#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j03 s ARG 3 N 0.00 3.09 -0.73 -0.52 3.52 -1.26 -5.02 118.95 118.03 2j03 s ARG 3 Ca 0.00 -0.77 -0.24 0.00 -0.13 0.00 0.00 55.73 54.59 2j03 s ARG 3 Cb 0.00 -3.97 0.06 0.00 -1.56 0.00 0.00 34.95 29.48 2j03 s ARG 3 CO 0.00 -0.86 1.13 0.00 -0.81 0.00 0.00 175.30 174.75 2j03 s ALA 4 N 2.14 2.97 0.79 6.12 0.00 -1.26 -5.02 121.76 127.51 2j03 s ALA 4 Ca 0.12 -1.77 -0.11 0.00 0.00 0.00 0.00 51.96 50.19 2j03 s ALA 4 Cb -0.17 -4.07 0.07 0.00 0.00 0.00 0.00 23.12 18.95 2j03 s ALA 4 CO 0.13 -3.04 1.12 0.15 0.00 0.00 0.00 175.76 174.12 2j03 s LYS 5 N 4.63 2.00 0.25 0.00 1.02 -1.26 -4.91 119.74 121.47 2j03 s LYS 5 Ca 0.29 1.33 -0.02 0.00 0.02 0.00 0.00 55.97 57.59 2j03 s LYS 5 Cb -0.12 -1.86 0.29 0.00 -0.52 0.00 0.00 37.83 35.63 2j03 s LYS 5 CO 0.09 -1.86 1.71 1.15 -0.92 0.00 0.00 175.35 175.52 2j03 h THR 6 N -1.12 1.25 0.00 2.17 2.02 -2.05 -3.45 112.91 111.73 2j03 h THR 6 Ca -0.44 -1.13 0.00 0.00 0.77 0.00 0.00 66.41 65.61 2j03 h THR 6 Cb 1.25 1.03 0.00 0.00 -1.74 0.00 0.00 68.15 68.68 2j03 h THR 6 CO 0.49 0.39 0.00 0.61 0.37 0.00 0.00 175.52 177.38 2j03 n GLY 7 N -0.48 0.34 0.60 2.16 0.00 -1.26 -3.44 105.19 103.10 2j03 n GLY 7 Ca 0.01 0.58 -0.04 0.00 0.00 0.00 0.00 46.02 46.58 2j03 n GLY 7 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2j03 n VAL 8 N 0.00 1.21 0.00 1.61 0.31 -1.26 -4.89 118.33 115.31 2j03 n VAL 8 Ca 0.00 0.28 0.00 0.00 -0.01 0.00 0.00 64.34 64.61 2j03 n VAL 8 Cb 0.00 -1.87 0.00 0.00 -0.91 0.00 0.00 33.84 31.06 2j03 n VAL 8 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 2j03 n VAL 9 N -3.79 0.00 -0.08 2.52 0.31 -1.22 -0.51 118.33 115.56 2j03 n VAL 9 Ca -0.06 0.00 -0.06 0.00 -0.01 0.00 0.00 64.34 64.21 2j03 n VAL 9 Cb 0.21 0.00 -0.05 0.00 -0.91 0.00 0.00 33.84 33.10 2j03 n VAL 9 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 2j03 h ARG 10 N 0.00 -0.16 -0.73 5.55 2.43 -1.91 0.14 114.38 119.70 2j03 h ARG 10 Ca 0.00 0.01 0.11 0.00 -0.81 0.00 0.00 59.98 59.29 2j03 h ARG 10 Cb 0.00 0.04 -0.12 0.00 -0.42 0.00 0.00 29.97 29.47 2j03 h ARG 10 CO 0.00 -0.11 -0.29 -2.13 -1.51 0.00 0.00 179.97 175.93 2j03 n ARG 11 N -3.96 -0.18 0.42 0.20 0.63 0.33 0.13 116.66 114.24 2j03 n ARG 11 Ca -0.01 1.13 -0.19 0.00 -0.92 0.00 0.00 57.85 57.85 2j03 n ARG 11 Cb 0.16 -1.67 -0.10 0.00 0.45 0.00 0.00 32.46 31.30 2j03 n ARG 11 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2j03 h ARG 12 N 0.00 -1.11 -1.60 -0.14 3.08 -1.38 -0.21 114.38 113.02 2j03 h ARG 12 Ca 0.25 0.08 0.46 0.00 0.07 0.00 0.00 59.98 60.84 2j03 h ARG 12 Cb 0.43 0.25 -0.06 0.00 0.08 0.00 0.00 29.97 30.67 2j03 h ARG 12 CO -0.73 -0.74 1.32 1.63 -1.07 0.00 0.00 179.97 180.39 2j03 n LYS 13 N -5.60 0.01 -0.08 0.04 4.76 0.36 -0.56 118.16 117.08 2j03 n LYS 13 Ca -0.15 1.04 -0.22 0.00 -2.87 0.00 0.00 58.31 56.11 2j03 n LYS 13 Cb 0.48 -2.46 -0.12 0.00 -1.84 0.00 0.00 35.03 31.09 2j03 n LYS 13 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 2j03 n HIS 14 N -3.62 0.74 -0.32 2.13 8.25 -0.21 -3.90 115.22 118.29 2j03 n HIS 14 Ca 0.36 0.22 0.15 0.00 -0.26 0.00 0.00 57.72 58.19 2j03 n HIS 14 Cb 1.80 -1.09 0.34 0.00 1.12 0.00 0.00 29.99 32.16 2j03 n HIS 14 CO 0.00 0.00 0.00 1.57 0.64 0.00 0.00 176.34 178.55 2j03 h LYS 15 N -0.44 0.40 0.10 -0.41 2.10 0.97 0.74 116.57 120.03 2j03 h LYS 15 Ca -0.48 -0.02 -0.00 0.00 -2.00 0.00 0.00 60.65 58.15 2j03 h LYS 15 Cb 1.73 -0.09 -0.01 0.00 -0.90 0.00 0.00 32.23 32.95 2j03 h LYS 15 CO -0.12 0.27 -0.18 0.87 -2.00 0.00 0.00 179.45 178.29 2j03 h LYS 16 N 0.42 -0.29 -0.91 0.07 1.57 -1.57 0.46 116.57 116.33 2j03 h LYS 16 Ca 0.59 0.02 0.18 0.00 -1.87 0.00 0.00 60.65 59.57 2j03 h LYS 16 Cb 1.15 0.07 -0.07 0.00 0.08 0.00 0.00 32.23 33.45 2j03 h LYS 16 CO -0.53 -0.19 0.59 0.82 -0.57 0.00 0.00 179.45 179.56 2j03 h ILE 17 N -0.30 0.74 0.76 1.86 1.08 -1.43 -2.19 117.51 118.04 2j03 h ILE 17 Ca -0.01 -0.19 -0.04 0.00 -0.39 0.00 0.00 64.86 64.23 2j03 h ILE 