#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3jr2 s LYS 3 N 0.00 2.88 0.72 -0.78 2.20 -1.26 -4.53 119.74 118.97 3jr2 s LYS 3 Ca 0.00 -0.55 -0.12 0.00 -0.36 0.00 0.00 55.97 54.94 3jr2 s LYS 3 Cb 0.00 -2.73 0.18 0.00 -1.51 0.00 0.00 37.83 33.77 3jr2 s LYS 3 CO 0.00 0.64 0.41 -2.30 -0.36 0.00 0.00 175.35 173.74 3jr2 n PRO 4 N 1.48 -3.13 -4.05 4.03 -0.02 -1.25 -4.93 135.00 127.13 3jr2 n PRO 4 Ca -0.15 -0.69 -0.24 0.00 -2.02 0.00 0.00 63.50 60.40 3jr2 n PRO 4 Cb 0.53 -0.93 -0.17 0.00 -0.02 0.00 0.00 33.50 32.91 3jr2 n PRO 4 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3jr2 s ILE 6 N -1.52 0.80 -0.08 4.25 -1.09 -1.26 -4.88 121.20 117.43 3jr2 s ILE 6 Ca 0.32 -0.20 0.05 0.00 -2.23 0.00 0.00 60.65 58.59 3jr2 s ILE 6 Cb -0.06 -0.83 -0.00 0.00 -1.58 0.00 0.00 42.46 39.99 3jr2 s ILE 6 CO 0.27 0.31 -0.23 -1.58 -1.23 0.00 0.00 174.94 172.48 3jr2 s GLN 7 N 1.42 2.65 -0.18 2.79 0.74 -0.48 -0.75 119.66 125.86 3jr2 s GLN 7 Ca -0.02 -0.83 -0.07 0.00 0.05 0.00 0.00 55.36 54.49 3jr2 s GLN 7 Cb -0.13 -2.12 -0.04 0.00 1.10 0.00 0.00 33.01 31.82 3jr2 s GLN 7 CO -0.04 0.25 0.04 -1.50 -0.55 0.00 0.00 175.29 173.50 3jr2 s ILE 8 N 0.14 4.55 -0.41 -2.34 2.07 -0.42 -1.66 121.20 123.13 3jr2 s ILE 8 Ca -0.11 -0.12 -0.18 0.00 -1.41 0.00 0.00 60.65 58.83 3jr2 s ILE 8 Cb -0.16 -3.05 0.02 0.00 0.13 0.00 0.00 42.46 39.40 3jr2 s ILE 8 CO 0.06 0.46 0.48 0.00 -1.91 0.00 0.00 174.94 174.03 3jr2 s ALA 9 N 0.48 3.42 -0.51 1.50 0.00 -0.26 -0.83 121.76 125.56 3jr2 s ALA 9 Ca 0.02 -1.37 -0.25 0.00 0.00 0.00 0.00 51.96 50.36 3jr2 s ALA 9 Cb -0.13 -3.08 0.03 0.00 0.00 0.00 0.00 23.12 19.94 3jr2 s ALA 9 CO 0.01 -1.54 0.93 -0.51 0.00 0.00 0.00 175.76 174.65 3jr2 s LEU 10 N 2.30 4.05 -0.21 0.00 1.43 0.49 -4.56 118.68 122.17 3jr2 s LEU 10 Ca 0.15 -0.12 0.13 0.00 -1.03 0.00 0.00 54.13 53.25 3jr2 s LEU 10 Cb -0.16 -3.00 0.42 0.00 0.03 0.00 0.00 46.19 43.47 3jr2 s LEU 10 CO 0.15 -1.14 1.28 0.47 0.23 0.00 0.00 176.35 177.33 3jr2 n ASP 11 N 7.32 2.19 -4.76 2.29 10.43 -1.26 -0.77 116.55 132.00 3jr2 n ASP 11 Ca 0.04 -3.63 -0.34 0.00 2.57 0.00 0.00 54.79 53.42 3jr2 n ASP 11 Cb 0.48 -0.53 0.04 0.00 1.84 0.00 0.00 41.12 42.95 3jr2 n ASP 11 CO 0.00 0.00 0.00 -1.10 -1.07 0.00 0.00 177.20 175.03 3jr2 s GLN 12 N -3.13 2.81 0.00 -1.24 1.11 -1.26 -4.55 119.66 113.39 3jr2 s GLN 12 Ca 0.39 1.59 0.20 0.00 0.01 0.00 0.00 55.36 57.55 3jr2 s GLN 12 Cb 0.36 -1.93 0.55 0.00 -1.01 0.00 0.00 33.01 30.97 3jr2 s GLN 12 CO -0.02 -1.28 1.46 0.25 0.01 0.00 0.00 175.29 175.71 3jr2 n THR 13 N -2.09 0.76 -3.76 -0.19 -2.24 -1.26 -3.52 114.28 101.98 3jr2 n THR 13 Ca 0.12 -0.81 -0.12 0.00 -2.27 0.00 0.00 64.05 60.97 3jr2 n THR 13 Cb 0.51 0.51 -0.08 0.00 -2.10 0.00 0.00 70.33 69.17 3jr2 n THR 13 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3jr2 s ASN 14 N -1.10 -0.12 0.18 3.42 4.22 -1.26 -4.87 114.94 115.41 3jr2 s ASN 