#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x2t s PRO 3 N -4.99 1.16 0.17 0.00 0.02 -1.26 -4.85 135.00 125.24 1x2t s PRO 3 Ca 0.61 1.23 -0.34 0.00 0.02 0.00 0.00 61.00 62.52 1x2t s PRO 3 Cb -0.16 -1.77 -0.14 0.00 0.02 0.00 0.00 34.50 32.45 1x2t s PRO 3 CO 0.56 -2.43 1.59 0.45 -0.33 0.00 0.00 177.00 176.84 1x2t n SER 4 N -4.06 3.19 0.00 2.53 2.88 -1.26 -1.32 113.62 115.58 1x2t n SER 4 Ca 0.09 1.08 0.00 0.00 -1.33 0.00 0.00 58.87 58.71 1x2t n SER 4 Cb 0.53 -1.44 0.00 0.00 -0.75 0.00 0.00 64.21 62.55 1x2t n SER 4 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x2t n GLY 5 N 3.43 1.18 3.91 0.46 0.00 -1.26 -5.05 105.19 107.87 1x2t n GLY 5 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 1x2t n GLY 5 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1x2t s TRP 6 N -2.39 3.49 -0.02 1.61 0.52 -0.43 -4.80 118.94 116.93 1x2t s TRP 6 Ca 0.00 0.22 0.04 0.00 0.02 0.00 0.00 56.10 56.38 1x2t s TRP 6 Cb 0.00 -1.74 -0.03 0.00 -1.15 0.00 0.00 33.47 30.55 1x2t s TRP 6 CO 0.00 0.57 -0.13 -1.12 0.02 0.00 0.00 176.95 176.30 1x2t s SER 7 N -2.61 4.17 0.16 2.95 0.01 0.13 -4.75 113.70 113.75 1x2t s SER 7 Ca 0.35 -0.22 -0.02 0.00 1.31 0.00 0.00 55.95 57.36 1x2t s SER 7 Cb -0.13 -0.87 -0.05 0.00 0.21 0.00 0.00 66.02 65.18 1x2t s SER 7 CO 0.28 0.31 0.35 -0.94 0.41 0.00 0.00 173.24 173.65 1x2t s SER 8 N -1.09 6.42 -0.30 2.44 1.04 -1.26 0.28 113.70 121.23 1x2t s SER 8 Ca 0.14 0.44 -0.05 0.00 0.48 0.00 0.00 55.95 56.96 1x2t s SER 8 Cb -0.11 -2.03 0.17 0.00 0.10 0.00 0.00 66.02 64.16 1x2t s SER 8 CO 0.04 0.03 0.65 -0.47 0.98 0.00 0.00 173.24 174.47 1x2t s TYR 9 N -1.73 -1.44 -1.06 5.02 5.04 -0.47 -4.97 117.35 117.74 1x2t s TYR 9 Ca 0.39 1.81 -0.21 0.00 -2.44 0.00 0.00 57.07 56.61 1x2t s TYR 9 Cb -0.12 0.61 0.03 0.00 0.35 0.00 0.00 41.96 42.83 1x2t s TYR 9 CO 0.27 -0.77 0.67 0.39 -1.34 0.00 0.00 175.55 174.77 1x2t n GLU 10 N 5.42 -0.78 -0.90 4.97 1.02 -1.26 -1.78 120.64 127.33 1x2t n GLU 10 Ca -0.05 0.37 0.00 0.00 -0.02 0.00 0.00 57.16 57.46 1x2t n GLU 10 Cb 0.51 -2.62 0.00 0.00 -0.02 0.00 0.00 31.44 29.31 1x2t n GLU 10 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1x2t n GLY 11 N -1.91 0.59 3.38 0.62 0.00 -1.26 -5.01 105.19 101.61 1x2t n GLY 11 Ca -0.18 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.62 1x2t n GLY 11 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1x2t s HIS 12 N -2.67 1.93 -0.06 1.61 3.76 -0.74 -5.10 115.29 114.03 1x2t s HIS 12 Ca 0.00 -0.46 0.02 0.00 -0.15 0.00 0.00 55.06 54.47 1x2t s HIS 12 Cb 0.00 -0.91 -0.03 0.00 1.11 0.00 0.00 32.58 32.76 1x2t s HIS 12 CO 0.00 0.44 -0.13 0.00 -0.85 0.00 0.00 174.74 174.21 1x2t s TYR 14 N -0.59 1.25 -0.16 0.00 1.51 0.14 -1.23 117.35 118.27 1x2t s TYR 14 Ca 0.09 -0.41 -0.06 0.00 -1.01 0.00 0.00 57.07 55.67 1x2t s TYR 14 Cb -0.11 -0.72 0.07 0.00 -0.11 0.00 0.00 41.96 41.09 1x2t s TYR 14 CO 0.01 0.06 0.35 0.21 -1.11 0.00 0.00 175.55 175.07 1x2t s LYS 15 N -1.50 0.27 0.33 -0.62 2.20 -0.58 0.20 119.74 120.04 1x2t s LYS 15 Ca -0.00 0.84 -0.17 0.00 -0.36 0.00 0.00 55.97 56.28 1x2t s LYS 15 Cb -0.09 0.10 -0.09 0.00 -1.51 0.00 0.00 37.83 36.23 1x2t s LYS 15 CO 0.02 -0.23 0.78 -1.25 -0.36 0.00 0.00 175.35 174.30 1x2t s PRO 16 N 2.17 4.09 -0.07 4.03 0.04 -1.26 -0.88 135.00 143.11 1x2t s PRO 16 Ca -0.03 0.79 -0.01 0.00 0.04 0.00 0.00 61.00 61.79 1x2t s PRO 16 Cb -0.11 -2.44 0.03 0.00 0.04 0.00 0.00 34.50 32.01 1x2t s PRO 16 CO -0.11 0.15 -0.01 -0.06 0.04 0.00 0.00 177.00 177.01 1x2t s PHE 17 N -1.96 0.76 -1.33 0.56 0.40 0.46 -4.95 117.98 111.92 1x2t s PHE 17 Ca 0.54 -0.23 -0.06 0.00 -0.60 0.00 0.00 56.93 56.58 1x2t s PHE 17 Cb -0.11 -0.84 0.12 0.00 0.51 0.00 0.00 43.02 42.70 1x2t s PHE 17 CO 0.17 -0.34 2.34 1.17 0.70 0.00 0.00 175.22 179.26 1x2t n LYS 18 N 5.06 4.44 -5.06 0.44 4.81 -1.26 -2.13 118.16 124.45 1x2t n LYS 18 Ca -0.09 -3.43 -0.30 0.00 -0.87 0.00 0.00 58.31 53.63 1x2t n LYS 18 Cb 0.50 -2.68 -0.17 0.00 0.02 0.00 0.00 35.03 32.71 1x2t n LYS 18 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1x2t s LEU 19 N -1.78 1.98 -0.46 3.14 1.43 -1.26 -5.00 118.68 