17 Cb 0.28 0.13 0.01 0.00 -3.07 0.00 0.00 36.82 34.17 2j03 h ILE 17 CO -0.06 0.10 -0.36 -0.07 -0.69 0.00 0.00 178.15 177.07 2j03 h LEU 18 N 0.56 -0.86 -0.85 1.44 3.38 -0.21 -2.09 115.31 116.68 2j03 h LEU 18 Ca 0.47 0.03 0.08 0.00 0.09 0.00 0.00 57.88 58.55 2j03 h LEU 18 Cb 0.95 0.22 -0.10 0.00 0.09 0.00 0.00 40.66 41.82 2j03 h LEU 18 CO -0.21 -0.61 -0.50 0.29 0.09 0.00 0.00 178.44 177.50 2j03 n LYS 19 N -4.79 -0.38 -0.32 1.13 5.02 0.09 0.24 118.16 119.15 2j03 n LYS 19 Ca -0.13 1.31 0.29 0.00 -2.02 0.00 0.00 58.31 57.76 2j03 n LYS 19 Cb 0.40 -1.92 0.55 0.00 -0.02 0.00 0.00 35.03 34.04 2j03 n LYS 19 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 2j03 h LEU 20 N 0.00 0.29 -3.97 -0.35 -0.00 -1.24 0.14 115.31 110.18 2j03 h LEU 20 Ca 0.14 0.25 -0.59 0.00 -0.00 0.00 0.00 57.88 57.68 2j03 h LEU 20 Cb 0.35 0.27 -0.30 0.00 -0.00 0.00 0.00 40.66 40.98 2j03 h LEU 20 CO -0.80 -0.39 0.70 0.00 -0.00 0.00 0.00 178.44 177.95 2j03 n ALA 21 N -2.33 5.92 -1.84 1.53 0.00 0.66 -4.98 120.51 119.46 2j03 n ALA 21 Ca 0.36 -3.23 -0.38 0.00 0.00 0.00 0.00 53.44 50.18 2j03 n ALA 21 Cb 1.21 -1.56 -0.06 0.00 0.00 0.00 0.00 19.45 19.04 2j03 n ALA 21 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2j03 s LYS 22 N -3.58 4.65 0.00 0.00 -0.14 0.50 -3.59 119.74 117.58 2j03 s LYS 22 Ca 0.60 1.31 0.00 0.00 -1.36 0.00 0.00 55.97 56.53 2j03 s LYS 22 Cb 0.49 -3.06 0.00 0.00 -1.68 0.00 0.00 37.83 33.58 2j03 s LYS 22 CO 0.04 0.43 0.00 0.41 -0.76 0.00 0.00 175.35 175.47 2j03 n GLY 23 N 1.10 1.00 2.92 -3.33 0.00 -1.26 -5.05 105.19 100.57 2j03 n GLY 23 Ca -0.01 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.76 2j03 n GLY 23 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2j03 n TYR 24 N -2.00 -3.74 0.00 1.61 0.53 -1.24 -5.05 117.16 107.27 2j03 n TYR 24 Ca 0.00 -0.83 0.00 0.00 -1.02 0.00 0.00 57.90 56.05 2j03 n TYR 24 Cb 0.00 -0.96 0.00 0.00 -1.03 0.00 0.00 39.34 37.35 2j03 n TYR 24 CO 0.00 0.00 0.00 1.87 -1.02 0.00 0.00 176.86 177.71 2j03 n TRP 25 N -4.51 0.00 0.00 -0.72 -0.00 -1.26 -4.65 117.44 106.31 2j03 n TRP 25 Ca 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.63 2j03 n TRP 25 Cb 0.49 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.80 2j03 n TRP 25 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 2j03 n GLY 26 N 0.79 1.12 0.22 5.87 0.00 -1.26 -4.66 105.19 107.27 2j03 n GLY 26 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 2j03 n GLY 26 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2j03 h LEU 27 N 0.00 0.00 -1.95 0.99 3.38 -1.95 0.96 115.31 116.74 2j03 h LEU 27 Ca 0.00 0.00 0.22 0.00 0.09 0.00 0.00 57.88 58.19 2j03 h LEU 27 Cb 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 2j03 h LEU 27 CO 0.00 0.00 0.61 0.03 0.09 0.00 0.00 178.44 179.17 2j03 h ARG 28 N 0.00 0.00 -0.15 1.13 3.08 -1.85 0.15 114.38 116.74 2j03 h ARG 28 Ca 0.00 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.90 2j03 h ARG 28 Cb 0.58 0.00 -0.19 0.00 0.08 0.00 0.00 29.97 30.44 2j03 h ARG 28 CO 0.00 0.00 -0.72 -1.13 -1.07 0.00 0.00 179.97 177.05 2j03 n SER 29 N -4.04 2.05 0.00 7.04 3.41 0.33 -2.89 113.62 119.52 2j03 n SER 29 Ca 0.15 -3.31 0.00 0.00 -0.26 0.00 0.00 58.87 55.45 2j03 n SER 29 Cb 0.89 -0.44 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 2j03 n SER 29 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2j03 n LYS 30 N -0.64 0.22 -3.84 4.33 4.76 0.24 -4.87 118.16 118.36 2j03 n LYS 30 Ca 0.19 0.00 -0.36 0.00 -2.87 0.00 0.00 58.31 55.27 2j03 n LYS 30 Cb 0.85 -0.02 -0.13 0.00 -1.84 0.00 0.00 35.03 33.89 2j03 n LYS 30 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2j03 s SER 31 N 0.00 4.77 0.15 4.39 0.15 0.26 -4.95 113.70 118.48 2j03 s SER 31 Ca 0.00 -0.72 0.00 0.00 0.70 0.00 0.00 55.95 55.93 2j03 s SER 31 Cb 0.00 -1.79 0.00 0.00 -1.71 0.00 0.00 66.02 62.52 2j03 s SER 31 CO 0.00 -0.15 0.59 2.22 1.20 0.00 0.00 173.24 177.10 2j03 n PHE 32 N 4.79 0.00 0.00 3.44 -1.74 -1.26 0.31 