14 Ca 0.41 -0.17 -0.04 0.00 -2.14 0.00 0.00 52.86 50.93 3jr2 s ASN 14 Cb 0.22 0.35 0.09 0.00 1.28 0.00 0.00 41.25 43.18 3jr2 s ASN 14 CO 0.29 -0.59 1.49 0.25 -2.04 0.00 0.00 177.10 176.50 3jr2 h LEU 15 N 3.32 0.64 -0.22 3.54 5.85 -1.94 -2.95 115.31 123.55 3jr2 h LEU 15 Ca -0.31 -0.35 0.06 0.00 0.84 0.00 0.00 57.88 58.11 3jr2 h LEU 15 Cb 1.20 -0.18 -0.07 0.00 0.37 0.00 0.00 40.66 41.97 3jr2 h LEU 15 CO 0.45 1.07 -0.27 0.74 -0.34 0.00 0.00 178.44 180.10 3jr2 h THR 16 N 0.44 0.36 -0.92 1.05 2.02 -1.99 0.11 112.91 113.98 3jr2 h THR 16 Ca 0.00 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.19 3jr2 h THR 16 Cb 1.12 0.36 -0.05 0.00 -1.74 0.00 0.00 68.15 67.84 3jr2 h THR 16 CO 0.11 0.00 0.61 0.44 0.37 0.00 0.00 175.52 177.05 3jr2 h ASP 17 N -0.29 1.06 -0.19 4.18 3.32 -1.99 -1.74 116.42 120.77 3jr2 h ASP 17 Ca 0.13 -0.03 -0.14 0.00 0.02 0.00 0.00 57.03 57.01 3jr2 h ASP 17 Cb 0.49 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.76 3jr2 h ASP 17 CO -0.38 0.76 -0.36 0.00 -1.72 0.00 0.00 179.24 177.54 3jr2 h ALA 18 N 1.43 0.78 -0.36 3.45 0.00 -1.24 -0.69 119.26 122.62 3jr2 h ALA 18 Ca 0.34 -0.43 -0.14 0.00 0.00 0.00 0.00 54.91 54.67 3jr2 h ALA 18 Cb -0.14 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 3jr2 h ALA 18 CO -0.07 0.65 -0.34 0.28 0.00 0.00 0.00 179.25 179.77 3jr2 h VAL 19 N 0.59 1.28 -0.15 0.00 2.07 -0.47 0.25 116.25 119.82 3jr2 h VAL 19 Ca 0.06 -1.50 -0.01 0.00 0.82 0.00 0.00 66.70 66.06 3jr2 h VAL 19 Cb 0.89 1.36 -0.01 0.00 -1.52 0.00 0.00 31.29 32.02 3jr2 h VAL 19 CO 0.08 0.50 0.04 0.00 0.02 0.00 0.00 177.57 178.21 3jr2 h ALA 20 N 0.92 0.19 -0.15 1.67 0.00 -1.10 -1.19 119.26 119.60 3jr2 h ALA 20 Ca 0.07 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 3jr2 h ALA 20 Cb 0.90 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 3jr2 h ALA 20 CO 0.08 -0.17 0.07 0.28 0.00 0.00 0.00 179.25 179.50 3jr2 h VAL 21 N 0.04 1.14 -0.79 0.00 2.07 -0.95 -1.55 116.25 116.21 3jr2 h VAL 21 Ca 0.05 -0.41 0.08 0.00 0.82 0.00 0.00 66.70 67.24 3jr2 h VAL 21 Cb 0.25 1.13 -0.07 0.00 -1.52 0.00 0.00 31.29 31.09 3jr2 h VAL 21 CO 0.00 0.13 0.45 0.00 0.02 0.00 0.00 177.57 178.17 3jr2 h ALA 22 N 0.92 1.10 -0.89 1.67 0.00 -0.90 -1.23 119.26 119.93 3jr2 h ALA 22 Ca 0.05 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3jr2 h ALA 22 Cb 0.14 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 3jr2 h ALA 22 CO -0.01 0.10 0.57 1.03 0.00 0.00 0.00 179.25 180.94 3jr2 h SER 23 N 0.78 1.05 0.39 0.00 0.87 -0.91 -1.53 113.55 114.19 3jr2 h SER 23 Ca 0.37 -0.05 -0.13 0.00 -1.23 0.00 0.00 61.79 60.75 3jr2 h SER 23 Cb 0.31 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 61.99 3jr2 h SER 23 CO -0.23 0.78 -0.56 0.78 -0.53 0.00 0.00 176.83 177.07 3jr2 h ASN 24 N 1.22 0.19 0.00 6.23 2.35 -0.23 -3.32 115.58 122.02 3jr2 h ASN 24 Ca 0.32 -0.10 0.00 0.00 -0.55 0.00 0.00 