00 0.00 56.93 56.14 1g3g s PHE 68 Cb -0.15 -2.37 0.00 0.00 0.51 0.00 0.00 43.02 41.01 1g3g s PHE 68 CO 0.01 -0.25 0.00 0.41 0.70 0.00 0.00 175.22 176.09 1g3g n GLY 69 N 5.04 -0.35 3.56 4.36 0.00 -1.21 0.14 105.19 116.72 1g3g n GLY 69 Ca -0.14 -1.08 -0.35 0.00 0.00 0.00 0.00 46.02 44.45 1g3g n GLY 69 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1g3g s ARG 70 N -2.00 3.05 0.10 1.61 0.52 -1.25 -4.01 118.95 116.96 1g3g s ARG 70 Ca 0.00 -0.55 -0.12 0.00 -0.52 0.00 0.00 55.73 54.54 1g3g s ARG 70 Cb 0.00 -5.04 0.01 0.00 0.52 0.00 0.00 34.95 30.44 1g3g s ARG 70 CO 0.00 -2.72 0.28 -0.80 0.02 0.00 0.00 175.30 172.08 1g3g s ASN 71 N 6.37 -0.04 0.00 0.23 -0.87 -1.26 -4.70 114.94 114.67 1g3g s ASN 71 Ca 0.57 -0.47 0.06 0.00 -1.57 0.00 0.00 52.86 51.45 1g3g s ASN 71 Cb -0.05 0.39 0.31 0.00 -0.02 0.00 0.00 41.25 41.89 1g3g s ASN 71 CO -0.01 -0.76 1.10 -0.81 -2.57 0.00 0.00 177.10 174.05 1g3g n PRO 72 N -0.03 0.06 0.00 -0.60 -0.04 -1.26 -4.26 135.00 128.87 1g3g n PRO 72 Ca -0.16 0.28 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 1g3g n PRO 72 Cb 0.62 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.58 1g3g n PRO 72 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1g3g n ALA 73 N -1.35 0.00 0.01 0.55 0.00 -1.26 -4.40 120.51 114.06 1g3g n ALA 73 Ca 0.03 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.46 1g3g n ALA 73 Cb 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.50 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 -2.52 1.94 -3.83 0.00 -0.08 0.88 -4.46 116.55 108.47 1g3g n ASP 75 Ca -0.01 0.32 -0.12 0.00 -1.51 0.00 0.00 54.79 53.47 1g3g n ASP 75 Cb 0.02 -0.85 -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 -0.13 -0.46 -0.67 6.14 -1.16 -4.91 117.35 113.71 1g3g s TYR 76 Ca -0.33 0.30 -0.17 0.00 0.64 0.00 0.00 57.07 57.51 1g3g s TYR 76 Cb 0.10 0.03 0.05 0.00 0.42 0.00 0.00 41.96 42.57 1g3g s TYR 76 CO 0.56 -0.14 0.45 -1.58 0.64 0.00 0.00 175.55 175.48 1g3g s HIS 77 N -0.30 3.18 0.33 4.97 5.65 -1.26 -3.97 115.29 123.90 1g3g s HIS 77 Ca -0.04 -0.66 0.00 0.00 0.25 0.00 0.00 55.06 54.61 1g3g s HIS 77 Cb -0.03 -3.13 -0.00 0.00 -1.18 0.00 0.00 32.58 28.24 1g3g s HIS 77 CO 0.01 -0.81 0.01 1.47 -0.65 0.00 0.00 174.74 174.77 1g3g n LEU 78 N 5.53 0.00 0.00 8.88 -0.00 -1.26 -4.91 117.00 125.24 1g3g n LEU 78 Ca -0.10 -2.15 -0.14 0.00 -0.00 0.00 0.00 56.01 53.63 1g3g n LEU 78 Cb 0.45 0.31 0.13 0.00 -0.00 0.00 0.00 43.42 44.31 1g3g n LEU 78 CO 0.48 -0.31 0.18 0.61 -0.00 0.00 0.00 177.39 178.35 1g3g n GLY 79 N 0.80 -3.56 3.13 1.47 0.00 -1.26 -4.74 105.19 101.02 1g3g n GLY 79 Ca -0.13 -1.30 -0.37 0.00 0.00 0.00 0.00 46.02 44.22 1g3g n GLY 79 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1g3g s ASN 80 N -2.57 5.34 -0.25 1.61 2.20 -1.26 -4.58 114.94 115.43 1g3g s ASN 80 Ca 0.30 -2.15 -0.02 0.00 -0.94 0.00 0.00 52.86 50.05 1g3g s ASN 80 Cb -0.05 -1.87 0.02 0.00 -2.00 0.00 0.00 41.25 37.36 1g3g s ASN 80 CO 0.25 -0.54 -0.05 -0.63 -2.94 0.00 0.00 177.10 173.19 1g3g s ILE 81 N 0.97 2.93 0.61 0.54 1.09 -1.26 -4.99 121.20 121.09 1g3g s ILE 81 Ca 0.09 -1.01 0.31 0.00 -1.10 