117.46 123.00 2j03 n PHE 32 Ca -0.16 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.73 2j03 n PHE 32 Cb 0.48 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.48 2j03 n PHE 32 CO 0.00 0.00 0.00 2.89 -0.56 0.00 0.00 176.76 179.09 2j03 n ARG 33 N -1.31 1.11 -0.13 3.97 1.85 -1.26 -4.26 116.66 116.63 2j03 n ARG 33 Ca 0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 57.85 56.83 2j03 n ARG 33 Cb 0.59 -0.65 0.22 0.00 -1.05 0.00 0.00 32.46 31.57 2j03 n ARG 33 CO 0.00 0.00 0.00 0.87 -0.01 0.00 0.00 177.63 178.49 2j03 h LYS 34 N 0.00 0.83 0.53 2.89 1.79 -0.84 -1.72 116.57 120.05 2j03 h LYS 34 Ca 0.00 -0.14 -0.03 0.00 -2.18 0.00 0.00 60.65 58.30 2j03 h LYS 34 Cb 0.30 -0.14 0.01 0.00 -1.58 0.00 0.00 32.23 30.82 2j03 h LYS 34 CO 0.00 0.70 -0.26 0.00 -1.08 0.00 0.00 179.45 178.82 2j03 h ALA 35 N 1.40 -1.19 -0.04 3.86 0.00 -0.01 -2.93 119.26 120.37 2j03 h ALA 35 Ca 0.19 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2j03 h ALA 35 Cb 0.20 0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 2j03 h ALA 35 CO -0.01 -1.13 -0.02 -2.13 0.00 0.00 0.00 179.25 175.95 2j03 n ARG 36 N -3.94 -0.02 -0.31 0.00 0.63 -0.98 0.77 116.66 112.82 2j03 n ARG 36 Ca -0.09 0.73 0.23 0.00 -0.92 0.00 0.00 57.85 57.80 2j03 n ARG 36 Cb 0.28 -1.09 0.43 0.00 0.45 0.00 0.00 32.46 32.54 2j03 n ARG 36 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 2j03 n GLU 37 N -2.82 -0.06 0.37 -0.14 1.02 -0.68 -0.14 120.64 118.19 2j03 n GLU 37 Ca 0.00 1.34 -0.15 0.00 -0.02 0.00 0.00 57.16 58.33 2j03 n GLU 37 Cb 0.01 -2.29 -0.07 0.00 -0.02 0.00 0.00 31.44 29.07 2j03 n GLU 37 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 2j03 h THR 38 N 0.00 0.00 -0.14 2.62 2.02 0.56 -2.70 112.91 115.27 2j03 h THR 38 Ca 0.70 -0.28 0.04 0.00 0.77 0.00 0.00 66.41 67.64 2j03 h THR 38 Cb 1.71 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 68.11 2j03 h THR 38 CO -0.79 0.00 0.77 -0.07 0.37 0.00 0.00 175.52 175.80 2j03 h LEU 39 N -1.26 0.00 0.19 2.58 3.38 0.91 0.49 115.31 121.60 2j03 h LEU 39 Ca -0.10 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 2j03 h LEU 39 Cb 0.75 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.50 2j03 h LEU 39 CO 0.16 0.00 -0.09 -0.26 0.09 0.00 0.00 178.44 178.34 2j03 h PHE 40 N 0.00 -0.24 0.14 1.13 0.05 -1.00 -0.95 116.94 116.07 2j03 h PHE 40 Ca 0.07 -0.01 0.02 0.00 3.82 0.00 0.00 57.97 61.87 2j03 h PHE 40 Cb 1.61 0.08 -0.04 0.00 2.00 0.00 0.00 35.95 39.60 2j03 h PHE 40 CO 0.00 0.15 -0.30 0.00 -0.18 0.00 0.00 178.31 177.98 2j03 h ALA 41 N -0.45 -0.53 -1.49 2.45 0.00 -0.05 0.78 119.26 119.97 2j03 h ALA 41 Ca -0.03 -0.05 0.43 0.00 0.00 0.00 0.00 54.91 55.26 2j03 h ALA 41 Cb 0.50 0.48 -0.07 0.00 0.00 0.00 0.00 17.79 18.70 2j03 h ALA 41 CO 0.04 -0.85 1.06 0.00 0.00 0.00 0.00 179.25 179.50 2j03 h ALA 42 N 0.13 3.34 -2.45 0.00 0.00 -1.11 0.17 119.26 119.34 2j03 h ALA 42 Ca 0.02 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2j03 h ALA 42 Cb 0.55 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.46 2j03 h ALA 42 CO -0.16 -1.79 0.00 0.41 0.00 0.00 0.00 179.25 177.71 2j03 n GLY 43 N -1.80 -2.95 0.28 0.00 0.00 0.27 -2.21 105.19 98.78 2j03 n GLY 43 Ca 0.34 0.09 0.02 0.00 0.00 0.00 0.00 46.02 46.46 2j03 n GLY 43 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2j03 h ASN 44 N 0.00 0.53 -0.71 1.61 2.35 -1.26 -2.45 115.58 115.65 2j03 h ASN 44 Ca 0.00 0.06 0.07 0.00 -0.55 0.00 0.00 56.30 55.87 2j03 h ASN 44 Cb 0.00 -0.04 -0.10 0.00 0.05 0.00 0.00 38.32 38.24 2j03 h ASN 44 CO 0.00 0.30 -0.53 1.88 -1.65 0.00 0.00 177.43 177.43 2j03 h TYR 45 N 0.66 -1.68 0.35 1.19 0.99 -1.02 2.17 116.97 119.63 2j03 h TYR 45 Ca 0.37 0.10 -0.01 0.00 2.00 0.00 0.00 58.73 61.19 2j03 h TYR 45 Cb 0.37 0.82 -0.02 0.00 1.00 0.00 0.00 36.73 38.91 2j03 h TYR 45 CO -0.09 -0.38 -0.37 0.00 -0.00 0.00 0.00 178.16 177.31 2j03 h ALA 46 N 0.17 -1.03 -0.67 3.88 0.00 -1.02 0.44 119.26 121.02 2j03 h ALA 46 Ca 0.12 -0.14 0.14 0.00 