56.30 55.97 3jr2 h ASN 24 Cb -0.10 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.22 3jr2 h ASN 24 CO -0.07 0.71 -0.94 1.33 -1.65 0.00 0.00 177.43 176.81 3jr2 n VAL 25 N -3.90 0.00 -0.22 2.81 0.24 -0.65 -4.64 118.33 111.97 3jr2 n VAL 25 Ca -0.02 -0.03 0.02 0.00 -2.04 0.00 0.00 64.34 62.27 3jr2 n VAL 25 Cb 0.58 1.02 0.13 0.00 -1.47 0.00 0.00 33.84 34.10 3jr2 n VAL 25 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3jr2 h ALA 26 N 3.09 0.85 0.00 2.33 0.00 -1.38 -1.57 119.26 122.57 3jr2 h ALA 26 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3jr2 h ALA 26 Cb 0.53 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.41 3jr2 h ALA 26 CO 0.00 -0.22 0.00 0.66 0.00 0.00 0.00 179.25 179.69 3jr2 h SER 27 N 0.39 0.00 0.00 0.00 4.64 -1.84 -3.10 113.55 113.63 3jr2 h SER 27 Ca 0.34 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.66 3jr2 h SER 27 Cb 0.46 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 3jr2 h SER 27 CO -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.61 3jr2 n TYR 28 N -2.71 0.00 -4.44 4.77 0.18 -0.64 -5.04 117.16 109.29 3jr2 n TYR 28 Ca -0.01 -0.34 -0.30 0.00 1.88 0.00 0.00 57.90 59.14 3jr2 n TYR 28 Cb 0.14 -0.03 -0.12 0.00 -0.38 0.00 0.00 39.34 38.94 3jr2 n TYR 28 CO 0.00 0.00 0.00 0.14 -2.08 0.00 0.00 176.86 174.92 3jr2 s VAL 29 N -0.68 2.66 -0.06 -3.48 -7.23 -0.94 -4.95 120.40 105.73 3jr2 s VAL 29 Ca 0.00 -1.49 0.06 0.00 -1.81 0.00 0.00 61.98 58.75 3jr2 s VAL 29 Cb 0.00 -2.18 -0.24 0.00 0.56 0.00 0.00 36.38 34.52 3jr2 s VAL 29 CO 0.00 0.16 0.61 0.44 -0.31 0.00 0.00 175.10 176.01 3jr2 h ASP 30 N 4.00 0.13 -3.47 4.85 3.32 -1.25 -3.47 116.42 120.53 3jr2 h ASP 30 Ca -0.49 -0.29 -0.46 0.00 0.02 0.00 0.00 57.03 55.81 3jr2 h ASP 30 Cb 1.16 -0.04 -0.33 0.00 0.22 0.00 0.00 39.33 40.34 3jr2 h ASP 30 CO 0.45 1.26 -0.79 -0.69 -1.72 0.00 0.00 179.24 177.74 3jr2 s VAL 31 N -2.59 0.84 -0.18 -1.35 1.01 -0.87 -2.78 120.40 114.47 3jr2 s VAL 31 Ca -0.09 -0.31 -0.04 0.00 0.00 0.00 0.00 61.98 61.53 3jr2 s VAL 31 Cb 0.08 -0.80 -0.02 0.00 0.00 0.00 0.00 36.38 35.64 3jr2 s VAL 31 CO 0.81 0.29 -0.03 -0.63 0.00 0.00 0.00 175.10 175.54 3jr2 s ILE 32 N 0.72 3.79 -0.14 2.22 1.01 0.19 -1.30 121.20 127.69 3jr2 s ILE 32 Ca -0.12 -0.37 0.01 0.00 0.00 0.00 0.00 60.65 60.16 3jr2 s ILE 32 Cb -0.15 -2.69 -0.01 0.00 0.01 0.00 0.00 42.46 39.62 3jr2 s ILE 32 CO 0.02 0.45 -0.15 -0.70 0.00 0.00 0.00 174.94 174.56 3jr2 s GLU 33 N 0.82 3.28 -0.64 2.79 2.12 -0.01 -0.83 118.70 126.23 3jr2 s GLU 33 Ca -0.00 -0.74 -0.28 0.00 0.36 0.00 0.00 54.97 54.31 3jr2 s GLU 33 Cb -0.14 -2.58 0.03 0.00 0.26 0.00 0.00 34.13 31.69 3jr2 s GLU 33 CO 0.02 0.14 1.22 0.08 -0.54 0.00 0.00 175.26 176.18 3jr2 s VAL 34 N 0.52 3.90 0.87 3.70 1.01 0.01 -0.38 120.40 130.04 3jr2 s VAL 34 Ca -0.10 0.69 -0.11 0.00 0.00 0.00 0.00 61.98 62.46 3jr2 s VAL 34 Cb -0.16 -4.80 0.11 0.00 0.00 0.00 0.00 