0.00 0.00 60.65 58.94 1g3g s ILE 81 Cb -0.23 -2.49 0.36 0.00 -1.06 0.00 0.00 42.46 39.05 1g3g s ILE 81 CO -0.04 0.19 2.10 -1.28 -0.10 0.00 0.00 174.94 175.81 1g3g h SER 82 N 8.02 0.00 0.00 3.58 0.87 -2.00 -3.18 113.55 120.85 1g3g h SER 82 Ca -0.33 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.23 1g3g h SER 82 Cb 1.11 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.07 1g3g h SER 82 CO 0.57 0.00 0.00 0.54 -0.53 0.00 0.00 176.83 177.41 1g3g n ARG 83 N -3.60 0.00 -3.76 2.24 3.00 -1.26 -4.95 116.66 108.33 1g3g n ARG 83 Ca 0.01 0.00 -0.38 0.00 -0.01 0.00 0.00 57.85 57.47 1g3g n ARG 83 Cb 0.32 0.00 -0.12 0.00 0.00 0.00 0.00 32.46 32.66 1g3g n ARG 83 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.63 177.15 1g3g s LEU 84 N 0.00 4.12 0.00 0.55 2.34 -1.26 -4.50 118.68 119.93 1g3g s LEU 84 Ca 0.00 -0.97 0.00 0.00 0.06 0.00 0.00 54.13 53.22 1g3g s LEU 84 Cb 0.00 -1.87 0.00 0.00 -0.56 0.00 0.00 46.19 43.76 1g3g s LEU 84 CO 0.00 -0.27 0.00 -1.20 -1.06 0.00 0.00 176.35 173.82 1g3g n SER 85 N 4.83 0.00 -3.75 1.48 7.64 -1.26 -4.94 113.62 117.62 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 0.46 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.66 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 -3.99 6.43 3.02 -1.20 -3.60 115.26 115.92 1g3g n ASN 86 Ca 0.00 0.00 -0.11 0.00 -0.03 0.00 0.00 54.58 54.44 1g3g n ASN 86 Cb 0.00 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.13 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 0.04 3.52 2.85 -1.25 -3.36 118.16 119.97 1g3g n LYS 87 Ca 0.00 -0.45 0.11 0.00 -1.05 0.00 0.00 58.31 56.92 1g3g n LYS 87 Cb 0.00 -1.73 -0.08 0.00 -0.65 0.00 0.00 35.03 32.57 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 7.35 0.39 -3.60 5.58 -0.00 0.12 -4.35 115.22 120.71 1g3g n HIS 88 Ca 0.15 0.11 -0.05 0.00 0.46 0.00 0.00 57.72 58.39 1g3g n HIS 88 Cb 0.39 -0.64 -0.03 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 -0.16 0.08 1.57 5.36 0.14 -2.73 117.98 118.84 1g3g s PHE 89 Ca -0.03 0.20 0.01 0.00 -0.96 0.00 0.00 56.93 56.15 1g3g s PHE 89 Cb 0.13 0.50 -0.04 0.00 -0.34 0.00 0.00 43.02 43.26 1g3g s PHE 89 CO 0.85 -0.20 -0.06 -0.65 -1.46 0.00 0.00 175.22 173.70 1g3g s GLN 90 N -1.73 0.72 -0.07 10.12 -0.21 0.31 0.85 119.66 129.65 1g3g s GLN 90 Ca 0.07 -1.21 0.01 0.00 0.02 0.00 0.00 55.36 54.25 1g3g s GLN 90 Cb -0.01 -0.10 0.02 0.00 1.00 0.00 0.00 33.01 33.92 1g3g s GLN 90 CO -0.04 -0.03 -0.10 0.42 -2.12 0.00 0.00 175.29 173.41 1g3g s ILE 91 N -3.34 1.00 -0.07 1.08 1.01 0.58 0.12 121.20 121.58 1g3g s ILE 91 Ca 0.07 -0.37 -0.03 0.00 0.00 0.00 0.00 60.65 60.31 1g3g s ILE 91 Cb 0.04 -0.95 -0.04 0.00 0.01 0.00 0.00 42.46 41.51 1g3g s ILE 91 CO -0.05 0.33 0.09 -0.76 0.00 0.00 0.00 174.94 174.55 1g3g s LEU 92 N 0.94 4.04 -0.07 2.97 1.02 0.52 0.20 118.68 128.30 1g3g s LEU 92 Ca -0.10 0.29 0.03 0.00 0.02 0.00 0.00 54.13 54.37 1g3g s LEU 92 Cb -0.15 -2.11 0.01 0.00 0.02 0.00 0.00 46.19 43.96 1g3g s LEU 92 CO 0.00 0.35 -0.16 -0.22 0.02 0.00 0.00 176.35 176.34 1g3g s LEU 93 N -1.27 1.81 0.00 1.79 1.98 0.19 0.01 118.68 123.18 1g3g s LEU 93 Ca 0.18 -0.39 0.00 0.00 -2.89 0.00 0.00 54.13 51.03 1g3g s LEU 93 Cb -0.12 -1.02 0.00 0.00 0.66 0.00 0.00 46.19 45.71 1g3g s LEU 93 CO 0.08 0.08 0.00 0.61 -1.89 0.00 0.00 176.35 175.23 1g3g n GLY 94 N 3.67 1.51 5.00 7.98 0.00 0.32 -2.98 105.19 120.70 1g3g n GLY 94 Ca -0.21 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.16 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 3.33 0.00 -1.42 1.61 0.00 -1.10 -2.59 120.64 120.47 1g3g n GLU 95 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 57.16 57.17 1g3g n GLU 95 Cb 0.00 0.00 0.09 0.00 0.00 0.00 0.00 31.44 31.53 1g3g n GLU 95 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 1g3g n ASP 96 N 1.96 1.81 -0.26 4.31 -0.08 -1.26 -4.95 116.55 118.09 1g3g n ASP 96 Ca 0.00 -2.90 -0.02 0.00 -1.51 0.00 0.00 54.79 50.36 1g3g n ASP 96 Cb 0.00 -0.41 0.00 0.00 2.34 0.00 0.00 41.12 43.05 1g3g n ASP 96 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1g3g n GLY 97 N -0.37 0.37 3.23 0.27 0.00 -1.17 -5.03 105.19 102.47 1g3g n GLY 97 Ca 0.15 -0.79 -0.10 0.00 0.00 0.00 0.00 46.02 45.28 1g3g n GLY 97 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1g3g n ASN 98 N 1.61 -1.72 -4.66 1.61 6.94 -1.07 -4.97 115.26 113.01 1g3g n ASN 98 Ca -0.02 -2.54 -0.35 0.00 -0.02 0.00 0.00 54.58 51.66 1g3g n ASN 98 Cb 0.51 2.96 -0.10 0.00 -2.36 0.00 0.00 39.78 40.80 1g3g n ASN 98 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1g3g s LEU 99 N 0.00 3.57 0.05 -4.53 1.43 -1.26 0.12 118.68 118.05 1g3g s LEU 99 Ca 0.19 0.11 0.03 0.00 -1.03 0.00 0.00 54.13 53.43 1g3g s LEU 99 Cb -0.03 -1.83 -0.02 0.00 0.03 0.00 0.00 46.19 44.34 1g3g s LEU 99 CO 0.14 0.34 -0.10 -0.76 0.23 0.00 0.00 176.35 176.20 1g3g s LEU 100 N -0.65 2.23 -0.12 1.79 1.43 0.10 -3.03 118.68 120.43 1g3g s LEU 100 Ca 0.10 -0.51 -0.00 0.00 -1.03 0.00 0.00 54.13 52.69 1g3g s LEU 100 Cb -0.12 -0.34 -0.02 0.00 0.03 0.00 0.00 46.19 45.74 1g3g s LEU 100 CO 0.02 -0.11 -0.11 -0.76 0.23 0.00 0.00 176.35 175.63 1g3g s LEU 101 N -1.42 2.88 -0.29 1.79 1.02 0.35 0.20 118.68 123.20 1g3g s LEU 101 Ca -0.05 -0.24 -0.03 0.00 0.02 0.00 0.00 54.13 53.83 1g3g s LEU 101 Cb -0.09 -1.65 0.04 0.00 0.02 0.00 0.00 46.19 44.51 1g3g s LEU 101 CO 0.01 0.21 0.01 0.21 0.02 0.00 0.00 176.35 176.81 1g3g s ASN 102 N 0.10 4.84 -0.41 2.29 2.47 0.31 0.18 114.94 124.72 1g3g s ASN 102 Ca -0.05 -1.09 -0.25 0.00 0.42 0.00 0.00 52.86 51.89 1g3g s ASN 102 Cb -0.14 -1.74 0.02 0.00 -1.45 0.00 0.00 41.25 37.93 1g3g s ASN 102 CO 0.04 -0.23 0.91 -1.81 -3.72 0.00 0.00 177.10 172.30 1g3g s ASP 103 N 1.32 6.58 -0.27 -4.21 1.01 -1.24 0.11 116.67 119.98 1g3g s ASP 103 Ca -0.03 0.34 0.02 0.00 0.71 0.00 0.00 52.55 53.59 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 -0.01 -0.94 -0.04 0.27 0.21 0.00 0.00 175.17 174.65 1g3g s ILE 104 N 3.59 1.84 0.31 0.77 -4.36 -1.23 0.89 121.20 123.00 1g3g s ILE 104 Ca 0.37 -1.58 0.03 0.00 -0.26 0.00 0.00 60.65 59.21 1g3g s ILE 104 Cb -0.11 -2.11 -0.06 0.00 1.25 0.00 0.00 42.46 41.43 1g3g s ILE 104 CO 0.22 -0.20 0.08 -0.44 0.24 0.00 0.00 174.94 174.84 1g3g s SER 105 N 1.22 1.94 -0.01 4.36 0.01 -1.11 0.29 113.70 120.40 