0.00 0.00 0.00 54.91 55.03 2j03 h ALA 46 Cb 0.44 0.62 -0.13 0.00 0.00 0.00 0.00 17.79 18.72 2j03 h ALA 46 CO -0.74 -1.06 -0.16 -0.92 0.00 0.00 0.00 179.25 176.37 2j03 h TYR 47 N -0.72 -0.33 -0.30 0.00 3.20 -0.72 0.41 116.97 118.49 2j03 h TYR 47 Ca -0.04 0.06 -0.04 0.00 3.14 0.00 0.00 58.73 61.85 2j03 h TYR 47 Cb 0.63 0.25 -0.02 0.00 1.54 0.00 0.00 36.73 39.14 2j03 h TYR 47 CO -0.22 -0.28 0.02 0.00 -1.64 0.00 0.00 178.16 176.04 2j03 h ALA 48 N 1.67 1.48 -0.06 1.82 0.00 0.37 -3.07 119.26 121.47 2j03 h ALA 48 Ca 0.33 -0.16 -0.18 0.00 0.00 0.00 0.00 54.91 54.89 2j03 h ALA 48 Cb 0.50 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.17 2j03 h ALA 48 CO -0.69 0.38 -0.67 0.45 0.00 0.00 0.00 179.25 178.72 2j03 h HIS 49 N 0.44 0.79 -0.55 0.00 3.86 0.19 -2.56 115.15 117.32 2j03 h HIS 49 Ca 0.10 -0.39 0.16 0.00 -1.16 0.00 0.00 60.37 59.08 2j03 h HIS 49 Cb 0.26 -0.11 -0.02 0.00 1.06 0.00 0.00 27.41 28.60 2j03 h HIS 49 CO 0.01 1.20 0.49 0.00 0.86 0.00 0.00 177.93 180.49 2j03 h ARG 50 N 0.16 0.00 0.01 2.45 3.08 -0.60 1.27 114.38 120.75 2j03 h ARG 50 Ca -0.07 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 59.76 2j03 h ARG 50 Cb 1.34 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.38 2j03 h ARG 50 CO 0.14 0.00 -0.94 0.87 -1.07 0.00 0.00 179.97 178.97 2j03 h LYS 51 N 0.00 0.32 0.22 0.04 1.79 -1.50 -3.24 116.57 114.20 2j03 h LYS 51 Ca 0.26 -0.36 -0.01 0.00 -2.18 0.00 0.00 60.65 58.37 2j03 h LYS 51 Cb 1.24 0.10 0.00 0.00 -1.58 0.00 0.00 32.23 32.00 2j03 h LYS 51 CO -0.00 1.06 -0.10 0.00 -1.08 0.00 0.00 179.45 179.32 2j03 h ARG 52 N 0.17 -0.28 -0.89 3.15 2.47 0.16 -3.32 114.38 115.84 2j03 h ARG 52 Ca -0.07 0.02 0.24 0.00 -1.26 0.00 0.00 59.98 58.91 2j03 h ARG 52 Cb 1.58 0.06 -0.17 0.00 -1.65 0.00 0.00 29.97 29.79 2j03 h ARG 52 CO 0.15 0.04 -0.00 -2.13 0.56 0.00 0.00 179.97 178.59 2j03 n ARG 53 N -4.96 -0.07 0.04 0.04 0.63 0.24 0.12 116.66 112.70 2j03 n ARG 53 Ca -0.07 1.34 -0.04 0.00 -0.92 0.00 0.00 57.85 58.16 2j03 n ARG 53 Cb 0.23 -2.11 -0.02 0.00 0.45 0.00 0.00 32.46 31.00 2j03 n ARG 53 CO 0.00 0.00 0.00 0.87 -2.51 0.00 0.00 177.63 175.99 2j03 h LYS 54 N 0.00 -0.19 0.00 -0.14 1.57 -1.66 0.54 116.57 116.69 2j03 h LYS 54 Ca 0.53 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.32 2j03 h LYS 54 Cb 1.07 0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.42 2j03 h LYS 54 CO -0.84 -0.13 0.00 2.89 -0.57 0.00 0.00 179.45 180.80 2j03 n ARG 55 N -3.12 0.43 0.05 3.15 1.85 0.44 -2.56 116.66 116.91 2j03 n ARG 55 Ca -0.02 0.03 -0.11 0.00 -1.00 0.00 0.00 57.85 56.75 2j03 n ARG 55 Cb 0.10 -1.50 -0.08 0.00 -1.05 0.00 0.00 32.46 29.93 2j03 n ARG 55 CO 0.00 0.00 0.00 0.22 -0.01 0.00 0.00 177.63 177.84 2j03 h ASP 56 N 0.00 -0.17 0.36 2.89 1.82 0.32 -3.22 116.42 118.41 2j03 h ASP 56 Ca 0.00 -0.37 -0.08 0.00 -0.39 0.00 0.00 57.03 56.19 2j03 h ASP 56 Cb 0.02 0.04 -0.01 0.00 0.68 0.00 0.00 39.33 40.07 2j03 h ASP 56 CO 0.00 0.39 -0.39 -0.26 -1.61 0.00 0.00 179.24 177.37 2j03 h PHE 57 N -0.86 0.05 -0.35 0.28 -1.00 -1.07 -0.71 116.94 113.28 2j03 h PHE 57 Ca -0.02 -0.01 0.04 0.00 2.81 0.00 0.00 57.97 60.78 2j03 h PHE 57 Cb 0.53 -0.01 -0.05 0.00 3.61 0.00 0.00 35.95 40.02 2j03 h PHE 57 CO 0.09 0.42 -0.30 0.00 -1.61 0.00 0.00 178.31 176.91 2j03 h ARG 58 N 0.04 -0.11 0.30 1.51 3.08 -1.56 0.16 114.38 117.80 2j03 h ARG 58 Ca 0.00 0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 2j03 h ARG 58 Cb 0.70 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.76 2j03 h ARG 58 CO 0.05 -0.08 -0.27 0.00 -1.07 0.00 0.00 179.97 178.60 2j03 h ARG 59 N -0.12 -0.57 -0.62 0.04 3.08 -1.52 -2.12 114.38 112.55 2j03 h ARG 59 Ca 0.06 0.04 0.18 0.00 0.07 0.00 0.00 59.98 60.33 2j03 h ARG 59 Cb 0.27 0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.43 2j03 h ARG 59 CO -0.39 -0.38 1.02 -0.07 -1.07 0.00 0.00 179.97 179.08 2j03 h LEU 60 N -0.59 0.00 0.00 3.04 3.38 0.48 0.30 115.31 121.93 2j03 h LEU 60 Ca -0.02 