36.38 31.53 3jr2 s VAL 34 CO 0.04 -1.55 1.10 -0.83 0.00 0.00 0.00 175.10 173.86 3jr2 s GLY 35 N 3.28 1.65 0.29 4.51 0.00 0.05 -1.16 107.32 115.94 3jr2 s GLY 35 Ca 0.39 0.18 0.01 0.00 0.00 0.00 0.00 44.72 45.31 3jr2 s GLY 35 CO 0.21 0.62 1.88 -0.84 0.00 0.00 0.00 173.10 174.97 3jr2 h THR 36 N -1.52 1.01 -0.41 0.90 2.02 -1.81 -0.24 112.91 112.86 3jr2 h THR 36 Ca -0.47 -0.35 -0.02 0.00 0.77 0.00 0.00 66.41 66.34 3jr2 h THR 36 Cb 1.26 -0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 67.55 3jr2 h THR 36 CO 0.51 0.19 0.17 0.40 0.37 0.00 0.00 175.52 177.15 3jr2 h ILE 37 N 1.02 1.19 -0.56 3.11 2.04 -1.87 -0.54 117.51 121.90 3jr2 h ILE 37 Ca 0.43 -0.57 -0.09 0.00 1.00 0.00 0.00 64.86 65.63 3jr2 h ILE 37 Cb 0.32 0.82 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 3jr2 h ILE 37 CO -0.19 0.21 -0.01 0.25 0.00 0.00 0.00 178.15 178.41 3jr2 h LEU 38 N 0.51 0.97 -0.31 1.44 5.85 -1.45 -1.16 115.31 121.17 3jr2 h LEU 38 Ca 0.14 -0.31 0.04 0.00 0.84 0.00 0.00 57.88 58.58 3jr2 h LEU 38 Cb 0.17 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 40.90 3jr2 h LEU 38 CO -0.01 1.05 0.09 0.00 -0.34 0.00 0.00 178.44 179.23 3jr2 h ALA 39 N 0.96 0.35 0.00 1.25 0.00 -0.88 -1.09 119.26 119.85 3jr2 h ALA 39 Ca 0.16 0.04 -0.11 0.00 0.00 0.00 0.00 54.91 55.00 3jr2 h ALA 39 Cb 0.55 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 3jr2 h ALA 39 CO 0.03 -0.31 -0.51 0.74 0.00 0.00 0.00 179.25 179.19 3jr2 h PHE 40 N 0.22 0.00 -0.21 0.00 0.04 -1.04 0.47 116.94 116.41 3jr2 h PHE 40 Ca 0.14 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.87 3jr2 h PHE 40 Cb 0.13 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.27 3jr2 h PHE 40 CO -0.15 0.51 -0.01 0.00 -0.60 0.00 0.00 178.31 178.06 3jr2 h ALA 41 N 1.49 0.29 0.00 2.45 0.00 -0.73 -3.39 119.26 119.36 3jr2 h ALA 41 Ca -0.01 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3jr2 h ALA 41 Cb 1.05 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.76 3jr2 h ALA 41 CO 0.07 0.03 -0.96 0.39 0.00 0.00 0.00 179.25 178.78 3jr2 n GLU 42 N -4.66 0.35 0.00 0.00 -0.58 -0.46 -5.03 120.64 110.27 3jr2 n GLU 42 Ca -0.04 -0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.70 3jr2 n GLU 42 Cb 0.25 -0.98 0.00 0.00 -0.57 0.00 0.00 31.44 30.14 3jr2 n GLU 42 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3jr2 n GLY 43 N 2.42 1.96 4.06 0.62 0.00 0.16 -4.46 105.19 109.94 3jr2 n GLY 43 Ca -0.00 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.10 3jr2 n GLY 43 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3jr2 n LYS 45 N 0.00 0.00 -0.31 1.61 3.00 -1.26 -4.24 118.16 116.97 3jr2 n LYS 45 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 58.31 58.29 3jr2 n LYS 45 Cb 0.00 -0.99 0.13 0.00 0.00 0.00 0.00 35.03 34.18 3jr2 n LYS 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3jr2 h ALA 46 N 0.00 1.26 -0.02 3.14 0.00 -1.92 -0.67 119.26 121.05 3jr2 h ALA 46 Ca 0.00 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 3jr2 h ALA 46 Cb 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.44 3jr2 h ALA 46 CO 0.00 0.63 -0.14 0.28 0.00 0.00 0.00 179.25 180.02 3jr2 h VAL 47 N 1.21 1.51 -0.34 0.00 2.07 -1.89 -2.61 116.25 116.20 3jr2 h VAL 47 Ca 0.31 -1.70 -0.09 0.00 0.82 0.00 0.00 66.70 66.04 3jr2 h VAL 47 Cb -0.03 2.57 -0.02 0.00 -1.52 0.00 0.00 31.29 32.30 3jr2 h VAL 47 CO -0.06 0.46 -0.16 0.77 0.02 0.00 0.00 177.57 178.61 3jr2 h SER 48 N -0.50 0.59 -0.24 0.57 4.64 -1.52 0.08 113.55 117.18 3jr2 h SER 48 Ca -0.01 -0.18 -0.03 0.00 -0.47 0.00 0.00 61.79 61.11 3jr2 h SER 48 Cb 0.82 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.74 3jr2 h SER 48 CO 0.03 0.77 0.04 0.74 -0.87 0.00 0.00 176.83 177.54 3jr2 h THR 49 N 0.54 1.22 0.00 2.95 2.02 -1.15 -2.50 112.91 116.00 3jr2 h THR 49 Ca 0.09 -0.74 -0.12 0.00 0.77 0.00 0.00 66.41 66.41 3jr2 h THR 49 Cb 0.58 1.25 -0.02 0.00 -1.74 0.00 0.00 68.15 68.23 3jr2 h THR 49 CO 0.04 0.23 -0.59 -0.07 0.37 0.00 0.00 175.52 175.50 3jr2 h LEU 50 N 0.20 0.00 -0.44 2.58 3.38 -1.25 -1.28 115.31 118.50 3jr2 h LEU 50 Ca 0.07 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 3jr2 h LEU 50 Cb 0.31 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 3jr2 h LEU 50 CO 0.00 0.59 0.26 -0.09 0.09 0.00 0.00 178.44 179.29 3jr2 h ARG 51 N 0.00 0.60 -0.32 1.13 9.65 -0.86 -1.52 114.38 123.06 3jr2 h ARG 51 Ca -0.01 -0.06 -0.10 0.00 -1.10 0.00 0.00 59.98 58.72 3jr2 h ARG 51 Cb 1.12 -0.12 -0.01 0.00 -1.39 0.00 0.00 29.97 29.57 3jr2 h ARG 51 CO 0.08 0.45 -0.19 1.25 2.80 0.00 0.00 179.97 184.36 3jr2 h HIS 52 N 0.58 0.80 0.00 2.20 2.76 -1.14 -3.15 115.15 117.20 3jr2 h HIS 52 Ca 0.16 -0.21 -0.05 0.00 -2.20 0.00 0.00 60.37 58.06 3jr2 h HIS 52 Cb 0.01 -0.18 -0.01 0.00 1.55 0.00 0.00 27.41 28.79 3jr2 h HIS 52 CO -0.03 0.92 -0.26 -0.91 -1.30 0.00 0.00 177.93 176.35 3jr2 h ASN 53 N 0.45 0.00 -1.98 3.26 2.35 -1.06 -3.36 115.58 115.23 3jr2 h ASN 53 Ca 0.07 0.00 -0.55 0.00 -0.55 0.00 0.00 56.30 55.27 3jr2 h ASN 53 Cb 0.73 0.00 -0.39 0.00 0.05 0.00 0.00 38.32 38.71 3jr2 h ASN 53 CO 0.05 0.26 -1.11 1.41 -1.65 0.00 0.00 177.43 176.39 3jr2 n HIS 54 N -3.82 -0.37 0.27 1.19 8.25 -0.59 -4.99 115.22 115.16 3jr2 n HIS 54 Ca -0.02 -3.56 0.17 0.00 -0.26 0.00 0.00 57.72 54.05 3jr2 n HIS 54 Cb 0.35 -0.33 0.69 0.00 1.12 0.00 0.00 29.99 31.82 3jr2 n HIS 54 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 3jr2 h PRO 55 N 3.93 0.00 0.00 -0.41 0.13 -1.71 -2.94 132.00 131.00 3jr2 h PRO 55 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 3jr2 h PRO 55 Cb 0.89 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.02 3jr2 h PRO 55 CO 0.46 0.03 -0.82 0.09 -0.23 0.00 0.00 178.00 177.54 3jr2 n ASN 56 N -3.15 0.63 -4.83 1.44 3.02 -1.26 -4.96 115.26 106.15 3jr2 n ASN 56 Ca 0.00 -0.17 -0.32 