1g3g s SER 105 Ca -0.03 -1.41 -0.14 0.00 1.31 0.00 0.00 55.95 55.68 1g3g s SER 105 Cb -0.19 0.07 -0.08 0.00 0.21 0.00 0.00 66.02 66.03 1g3g s SER 105 CO -0.07 -0.69 0.74 0.74 0.41 0.00 0.00 173.24 174.37 1g3g h THR 106 N 2.19 0.00 0.00 1.44 2.02 -1.83 -3.43 112.91 113.31 1g3g h THR 106 Ca -0.39 -0.33 -0.15 0.00 0.77 0.00 0.00 66.41 66.31 1g3g h THR 106 Cb 1.25 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 67.63 1g3g h THR 106 CO 0.65 0.00 -1.55 -0.46 0.37 0.00 0.00 175.52 174.53 1g3g n ASN 107 N -4.27 3.12 -3.73 4.18 0.23 -1.26 -5.05 115.26 108.47 1g3g n ASN 107 Ca -0.06 -0.02 -0.12 0.00 -0.53 0.00 0.00 54.58 53.85 1g3g n ASN 107 Cb 0.20 0.42 -0.13 0.00 -2.08 0.00 0.00 39.78 38.19 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 -0.15 -0.03 4.83 0.00 -1.26 -5.03 107.32 101.39 1g3g s GLY 108 Ca -0.07 1.00 0.07 0.00 0.00 0.00 0.00 44.72 45.72 1g3g s GLY 108 CO 0.29 1.25 -0.24 -1.59 0.00 0.00 0.00 173.10 172.81 1g3g s THR 109 N 1.24 1.94 0.12 0.90 2.01 -1.26 -4.16 115.64 116.43 1g3g s THR 109 Ca -0.09 -1.03 0.11 0.00 0.31 0.00 0.00 61.69 60.98 1g3g s THR 109 Cb -0.10 -1.62 -0.04 0.00 0.01 0.00 0.00 72.50 70.75 1g3g s THR 109 CO -0.08 0.55 -0.26 0.26 -0.69 0.00 0.00 174.62 174.39 1g3g s TRP 110 N -0.41 2.34 -0.24 4.92 0.51 0.44 -1.09 118.94 125.41 1g3g s TRP 110 Ca 0.05 -0.37 0.02 0.00 -2.12 0.00 0.00 56.10 53.68 1g3g s TRP 110 Cb -0.11 -1.28 0.05 0.00 -0.81 0.00 0.00 33.47 31.32 1g3g s TRP 110 CO 0.01 0.32 -0.12 -1.17 -0.51 0.00 0.00 176.95 175.48 1g3g s LEU 111 N -1.96 3.04 -1.67 2.99 2.96 -0.52 0.15 118.68 123.67 1g3g s LEU 111 Ca 0.14 -1.21 -0.14 0.00 -0.22 0.00 0.00 54.13 52.70 1g3g s LEU 111 Cb -0.10 -1.47 0.13 0.00 0.50 0.00 0.00 46.19 45.24 1g3g s LEU 111 CO 0.06 -0.16 0.58 0.59 -1.32 0.00 0.00 176.35 176.10 1g3g n ASN 112 N 4.51 -1.90 -0.03 3.68 3.02 0.19 0.04 115.26 124.77 1g3g n ASN 112 Ca -0.15 -1.10 -0.00 0.00 -0.03 0.00 0.00 54.58 53.30 1g3g n ASN 112 Cb 0.44 -2.41 -0.00 0.00 -0.61 0.00 0.00 39.78 37.20 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 -1.59 0.37 2.57 7.41 0.00 -1.26 -5.03 105.19 107.67 1g3g n GLY 113 Ca -0.04 -0.94 -0.29 0.00 0.00 0.00 0.00 46.02 44.75 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 -3.38 0.38 0.00 1.61 0.74 0.11 -5.11 119.66 114.01 1g3g s GLN 114 Ca 0.00 -0.80 -0.38 0.00 0.05 0.00 0.00 55.36 54.23 1g3g s GLN 114 Cb 0.00 -1.38 -0.18 0.00 1.10 0.00 0.00 33.01 32.56 1g3g s GLN 114 CO 0.00 -1.05 1.30 1.17 -0.55 0.00 0.00 175.29 176.16 1g3g n LYS 115 N 4.94 0.74 -4.57 1.67 3.00 -1.26 -1.44 118.16 121.24 1g3g n LYS 115 Ca -0.02 0.27 -0.31 0.00 -0.00 0.00 0.00 58.31 58.25 1g3g n LYS 115 Cb 0.41 -1.87 -0.07 0.00 0.00 0.00 0.00 35.03 33.51 1g3g n LYS 115 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.40 178.73 1g3g n VAL 116 N 2.44 0.00 -3.08 3.15 0.24 -0.25 -4.85 118.33 115.98 1g3g n VAL 116 Ca 0.20 -2.33 -0.38 0.00 -2.04 0.00 0.00 64.34 59.79 1g3g n VAL 116 Cb 0.14 0.50 -0.06 0.00 -1.47 0.00 0.00 33.84 32.96 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 -3.75 4.38 0.91 7.34 2.02 -1.26 -4.48 118.70 123.85 1g3g