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.83 2j03 h LEU 60 Cb 0.53 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 2j03 h LEU 60 CO -0.04 0.00 -0.97 0.79 0.09 0.00 0.00 178.44 178.31 2j03 n TRP 61 N -3.07 0.85 -0.29 1.13 8.01 0.40 -4.21 117.44 120.26 2j03 n TRP 61 Ca 0.14 0.37 0.07 0.00 -1.31 0.00 0.00 57.50 56.76 2j03 n TRP 61 Cb 1.22 -0.90 0.15 0.00 -2.01 0.00 0.00 31.31 29.76 2j03 n TRP 61 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.69 175.79 2j03 n ILE 62 N -4.51 -0.34 -0.12 -0.99 -0.00 0.07 0.16 119.36 113.62 2j03 n ILE 62 Ca -0.21 1.86 -0.13 0.00 -0.00 0.00 0.00 62.75 64.27 2j03 n ILE 62 Cb 0.49 -2.60 -0.08 0.00 -0.00 0.00 0.00 39.64 37.44 2j03 n ILE 62 CO 0.00 0.00 0.00 0.58 -0.00 0.00 0.00 176.55 177.13 2j03 h VAL 63 N 0.00 0.03 0.07 1.39 2.07 -1.68 0.36 116.25 118.50 2j03 h VAL 63 Ca 0.42 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.95 2j03 h VAL 63 Cb 0.70 0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.48 2j03 h VAL 63 CO -0.83 0.00 -0.33 0.03 0.02 0.00 0.00 177.57 176.47 2j03 h ARG 64 N -0.39 -0.44 -0.21 1.57 2.47 0.13 1.84 114.38 119.35 2j03 h ARG 64 Ca 0.09 0.03 0.02 0.00 -1.26 0.00 0.00 59.98 58.86 2j03 h ARG 64 Cb 0.60 0.10 -0.03 0.00 -1.65 0.00 0.00 29.97 29.00 2j03 h ARG 64 CO -0.58 -0.30 -0.12 0.82 0.56 0.00 0.00 179.97 180.35 2j03 h ILE 65 N -0.46 0.00 0.06 2.04 2.04 -0.78 0.70 117.51 121.10 2j03 h ILE 65 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 2j03 h ILE 65 Cb 0.47 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.53 2j03 h ILE 65 CO -0.18 0.00 -0.16 -1.13 0.00 0.00 0.00 178.15 176.68 2j03 h ASN 66 N -0.00 -0.47 0.00 1.72 -1.24 0.02 0.52 115.58 116.13 2j03 h ASN 66 Ca 0.03 0.05 0.00 0.00 0.71 0.00 0.00 56.30 57.09 2j03 h ASN 66 Cb 0.09 0.17 0.00 0.00 0.73 0.00 0.00 38.32 39.31 2j03 h ASN 66 CO -0.20 -0.17 0.00 0.00 -1.29 0.00 0.00 177.43 175.77 2j03 n ALA 67 N -2.56 1.36 -0.00 1.57 0.00 0.62 -0.97 120.51 120.53 2j03 n ALA 67 Ca -0.03 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.41 2j03 n ALA 67 Cb 0.13 -1.00 -0.00 0.00 0.00 0.00 0.00 19.45 18.57 2j03 n ALA 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2j03 n ALA 68 N 0.00 2.90 1.19 0.00 0.00 0.24 -4.67 120.51 120.17 2j03 n ALA 68 Ca 0.00 -0.03 0.04 0.00 0.00 0.00 0.00 53.44 53.45 2j03 n ALA 68 Cb 0.01 0.49 0.11 0.00 0.00 0.00 0.00 19.45 20.06 2j03 n ALA 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2j03 h ARG 70 N 1.45 0.00 0.00 0.00 2.43 -1.15 -3.14 114.38 113.98 2j03 h ARG 70 Ca 0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 2j03 h ARG 70 Cb 0.35 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.90 2j03 h ARG 70 CO 0.00 0.14 -0.03 0.37 -1.51 0.00 0.00 179.97 178.94 2j03 h GLN 71 N 0.00 0.00 -0.88 0.20 4.15 -1.79 -2.47 115.11 114.32 2j03 h GLN 71 Ca -0.03 0.00 -0.49 0.00 0.77 0.00 0.00 58.65 58.90 2j03 h GLN 71 Cb 1.17 0.00 -0.28 0.00 0.21 0.00 0.00 27.48 28.58 2j03 h GLN 71 CO 0.02 0.03 0.53 0.72 -1.93 0.00 0.00 178.83 178.20 2j03 n HIS 72 N -3.15 2.76 -3.62 3.99 8.25 -1.21 -4.94 115.22 117.30 2j03 n HIS 72 Ca 0.00 -2.01 -0.21 0.00 -0.26 0.00 0.00 57.72 55.24 2j03 n HIS 72 Cb 0.30 -0.94 0.06 0.00 1.12 0.00 0.00 29.99 30.53 2j03 n HIS 72 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2j03 n GLY 73 N -1.10 -0.38 3.43 -1.41 0.00 -0.93 -5.02 105.19 99.78 2j03 n GLY 73 Ca 0.56 0.14 -0.16 0.00 0.00 0.00 0.00 46.02 46.56 2j03 n GLY 73 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2j03 s LEU 74 N -6.73 -0.16 0.30 0.99 0.05 -1.19 -5.06 118.68 106.89 2j03 s LEU 74 Ca 0.16 0.49 -0.28 0.00 0.05 0.00 0.00 54.13 54.56 2j03 s LEU 74 Cb -0.08 2.12 -0.09 0.00 -2.05 0.00 0.00 46.19 46.09 2j03 s LEU 74 CO 0.77 -0.57 1.01 0.20 -0.55 0.00 0.00 176.35 177.22 2j03 s ASN 75 N -1.28 7.30 0.36 1.48 0.01 -1.26 -3.79 114.94 117.76 2j03 s ASN 75 Ca -0.11 2.05 0.07 0.00 -0.71 0.00 0.00 52.86 54.16 2j03 s ASN 75 Cb -0.02 -2.61 0.78 0.00 0.41 