116.72 1x2t s LEU 19 Ca 0.53 -0.47 -0.20 0.00 -1.03 0.00 0.00 54.13 52.96 1x2t s LEU 19 Cb 0.17 -1.22 0.04 0.00 0.03 0.00 0.00 46.19 45.20 1x2t s LEU 19 CO -0.08 0.16 0.62 -0.31 0.23 0.00 0.00 176.35 176.97 1x2t s TYR 20 N 0.18 3.06 0.13 0.29 1.51 -1.26 -3.48 117.35 117.78 1x2t s TYR 20 Ca -0.11 -0.27 0.02 0.00 -1.01 0.00 0.00 57.07 55.70 1x2t s TYR 20 Cb -0.15 -3.37 -0.04 0.00 -0.11 0.00 0.00 41.96 38.28 1x2t s TYR 20 CO 0.05 -0.92 -0.04 0.15 -1.11 0.00 0.00 175.55 173.68 1x2t s LYS 21 N 2.70 0.95 0.88 -0.62 1.02 -0.92 -4.66 119.74 119.09 1x2t s LYS 21 Ca 0.19 -1.42 -0.12 0.00 0.02 0.00 0.00 55.97 54.64 1x2t s LYS 21 Cb -0.16 -0.22 0.12 0.00 -0.52 0.00 0.00 37.83 37.05 1x2t s LYS 21 CO 0.16 -0.07 1.11 0.95 -0.92 0.00 0.00 175.35 176.58 1x2t s THR 22 N -3.64 2.53 0.13 2.17 -4.23 -1.25 -1.15 115.64 110.20 1x2t s THR 22 Ca 0.17 0.17 -0.19 0.00 -1.18 0.00 0.00 61.69 60.66 1x2t s THR 22 Cb 0.06 -2.82 -0.02 0.00 1.34 0.00 0.00 72.50 71.05 1x2t s THR 22 CO -0.01 -0.22 1.72 -0.25 -0.54 0.00 0.00 174.62 175.32 1x2t h TRP 23 N -1.43 0.01 -0.42 3.99 7.01 -1.60 0.16 115.95 123.67 1x2t h TRP 23 Ca -0.50 0.02 0.04 0.00 2.11 0.00 0.00 58.89 60.56 1x2t h TRP 23 Cb 1.30 0.03 -0.04 0.00 -2.10 0.00 0.00 29.16 28.35 1x2t h TRP 23 CO 0.38 -0.02 0.19 -0.44 -2.79 0.00 0.00 178.44 175.76 1x2t h ASP 24 N 0.09 0.25 -0.08 2.65 3.32 -1.92 0.24 116.42 120.96 1x2t h ASP 24 Ca 0.11 0.03 -0.12 0.00 0.02 0.00 0.00 57.03 57.07 1x2t h ASP 24 Cb 0.13 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 1x2t h ASP 24 CO -0.18 0.18 -0.34 0.44 -1.72 0.00 0.00 179.24 177.63 1x2t h ASP 25 N 0.38 0.60 -0.29 6.45 5.19 -1.85 -1.11 116.42 125.78 1x2t h ASP 25 Ca 0.19 -0.24 -0.04 0.00 -0.62 0.00 0.00 57.03 56.31 1x2t h ASP 25 Cb 0.13 -0.17 -0.01 0.00 0.18 0.00 0.00 39.33 39.46 1x2t h ASP 25 CO -0.16 0.89 0.01 0.00 -3.12 0.00 0.00 179.24 176.86 1x2t h ALA 26 N 1.15 0.39 -0.34 3.45 0.00 -0.27 0.67 119.26 124.31 1x2t h ALA 26 Ca 0.05 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1x2t h ALA 26 Cb 0.82 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 1x2t h ALA 26 CO 0.07 0.13 0.16 1.49 0.00 0.00 0.00 179.25 181.09 1x2t h GLU 27 N 0.31 0.49 -0.59 0.00 4.57 -0.87 -0.59 114.58 117.91 1x2t h GLU 27 Ca 0.08 -0.08 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 1x2t h GLU 27 Cb 0.41 -0.09 -0.03 0.00 -0.16 0.00 0.00 28.75 28.89 1x2t h GLU 27 CO 0.01 0.46 0.38 -0.09 -1.18 0.00 0.00 179.01 178.59 1x2t h ARG 28 N 0.41 0.79 -0.37 1.92 2.43 -1.09 -1.34 114.38 117.13 1x2t h ARG 28 Ca 0.12 -0.06 0.05 0.00 -0.81 0.00 0.00 59.98 59.28 1x2t h ARG 28 Cb 0.13 -0.17 -0.05 0.00 -0.42 0.00 0.00 29.97 29.47 1x2t h ARG 28 CO -0.01 0.54 0.09 0.35 -1.51 0.00 0.00 179.97 179.43 1x2t h PHE 29 N 0.80 0.16 -0.73 2.20 3.57 -0.53 -1.64 116.94 120.77 1x2t h PHE 29 Ca 0.21 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.74 1x2t h PHE 29 Cb -0.06 -0.02 -0.04 0.00 2.79 0.00 0.00 35.95 38.62 1x2t h PHE 29 CO -0.03 0.04 0.47 0.00 -2.23 0.00 0.00 178.31 176.57 1x2t h THR 31 N 1.00 0.00 -0.02 0.00 1.35 -0.30 -2.33 112.91 112.60 1x2t h THR 31 Ca 0.27 -0.23 0.00 0.00 -0.55 0.00 0.00 66.41 65.90 1x2t h THR 31 Cb -0.09 1.02 0.00 0.00 -1.73 0.00 0.00 68.15 67.34 1x2t h THR 31 CO -0.06 0.00 -0.38 -0.62 -0.25 0.00 0.00 175.52 174.22 1x2t n GLU 32 N -2.58 1.43 0.10 4.72 1.02 -0.35 -4.26 120.64 120.72 1x2t n GLU 32 Ca 0.00 -1.18 0.10 0.00 -0.02 0.00 0.00 57.16 56.06 1x2t n GLU 32 Cb 0.19 -1.48 -0.00 0.00 -0.02 0.00 0.00 31.44 30.13 1x2t n GLU 32 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 1x2t h GLN 33 N 2.87 0.00 -2.18 3.49 1.08 -1.06 -3.48 115.11 115.83 1x2t h GLN 33 Ca 0.00 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1x2t h GLN 33 Cb 0.80 0.00 -0.18 0.00 -0.05 0.00 0.00 27.48 28.05 1x2t h GLN 33 CO 0.00 0.05 0.30 0.00 -0.95 0.00 0.00 178.83 178.23 1x2t s ALA 34 N -3.29 -1.77 -0.00 3.87 0.00 -1.24 -5.05 121.76 114.28 1x2t s ALA 34 Ca -0.00 1.14 -0.32 0.00 0.00 0.00 0.00 51.96 52.78 1x2t s ALA 34 Cb 0.09 0.12 -0.11 0.00 0.00 0.00 0.00 23.12 23.23 1x2t s ALA 34 CO 0.79 -0.49 