s GLU 117 Ca 0.02 0.97 -0.11 0.00 0.02 0.00 0.00 54.97 55.87 1g3g s GLU 117 Cb 0.00 -3.10 0.14 0.00 0.10 0.00 0.00 34.13 31.26 1g3g s GLU 117 CO 0.02 0.51 1.10 0.21 0.02 0.00 0.00 175.26 177.11 1g3g s LYS 118 N -1.48 1.16 -1.22 1.61 2.20 -1.26 -3.13 119.74 117.62 1g3g s LYS 118 Ca 0.37 1.09 -0.15 0.00 -0.36 0.00 0.00 55.97 56.92 1g3g s LYS 118 Cb -0.20 -1.78 0.15 0.00 -1.51 0.00 0.00 37.83 34.50 1g3g s LYS 118 CO 0.23 -2.39 0.39 0.09 -0.36 0.00 0.00 175.35 173.31 1g3g n ASN 119 N -4.02 -1.25 -4.29 1.43 3.02 0.26 -4.85 115.26 105.56 1g3g n ASN 119 Ca 0.08 -0.77 -0.36 0.00 -0.03 0.00 0.00 54.58 53.50 1g3g n ASN 119 Cb 0.54 -1.10 -0.13 0.00 -0.61 0.00 0.00 39.78 38.48 1g3g n ASN 119 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1g3g s SER 120 N -2.49 4.78 0.35 6.41 1.04 -1.18 -4.91 113.70 117.70 1g3g s SER 120 Ca 0.54 -0.75 -0.29 0.00 0.48 0.00 0.00 55.95 55.93 1g3g s SER 120 Cb -0.32 -1.79 -0.11 0.00 0.10 0.00 0.00 66.02 63.90 1g3g s SER 120 CO 0.66 -0.16 1.52 0.59 0.98 0.00 0.00 173.24 176.83 1g3g n ASN 121 N 4.79 3.79 -4.16 7.02 3.02 -1.25 -3.61 115.26 124.86 1g3g n ASN 121 Ca -0.15 1.20 -0.21 0.00 -0.03 0.00 0.00 54.58 55.39 1g3g n ASN 121 Cb 0.48 -1.61 -0.14 0.00 -0.61 0.00 0.00 39.78 37.90 1g3g n ASN 121 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1g3g s GLN 122 N -1.62 1.03 0.02 3.52 -1.52 0.47 -4.81 119.66 116.75 1g3g s GLN 122 Ca 0.56 -0.76 -0.30 0.00 -1.95 0.00 0.00 55.36 52.91 1g3g s GLN 122 Cb -0.48 -1.05 -0.05 0.00 -0.22 0.00 0.00 33.01 31.20 1g3g s GLN 122 CO 0.59 0.27 1.30 -1.17 -0.25 0.00 0.00 175.29 176.03 1g3g s LEU 123 N -1.05 4.33 0.43 2.90 2.96 -1.26 0.13 118.68 127.12 1g3g s LEU 123 Ca 0.03 2.05 -0.25 0.00 -0.22 0.00 0.00 54.13 55.74 1g3g s LEU 123 Cb -0.08 -3.57 -0.10 0.00 0.50 0.00 0.00 46.19 42.95 1g3g s LEU 123 CO 0.01 -0.62 1.19 -0.11 -1.32 0.00 0.00 176.35 175.50 1g3g n LEU 124 N 4.78 3.70 -4.27 -0.68 7.94 -1.17 -4.86 117.00 122.45 1g3g n LEU 124 Ca 0.11 1.07 -0.21 0.00 -1.11 0.00 0.00 56.01 55.87 1g3g n LEU 124 Cb 0.45 -1.46 -0.12 0.00 0.53 0.00 0.00 43.42 42.82 1g3g n LEU 124 CO 0.57 -0.92 -0.49 -0.44 -1.11 0.00 0.00 177.39 175.00 1g3g s SER 125 N -0.64 2.31 -0.26 1.96 0.01 -1.26 -5.08 113.70 110.75 1g3g s SER 125 Ca 0.63 -0.73 -0.29 0.00 1.31 0.00 0.00 55.95 56.86 1g3g s SER 125 Cb -0.51 -0.11 -0.02 0.00 0.21 0.00 0.00 66.02 65.59 1g3g s SER 125 CO 0.57 -0.02 1.54 -1.10 0.41 0.00 0.00 173.24 174.63 1g3g s GLN 126 N -2.21 3.77 -1.02 12.44 -1.52 -1.26 -2.37 119.66 127.49 1g3g s GLN 126 Ca 0.07 1.48 0.00 0.00 -1.95 0.00 0.00 55.36 54.97 1g3g s GLN 126 Cb -0.08 -4.01 0.00 0.00 -0.22 0.00 0.00 33.01 28.70 1g3g s GLN 126 CO 0.04 -1.32 0.00 0.41 -0.25 0.00 0.00 175.29 174.17 1g3g n GLY 127 N 4.67 0.46 3.51 3.09 0.00 -1.24 -4.98 105.19 110.70 1g3g n GLY 127 Ca 0.18 -0.47 -0.32 0.00 0.00 0.00 0.00 46.02 45.40 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 0.06 -1.19 -3.76 1.61 -0.08 -1.00 -4.62 116.55 107.56 1g3g n ASP 128 Ca -0.12 0.38 -0.13 0.00 -1.51 0.00 0.00 54.79 53.41 1g3g n ASP 128 Cb 0.50 -1.30 -0.12 0.00 2.34 0.00 0.00 41.12 42.53 1g3g n