#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g2t s ARG 2 N 0.00 1.39 0.00 -2.82 3.52 -1.26 -5.06 118.95 114.73 1g2t s ARG 2 Ca 0.00 -1.74 0.00 0.00 -0.13 0.00 0.00 55.73 53.86 1g2t s ARG 2 Cb 0.00 0.30 0.00 0.00 -1.56 0.00 0.00 34.95 33.69 1g2t s ARG 2 CO 0.00 -0.48 0.00 0.41 -0.81 0.00 0.00 175.30 174.42 1g2t n GLY 3 N -0.38 1.47 2.77 8.12 0.00 -1.26 -5.03 105.19 110.88 1g2t n GLY 3 Ca 0.04 -0.47 -0.36 0.00 0.00 0.00 0.00 46.02 45.23 1g2t n GLY 3 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1g2t n SER 4 N 0.00 6.64 -2.84 1.61 7.64 -1.26 -5.01 113.62 120.40 1g2t n SER 4 Ca 0.00 -3.78 -0.11 0.00 1.01 0.00 0.00 58.87 55.99 1g2t n SER 4 Cb 0.00 -0.91 0.07 0.00 -1.01 0.00 0.00 64.21 62.36 1g2t n SER 4 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1g2t n ASP 5 N -0.43 0.22 -2.32 6.43 9.92 -1.26 -5.03 116.55 124.09 1g2t n ASP 5 Ca 0.48 -1.28 -0.18 0.00 -0.53 0.00 0.00 54.79 53.27 1g2t n ASP 5 Cb 0.35 -0.35 0.02 0.00 -0.64 0.00 0.00 41.12 40.50 1g2t n ASP 5 CO 0.00 0.00 0.00 -0.38 0.13 0.00 0.00 177.20 176.95 1g2t n ILE 6 N -2.45 2.12 -1.40 0.53 2.08 -1.26 -4.83 119.36 114.15 1g2t n ILE 6 Ca 0.07 -3.95 -0.35 0.00 0.56 0.00 0.00 62.75 59.08 1g2t n ILE 6 Cb 0.23 -0.48 0.07 0.00 -0.75 0.00 0.00 39.64 38.72 1g2t n ILE 6 CO 0.00 0.00 0.00 -1.54 0.56 0.00 0.00 176.55 175.57 1g2t n SER 7 N -0.61 7.58 -3.99 4.38 3.41 -1.26 -4.95 113.62 118.17 1g2t n SER 7 Ca 0.33 -3.79 0.00 0.00 -0.26 0.00 0.00 58.87 55.14 1g2t n SER 7 Cb 0.88 -0.96 0.00 0.00 -0.26 0.00 0.00 64.21 63.87 1g2t n SER 7 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1g2t n LYS 8 N -0.89 1.13 0.00 4.33 4.81 -1.26 -4.88 118.16 121.40 1g2t n LYS 8 Ca 0.62 0.00 -0.17 0.00 -0.87 0.00 0.00 58.31 57.88 1g2t n LYS 8 Cb 0.65 0.00 -0.07 0.00 0.02 0.00 0.00 35.03 35.63 1g2t n LYS 8 CO 0.00 0.00 0.00 1.15 1.17 0.00 0.00 177.40 179.72 1g2t h THR 9 N -0.86 1.29 -3.87 3.15 2.02 -2.00 -3.45 112.91 109.18 1g2t h THR 9 Ca 0.00 -2.06 -0.45 0.00 0.77 0.00 0.00 66.41 64.67 1g2t h THR 9 Cb 0.00 2.09 0.15 0.00 -1.74 0.00 0.00 68.15 68.65 1g2t h THR 9 CO 0.00 0.65 0.39 0.00 0.37 0.00 0.00 175.52 176.93 1g2t n PHE 12 N -0.10 -1.62 -2.33 0.00 3.01 -1.26 -4.77 117.46 110.39 1g2t n PHE 12 Ca -0.11 