1.90 1.17 0.00 0.00 0.00 175.76 179.13 1x2t n LYS 35 N 0.44 2.52 -1.65 0.00 4.81 -1.26 -0.83 118.16 122.19 1x2t n LYS 35 Ca -0.16 0.92 -0.10 0.00 -0.87 0.00 0.00 58.31 58.10 1x2t n LYS 35 Cb 0.60 -2.82 -0.03 0.00 0.02 0.00 0.00 35.03 32.80 1x2t n LYS 35 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1x2t n GLY 36 N 4.40 0.70 3.77 3.14 0.00 -1.26 -4.96 105.19 110.98 1x2t n GLY 36 Ca 0.21 -0.51 -0.33 0.00 0.00 0.00 0.00 46.02 45.39 1x2t n GLY 36 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1x2t s GLY 37 N -2.75 2.10 0.27 -0.02 0.00 -0.01 -4.78 107.32 102.12 1x2t s GLY 37 Ca 0.00 0.51 -0.17 0.00 0.00 0.00 0.00 44.72 45.06 1x2t s GLY 37 CO 0.00 0.86 0.60 0.30 0.00 0.00 0.00 173.10 174.86 1x2t s HIS 38 N -2.41 0.10 0.68 1.90 3.76 -0.49 -3.29 115.29 115.54 1x2t s HIS 38 Ca 0.66 -0.52 -0.15 0.00 -0.15 0.00 0.00 55.06 54.90 1x2t s HIS 38 Cb -0.20 0.45 0.01 0.00 1.11 0.00 0.00 32.58 33.96 1x2t s HIS 38 CO 0.43 -1.13 1.15 -0.51 -0.85 0.00 0.00 174.74 173.83 1x2t s LEU 39 N -2.98 3.37 0.42 0.89 1.43 -1.26 -0.47 118.68 120.08 1x2t s LEU 39 Ca 0.17 2.15 -0.26 0.00 -1.03 0.00 0.00 54.13 55.16 1x2t s LEU 39 Cb -0.03 -4.57 -0.10 0.00 0.03 0.00 0.00 46.19 41.52 1x2t s LEU 39 CO 0.08 -1.87 1.34 0.55 0.23 0.00 0.00 176.35 176.68 1x2t n VAL 40 N -2.50 2.53 -4.75 -1.59 3.14 -0.12 -4.22 118.33 110.81 1x2t n VAL 40 Ca 0.12 -0.50 -0.33 0.00 -2.96 0.00 0.00 64.34 60.67 1x2t n VAL 40 Cb 0.51 -1.69 -0.15 0.00 -1.06 0.00 0.00 33.84 31.45 1x2t n VAL 40 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 1x2t s SER 41 N -0.46 3.79 -0.44 6.55 1.04 -1.26 0.10 113.70 123.02 1x2t s SER 41 Ca 0.60 -0.40 -0.07 0.00 0.48 0.00 0.00 55.95 56.56 1x2t s SER 41 Cb -0.49 -1.57 0.11 0.00 0.10 0.00 0.00 66.02 64.16 1x2t s SER 41 CO 0.59 0.14 0.29 -0.63 0.98 0.00 0.00 173.24 174.60 1x2t s ILE 42 N 0.51 3.92 -2.38 -1.02 1.01 -1.26 -4.93 121.20 117.04 1x2t s ILE 42 Ca -0.10 -1.81 0.20 0.00 0.00 0.00 0.00 60.65 58.94 1x2t s ILE 42 Cb -0.16 -3.58 0.22 0.00 0.01 0.00 0.00 42.46 38.95 1x2t s ILE 42 CO 0.04 -0.70 1.19 -0.62 0.00 0.00 0.00 174.94 174.85 1x2t n GLU 43 N 4.81 1.96 -3.62 2.79 1.02 -1.26 -4.97 120.64 121.37 1x2t n GLU 43 Ca -0.07 -1.83 -0.10 0.00 -0.02 0.00 0.00 57.16 55.14 1x2t n GLU 43 Cb 0.41 -1.40 -0.02 0.00 -0.02 0.00 0.00 31.44 30.40 1x2t n GLU 43 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1x2t s SER 44 N -1.57 -0.40 0.20 1.62 1.04 -1.26 -5.02 113.70 108.30 1x2t s SER 44 Ca 0.27 -0.29 -0.09 0.00 0.48 0.00 0.00 55.95 56.31 1x2t s SER 44 Cb 0.18 0.63 0.14 0.00 0.10 0.00 0.00 66.02 67.06 1x2t s SER 44 CO 0.26 -1.10 1.79 0.00 0.98 0.00 0.00 173.24 175.17 1x2t h ALA 45 N 2.05 0.95 -0.74 5.32 0.00 -1.99 -0.58 119.26 124.28 1x2t h ALA 45 Ca -0.28 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.45 1x2t h ALA 45 Cb 1.28 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.74 1x2t h ALA 45 CO 0.34 0.52 0.35 0.78 0.00 0.00 0.00 179.25 181.24 1x2t h GLY 46 N 1.04 1.14 1.51 0.00 0.00 -2.00 -1.24 103.07 103.53 1x2t h GLY 46 Ca 0.25 -0.57 -0.12 0.00 0.00 0.00 0.00 47.33 46.90 1x2t h GLY 46 CO -0.03 0.54 -0.32 -2.09 0.00 0.00 0.00 176.54 174.63 1x2t h GLU 47 N 1.04 0.55 -0.84 4.80 4.81 -1.88 -2.01 114.58 121.05 1x2t h GLU 47 Ca 0.25 -0.24 -0.03 0.00 -0.13 0.00 0.00 59.36 59.21 1x2t h GLU 47 Cb 0.12 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.45 1x2t h GLU 47 CO -0.03 0.81 0.40 0.00 -0.73 0.00 0.00 179.01 179.46 1x2t h ALA 48 N 1.18 1.08 -0.41 2.92 0.00 -0.55 -0.68 119.26 122.80 1x2t h ALA 48 Ca 0.06 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 1x2t h ALA 48 Cb 0.79 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1x2t h ALA 48 CO 0.06 0.65 -0.10 -0.44 0.00 0.00 0.00 179.25 179.42 1x2t h ASP 49 N 1.20 0.81 -0.09 0.00 3.32 -0.98 -1.05 116.42 119.61 1x2t h ASP 49 Ca 0.29 -0.36 0.01 0.00 0.02 0.00 0.00 57.03 56.98 1x2t h ASP 49 Cb 0.12 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 1x2t h ASP 49 CO -0.04 0.99 0.04 0.15 -1.72 0.00 0.00 179.24 178.66 1x2t h PHE 50 N 0.62 0.08 -0.70 4.55 3.57 -1.01 -1.21 116.94 122.84 