ASP 128 CO 0.00 0.00 0.00 -0.70 0.12 0.00 0.00 177.20 176.62 1g3g s GLU 129 N -3.93 0.24 -0.16 -0.67 2.12 -1.26 -0.47 118.70 114.57 1g3g s GLU 129 Ca 0.61 0.42 -0.02 0.00 0.36 0.00 0.00 54.97 56.34 1g3g s GLU 129 Cb -0.22 0.01 -0.02 0.00 0.26 0.00 0.00 34.13 34.16 1g3g s GLU 129 CO 0.64 -0.09 -0.07 0.42 -0.54 0.00 0.00 175.26 175.61 1g3g s ILE 130 N 0.66 3.50 -0.03 -3.70 1.01 0.42 0.56 121.20 123.62 1g3g s ILE 130 Ca -0.04 -0.49 -0.02 0.00 0.00 0.00 0.00 60.65 60.10 1g3g s ILE 130 Cb -0.06 -2.52 -0.04 0.00 0.01 0.00 0.00 42.46 39.85 1g3g s ILE 130 CO -0.04 0.49 0.10 -0.89 0.00 0.00 0.00 174.94 174.60 1g3g s THR 131 N 0.58 4.90 0.04 2.92 2.01 0.41 0.51 115.64 127.01 1g3g s THR 131 Ca -0.05 -0.28 -0.02 0.00 0.31 0.00 0.00 61.69 61.66 1g3g s THR 131 Cb -0.15 -3.22 -0.03 0.00 0.01 0.00 0.00 72.50 69.12 1g3g s THR 131 CO 0.03 0.41 0.00 0.68 -0.69 0.00 0.00 174.62 175.04 1g3g s VAL 132 N -1.16 0.17 -0.51 3.82 -7.23 0.30 0.17 120.40 115.95 1g3g s VAL 132 Ca 0.22 -1.41 -0.03 0.00 -1.81 0.00 0.00 61.98 58.94 1g3g s VAL 132 Cb -0.12 -1.05 0.00 0.00 0.56 0.00 0.00 36.38 35.77 1g3g s VAL 132 CO 0.12 -0.78 0.45 0.61 -0.31 0.00 0.00 175.10 175.19 1g3g n GLY 133 N 0.63 0.39 3.82 2.32 0.00 -1.26 -0.59 105.19 110.50 1g3g n GLY 133 Ca -0.18 -0.32 -0.32 0.00 0.00 0.00 0.00 46.02 45.20 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 -3.12 4.04 0.00 1.61 1.01 -1.26 -3.92 120.40 118.76 1g3g s VAL 134 Ca 0.22 0.85 0.00 0.00 0.00 0.00 0.00 61.98 63.05 1g3g s VAL 134 Cb -0.10 -3.47 0.00 0.00 0.00 0.00 0.00 36.38 32.81 1g3g s VAL 134 CO 0.28 -0.68 0.00 0.61 0.00 0.00 0.00 175.10 175.30 1g3g n GLY 135 N -1.50 2.26 3.11 4.51 0.00 -1.26 -5.01 105.19 107.30 1g3g n GLY 135 Ca 0.08 -0.24 -0.26 0.00 0.00 0.00 0.00 46.02 45.61 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 1.36 0.50 1.61 1.01 -1.26 -5.02 120.40 118.60 1g3g s VAL 136 Ca 0.00 -0.67 0.27 0.00 0.00 0.00 0.00 61.98 61.58 1g3g s VAL 136 Cb 0.00 -1.18 0.45 0.00 0.00 0.00 0.00 36.38 35.65 1g3g s VAL 136 CO 0.00 0.40 1.88 1.05 0.00 0.00 0.00 175.10 178.42 1g3g h GLU 137 N 6.37 0.12 -0.34 2.72 4.11 -1.99 0.66 114.58 126.23 1g3g h GLU 137 Ca -0.32 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.10 1g3g h GLU 137 Cb 1.18 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1g3g h GLU 137 CO 0.48 0.08 0.00 0.45 0.07 0.00 0.00 179.01 180.09 1g3g n SER 138 N -4.36 2.55 -1.01 3.06 2.88 -1.26 -4.15 113.62 111.34 1g3g n SER 138 Ca 0.19 -1.89 0.05 0.00 -1.33 0.00 0.00 58.87 55.89 1g3g n SER 138 Cb 0.88 -0.22 0.12 0.00 -0.75 0.00 0.00 64.21 64.23 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 0.90 1.36 -4.74 -3.46 9.92 0.23 -5.05 116.55 115.69 1g3g n ASP 139 Ca 0.17 -2.96 -0.35 0.00 -0.53 0.00 0.00 54.79 51.13 1g3g n ASP 139 Cb 0.45 -0.41 -0.08 0.00 -0.64 0.00 0.00 41.12 40.43 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 -1.65 4.64 -0.07 0.53 1.01 -1.09 -4.40 121.20 120.17 1g3g s ILE 140 Ca 0.35 -0.20 0.05 0.00 0.00 0.00 0.00 60.65 60.86 1g3g s ILE 140 Cb 0.37 -3.01 -0.01 0.00 0.01 0.00 0.00 42.46 39.82 1g3g s ILE 140 CO -0.11 0.55 -0.22 -0.76 0.00 0.00 0.00 174.94 174.39 1g3g s LEU 141 N -1.11 2.22 0.15 2.97 1.02 0.24 -4.99 118.68 119.19 1g3g s LEU 141 Ca 0.16 -0.46 0.09 0.00 0.02 0.00 0.00 54.13 53.94 1g3g s LEU 141 Cb -0.12 -1.42 -0.04 0.00 0.02 0.00 0.00 46.19 44.63 1g3g s LEU 141 CO 0.05 0.24 -0.13 -0.55 0.02 0.00 0.00 176.35 175.98 1g3g s SER 142 N -0.14 4.12 -0.04 2.29 0.15 -1.26 0.11 113.70 118.92 1g3g s SER 142 Ca -0.04 -0.56 0.01 0.00 0.70 0.00 0.00 55.95 56.07 1g3g s SER 142 Cb -0.14 -0.66 0.02 0.00 -1.71 0.00 0.00 66.02 63.54 1g3g s SER 142 CO 0.04 0.14 -0.02 -0.22 1.20 0.00 0.00 173.24 174.38 1g3g s LEU 143 N -2.50 1.24 -0.02 3.45 1.98 0.18 -3.98 118.68 119.04 1g3g s LEU 143 Ca 0.22 -0.08 0.08 0.00 -2.89 0.00 0.00 54.13 51.45 1g3g s LEU 143 Cb -0.10 -0.35 -0.02 0.00 0.66 0.00 0.00 46.19 46.38 1g3g s LEU 143 CO 0.13 -0.08 -0.26 -0.69 -1.89 0.00 0.00 176.35 173.57 1g3g s VAL 144 N 0.99 2.09 -0.07 1.68 1.01 -0.59 0.16 120.40 125.67 1g3g s VAL 144 Ca -0.10 -1.11 0.01 0.00 0.00 0.00 0.00 61.98 60.78 1g3g s VAL 144 Cb -0.14 -1.72 -0.03 0.00 0.00 0.00 0.00 36.38 34.49 1g3g s VAL 144 CO -0.01 0.57 -0.07 -0.51 0.00 0.00 0.00 175.10 175.08 1g3g s ILE 145 N -0.62 3.68 -0.22 2.22 2.07 0.38 0.19 121.20 128.90 1g3g s ILE 145 Ca 0.10 -0.49 -0.02 0.00 -1.41 0.00 0.00 60.65 58.84 1g3g s ILE 145 Cb -0.10 -2.50 0.01 0.00 0.13 0.00 0.00 42.46 39.99 1g3g s ILE 145 CO -0.01 0.60 -0.09 0.12 -1.91 0.00 0.00 174.94 173.64 1g3g s PHE 146 N -0.77 2.93 -0.15 3.50 5.36 0.37 -3.60 117.98 125.62 1g3g s PHE 146 Ca 0.12 -1.32 -0.11 0.00 -0.96 0.00 0.00 56.93 54.66 1g3g s PHE 146 Cb -0.11 -2.04 -0.05 0.00 -0.34 0.00 0.00 43.02 40.49 1g3g s PHE 146 CO 0.01 -0.68 0.21 0.42 -1.46 0.00 0.00 175.22 173.73 1g3g s ILE 147 N 1.38 5.37 -0.10 3.12 1.01 -1.26 0.34 121.20 131.05 1g3g s ILE 147 Ca 0.04 0.36 -0.30 0.00 0.00 0.00 0.00 60.65 60.75 1g3g s ILE 147 Cb -0.14 -3.52 -0.02 0.00 0.01 0.00 0.00 42.46 38.79 1g3g s ILE 147 CO -0.07 0.48 1.10 0.54 0.00 0.00 0.00 174.94 177.00 1g3g s ASN 148 N -0.10 7.14 0.50 3.58 4.22 -1.26 -4.92 114.94 124.10 1g3g s ASN 148 Ca 0.14 1.63 0.26 0.00 -2.14 0.00 0.00 52.86 52.75 1g3g s ASN 148 Cb -0.12 -2.55 1.32 0.00 1.28 0.00 0.00 41.25 41.17 1g3g s ASN 148 CO 0.03 -0.54 2.02 0.44 -2.04 0.00 0.00 177.10 177.00 1g3g h ASP 149 N 7.35 0.00 -0.59 3.54 3.32 -1.95 -2.87 116.42 125.22 1g3g h ASP 149 Ca -0.31 0.00 0.02 0.00 0.02 0.00 0.00 57.03 56.76 1g3g h ASP 149 Cb 1.14 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.66 1g3g h ASP 149 CO 0.89 0.15 0.37 0.11 -1.72 0.00 0.00 179.24 179.04 1g3g h LYS 150 N 0.00 0.72 -0.47 3.56 6.56 -1.86 -1.53 116.57 123.55 1g3g h LYS 150 Ca -0.00 -0.04 -0.02 0.00 -1.06 0.00 0.00 60.65 59.52 1g3g h LYS 150 Cb 0.42 -0.16 -0.02 0.00 -0.57 0.00 0.00 32.23 31.90 1g3g h LYS 150 CO 0.02 0.48 0.21 0.35 -2.06 0.00 0.00 179.45 178.45 1g3g h PHE 151 N 0.75 0.70 -0.29 -1.35 3.04 -1.43 -1.69 116.94 116.67 1g3g h PHE 151 Ca 0.23 -0.04 0.02 0.00 3.98 0.00 0.00 57.97 62.15 1g3g h PHE 151 Cb -0.03 -0.21 -0.02 0.00 2.56 0.00 0.00 35.95 38.25 1g3g h PHE 151 CO -0.05 0.57 0.15 -0.22 -2.02 0.00 0.00 178.31 176.75 