0.00 0.00 41.25 39.82 2j03 s ASN 75 CO 0.08 -0.10 1.92 0.22 -1.51 0.00 0.00 177.10 177.70 2j03 h TYR 76 N 3.55 0.78 0.14 2.20 3.20 -1.90 0.82 116.97 125.75 2j03 h TYR 76 Ca -0.46 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.42 2j03 h TYR 76 Cb 1.20 -0.25 -0.00 0.00 1.54 0.00 0.00 36.73 39.22 2j03 h TYR 76 CO 0.60 0.36 -0.11 0.66 -1.64 0.00 0.00 178.16 178.03 2j03 h SER 77 N 0.72 -0.29 -0.35 -2.11 4.64 -2.00 -0.75 113.55 113.41 2j03 h SER 77 Ca 0.37 0.02 0.06 0.00 -0.47 0.00 0.00 61.79 61.77 2j03 h SER 77 Cb 0.46 0.09 -0.08 0.00 -0.31 0.00 0.00 62.40 62.56 2j03 h SER 77 CO -0.14 -0.15 -0.46 0.74 -0.87 0.00 0.00 176.83 175.94 2j03 h THR 78 N -0.24 0.08 0.00 2.95 2.02 -1.70 -2.59 112.91 113.44 2j03 h THR 78 Ca -0.02 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.16 2j03 h THR 78 Cb 0.20 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.69 2j03 h THR 78 CO 0.00 0.00 0.00 0.33 0.37 0.00 0.00 175.52 176.22 2j03 n PHE 79 N -5.41 0.00 -0.20 3.16 -0.00 0.28 -0.17 117.46 115.11 2j03 n PHE 79 Ca -0.02 0.00 -0.08 0.00 -0.00 0.00 0.00 57.45 57.35 2j03 n PHE 79 Cb 0.35 -0.32 -0.06 0.00 -0.00 0.00 0.00 39.48 39.45 2j03 n PHE 79 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 176.76 177.58 2j03 h ILE 80 N 0.00 0.00 -0.90 -2.13 1.08 -0.93 0.24 117.51 114.87 2j03 h ILE 80 Ca 0.00 0.00 0.25 0.00 -0.39 0.00 0.00 64.86 64.72 2j03 h ILE 80 Cb 0.00 0.00 -0.15 0.00 -3.07 0.00 0.00 36.82 33.60 2j03 h ILE 80 CO 0.00 0.00 0.25 -0.74 -0.69 0.00 0.00 178.15 176.97 2j03 h HIS 81 N -0.09 0.38 0.00 1.37 2.76 -0.97 2.00 115.15 120.60 2j03 h HIS 81 Ca 0.08 0.05 0.00 0.00 -2.20 0.00 0.00 60.37 58.30 2j03 h HIS 81 Cb 0.30 -0.02 0.00 0.00 1.55 0.00 0.00 27.41 29.24 2j03 h HIS 81 CO -0.88 -0.24 0.23 0.78 -1.30 0.00 0.00 177.93 176.52 2j03 h GLY 82 N 0.19 0.00 0.00 5.26 0.00 0.28 -2.16 103.07 106.64 2j03 h GLY 82 Ca 0.58 0.00 -0.26 0.00 0.00 0.00 0.00 47.33 47.66 2j03 h GLY 82 CO -0.68 0.00 -1.69 1.04 0.00 0.00 0.00 176.54 175.20 2j03 n LEU 83 N -2.69 1.92 -0.22 3.11 4.32 0.67 -3.91 117.00 120.20 2j03 n LEU 83 Ca -0.02 0.39 -0.01 0.00 -0.02 0.00 0.00 56.01 56.35 2j03 n LEU 83 Cb 0.27 -0.84 0.06 0.00 -1.62 0.00 0.00 43.42 41.29 2j03 n LEU 83 CO 0.13 0.20 0.71 0.50 -1.22 0.00 0.00 177.39 177.71 2j03 h LYS 84 N -1.00 -0.03 0.00 3.23 1.63 -0.89 1.31 116.57 120.82 2j03 h LYS 84 Ca -0.39 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.41 2j03 h LYS 84 Cb 1.28 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.92 2j03 h LYS 84 CO -0.24 -0.02 0.00 1.17 -3.45 0.00 0.00 179.45 176.91 2j03 n LYS 85 N -5.45 0.81 -0.09 1.90 4.81 -0.85 -3.22 118.16 116.08 2j03 n LYS 85 Ca 0.07 0.00 -0.16 0.00 -0.87 0.00 0.00 58.31 57.36 2j03 n LYS 85 Cb 0.34 -1.45 -0.07 0.00 0.02 0.00 0.00 35.03 33.87 2j03 n LYS 85 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2j03 n ALA 86 N -0.95 1.74 0.00 3.14 0.00 0.31 -5.03 120.51 119.72 2j03 n ALA 86 Ca 0.18 -0.71 0.00 0.00 0.00 0.00 0.00 53.44 52.90 2j03 n ALA 86 Cb 0.08 0.19 0.00 0.00 0.00 0.00 0.00 19.45 19.72 2j03 n ALA 86 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2j03 n GLY 87 N 2.28 3.24 0.00 0.00 0.00 0.37 -5.07 105.19 106.01 2j03 n GLY 87 Ca -0.33 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 44.59 2j03 n GLY 87 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2j03 n ILE 88 N 0.29 0.00 0.25 -0.61 -6.64 -1.26 -4.90 119.36 106.49 2j03 n ILE 88 Ca 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 60.98 2j03 n ILE 88 Cb 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 39.64 38.20 2j03 n ILE 88 CO 0.00 0.00 0.00 -0.62 -1.77 0.00 0.00 176.55 174.16 2j03 n GLU 89 N 0.00 0.25 0.00 6.28 4.71 -1.26 -4.56 120.64 126.06 2j03 n GLU 89 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.15 2j03 n GLU 89 Cb 0.00 -1.27 0.00 0.00 -1.01 0.00 0.00 31.44 29.16 2j03 n GLU 89 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 2j03 n VAL 90 N 0.67 0.00 