1x2t h PHE 50 Ca 0.10 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.55 1x2t h PHE 50 Cb 0.63 -0.02 -0.03 0.00 2.79 0.00 0.00 35.95 39.32 1x2t h PHE 50 CO 0.05 0.05 0.20 0.28 -2.23 0.00 0.00 178.31 176.66 1x2t h VAL 51 N 0.10 1.26 -0.54 1.41 2.07 -1.09 -0.14 116.25 119.32 1x2t h VAL 51 Ca 0.04 -0.92 0.02 0.00 0.82 0.00 0.00 66.70 66.66 1x2t h VAL 51 Cb 0.01 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.27 1x2t h VAL 51 CO -0.03 0.36 0.33 0.00 0.02 0.00 0.00 177.57 178.25 1x2t h ALA 52 N 1.09 0.70 -0.35 1.67 0.00 -0.91 0.36 119.26 121.82 1x2t h ALA 52 Ca 0.22 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.04 1x2t h ALA 52 Cb 0.33 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1x2t h ALA 52 CO -0.00 0.06 -0.09 0.37 0.00 0.00 0.00 179.25 179.59 1x2t h GLN 53 N 0.67 0.68 -0.39 0.00 4.15 -0.98 -0.39 115.11 118.85 1x2t h GLN 53 Ca 0.21 -0.26 0.04 0.00 0.77 0.00 0.00 58.65 59.42 1x2t h GLN 53 Cb -0.00 -0.04 -0.04 0.00 0.21 0.00 0.00 27.48 27.61 1x2t h GLN 53 CO -0.08 0.84 0.15 1.25 -1.93 0.00 0.00 178.83 179.06 1x2t h LEU 54 N 0.47 0.18 -0.13 -2.39 5.85 -0.61 -1.29 115.31 117.39 1x2t h LEU 54 Ca 0.09 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 1x2t h LEU 54 Cb 0.59 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 1x2t h LEU 54 CO 0.03 0.14 0.06 0.58 -0.34 0.00 0.00 178.44 178.91 1x2t h VAL 55 N 0.32 1.14 -0.99 1.05 2.07 -0.82 -1.86 116.25 117.17 1x2t h VAL 55 Ca 0.18 -0.43 0.12 0.00 0.82 0.00 0.00 66.70 67.39 1x2t h VAL 55 Cb 0.14 1.19 -0.08 0.00 -1.52 0.00 0.00 31.29 31.01 1x2t h VAL 55 CO -0.17 0.13 0.63 0.74 0.02 0.00 0.00 177.57 178.92 1x2t h THR 56 N 0.06 0.91 0.00 2.57 2.02 -0.63 0.16 112.91 118.00 1x2t h THR 56 Ca 0.04 -0.33 0.00 0.00 0.77 0.00 0.00 66.41 66.90 1x2t h THR 56 Cb 0.16 -0.13 0.00 0.00 -1.74 0.00 0.00 68.15 66.43 1x2t h THR 56 CO -0.00 0.17 -0.46 -0.33 0.37 0.00 0.00 175.52 175.28 1x2t h GLU 57 N 0.96 0.00 0.00 6.66 5.08 -1.11 -3.40 114.58 122.77 1x2t h GLU 57 Ca 0.49 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.82 1x2t h GLU 57 Cb 0.52 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 1x2t h GLU 57 CO -0.26 0.00 -1.32 0.09 -1.00 0.00 0.00 179.01 176.52 1x2t n ASN 58 N -2.66 3.59 -3.92 1.42 3.02 -0.71 -4.82 115.26 111.18 1x2t n ASN 58 Ca 0.03 0.00 -0.29 0.00 -0.03 0.00 0.00 54.58 54.29 1x2t n ASN 58 Cb 0.51 1.08 -0.13 0.00 -0.61 0.00 0.00 39.78 40.63 1x2t n ASN 58 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1x2t s ILE 59 N -2.34 2.83 0.43 2.41 1.01 0.51 -4.85 121.20 121.20 1x2t s ILE 59 Ca -0.02 -3.99 0.08 0.00 0.00 0.00 0.00 60.65 56.72 1x2t s ILE 59 Cb 0.03 -2.89 0.01 0.00 0.01 0.00 0.00 42.46 39.63 1x2t s ILE 59 CO 0.25 -0.94 0.56 -1.10 0.00 0.00 0.00 174.94 173.70 1x2t s GLN 60 N -1.10 2.77 -1.37 2.79 -0.21 -1.26 -4.67 119.66 116.59 1x2t s GLN 60 Ca 0.22 -1.30 -0.10 0.00 0.02 0.00 0.00 55.36 54.20 1x2t s GLN 60 Cb -0.11 -2.71 0.01 0.00 1.00 0.00 0.00 33.01 31.20 1x2t s GLN 60 CO -0.11 -0.30 0.39 0.09 -2.12 0.00 0.00 175.29 173.24 1x2t n ASN 61 N -1.84 -1.40 -3.82 5.90 5.03 -1.26 -4.97 115.26 112.91 1x2t n ASN 61 Ca 0.08 -1.16 -0.12 0.00 0.87 0.00 0.00 54.58 54.24 1x2t n ASN 61 Cb 0.59 -2.33 -0.12 0.00 -1.02 0.00 0.00 39.78 36.91 1x2t n ASN 61 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.26 175.71 1x2t s THR 62 N -3.94 0.01 -1.81 3.41 -1.32 -1.26 -5.02 115.64 105.72 1x2t s THR 62 Ca 0.17 -0.12 0.18 0.00 -1.21 0.00 0.00 61.69 60.71 1x2t s THR 62 Cb -0.08 -0.30 0.35 0.00 -1.51 0.00 0.00 72.50 70.95 1x2t s THR 62 CO 0.94 -0.07 1.27 0.29 -2.21 0.00 0.00 174.62 174.84 1x2t n LYS 63 N 2.69 2.25 -1.87 7.08 5.02 -1.26 -4.86 118.16 127.22 1x2t n LYS 63 Ca -0.14 -2.05 -0.30 0.00 -2.02 0.00 0.00 58.31 53.80 1x2t n LYS 63 Cb 0.58 -1.40 0.05 0.00 -0.02 0.00 0.00 35.03 34.24 1x2t n LYS 63 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1x2t s SER 64 N -1.21 5.38 0.56 4.39 0.01 -1.26 -4.94 113.70 116.63 1x2t s SER 64 Ca 0.31 1.13 -0.06 0.00 1.31 0.00 0.00 55.95 58.63 1x2t s SER 64 Cb 0.18 -1.91 -0.01 0.00 0.21 0.00 0.00 66.02 64.49 1x2t s