1g3g h LYS 152 N 0.62 0.31 -0.63 1.11 3.64 -1.50 -1.84 116.57 118.28 1g3g h LYS 152 Ca 0.16 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.50 1g3g h LYS 152 Cb 0.15 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 31.87 1g3g h LYS 152 CO -0.02 0.20 0.32 1.96 -2.27 0.00 0.00 179.45 179.64 1g3g h GLN 153 N 0.31 0.88 -0.38 1.90 4.20 -1.14 -0.20 115.11 120.69 1g3g h GLN 153 Ca 0.12 -0.10 -0.01 0.00 0.06 0.00 0.00 58.65 58.71 1g3g h GLN 153 Cb 0.02 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.61 1g3g h GLN 153 CO -0.07 0.67 0.18 0.00 -0.67 0.00 0.00 178.83 178.94 1g3g h LEU 155 N 0.48 0.34 -0.20 0.00 7.12 -1.00 0.96 115.31 123.01 1g3g h LEU 155 Ca 0.13 -0.44 0.01 0.00 0.13 0.00 0.00 57.88 57.71 1g3g h LEU 155 Cb 0.12 -0.09 -0.02 0.00 -0.53 0.00 0.00 40.66 40.13 1g3g h LEU 155 CO -0.02 0.71 0.09 -0.33 -0.13 0.00 0.00 178.44 178.76 1g3g h GLU 156 N -0.03 0.19 0.13 1.25 4.39 -0.97 -3.02 114.58 116.52 1g3g h GLU 156 Ca 0.03 -0.01 -0.28 0.00 0.34 0.00 0.00 59.36 59.43 1g3g h GLU 156 Cb 0.59 -0.04 0.02 0.00 -0.10 0.00 0.00 28.75 29.22 1g3g h GLU 156 CO 0.03 0.13 -1.23 0.37 -1.16 0.00 0.00 179.01 177.14 1g3g h GLN 157 N 0.20 0.42 -6.97 2.33 4.15 -0.95 -3.48 115.11 110.81 1g3g h GLN 157 Ca 0.08 -0.63 -0.59 0.00 0.77 0.00 0.00 58.65 58.28 1g3g h GLN 157 Cb 0.03 0.22 -0.24 0.00 0.21 0.00 0.00 27.48 27.70 1g3g h GLN 157 CO -0.07 1.27 -0.92 0.27 -1.93 0.00 0.00 178.83 177.46 1g3g n ASN 158 N -3.66 -0.82 -4.44 -0.69 0.23 0.33 -4.93 115.26 101.27 1g3g n ASN 158 Ca -0.11 -1.18 -0.30 0.00 -0.53 0.00 0.00 54.58 52.46 1g3g n ASN 158 Cb 1.00 -2.03 -0.12 0.00 -2.08 0.00 0.00 39.78 36.55 1g3g n ASN 158 CO 0.00 0.00 0.00 -1.59 -0.93 0.00 0.00 177.26 174.74 1g3g s LYS 159 N -7.14 1.76 -0.13 -3.83 0.00 -1.26 -5.08 119.74 104.07 1g3g s LYS 159 Ca 0.38 -1.17 -0.09 0.00 0.00 0.00 0.00 55.97 55.10 1g3g s LYS 159 Cb -0.22 -2.06 -0.04 0.00 0.00 0.00 0.00 37.83 35.51 1g3g s LYS 159 CO 0.98 0.49 0.17 0.08 0.00 0.00 0.00 175.35 177.07 1g3g s VAL 160 N -1.03 5.43 -0.01 1.79 1.01 -1.26 -5.08 120.40 121.24 1g3g s VAL 160 Ca 0.15 0.29 0.06 0.00 0.00 0.00 0.00 61.98 62.48 1g3g s VAL 160 Cb -0.10 -3.46 -0.03 0.00 0.00 0.00 0.00 36.38 32.79 1g3g s VAL 160 CO 0.07 0.56 -0.19 -1.81 0.00 0.00 0.00 175.10 173.73 1g3g s ASP 161 N -0.64 3.67 -0.41 3.32 1.01 -1.26 -5.10 116.67 117.27 1g3g s ASP 161 Ca 0.14 -0.35 -0.11 0.00 0.71 0.00 0.00 52.55 52.95 1g3g s ASP 161 Cb -0.12 -0.63 0.06 0.00 1.01 0.00 0.00 42.92 43.24 1g3g s ASP 161 CO 0.04 0.31 0.26 -0.60 0.21 0.00 0.00 175.17 175.38 1g3g s ARG 162 N -0.91 2.73 -0.22 8.23 6.06 -1.26 -5.07 118.95 128.51 1g3g s ARG 162 Ca 0.12 -1.31 -0.17 0.00 -2.50 0.00 0.00 55.73 51.87 1g3g s ARG 162 Cb -0.10 -3.81 -0.03 0.00 0.06 0.00 0.00 34.95 31.07 1g3g s ARG 162 CO 0.01 -0.87 0.47 -1.50 -2.50 0.00 0.00 175.30 170.91 1g3g s ILE 163 N 1.50 5.13 -2.00 4.11 2.07 -1.26 -5.38 121.20 125.37 1g3g s ILE 163 Ca 0.03 0.83 0.15 0.00 -1.41 0.00 0.00 60.65 60.25 1g3g s ILE 163 Cb -0.22 -3.79 0.42 0.00 0.13 0.00 0.00 42.46 39.00 1g3g s ILE 163 CO 0.04 0.17 1.30 -1.14 -1.91 0.00 0.00 174.94 173.41