0.29 -0.26 0.00 1.01 0.00 0.00 57.45 58.37 1g2t n PHE 12 Cb 0.63 0.48 0.04 0.00 -0.01 0.00 0.00 39.48 40.62 1g2t n PHE 12 CO 0.00 0.00 0.00 1.14 1.01 0.00 0.00 176.76 178.91 1g2t s GLN 13 N -1.73 2.65 -0.02 -1.08 1.03 -1.26 -5.06 119.66 114.19 1g2t s GLN 13 Ca 0.00 -0.11 -0.00 0.00 0.04 0.00 0.00 55.36 55.29 1g2t s GLN 13 Cb 0.00 -2.24 0.03 0.00 0.03 0.00 0.00 33.01 30.83 1g2t s GLN 13 CO 0.00 -0.90 0.04 0.71 -2.54 0.00 0.00 175.29 172.60 1g2t s TYR 14 N -3.08 0.02 -0.41 9.60 2.02 -1.26 -4.45 117.35 119.79 1g2t s TYR 14 Ca 0.56 0.16 -0.20 0.00 -0.37 0.00 0.00 57.07 57.21 1g2t s TYR 14 Cb -0.11 -0.25 0.02 0.00 -0.40 0.00 0.00 41.96 41.22 1g2t s TYR 14 CO 0.45 -0.10 0.63 -1.12 -1.57 0.00 0.00 175.55 173.84 1g2t s SER 15 N 1.15 6.35 -0.38 2.29 0.01 -1.20 -4.93 113.70 117.00 1g2t s SER 15 Ca -0.08 -0.17 -0.01 0.00 1.31 0.00 0.00 55.95 57.00 1g2t s SER 15 Cb -0.13 -2.32 0.27 0.00 0.21 0.00 0.00 66.02 64.05 1g2t s SER 15 CO -0.03 -0.71 1.98 0.00 0.41 0.00 0.00 173.24 174.89 1g2t n HIS 16 N 6.17 1.87 -4.25 2.43 1.44 -1.26 -4.91 115.22 116.71 1g2t n HIS 16 Ca -0.02 -2.11 -0.30 0.00 -2.01 0.00 0.00 57.72 53.28 1g2t n HIS 16 Cb 0.48 -1.02 -0.09 0.00 0.12 0.00 0.00 29.99 29.47 1g2t n HIS 16 CO 0.00 0.00 0.00 0.21 -2.81 0.00 0.00 176.34 173.74 1g2t s LYS 17 N -2.19 2.35 -0.59 -1.40 2.20 -1.26 -5.05 119.74 113.80 1g2t s LYS 17 Ca 0.37 -0.90 -0.27 0.00 -0.36 0.00 0.00 55.97 54.81 1g2t s LYS 17 Cb 0.29 -2.42 -0.01 0.00 -1.51 0.00 0.00 37.83 34.19 1g2t s LYS 17 CO -0.00 0.54 1.67 -1.25 -0.36 0.00 0.00 175.35 175.95 1g2t s PRO 18 N -2.06 2.93 0.38 4.03 0.04 -1.26 -4.97 135.00 134.08 1g2t s PRO 18 Ca 0.22 0.54 -0.26 0.00 0.04 0.00 0.00 61.00 61.53 1g2t s PRO 18 Cb -0.11 -4.28 -0.09 0.00 0.04 0.00 0.00 34.50 30.06 1g2t s PRO 18 CO 0.14 -2.38 1.19 -1.17 0.04 0.00 0.00 177.00 174.81 1g2t s LEU 19 N 7.71 4.27 -0.23 -3.56 2.96 -1.26 -4.92 118.68 123.66 1g2t s LEU 19 Ca 0.61 2.41 -0.29 0.00 -0.22 0.00 0.00 54.13 56.64 1g2t s LEU 19 Cb -0.13 -3.91 -0.04 0.00 0.50 0.00 0.00 46.19 42.62 1g2t s LEU 19 CO 0.22 -0.60 1.89 -2.16 -1.32 0.00 0.00 176.35 174.38 1g2t s PRO 20 N -2.11 3.48 0.58 0.98 0.04 -1.26 -4.83 135.00 131.88 1g2t s PRO 20 Ca 0.54 1.80 0.30 0.00 0.04 0.00 0.00 