SER 64 CO 0.24 -1.39 0.87 -0.31 0.41 0.00 0.00 173.24 173.07 1x2t s TYR 65 N -3.36 3.36 -0.23 2.43 2.02 -1.26 -4.72 117.35 115.59 1x2t s TYR 65 Ca 0.58 0.72 0.00 0.00 -0.37 0.00 0.00 57.07 58.01 1x2t s TYR 65 Cb -0.11 -2.61 0.03 0.00 -0.40 0.00 0.00 41.96 38.87 1x2t s TYR 65 CO 0.52 -0.65 -0.11 0.08 -1.57 0.00 0.00 175.55 173.81 1x2t s VAL 66 N -2.92 2.51 0.36 0.71 1.01 -0.31 -3.35 120.40 118.40 1x2t s VAL 66 Ca 0.52 -1.13 -0.28 0.00 0.00 0.00 0.00 61.98 61.09 1x2t s VAL 66 Cb -0.10 -2.26 -0.12 0.00 0.00 0.00 0.00 36.38 33.90 1x2t s VAL 66 CO 0.45 0.24 1.40 0.79 0.00 0.00 0.00 175.10 177.99 1x2t n TRP 67 N 4.61 2.68 -4.47 5.22 5.03 -0.45 -0.39 117.44 129.66 1x2t n TRP 67 Ca -0.17 0.49 -0.23 0.00 3.03 0.00 0.00 57.50 60.62 1x2t n TRP 67 Cb 0.47 -2.48 -0.10 0.00 -1.03 0.00 0.00 31.31 28.16 1x2t n TRP 67 CO 0.00 0.00 0.00 0.96 -0.03 0.00 0.00 177.69 178.62 1x2t s ILE 68 N -1.08 1.79 -2.00 -0.99 -4.36 -1.06 -3.79 121.20 109.71 1x2t s ILE 68 Ca 0.54 -2.14 0.16 0.00 -0.26 0.00 0.00 60.65 58.95 1x2t s ILE 68 Cb -0.52 -2.53 0.45 0.00 1.25 0.00 0.00 42.46 41.11 1x2t s ILE 68 CO 0.63 -0.25 1.57 0.61 0.24 0.00 0.00 174.94 177.74 1x2t n GLY 69 N -0.65 -0.95 3.64 6.27 0.00 0.11 -4.70 105.19 108.92 1x2t n GLY 69 Ca -0.05 -0.10 -0.39 0.00 0.00 0.00 0.00 46.02 45.48 1x2t n GLY 69 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1x2t s LEU 70 N -1.52 4.10 0.26 0.99 2.96 -1.26 -4.98 118.68 119.23 1x2t s LEU 70 Ca 0.24 0.43 -0.19 0.00 -0.22 0.00 0.00 54.13 54.39 1x2t s LEU 70 Cb 0.11 -2.49 0.02 0.00 0.50 0.00 0.00 46.19 44.33 1x2t s LEU 70 CO 0.18 -0.13 0.63 0.00 -1.32 0.00 0.00 176.35 175.72 1x2t s ARG 71 N 1.65 1.67 -0.00 1.98 1.70 -1.26 -3.25 118.95 121.44 1x2t s ARG 71 Ca 0.18 -1.03 -0.30 0.00 -0.47 0.00 0.00 55.73 54.11 1x2t s ARG 71 Cb -0.15 0.56 -0.05 0.00 -0.57 0.00 0.00 34.95 34.74 1x2t s ARG 71 CO 0.09 -0.74 1.37 0.08 -1.08 0.00 0.00 175.30 175.02 1x2t s VAL 72 N -3.93 3.77 -1.40 4.99 1.01 -0.73 -4.89 120.40 119.21 1x2t s VAL 72 Ca 0.13 1.15 -0.13 0.00 0.00 0.00 0.00 61.98 63.13 1x2t s VAL 72 Cb -0.04 -3.74 -0.02 0.00 0.00 0.00 0.00 36.38 32.58 1x2t s VAL 72 CO 0.06 0.00 2.40 0.00 0.00 0.00 0.00 175.10 177.56 1x2t n GLN 73 N 5.28 2.90 0.00 2.72 1.13 -1.26 -4.77 117.38 123.39 1x2t n GLN 73 Ca 0.13 -2.34 0.00 0.00 -1.94 0.00 0.00 57.00 52.85 1x2t n GLN 73 Cb 0.44 -3.06 0.00 0.00 0.11 0.00 0.00 30.24 27.73 1x2t n GLN 73 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1x2t n GLY 74 N 3.98 0.43 1.07 1.08 0.00 -1.26 -5.02 105.19 105.47 1x2t n GLY 74 Ca 0.59 -0.98 0.10 0.00 0.00 0.00 0.00 46.02 45.73 1x2t n GLY 74 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1x2t n LYS 75 N -0.36 2.58 -1.61 1.61 5.02 -1.26 -5.01 118.16 119.12 1x2t n LYS 75 Ca 0.00 -2.32 -0.36 0.00 -2.02 0.00 0.00 58.31 53.60 1x2t n LYS 75 Cb 0.00 -1.46 0.08 0.00 -0.02 0.00 0.00 35.03 33.63 1x2t n LYS 75 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 1x2t n GLU 76 N 1.26 0.94 0.08 1.97 0.00 -1.26 -4.94 120.64 118.69 1x2t n GLU 76 Ca 0.19 0.38 -0.11 0.00 0.00 0.00 0.00 57.16 57.62 1x2t n GLU 76 Cb 0.55 -2.51 -0.13 0.00 0.00 0.00 0.00 31.44 29.34 1x2t n GLU 76 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.13 178.00 1x2t h LYS 77 N 0.26 0.13 -3.34 3.44 1.79 -1.99 -3.48 116.57 113.38 1x2t h LYS 77 Ca -0.50 -0.22 -0.00 0.00 -2.18 0.00 0.00 60.65 57.74 1x2t h LYS 77 Cb 1.33 0.08 -0.08 0.00 -1.58 0.00 0.00 32.23 31.99 1x2t h LYS 77 CO 0.52 1.09 0.04 1.14 -1.08 0.00 0.00 179.45 181.16 1x2t s GLN 78 N -2.68 1.59 0.00 3.15 -2.07 -1.26 -4.81 119.66 113.58 1x2t s GLN 78 Ca -0.02 -1.07 0.00 0.00 -1.82 0.00 0.00 55.36 52.45 1x2t s GLN 78 Cb 0.09 0.53 0.00 0.00 -1.09 0.00 0.00 33.01 32.54 1x2t s GLN 78 CO 0.85 -0.69 0.65 0.00 -1.32 0.00 0.00 175.29 174.78 1x2t s SER 80 N -0.42 6.88 0.23 0.00 1.04 -1.26 -4.94 113.70 115.22 1x2t s SER 80 Ca 0.00 1.09 0.24 0.00 0.48 0.00 0.00 55.95 57.76 1x2t s SER 80 Cb 0.00 -2.45 0.40 0.00 0.10 0.00 0.00 66.02 64.07 1x2t s SER 80 CO 0.00 -0.51 1.45 -1.28 0.98 0.00 0.00 173.24 173.88 1x2t h SER 81 N 7.59 0.00 -4.74 7.02 