0.00 -0.03 0.00 0.00 54.58 54.06 3jr2 n ASN 56 Cb 0.30 0.53 -0.03 0.00 -0.61 0.00 0.00 39.78 39.97 3jr2 n ASN 56 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 3jr2 s HIS 57 N -3.14 3.37 0.04 3.10 3.76 -1.11 -5.01 115.29 116.30 3jr2 s HIS 57 Ca 0.06 1.49 -0.31 0.00 -0.15 0.00 0.00 55.06 56.16 3jr2 s HIS 57 Cb 0.15 -2.83 -0.06 0.00 1.11 0.00 0.00 32.58 30.95 3jr2 s HIS 57 CO 0.76 -0.42 1.33 0.42 -0.85 0.00 0.00 174.74 175.98 3jr2 s ILE 58 N -2.53 3.74 -0.18 0.60 1.01 -1.12 -4.93 121.20 117.79 3jr2 s ILE 58 Ca 0.60 1.19 -0.03 0.00 0.00 0.00 0.00 60.65 62.41 3jr2 s ILE 58 Cb -0.11 -3.76 -0.02 0.00 0.01 0.00 0.00 42.46 38.58 3jr2 s ILE 58 CO 0.29 0.05 -0.05 -0.22 0.00 0.00 0.00 174.94 175.01 3jr2 s LEU 59 N 1.69 3.00 -0.10 2.97 2.96 -1.26 -0.64 118.68 127.31 3jr2 s LEU 59 Ca 0.62 -0.29 -0.02 0.00 -0.22 0.00 0.00 54.13 54.23 3jr2 s LEU 59 Cb -0.32 -1.74 -0.03 0.00 0.50 0.00 0.00 46.19 44.60 3jr2 s LEU 59 CO 0.28 0.07 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.66 3jr2 s VAL 60 N 0.92 4.03 -0.30 1.68 1.01 -0.01 -0.53 120.40 127.20 3jr2 s VAL 60 Ca -0.01 -0.34 -0.04 0.00 0.00 0.00 0.00 61.98 61.59 3jr2 s VAL 60 Cb -0.15 -2.70 0.03 0.00 0.00 0.00 0.00 36.38 33.57 3jr2 s VAL 60 CO 0.01 0.57 0.03 0.00 0.00 0.00 0.00 175.10 175.71 3jr2 s ASP 62 N 1.35 6.67 0.00 0.00 2.15 -0.31 -2.64 116.67 123.89 3jr2 s ASP 62 Ca -0.02 0.80 0.00 0.00 0.43 0.00 0.00 52.55 53.76 3jr2 s ASP 62 Cb -0.18 -2.21 0.00 0.00 -0.30 0.00 0.00 42.92 40.23 3jr2 s ASP 62 CO -0.00 0.30 0.00 0.29 -0.17 0.00 0.00 175.17 175.59 3jr2 n LYS 64 N 2.15 0.00 -1.67 4.34 5.02 -1.18 -2.98 118.16 123.84 3jr2 n LYS 64 Ca -0.15 0.00 -0.51 0.00 -2.02 0.00 0.00 58.31 55.63 3jr2 n LYS 64 Cb 0.53 0.00 -0.05 0.00 -0.02 0.00 0.00 35.03 35.48 3jr2 n LYS 64 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 3jr2 n THR 65 N 0.00 0.28 -0.02 -0.18 -1.04 -1.00 -3.71 114.28 108.61 3jr2 n THR 65 Ca 0.00 -0.05 0.01 0.00 -2.04 0.00 0.00 64.05 61.97 3jr2 n THR 65 Cb 0.00 -1.43 -0.07 0.00 -1.82 0.00 0.00 70.33 67.01 3jr2 n THR 65 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 3jr2 n THR 66 N 4.14 0.21 -3.77 12.58 -1.04 -1.26 -0.54 114.28 124.60 3jr2 n THR 66 Ca 0.22 -0.25 -0.05 0.00 -2.04 0.00 0.00 64.05 61.92 3jr2 n THR 66 Cb 0.23 -0.11 -0.02 0.00 -1.82 0.00 0.00 70.33 68.62 3jr2 n THR 66 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3jr2 s ASP 67 N -3.38 -0.22 -1.03 8.00 -1.08 -1.26 -4.24 116.67 113.46 3jr2 s ASP 67 Ca -0.04 -0.44 -0.02 0.00 -0.52 0.00 0.00 52.55 51.54 3jr2 s ASP 67 Cb 0.04 0.55 0.00 0.00 -1.46 0.00 0.00 42.92 42.06 3jr2 s ASP 67 CO 0.35 -1.02 0.31 0.61 0.52 0.00 0.00 175.17 175.94 3jr2 n GLY 68 N -0.46 -0.11 0.26 2.66 0.00 -1.26 -4.91 105.19 101.38 3jr2 n GLY 68 Ca -0.06 -0.23 -0.10 0.00 0.00 0.00 0.00 46.02 45.63 3jr2 n GLY 68 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3jr2 