61.00 63.68 1g2t s PRO 20 Cb -0.33 -4.20 1.42 0.00 0.04 0.00 0.00 34.50 31.43 1g2t s PRO 20 CO 0.42 -1.69 1.81 -1.49 0.04 0.00 0.00 177.00 176.09 1g2t h TRP 21 N 12.72 0.00 -0.84 0.56 4.06 -1.91 0.16 115.95 130.70 1g2t h TRP 21 Ca -0.38 0.00 0.06 0.00 2.06 0.00 0.00 58.89 60.63 1g2t h TRP 21 Cb 1.19 0.00 -0.06 0.00 -1.00 0.00 0.00 29.16 29.29 1g2t h TRP 21 CO 0.94 0.00 0.52 1.79 -3.56 0.00 0.00 178.44 178.13 1g2t h THR 22 N 0.00 1.04 -0.01 1.49 1.35 -2.03 -1.67 112.91 113.09 1g2t h THR 22 Ca 0.32 -0.33 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1g2t h THR 22 Cb 1.61 0.01 0.00 0.00 -1.73 0.00 0.00 68.15 68.04 1g2t h THR 22 CO -0.00 0.17 -0.52 0.79 -0.25 0.00 0.00 175.52 175.71 1g2t n TRP 23 N -4.63 0.00 -2.93 4.73 7.02 0.48 -4.80 117.44 117.31 1g2t n TRP 23 Ca 0.12 0.00 -0.40 0.00 -1.02 0.00 0.00 57.50 56.20 1g2t n TRP 23 Cb 0.17 -0.11 -0.06 0.00 -2.42 0.00 0.00 31.31 28.89 1g2t n TRP 23 CO 0.00 0.00 0.00 0.08 -2.02 0.00 0.00 177.69 175.75 1g2t s VAL 24 N -2.74 4.38 0.00 -0.99 1.01 -0.63 0.21 120.40 121.64 1g2t s VAL 24 Ca 0.16 1.78 0.00 0.00 0.00 0.00 0.00 61.98 63.92 1g2t s VAL 24 Cb 0.18 -4.18 0.00 0.00 0.00 0.00 0.00 36.38 32.38 1g2t s VAL 24 CO 0.65 0.48 0.00 -1.14 0.00 0.00 0.00 175.10 175.09 1g2t n ARG 25 N 1.83 0.00 -0.03 2.72 0.00 0.21 -4.63 116.66 116.76 1g2t n ARG 25 Ca -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.81 1g2t n ARG 25 Cb 0.49 -0.77 0.00 0.00 0.00 0.00 0.00 32.46 32.18 1g2t n ARG 25 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 1g2t n SER 26 N -2.72 0.00 -1.27 6.15 3.41 -1.06 -4.94 113.62 113.19 1g2t n SER 26 Ca 0.00 -0.02 -0.02 0.00 -0.26 0.00 0.00 58.87 58.57 1g2t n SER 26 Cb 0.50 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.44 1g2t n SER 26 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1g2t n TYR 27 N 0.00 -0.51 -3.62 7.33 4.11 -1.26 0.49 117.16 123.70 1g2t n TYR 27 Ca 0.00 -0.32 -0.04 0.00 -0.00 0.00 0.00 57.90 57.54 1g2t n TYR 27 Cb 0.00 0.07 -0.03 0.00 -0.00 0.00 0.00 39.34 39.38 1g2t n TYR 27 CO 0.00 0.00 0.00 -1.83 -0.00 0.00 0.00 176.86 175.03 1g2t s GLU 28 N -2.12 0.20 0.02 -3.48 -1.05 0.26 -4.83 118.70 107.71 1g2t s GLU 28 Ca 0.04 -0.01 -0.01 0.00 -0.15 0.00 0.00 54.97 54.84 