0.87 -1.97 -3.46 113.55 118.85 1x2t h SER 81 Ca -0.24 -0.07 -0.27 0.00 -1.23 0.00 0.00 61.79 59.98 1x2t h SER 81 Cb 1.10 0.00 -0.21 0.00 -0.44 0.00 0.00 62.40 62.85 1x2t h SER 81 CO 0.87 0.03 -0.73 -1.61 -0.53 0.00 0.00 176.83 174.87 1x2t s GLU 82 N -3.20 0.57 0.73 2.24 2.02 -1.26 -1.89 118.70 117.91 1x2t s GLU 82 Ca 0.06 -0.82 -0.11 0.00 0.02 0.00 0.00 54.97 54.12 1x2t s GLU 82 Cb 0.10 -0.30 0.03 0.00 0.10 0.00 0.00 34.13 34.07 1x2t s GLU 82 CO 0.69 0.05 1.09 -1.58 0.02 0.00 0.00 175.26 175.53 1x2t s TRP 83 N -1.60 3.14 0.08 1.61 0.52 -0.03 -4.91 118.94 117.75 1x2t s TRP 83 Ca -0.08 1.13 0.32 0.00 0.02 0.00 0.00 56.10 57.49 1x2t s TRP 83 Cb -0.08 -3.05 1.57 0.00 -1.15 0.00 0.00 33.47 30.76 1x2t s TRP 83 CO -0.00 -1.38 1.96 0.66 0.02 0.00 0.00 176.95 178.21 1x2t h SER 84 N -0.80 0.00 -0.08 2.95 4.64 -2.01 -1.04 113.55 117.20 1x2t h SER 84 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1x2t h SER 84 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1x2t h SER 84 CO 0.61 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.67 1x2t n ASP 85 N -2.67 0.88 0.00 4.97 5.68 -1.26 -4.91 116.55 119.24 1x2t n ASP 85 Ca -0.01 -1.57 0.00 0.00 -0.50 0.00 0.00 54.79 52.71 1x2t n ASP 85 Cb 0.14 -0.05 0.00 0.00 -1.14 0.00 0.00 41.12 40.06 1x2t n ASP 85 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1x2t n GLY 86 N 0.97 1.18 3.85 6.12 0.00 -0.40 -5.05 105.19 111.85 1x2t n GLY 86 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 1x2t n GLY 86 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x2t s SER 87 N -2.82 6.65 0.40 1.61 1.04 -1.26 -4.79 113.70 114.53 1x2t s SER 87 Ca 0.00 1.49 -0.24 0.00 0.48 0.00 0.00 55.95 57.68 1x2t s SER 87 Cb 0.00 -2.47 -0.09 0.00 0.10 0.00 0.00 66.02 63.56 1x2t s SER 87 CO 0.00 -0.51 1.05 -0.44 0.98 0.00 0.00 173.24 174.33 1x2t s SER 88 N -2.94 6.73 -0.08 7.02 0.01 -1.26 -0.85 113.70 122.34 1x2t s SER 88 Ca 0.58 2.05 -0.27 0.00 1.31 0.00 0.00 55.95 59.62 1x2t s SER 88 Cb -0.10 -2.59 -0.02 0.00 0.21 0.00 0.00 66.02 63.52 1x2t s SER 88 CO 0.28 -0.51 0.87 -0.69 0.41 0.00 0.00 173.24 173.61 1x2t s VAL 89 N -1.66 4.91 0.00 3.43 1.01 -0.79 -4.80 120.40 122.50 1x2t s VAL 89 Ca 0.58 1.79 0.00 0.00 0.00 0.00 0.00 61.98 64.35 1x2t s VAL 89 Cb -0.22 -4.20 0.00 0.00 0.00 0.00 0.00 36.38 31.96 1x2t s VAL 89 CO 0.28 0.13 0.00 -0.24 0.00 0.00 0.00 175.10 175.26 1x2t n SER 90 N 4.38 0.00 -4.75 3.32 2.88 -1.26 -5.00 113.62 113.19 1x2t n SER 90 Ca 0.04 0.00 -0.41 0.00 -1.33 0.00 0.00 58.87 57.17 1x2t n SER 90 Cb 0.50 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.94 1x2t n SER 90 CO 0.00 0.00 0.00 -0.47 -1.23 0.00 0.00 175.04 173.34 1x2t s TYR 91 N -0.75 3.12 0.03 0.66 5.04 -1.26 -5.02 117.35 119.17 1x2t s TYR 91 Ca 0.00 1.18 -0.01 0.00 -2.44 0.00 0.00 57.07 55.79 1x2t s TYR 91 Cb 0.00 -3.71 -0.02 0.00 0.35 0.00 0.00 41.96 38.58 1x2t s TYR 91 CO 0.00 -2.20 -0.01 -1.21 -1.34 0.00 0.00 175.55 170.79 1x2t s GLU 92 N -0.53 0.40 -0.38 4.97 2.02 -1.26 -5.10 118.70 118.83 1x2t s GLU 92 Ca 0.56 -0.73 0.12 0.00 0.02 0.00 0.00 54.97 54.94 1x2t s GLU 92 Cb -0.39 0.15 0.39 0.00 0.10 0.00 0.00 34.13 34.37 1x2t s GLU 92 CO 0.43 -0.07 1.02 -1.71 0.02 0.00 0.00 175.26 174.94 1x2t n ASN 93 N 1.22 -0.19 -4.78 -0.19 5.15 -1.26 -5.13 115.26 110.08 1x2t n ASN 93 Ca -0.21 -2.92 -0.35 0.00 -0.60 0.00 0.00 54.58 50.50 1x2t n ASN 93 Cb 0.57 0.26 -0.01 0.00 -0.53 0.00 0.00 39.78 40.06 1x2t n ASN 93 CO 0.00 0.00 0.00 0.26 1.40 0.00 0.00 177.26 178.92 1x2t s TRP 94 N -1.55 2.79 -0.08 1.20 0.52 -1.26 -5.02 118.94 115.54 1x2t s TRP 94 Ca 0.28 1.56 -0.20 0.00 0.02 0.00 0.00 56.10 57.76 1x2t s TRP 94 Cb 0.39 -3.20 -0.04 0.00 -1.15 0.00 0.00 33.47 29.46 1x2t s TRP 94 CO -0.04 -1.30 0.57 0.42 0.02 0.00 0.00 176.95 176.63 1x2t s ILE 95 N -1.87 5.09 0.19 2.03 1.01 -1.26 -4.97 121.20 121.43 1x2t s ILE 95 Ca 0.71 1.17 -0.18 0.00 0.00 0.00 0.00 60.65 62.35 1x2t s ILE 95 Cb -0.21 -3.91 0.16 0.00 0.01 0.00 0.00 42.46 38.51 1x2t s ILE 95 CO 0.25 0.32 1.61 -0.33 0.00 0.00 0.00 174.94 176.78 1x2t h GLU 96 N 6.51 -0.11 0.00 2.79 4.39 -1.96 0.44 