0.00 2.62 0.31 -1.26 -4.74 118.33 115.93 2j03 n VAL 90 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2j03 n VAL 90 Cb 0.10 -0.24 0.00 0.00 -0.91 0.00 0.00 33.84 32.79 2j03 n VAL 90 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2j03 n ASP 91 N 0.00 0.00 -2.58 4.52 4.64 -1.26 -4.64 116.55 117.22 2j03 n ASP 91 Ca 0.00 0.00 -0.01 0.00 -1.38 0.00 0.00 54.79 53.40 2j03 n ASP 91 Cb 0.00 0.00 -0.01 0.00 -1.04 0.00 0.00 41.12 40.07 2j03 n ASP 91 CO 0.00 0.00 0.00 -1.14 -0.82 0.00 0.00 177.20 175.24 2j03 n ARG 92 N 0.00 -2.40 -0.23 -0.67 0.63 -1.26 -1.11 116.66 111.62 2j03 n ARG 92 Ca 0.00 1.87 0.17 0.00 -0.92 0.00 0.00 57.85 58.98 2j03 n ARG 92 Cb 0.00 -2.37 0.27 0.00 0.45 0.00 0.00 32.46 30.81 2j03 n ARG 92 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 2j03 n LYS 93 N 2.11 -0.00 0.14 -0.14 4.01 -1.26 0.32 118.16 123.34 2j03 n LYS 93 Ca -0.10 0.38 -0.08 0.00 -0.51 0.00 0.00 58.31 57.99 2j03 n LYS 93 Cb 0.16 -0.85 -0.05 0.00 -0.51 0.00 0.00 35.03 33.78 2j03 n LYS 93 CO 0.00 0.00 0.00 -0.97 -1.11 0.00 0.00 177.40 175.32 2j03 h ASN 94 N 0.00 -0.36 0.00 4.39 -1.24 -1.94 -3.25 115.58 113.19 2j03 h ASN 94 Ca 0.32 -0.08 0.00 0.00 0.71 0.00 0.00 56.30 57.25 2j03 h ASN 94 Cb 1.24 0.09 0.00 0.00 0.73 0.00 0.00 38.32 40.38 2j03 h ASN 94 CO -0.03 0.10 0.00 0.18 -1.29 0.00 0.00 177.43 176.39 2j03 n LEU 95 N -5.06 0.00 -1.79 0.34 4.77 0.97 -2.34 117.00 113.89 2j03 n LEU 95 Ca -0.07 0.19 -0.05 0.00 -0.03 0.00 0.00 56.01 56.05 2j03 n LEU 95 Cb 0.21 -0.19 -0.07 0.00 -2.33 0.00 0.00 43.42 41.05 2j03 n LEU 95 CO 0.18 -0.19 1.16 0.00 -1.33 0.00 0.00 177.39 177.21 2j03 n ALA 96 N -1.19 4.65 1.11 -1.18 0.00 -0.53 -2.79 120.51 120.58 2j03 n ALA 96 Ca 0.00 -0.75 0.12 0.00 0.00 0.00 0.00 53.44 52.82 2j03 n ALA 96 Cb 0.00 -1.67 0.24 0.00 0.00 0.00 0.00 19.45 18.02 2j03 n ALA 96 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2j03 n ASP 97 N 2.02 1.00 -0.16 0.00 4.64 -0.99 -3.68 116.55 119.38 2j03 n ASP 97 Ca 0.18 -0.79 -0.09 0.00 -1.38 0.00 0.00 54.79 52.70 2j03 n ASP 97 Cb 0.61 0.31 0.04 0.00 -1.04 0.00 0.00 41.12 41.03 2j03 n ASP 97 CO 0.00 0.00 0.00 -0.07 -0.82 0.00 0.00 177.20 176.31 2j03 h LEU 98 N 0.89 0.98 -1.51 -2.67 3.38 -1.67 -1.18 115.31 113.54 2j03 h LEU 98 Ca 0.00 -0.33 0.11 0.00 0.09 0.00 0.00 57.88 57.75 2j03 h LEU 98 Cb 0.54 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 2j03 h LEU 98 CO 0.00 1.11 0.67 0.00 0.09 0.00 0.00 178.44 180.30 2j03 h ALA 99 N 0.98 2.09 -3.00 1.53 0.00 -1.82 -3.05 119.26 115.99 2j03 h ALA 99 Ca 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2j03 h ALA 99 Cb 0.68 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2j03 h ALA 99 CO 0.05 -0.87 0.00 0.28 0.00 0.00 0.00 179.25 178.71 2j03 n VAL 100 N -3.23 0.00 -1.92 0.00 0.31 -0.77 -4.56 118.33 108.16 2j03 n VAL 100 Ca 0.08 0.00 -0.41 0.00 -0.01 0.00 0.00 64.34 63.99 2j03 n VAL 100 Cb 0.82 -0.82 -0.02 0.00 -0.91 0.00 0.00 33.84 32.90 2j03 n VAL 100 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 2j03 s ARG 101 N 0.00 4.21 -0.75 5.55 0.52 -0.52 -3.40 118.95 124.57 2j03 s ARG 101 Ca 0.00 2.41 -0.06 0.00 -0.52 0.00 0.00 55.73 57.56 2j03 s ARG 101 Cb 0.00 -3.08 0.01 0.00 0.52 0.00 0.00 34.95 32.40 2j03 s ARG 101 CO 0.00 -0.52 0.63 -0.85 0.02 0.00 0.00 175.30 174.58 2j03 n GLU 102 N 2.44 -1.59 0.10 3.54 0.00 -1.26 -4.09 120.64 119.79 2j03 n GLU 102 Ca 0.08 1.03 0.10 0.00 0.00 0.00 0.00 57.16 58.37 2j03 n GLU 102 Cb 0.39 -3.04 0.44 0.00 0.00 0.00 0.00 31.44 29.23 2j03 n GLU 102 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.13 176.78 2j03 n PRO 103 N -2.07 0.13 0.08 3.44 -0.04 -1.15 -2.22 135.00 133.17 2j03 n PRO 103 Ca -0.22 0.42 -0.07 0.00 -0.04 0.00 0.00 63.50 63.59 2j03 n PRO 103 Cb 0.65 -1.78 0.05 0.00 -0.04 0.00 0.00 33.50 32.38 2j03 n PRO 103 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 2j03 h GLN 104 N 0.00 0.24 -0.94 0.54 4.20 -1.89 -0.78 115.11 116.48 2j03 h GLN 