1g2t s GLU 28 Cb -0.00 0.09 -0.04 0.00 -0.44 0.00 0.00 34.13 33.74 1g2t s GLU 28 CO 0.03 -0.07 0.16 0.12 0.95 0.00 0.00 175.26 176.44 1g2t s PHE 29 N -1.57 3.45 0.99 4.83 2.19 -1.26 0.11 117.98 126.71 1g2t s PHE 29 Ca 0.08 0.27 -0.11 0.00 0.33 0.00 0.00 56.93 57.49 1g2t s PHE 29 Cb -0.01 -1.77 0.19 0.00 -1.31 0.00 0.00 43.02 40.12 1g2t s PHE 29 CO -0.05 0.60 1.09 0.95 1.83 0.00 0.00 175.22 179.64 1g2t s THR 30 N -1.36 2.22 0.87 0.12 -4.23 -0.79 -4.93 115.64 107.54 1g2t s THR 30 Ca 0.29 0.07 -0.12 0.00 -1.18 0.00 0.00 61.69 60.75 1g2t s THR 30 Cb -0.13 -2.21 0.11 0.00 1.34 0.00 0.00 72.50 71.62 1g2t s THR 30 CO 0.21 -0.09 1.14 -0.55 -0.54 0.00 0.00 174.62 174.78 1g2t s SER 31 N -2.78 3.93 0.29 3.99 0.15 -1.26 -4.87 113.70 113.14 1g2t s SER 31 Ca 0.66 0.99 0.16 0.00 0.70 0.00 0.00 55.95 58.46 1g2t s SER 31 Cb -0.22 -1.59 0.14 0.00 -1.71 0.00 0.00 66.02 62.64 1g2t s SER 31 CO 0.60 -2.29 1.48 -1.13 1.20 0.00 0.00 173.24 173.10 1g2t h ASN 32 N -1.32 0.00 0.69 5.45 -1.24 -1.98 -3.16 115.58 114.02 1g2t h ASN 32 Ca -0.49 0.00 -0.04 0.00 0.71 0.00 0.00 56.30 56.48 1g2t h ASN 32 Cb 1.32 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 40.36 1g2t h ASN 32 CO 0.62 0.49 -0.21 -1.28 -1.29 0.00 0.00 177.43 175.76 1g2t h SER 33 N 0.00 0.00 -3.82 1.15 0.87 -2.00 -3.45 113.55 106.30 1g2t h SER 33 Ca -0.00 0.00 -0.51 0.00 -1.23 0.00 0.00 61.79 60.05 1g2t h SER 33 Cb 1.33 0.00 0.21 0.00 -0.44 0.00 0.00 62.40 63.50 1g2t h SER 33 CO 0.06 0.21 -0.08 0.00 -0.53 0.00 0.00 176.83 176.49 1g2t n SER 35 N -3.46 1.49 -3.66 0.00 7.64 -1.26 -4.80 113.62 109.57 1g2t n SER 35 Ca 0.09 -1.49 -0.09 0.00 1.01 0.00 0.00 58.87 58.39 1g2t n SER 35 Cb 0.53 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.63 1g2t n SER 35 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1g2t s GLN 36 N -2.01 0.30 -0.22 1.43 -0.21 -1.26 -5.12 119.66 112.57 1g2t s GLN 36 Ca 0.38 0.99 -0.29 0.00 0.02 0.00 0.00 55.36 56.45 1g2t s GLN 36 Cb 0.21 0.27 0.01 0.00 1.00 0.00 0.00 33.01 34.49 1g2t s GLN 36 CO 0.34 -0.25 1.06 1.03 -2.12 0.00 0.00 175.29 175.35 1g2t s ARG 37 N 2.53 4.27 0.00 2.91 0.52 -1.26 -4.50 118.95 123.41 1g2t s ARG 37 Ca -0.02 1.39 -0.09 0.00 -0.52 0.00 0.00 55.73 56.50 1g2t s ARG 