114.58 126.65 1x2t h GLU 96 Ca -0.42 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.29 1x2t h GLU 96 Cb 1.19 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.86 1x2t h GLU 96 CO 0.74 -0.07 0.00 0.00 -1.16 0.00 0.00 179.01 178.52 1x2t n ALA 97 N -3.08 1.20 0.48 3.43 0.00 -1.26 -1.83 120.51 119.45 1x2t n ALA 97 Ca 0.05 0.09 0.12 0.00 0.00 0.00 0.00 53.44 53.70 1x2t n ALA 97 Cb 0.34 -1.22 0.19 0.00 0.00 0.00 0.00 19.45 18.76 1x2t n ALA 97 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1x2t h GLU 98 N 0.00 0.00 -5.43 0.00 4.39 -1.30 -3.41 114.58 108.83 1x2t h GLU 98 Ca 0.00 0.00 -0.64 0.00 0.34 0.00 0.00 59.36 59.06 1x2t h GLU 98 Cb 0.09 0.00 -0.15 0.00 -0.10 0.00 0.00 28.75 28.59 1x2t h GLU 98 CO 0.00 0.00 0.47 0.45 -1.16 0.00 0.00 179.01 178.77 1x2t s SER 99 N -4.63 6.22 -0.96 1.42 0.15 -0.76 -4.96 113.70 110.18 1x2t s SER 99 Ca 0.06 -0.87 -0.09 0.00 0.70 0.00 0.00 55.95 55.76 1x2t s SER 99 Cb 0.12 -2.40 0.24 0.00 -1.71 0.00 0.00 66.02 62.27 1x2t s SER 99 CO 0.71 -1.31 0.91 -0.54 1.20 0.00 0.00 173.24 174.20 1x2t s LYS 100 N 3.79 3.74 -0.10 5.44 1.02 -1.26 -4.35 119.74 128.02 1x2t s LYS 100 Ca 0.22 -2.98 0.16 0.00 0.02 0.00 0.00 55.97 53.39 1x2t s LYS 100 Cb -0.17 -4.35 0.55 0.00 -0.52 0.00 0.00 37.83 33.35 1x2t s LYS 100 CO 0.12 -1.25 1.47 0.25 -0.92 0.00 0.00 175.35 175.02 1x2t n THR 101 N 3.03 1.73 -4.51 2.17 -2.24 -1.20 -4.19 114.28 109.07 1x2t n THR 101 Ca 0.19 -1.33 -0.25 0.00 -2.27 0.00 0.00 64.05 60.39 1x2t n THR 101 Cb 0.41 0.13 -0.10 0.00 -2.10 0.00 0.00 70.33 68.66 1x2t n THR 101 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1x2t s LEU 103 N -3.57 2.27 0.10 0.00 1.43 -1.20 -0.66 118.68 117.05 1x2t s LEU 103 Ca 0.32 -0.65 -0.09 0.00 -1.03 0.00 0.00 54.13 52.67 1x2t s LEU 103 Cb 0.02 -0.94 -0.00 0.00 0.03 0.00 0.00 46.19 45.30 1x2t s LEU 103 CO 0.15 0.09 0.21 -0.83 0.23 0.00 0.00 176.35 176.21 1x2t s GLY 104 N -1.75 0.11 0.20 -3.19 0.00 -0.71 -2.56 107.32 99.42 1x2t s GLY 104 Ca 0.07 -0.62 -0.06 0.00 0.00 0.00 0.00 44.72 44.11 1x2t s GLY 104 CO 0.04 -0.78 0.47 1.08 0.00 0.00 0.00 173.10 173.90 1x2t s LEU 105 N -2.87 4.20 0.03 0.66 1.43 0.47 -0.80 118.68 121.80 1x2t s LEU 105 Ca 0.06 0.73 0.03 0.00 -1.03 0.00 0.00 54.13 53.92 1x2t s LEU 105 Cb 0.05 -3.48 -0.02 0.00 0.03 0.00 0.00 46.19 42.77 1x2t s LEU 105 CO -0.10 -0.04 -0.11 -1.83 0.23 0.00 0.00 176.35 174.51 1x2t s GLU 106 N -2.88 0.71 0.20 1.70 -1.05 -1.26 -1.17 118.70 114.96 1x2t s GLU 106 Ca 0.44 -0.66 -0.11 0.00 -0.15 0.00 0.00 54.97 54.49 1x2t s GLU 106 Cb -0.11 -0.64 0.20 0.00 -0.44 0.00 0.00 34.13 33.14 1x2t s GLU 106 CO 0.24 0.15 1.79 -0.22 0.95 0.00 0.00 175.26 178.18 1x2t h LYS 107 N 4.98 0.58 -0.17 -4.83 3.64 -1.89 0.13 116.57 119.00 1x2t h LYS 107 Ca -0.36 -0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.04 1x2t h LYS 107 Cb 1.19 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.87 1x2t h LYS 107 CO 0.44 0.38 0.21 0.93 -2.27 0.00 0.00 179.45 179.14 1x2t h GLU 108 N 0.59 0.00 -0.40 1.90 3.07 -1.97 -0.99 114.58 116.78 1x2t h GLU 108 Ca 0.27 0.00 -0.23 0.00 -0.50 0.00 0.00 59.36 58.90 1x2t h GLU 108 Cb 0.18 0.00 -0.14 0.00 -0.84 0.00 0.00 28.75 27.95 1x2t h GLU 108 CO -0.18 0.00 -0.12 0.25 -1.40 0.00 0.00 179.01 177.56 1x2t n THR 109 N -3.66 2.59 -1.78 1.13 -2.24 -1.00 -4.94 114.28 104.39 1x2t n THR 109 Ca 0.01 -2.92 -0.21 0.00 -2.27 0.00 0.00 64.05 58.67 1x2t n THR 109 Cb 0.33 -0.42 -0.07 0.00 -2.10 0.00 0.00 70.33 68.07 1x2t n THR 109 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1x2t n GLY 110 N -1.09 1.42 2.40 3.38 0.00 -0.38 -1.87 105.19 109.06 1x2t n GLY 110 Ca 0.35 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.19 1x2t n GLY 110 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1x2t n PHE 111 N -2.73 -0.94 0.30 1.61 3.72 -0.00 -4.83 117.46 114.59 1x2t n PHE 111 Ca -0.22 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.22 1x2t n PHE 111 Cb 0.68 -3.44 -0.02 0.00 -0.94 0.00 0.00 39.48 35.76 1x2t n PHE 111 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1x2t n ARG 112 N -2.77 3.83 -4.77 -1.08 1.74 -0.78 -4.38 116.66 108.44 1x2t n ARG 112 Ca -0.20 -0.20 -0.32 0.00 -0.77 0.00 0.00 57.85 56.36 1x2t n ARG 112 Cb 0.64 -0.87 -0.13 0.00 -1.02 0.00 0.00 32.46 31.08 1x2t n ARG 112 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1x2t s LYS 113 N -1.38 2.26 -0.35 5.56 -0.14 -1.24 -5.09 119.74 119.35 1x2t s LYS 113 Ca 0.04 -0.86 -0.21 0.00 -1.36 0.00 0.00 55.97 53.57 1x2t s LYS 113 Cb 0.05 -2.26 0.00 0.00 -1.68 0.00 0.00 37.83 33.94 1x2t s LYS 113 CO 0.22 0.57 0.68 -1.58 -0.76 0.00 0.00 175.35 174.49 1x2t s TRP 114 N -0.84 3.15 -0.16 3.18 0.51 -1.26 -4.22 118.94 119.29 1x2t s TRP 114 Ca 0.13 0.45 -0.11 0.00 -2.12 0.00 0.00 56.10 54.46 1x2t s TRP 114 Cb -0.11 -3.20 -0.05 0.00 -0.81 0.00 0.00 33.47 29.31 1x2t s TRP 114 CO 0.03 -0.64 0.19 0.08 -0.51 0.00 0.00 176.95 176.11 1x2t s VAL 115 N 2.82 5.38 -0.04 4.03 1.01 0.02 -4.87 120.40 128.75 1x2t s VAL 115 Ca 0.27 0.33 -0.30 0.00 0.00 0.00 0.00 61.98 62.28 1x2t s VAL 115 Cb -0.14 -3.51 -0.04 0.00 0.00 0.00 0.00 36.38 32.68 1x2t s VAL 115 CO 0.15 0.48 1.37 0.20 0.00 0.00 0.00 175.10 177.30 1x2t s ASN 116 N -0.03 6.88 0.04 3.32 -0.87 -1.26 -1.74 114.94 121.28 1x2t s ASN 116 Ca 0.13 2.01 -0.04 0.00 -1.57 0.00 0.00 52.86 53.38 1x2t s ASN 116 Cb -0.12 -2.55 -0.02 0.00 -0.02 0.00 0.00 41.25 38.54 1x2t s ASN 116 CO 0.02 -0.73 0.06 0.27 -2.57 0.00 0.00 177.10 174.16 1x2t s ILE 117 N 2.73 0.15 0.04 0.60 -4.36 0.16 -4.93 121.20 115.60 1x2t s ILE 117 Ca 0.62 -1.24 -0.30 0.00 -0.26 0.00 0.00 60.65 59.47 1x2t s ILE 117 Cb -0.29 -1.01 -0.08 0.00 1.25 0.00 0.00 42.46 42.33 1x2t s ILE 117 CO 0.24 -0.68 1.78 -0.47 0.24 0.00 0.00 174.94 176.04 1x2t s TYR 118 N -2.89 1.93 0.66 1.37 5.04 -1.26 -1.93 117.35 120.28 1x2t s TYR 118 Ca -0.03 -0.00 0.39 0.00 -2.44 0.00 0.00 57.07 54.99 1x2t s TYR 118 Cb 0.00 -4.08 2.12 0.00 0.35 0.00 0.00 41.96 40.36 1x2t s TYR 118 CO -0.06 -4.55 2.20 0.00 -1.34 0.00 0.00 175.55 171.80 1x2t n GLY 120 N -1.15 -1.09 3.77 0.00 0.00 -1.26 -2.25 105.19 103.22 1x2t n GLY 120 Ca -0.02 -0.20 -0.36 0.00 0.00 0.00 0.00 46.02 45.44 1x2t n GLY 120 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1x2t s GLN 121 N -2.42 3.59 -0.39 1.61 -0.21 -0.52 -4.80 119.66 116.51 1x2t s GLN 121 Ca 0.32 1.65 -0.13 0.00 0.02 0.00 0.00 55.36 57.22 1x2t s GLN 121 Cb 0.21 -2.20 0.02 0.00 1.00 0.00 0.00 33.01 32.03 1x2t s GLN 121 CO 0.45 -0.66 0.26 -0.65 -2.12 0.00 0.00 175.29 172.57 1x2t s GLN 122 N -3.00 2.97 0.15 2.91 -0.21 -1.26 -3.80 119.66 117.42 1x2t s GLN 122 Ca 0.68 -1.01 0.02 0.00 0.02 0.00 0.00 55.36 55.08 1x2t s GLN 122 Cb -0.25 -3.88 -0.04 0.00 1.00 0.00 0.00 33.01 29.83 1x2t s GLN 122 CO 0.30 -0.71 -0.03 -0.80 -2.12 0.00 0.00 175.29 171.93 1x2t s ASN 123 N 1.64 1.32 1.12 5.90 0.01 -0.30 -4.57 114.94 120.06 1x2t s ASN 123 Ca 0.04 -1.10 -0.18 0.00 -0.71 0.00 0.00 52.86 50.91 1x2t s ASN 123 Cb -0.19 0.09 0.25 0.00 0.41 0.00 0.00 41.25 41.81 1x2t s ASN 123 CO 0.09 -0.50 1.16 -2.16 -1.51 0.00 0.00 177.10 174.18 1x2t s PRO 124 N -3.86 -0.54 0.28 -0.60 0.04 -1.21 -2.16 135.00 126.95 1x2t s PRO 124 Ca 0.20 -0.10 -0.19 0.00 0.04 0.00 0.00 61.00 60.95 1x2t s PRO 124 Cb 0.05 -1.68 0.07 0.00 0.04 0.00 0.00 34.50 32.98 1x2t s PRO 124 CO 0.01 -3.25 0.93 -0.59 0.04 0.00 0.00 177.00 174.14 1x2t s PHE 125 N -3.24 0.11 -0.05 0.56 -0.71 -0.90 -1.34 117.98 112.40 1x2t s PHE 125 Ca 0.71 -0.64 0.02 0.00 -1.04 0.00 0.00 56.93 55.98 1x2t s PHE 125 Cb -0.09 0.77 0.01 0.00 -1.21 0.00 0.00 43.02 42.50 1x2t s PHE 125 CO 0.55 -1.24 -0.09 0.08 -1.34 0.00 0.00 175.22 173.18 1x2t s VAL 126 N -2.17 0.88 0.17 -2.49 1.01 -1.25 -0.41 120.40 116.15 1x2t s VAL 126 Ca 0.19 -0.36 0.04 0.00 0.00 0.00 0.00 61.98 61.85 1x2t s VAL 126 Cb -0.04 -0.81 -0.03 0.00 0.00 0.00 0.00 36.38 35.49 1x2t s VAL 126 CO 0.08 0.29 0.26 0.00 0.00 0.00 0.00 175.10 175.73 1x2t s GLU 128 N -3.36 0.18 0.00 0.00 2.12 0.38 -1.52 118.70 116.50 1x2t s GLU 128 Ca 0.34 0.08 0.00 0.00 0.36 0.00 0.00 54.97 55.74 1x2t s GLU 128 Cb -0.10 0.08 0.00 0.00 0.26 0.00 0.00 34.13 34.37 1x2t s GLU 128 CO 0.27 -0.03 0.00 0.00 -0.54 0.00 0.00 175.26 174.96