h GLY 69 N -0.70 0.96 0.60 -0.02 0.00 -1.93 -0.41 103.07 101.56 3jr2 h GLY 69 Ca -0.34 -0.74 0.08 0.00 0.00 0.00 0.00 47.33 46.33 3jr2 h GLY 69 CO 0.37 0.68 0.42 0.00 0.00 0.00 0.00 176.54 178.01 3jr2 h ALA 70 N 0.91 1.03 0.05 3.60 0.00 -1.85 -0.62 119.26 122.38 3jr2 h ALA 70 Ca 0.13 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 3jr2 h ALA 70 Cb 0.58 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.25 3jr2 h ALA 70 CO 0.03 0.08 -0.35 0.82 0.00 0.00 0.00 179.25 179.84 3jr2 h ILE 71 N 0.74 1.66 -0.88 0.00 2.04 -1.91 -2.84 117.51 116.33 3jr2 h ILE 71 Ca 0.35 -2.41 -0.02 0.00 1.00 0.00 0.00 64.86 63.78 3jr2 h ILE 71 Cb 0.27 3.29 -0.04 0.00 -0.74 0.00 0.00 36.82 39.59 3jr2 h ILE 71 CO -0.21 0.64 0.47 -0.07 0.00 0.00 0.00 178.15 178.97 3jr2 h LEU 72 N -0.77 1.11 -0.36 1.44 3.38 -1.03 -3.03 115.31 116.05 3jr2 h LEU 72 Ca -0.07 -0.11 -0.03 0.00 0.09 0.00 0.00 57.88 57.77 3jr2 h LEU 72 Cb 1.25 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.70 3jr2 h LEU 72 CO 0.05 0.90 0.11 0.28 0.09 0.00 0.00 178.44 179.86 3jr2 h SER 73 N 1.23 0.53 0.00 -0.43 0.02 -1.21 -1.42 113.55 112.28 3jr2 h SER 73 Ca 0.31 -0.21 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 3jr2 h SER 73 Cb 0.05 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.45 3jr2 h SER 73 CO -0.05 0.61 0.00 -1.14 -1.14 0.00 0.00 176.83 175.11 3jr2 n ARG 74 N -4.63 0.24 0.00 3.45 0.63 -1.07 -0.82 116.66 114.46 3jr2 n ARG 74 Ca -0.01 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.92 3jr2 n ARG 74 Cb 0.18 -1.38 0.00 0.00 0.45 0.00 0.00 32.46 31.71 3jr2 n ARG 74 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3jr2 n ALA 76 N 0.88 0.00 -0.08 5.13 0.00 -0.54 -0.68 120.51 125.23 3jr2 n ALA 76 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 3jr2 n ALA 76 Cb 0.12 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.52 3jr2 n ALA 76 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 3jr2 h PHE 77 N 0.00 0.92 -0.53 0.00 0.04 -1.23 -1.98 116.94 114.15 3jr2 h PHE 77 Ca 0.00 -0.32 0.03 0.00 2.80 0.00 0.00 57.97 60.48 3jr2 h PHE 77 Cb 0.00 -0.18 -0.03 0.00 2.20 0.00 0.00 35.95 37.95 3jr2 h PHE 77 CO 0.00 1.10 0.35 0.93 -0.60 0.00 0.00 178.31 180.10 3jr2 h GLU 78 N 0.47 0.61 0.00 1.51 5.08 -1.13 -1.21 114.58 119.91 3jr2 h GLU 78 Ca 0.02 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3jr2 h GLU 78 Cb 1.03 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 30.14 3jr2 h GLU 78 CO 0.10 0.40 -0.02 0.00 -1.00 0.00 0.00 179.01 178.49 3jr2 h ALA 79 N 1.69 1.02 0.00 3.43 0.00 -1.72 -3.47 119.26 120.21 3jr2 h ALA 79 Ca 0.21 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.11 3jr2 h ALA 79 Cb 0.08 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3jr2 h ALA 79 CO -0.05 0.02 0.00 0.41 0.00 0.00 0.00 179.25 179.63 3jr2 n GLY 80 N -0.28 0.58 3.73 0.00 0.00 -0.46 -3.22 