37 Cb -0.12 -3.65 0.01 0.00 0.52 0.00 0.00 34.95 31.71 1g2t s ARG 37 CO -0.12 -0.62 0.18 0.00 0.02 0.00 0.00 175.30 174.76 1g2t s ALA 38 N 3.16 -0.44 0.40 2.13 0.00 -1.26 -4.74 121.76 121.00 1g2t s ALA 38 Ca 0.45 -0.03 -0.13 0.00 0.00 0.00 0.00 51.96 52.25 1g2t s ALA 38 Cb -0.16 0.11 -0.08 0.00 0.00 0.00 0.00 23.12 23.00 1g2t s ALA 38 CO 0.08 -0.23 0.81 0.08 0.00 0.00 0.00 175.76 176.50 1g2t s VAL 39 N -1.43 4.69 -0.00 0.00 1.01 -0.28 -1.88 120.40 122.50 1g2t s VAL 39 Ca -0.14 0.87 0.04 0.00 0.00 0.00 0.00 61.98 62.74 1g2t s VAL 39 Cb -0.07 -3.69 -0.01 0.00 0.00 0.00 0.00 36.38 32.62 1g2t s VAL 39 CO 0.02 -0.44 -0.12 -0.63 0.00 0.00 0.00 175.10 173.93 1g2t s ILE 40 N -2.29 0.93 -0.14 2.22 1.01 0.29 0.19 121.20 123.41 1g2t s ILE 40 Ca 0.54 -0.54 0.01 0.00 0.00 0.00 0.00 60.65 60.66 1g2t s ILE 40 Cb -0.10 -0.79 -0.00 0.00 0.01 0.00 0.00 42.46 41.58 1g2t s ILE 40 CO 0.26 0.24 -0.17 -0.36 0.00 0.00 0.00 174.94 174.90 1g2t s PHE 41 N -0.33 2.73 0.17 3.97 0.08 0.19 0.90 117.98 125.71 1g2t s PHE 41 Ca 0.04 -1.02 0.04 0.00 0.12 0.00 0.00 56.93 56.11 1g2t s PHE 41 Cb -0.05 -1.84 -0.04 0.00 -0.57 0.00 0.00 43.02 40.52 1g2t s PHE 41 CO -0.00 -0.44 0.22 -0.08 -0.10 0.00 0.00 175.22 174.81 1g2t s THR 42 N 0.67 4.87 0.00 0.64 -1.32 0.18 0.53 115.64 121.21 1g2t s THR 42 Ca -0.09 -0.95 0.00 0.00 -1.21 0.00 0.00 61.69 59.45 1g2t s THR 42 Cb -0.16 -3.52 0.00 0.00 -1.51 0.00 0.00 72.50 67.31 1g2t s THR 42 CO 0.02 -0.14 0.00 0.35 -2.21 0.00 0.00 174.62 172.64 1g2t n THR 43 N -0.58 0.00 0.19 5.08 -2.24 -0.27 -0.62 114.28 115.84 1g2t n THR 43 Ca -0.08 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.78 1g2t n THR 43 Cb 0.55 -0.76 0.13 0.00 -2.10 0.00 0.00 70.33 68.15 1g2t n THR 43 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1g2t h LYS 44 N 0.00 0.00 0.00 -0.78 1.79 0.21 -3.18 116.57 114.62 1g2t h LYS 44 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1g2t h LYS 44 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 1g2t h LYS 44 CO 0.00 0.21 0.00 0.54 -1.08 0.00 0.00 179.45 179.12 1g2t n ARG 45 N -3.16 0.25 0.00 3.15 1.74 -1.26 -4.90 116.66 112.49 1g2t n ARG 45 Ca 0.03 0.21 0.00 0.00 -0.77 0.00 0.00 57.85 57.32 1g2t n ARG 45 Cb 0.60 -1.80 0.00 0.00 -1.02 0.00 0.00 32.46 30.25 1g2t n ARG 45 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1g2t n GLY 46 N 1.28 0.55 3.74 -0.13 0.00 -1.20 -4.95 105.19 104.49 1g2t n GLY 46 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 1g2t n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1g2t s LYS 47 N -0.72 4.68 -0.14 1.61 1.02 -1.26 -4.79 119.74 120.13 1g2t s LYS 47 Ca 0.00 1.65 -0.02 0.00 0.02 0.00 0.00 55.97 57.62 1g2t s LYS 47 Cb 0.00 -3.27 -0.02 0.00 -0.52 0.00 0.00 37.83 34.01 1g2t s LYS 47 CO 0.00 0.22 -0.08 0.15 -0.92 0.00 0.00 175.35 174.72 1g2t s LYS 48 N -0.71 3.51 -0.17 1.68 1.02 -1.26 -1.11 119.74 122.69 1g2t s LYS 48 Ca 0.46 -0.60 -0.06 0.00 0.02 0.00 0.00 55.97 55.79 1g2t s LYS 48 Cb -0.28 -2.77 -0.03 0.00 -0.52 0.00 0.00 37.83 34.23 1g2t s LYS 48 CO 0.35 0.24 0.02 0.08 -0.92 0.00 0.00 175.35 175.12 1g2t s VAL 49 N 0.32 4.40 0.61 3.17 1.01 0.19 -4.84 120.40 125.26 1g2t s VAL 49 Ca -0.07 -0.17 -0.10 0.00 0.00 0.00 0.00 61.98 61.63 1g2t s VAL 49 Cb -0.15 -2.96 -0.03 0.00 0.00 0.00 0.00 36.38 33.23 1g2t s VAL 49 CO 0.04 0.47 1.00 0.00 0.00 0.00 0.00 175.10 176.61 1g2t n THR 51 N -2.70 0.00 -4.89 0.00 -2.24 0.50 -3.27 114.28 101.68 1g2t n THR 51 Ca 0.05 -0.67 -0.33 0.00 -2.27 0.00 0.00 64.05 60.84 1g2t n THR 51 Cb 0.55 0.67 -0.13 0.00 -2.10 0.00 0.00 70.33 69.31 1g2t n THR 51 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1g2t s HIS 52 N -4.33 2.70 -0.20 4.78 2.46 -1.26 -1.13 115.29 118.31 1g2t s HIS 52 Ca 0.11 -0.17 0.29 0.00 0.47 0.00 0.00 55.06 55.75 1g2t s HIS 52 Cb -0.03 -1.63 1.11 0.00 -0.13 0.00 0.00 32.58 31.90 1g2t s HIS 52 CO 0.08 0.17 1.85 -1.00 -2.47 0.00 0.00 174.74 173.37 1g2t h PRO 53 N 5.38 0.00 -0.02 2.88 0.13 -1.91 -2.95 132.00 135.51 1g2t h PRO 53 Ca -0.46 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.54 1g2t h PRO 53 Cb 1.15 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.27 1g2t h PRO 53 CO 0.50 0.00 -0.59 -0.09 -0.23 0.00 0.00 178.00 177.59 1g2t h ARG 54 N 0.00 0.07 -6.34 0.86 2.43 -1.96 -3.43 114.38 106.01 1g2t h ARG 54 Ca 0.00 -0.05 -0.54 0.00 -0.81 0.00 0.00 59.98 58.59 1g2t h ARG 54 Cb 0.52 0.01 0.01 0.00 -0.42 0.00 0.00 29.97 30.09 1g2t h ARG 54 CO 0.00 0.64 1.15 0.15 -1.51 0.00 0.00 