104 Ca 0.00 -0.21 0.01 0.00 0.06 0.00 0.00 58.65 58.51 2j03 h GLN 104 Cb 0.27 0.05 -0.05 0.00 0.30 0.00 0.00 27.48 28.05 2j03 h GLN 104 CO 0.00 0.88 0.63 0.28 -0.67 0.00 0.00 178.83 179.94 2j03 h VAL 105 N 0.16 1.23 0.12 -0.54 2.07 -1.77 -2.43 116.25 115.09 2j03 h VAL 105 Ca -0.03 -0.43 -0.01 0.00 0.82 0.00 0.00 66.70 67.05 2j03 h VAL 105 Cb 1.31 -0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 2j03 h VAL 105 CO 0.12 0.23 -0.06 0.15 0.02 0.00 0.00 177.57 178.03 2j03 h PHE 106 N 1.27 -0.15 -0.90 1.57 3.57 -1.58 -3.21 116.94 117.50 2j03 h PHE 106 Ca 0.35 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.93 2j03 h PHE 106 Cb -0.13 0.05 -0.11 0.00 2.79 0.00 0.00 35.95 38.55 2j03 h PHE 106 CO -0.00 0.24 -0.53 0.00 -2.23 0.00 0.00 178.31 175.79 2j03 n ALA 107 N -2.39 -0.58 -0.31 2.41 0.00 -0.32 0.11 120.51 119.43 2j03 n ALA 107 Ca -0.09 0.77 0.12 0.00 0.00 0.00 0.00 53.44 54.24 2j03 n ALA 107 Cb 0.24 -0.10 0.30 0.00 0.00 0.00 0.00 19.45 19.89 2j03 n ALA 107 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2j03 h GLU 108 N 0.00 0.48 0.01 0.00 5.08 -1.57 0.12 114.58 118.71 2j03 h GLU 108 Ca 0.14 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.48 2j03 h GLU 108 Cb 0.37 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 2j03 h GLU 108 CO -0.85 0.32 -0.04 -0.07 -1.00 0.00 0.00 179.01 177.38 2j03 h LEU 109 N 0.50 -0.10 0.15 1.33 3.38 0.74 1.08 115.31 122.38 2j03 h LEU 109 Ca 0.55 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.54 2j03 h LEU 109 Cb 0.98 0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.75 2j03 h LEU 109 CO -0.47 -0.06 -0.31 0.58 0.09 0.00 0.00 178.44 178.27 2j03 h VAL 110 N -0.07 0.00 -0.99 1.22 2.07 0.11 2.22 116.25 120.81 2j03 h VAL 110 Ca 0.01 0.00 0.24 0.00 0.82 0.00 0.00 66.70 67.77 2j03 h VAL 110 Cb 0.09 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 29.77 2j03 h VAL 110 CO -0.03 0.00 0.64 -0.33 0.02 0.00 0.00 177.57 177.87 2j03 h GLU 111 N -0.49 0.43 -0.77 1.57 4.39 -1.09 1.79 114.58 120.40 2j03 h GLU 111 Ca -0.02 -0.03 -0.04 0.00 0.34 0.00 0.00 59.36 59.62 2j03 h GLU 111 Cb 0.47 -0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 28.99 2j03 h GLU 111 CO -0.12 0.28 0.34 -0.09 -1.16 0.00 0.00 179.01 178.26 2j03 h ARG 112 N 0.44 1.14 0.00 2.33 1.12 0.42 -2.35 114.38 117.48 2j03 h ARG 112 Ca 0.55 -0.19 0.00 0.00 -1.11 0.00 0.00 59.98 59.23 2j03 h ARG 112 Cb 1.33 -0.19 0.00 0.00 -0.01 0.00 0.00 29.97 31.10 2j03 h ARG 112 CO -0.26 0.90 0.00 0.00 -3.11 0.00 0.00 179.97 177.50 2j03 n ALA 113 N -2.41 -0.09 -0.66 2.80 0.00 0.72 -2.77 120.51 118.10 2j03 n ALA 113 Ca 0.07 0.00 0.51 0.00 0.00 0.00 0.00 53.44 54.02 2j03 n ALA 113 Cb 0.16 0.02 0.80 0.00 0.00 0.00 0.00 19.45 20.43 2j03 n ALA 113 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 2j03 h LYS 114 N 0.00 0.00 -0.12 0.00 -0.00 -1.30 0.71 116.57 115.87 2j03 h LYS 114 Ca 0.00 -0.00 0.02 0.00 -0.00 0.00 0.00 60.65 60.67 2j03 h LYS 114 Cb 0.00 -0.00 -0.04 0.00 -0.00 0.00 0.00 32.23 32.19 2j03 h LYS 114 CO 0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 179.45 179.16 2j03 h ALA 115 N 1.12 -0.64 0.00 0.07 0.00 -1.23 0.24 119.26 118.83 2j03 h ALA 115 Ca 0.93 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.82 2j03 h ALA 115 Cb 3.59 0.85 0.00 0.00 0.00 0.00 0.00 17.79 22.23 2j03 h ALA 115 CO -0.09 -0.75 0.51 0.00 0.00 0.00 0.00 179.25 178.92 2j03 h ALA 116 N -0.76 1.41 -1.39 0.00 0.00 -0.86 0.66 119.26 118.32 2j03 h ALA 116 Ca 0.02 0.00 -0.63 0.00 0.00 0.00 0.00 54.91 54.31 2j03 h ALA 116 Cb 0.35 0.00 -0.39 0.00 0.00 0.00 0.00 17.79 17.75 2j03 h ALA 116 CO -0.26 -0.41 -0.36 1.04 0.00 0.00 0.00 179.25 179.26 2j03 n GLN 117 N -2.20 3.29 0.00 0.00 1.13 0.85 -4.99 117.38 115.46 2j03 n GLN 117 Ca -0.01 -4.29 0.14 0.00 -1.94 0.00 0.00 57.00 50.90 2j03 n GLN 117 Cb 0.53 -2.26 0.60 0.00 0.11 0.00 0.00 30.24 29.23 2j03 n GLN 117 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03