179.97 180.40 1g2t s LYS 55 N -3.71 4.16 0.49 0.20 3.01 -1.12 -4.85 119.74 117.93 1g2t s LYS 55 Ca -0.02 2.43 0.18 0.00 -1.01 0.00 0.00 55.97 57.55 1g2t s LYS 55 Cb 0.13 -4.02 1.22 0.00 -1.01 0.00 0.00 37.83 34.15 1g2t s LYS 55 CO 0.77 -0.89 2.06 -0.22 0.51 0.00 0.00 175.35 177.58 1g2t h LYS 56 N 9.90 0.13 -0.27 1.68 3.11 -1.90 -1.02 116.57 128.20 1g2t h LYS 56 Ca -0.45 -0.01 -0.13 0.00 -2.81 0.00 0.00 60.65 57.25 1g2t h LYS 56 Cb 1.21 -0.03 -0.01 0.00 -1.00 0.00 0.00 32.23 32.40 1g2t h LYS 56 CO 0.94 0.09 -0.37 0.11 -2.81 0.00 0.00 179.45 177.41 1g2t h TRP 57 N 0.14 0.74 -0.58 1.91 5.08 -1.95 -2.87 115.95 118.42 1g2t h TRP 57 Ca 0.15 -0.20 -0.01 0.00 1.08 0.00 0.00 58.89 59.91 1g2t h TRP 57 Cb 0.43 -0.16 -0.03 0.00 -3.00 0.00 0.00 29.16 26.40 1g2t h TRP 57 CO -0.00 0.91 0.33 0.28 -1.28 0.00 0.00 178.44 178.68 1g2t h VAL 58 N 0.52 1.18 -0.06 0.12 2.07 -1.46 0.59 116.25 119.21 1g2t h VAL 58 Ca 0.05 -0.45 0.02 0.00 0.82 0.00 0.00 66.70 67.14 1g2t h VAL 58 Cb 0.88 0.42 -0.00 0.00 -1.52 0.00 0.00 31.29 31.07 1g2t h VAL 58 CO 0.08 0.20 0.06 1.56 0.02 0.00 0.00 177.57 179.48 1g2t h GLN 59 N 0.79 0.00 -0.05 1.57 1.08 -1.36 0.30 115.11 117.45 1g2t h GLN 59 Ca 0.21 0.00 -0.21 0.00 -1.45 0.00 0.00 58.65 57.20 1g2t h GLN 59 Cb 0.02 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.45 1g2t h GLN 59 CO -0.04 0.00 -0.84 -0.22 -0.95 0.00 0.00 178.83 176.78 1g2t h LYS 60 N 0.00 0.46 0.08 1.46 3.11 -0.72 -2.34 116.57 118.62 1g2t h LYS 60 Ca 0.03 -0.43 -0.26 0.00 -2.81 0.00 0.00 60.65 57.18 1g2t h LYS 60 Cb 0.14 0.11 0.01 0.00 -1.00 0.00 0.00 32.23 31.48 1g2t h LYS 60 CO -0.00 1.07 -1.13 1.88 -2.81 0.00 0.00 179.45 178.46 1g2t h TYR 61 N 0.29 0.58 -0.15 1.91 -1.99 0.34 -0.92 116.97 117.04 1g2t h TYR 61 Ca -0.06 -0.38 -0.07 0.00 2.00 0.00 0.00 58.73 60.22 1g2t h TYR 61 Cb 1.46 -0.04 -0.01 0.00 2.00 0.00 0.00 36.73 40.13 1g2t h TYR 61 CO 0.06 1.25 -0.24 0.82 -0.00 0.00 0.00 178.16 180.05 1g2t h ILE 62 N 0.15 1.23 0.09 -2.88 2.04 -0.54 0.91 117.51 118.51 1g2t h ILE 62 Ca -0.12 -1.09 -0.26 0.00 1.00 0.00 0.00 64.86 64.39 1g2t h ILE 62 Cb 1.82 1.38 -0.01 0.00 -0.74 0.00 0.00 36.82 39.27 1g2t h ILE 62 CO 0.19 0.33 -1.24 0.77 0.00 0.00 0.00 178.15 178.21 1g2t h SER 63 N 0.24 0.29 0.72 1.72 4.64 -1.39 -3.03 113.55 116.74 1g2t h SER 63 Ca 0.04 -0.33 -0.24 0.00 -0.47 0.00 0.00 61.79 60.79 1g2t h SER 63 Cb 0.55 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.54 1g2t h SER 63 CO 0.04 1.26 -1.12 -0.07 -0.87 0.00 0.00 176.83 176.07 1g2t h LEU 64 N 0.05 0.29 -1.70 5.97 3.38 -0.77 -3.15 115.31 119.37 1g2t h LEU 64 Ca -0.12 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.55 1g2t h LEU 64 Cb 1.93 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.58 1g2t h LEU 64 CO 0.17 1.21 0.00 0.18 0.09 0.00 0.00 178.44 180.09 1g2t n LEU 65 N -3.50 2.45 -4.60 1.67 4.77 0.31 -4.94 117.00 113.16 1g2t n LEU 65 Ca -0.05 -1.24 -0.50 0.00 -0.03 0.00 0.00 56.01 54.18 1g2t n LEU 65 Cb 0.97 -0.44 -0.05 0.00 -2.33 0.00 0.00 43.42 41.56 1g2t n LEU 65 CO 0.51 0.40 0.91 2.29 -1.33 0.00 0.00 177.39 180.18 1g2t n LYS 66 N 0.30 1.32 -2.70 3.23 2.85 -1.14 -4.09 118.16 117.93 1g2t n LYS 66 Ca 0.11 0.47 -0.07 0.00 -1.05 0.00 0.00 58.31 57.77 1g2t n LYS 66 Cb 0.50 -2.11 0.11 0.00 -0.65 0.00 0.00 35.03 32.88 1g2t n LYS 66 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 177.40 179.76 1g2t n THR 67 N 2.45 0.06 -2.11 0.58 -1.04 -1.26 -5.04 114.28 107.92 1g2t n THR 67 Ca 0.17 -1.60 -0.29 0.00 -2.04 0.00 0.00 64.05 60.30 1g2t n THR 67 Cb 0.22 1.00 -0.05 0.00 -1.82 0.00 0.00 70.33 69.68 1g2t n THR 67 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1g2t s PRO 68 N -0.00 2.66 -1.24 -2.82 0.04 -1.26 -4.85 135.00 127.52 1g2t s PRO 68 Ca 0.22 -0.61 -0.06 0.00 0.04 0.00 0.00 61.00 60.59 1g2t s PRO 68 Cb 0.40 -5.14 0.19 0.00 0.04 0.00 0.00 34.50 29.98 1g2t s PRO 68 CO -0.08 -3.40 1.98 1.17 0.04 0.00 0.00 177.00 176.71 1g2t n LYS 69 N 8.71 4.24 -4.20 4.56 4.81 -1.26 -4.93 118.16 130.09 1g2t n LYS 69 Ca 0.41 -3.76 -0.16 0.00 -0.87 0.00 0.00 58.31 53.93 1g2t n LYS 69 Cb 0.47 -2.72 -0.08 0.00 0.02 0.00 0.00 35.03 32.72 1g2t n LYS 69 CO 0.00 0.00 0.00 1.14 1.17 0.00 0.00 177.40 179.71 1g2t s GLN 70 N -1.04 1.62 0.00 1.64 -2.07 -1.26 -5.37 119.66 113.18 1g2t s GLN 70 Ca 0.43 -1.80 0.28 0.00 -1.82 0.00 0.00 55.36 52.45 1g2t s GLN 70 Cb 0.13 0.34 1.11 0.00 -1.09 0.00 0.00 33.01 33.51 1g2t s GLN 70 CO -0.02 -0.61 1.78 1.47 -1.32 0.00 0.00 175.29 176.59