105.19 105.54 3jr2 n GLY 80 Ca -0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 3jr2 n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jr2 n ALA 81 N 0.00 1.67 0.02 4.61 0.00 -0.78 -4.85 120.51 121.18 3jr2 n ALA 81 Ca 0.00 0.26 -0.22 0.00 0.00 0.00 0.00 53.44 53.48 3jr2 n ALA 81 Cb 0.00 -2.33 -0.14 0.00 0.00 0.00 0.00 19.45 16.98 3jr2 n ALA 81 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3jr2 h ASP 82 N 2.22 0.43 -4.28 0.00 3.32 -1.16 -3.42 116.42 113.53 3jr2 h ASP 82 Ca -0.49 -0.89 -0.54 0.00 0.02 0.00 0.00 57.03 55.13 3jr2 h ASP 82 Cb 1.28 -0.14 -0.29 0.00 0.22 0.00 0.00 39.33 40.40 3jr2 h ASP 82 CO 0.61 1.75 -0.83 0.26 -1.72 0.00 0.00 179.24 179.31 3jr2 s TRP 83 N -2.53 1.54 0.20 4.55 0.51 -0.73 -1.31 118.94 121.16 3jr2 s TRP 83 Ca -0.21 -0.30 0.08 0.00 -2.12 0.00 0.00 56.10 53.56 3jr2 s TRP 83 Cb 0.06 -0.99 -0.05 0.00 -0.81 0.00 0.00 33.47 31.68 3jr2 s TRP 83 CO 0.78 -0.03 -0.16 0.96 -0.51 0.00 0.00 176.95 177.98 3jr2 s ILE 84 N -0.37 1.82 0.01 2.03 -4.36 -0.77 -0.90 121.20 118.65 3jr2 s ILE 84 Ca 0.06 -2.13 0.01 0.00 -0.26 0.00 0.00 60.65 58.33 3jr2 s ILE 84 Cb -0.07 -1.99 -0.04 0.00 1.25 0.00 0.00 42.46 41.61 3jr2 s ILE 84 CO -0.00 -0.49 0.03 0.42 0.24 0.00 0.00 174.94 175.14 3jr2 s THR 85 N -2.62 4.36 -0.05 8.37 -4.23 -1.08 -0.98 115.64 119.41 3jr2 s THR 85 Ca 0.21 -0.57 0.02 0.00 -1.18 0.00 0.00 61.69 60.17 3jr2 s THR 85 Cb -0.03 -2.97 0.01 0.00 1.34 0.00 0.00 72.50 70.85 3jr2 s THR 85 CO 0.07 0.34 -0.09 -0.69 -0.54 0.00 0.00 174.62 173.72 3jr2 s VAL 86 N -1.15 0.83 0.35 2.29 1.01 0.32 -2.37 120.40 121.68 3jr2 s VAL 86 Ca 0.21 -0.33 -0.28 0.00 0.00 0.00 0.00 61.98 61.59 3jr2 s VAL 86 Cb -0.12 -0.78 -0.10 0.00 0.00 0.00 0.00 36.38 35.39 3jr2 s VAL 86 CO 0.12 0.28 1.29 -0.55 0.00 0.00 0.00 175.10 176.25 3jr2 s SER 87 N 0.59 6.64 0.63 3.32 0.15 0.30 0.52 113.70 125.85 3jr2 s SER 87 Ca -0.10 2.65 0.33 0.00 0.70 0.00 0.00 55.95 59.53 3jr2 s SER 87 Cb -0.13 -2.64 1.84 0.00 -1.71 0.00 0.00 66.02 63.38 3jr2 s SER 87 CO 0.02 -0.62 2.13 0.00 1.20 0.00 0.00 173.24 175.96 3jr2 h ALA 88 N 3.15 1.50 -0.00 5.45 0.00 -1.50 -0.55 119.26 127.31 3jr2 h ALA 88 Ca -0.49 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3jr2 h ALA 88 Cb 1.23 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.03 3jr2 h ALA 88 CO 0.64 -0.23 -0.03 0.00 0.00 0.00 0.00 179.25 179.63 3jr2 n ALA 89 N -2.17 2.53 -1.76 0.00 0.00 -1.26 -4.84 120.51 113.01 3jr2 n ALA 89 Ca -0.00 -0.16 -0.39 0.00 0.00 0.00 0.00 53.44 52.89 3jr2 n ALA 89 Cb 0.27 -1.45 0.02 0.00 0.00 0.00 0.00 19.45 18.30 3jr2 n ALA 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3jr2 s ALA 90 N -2.66 3.00 0.61 0.00 0.00 -0.21 -4.96 121.76 117.54 3jr2 s ALA 90 Ca 0.25 1.28 -0.18 0.00 0.00 0.00 0.00 51.96 53.31 3jr2 s ALA 90 Cb 0.20 -3.53 -0.03 0.00 0.00 0.00 0.00 23.12 19.76 3jr2 s ALA 90 CO 0.49 -1.13 1.23 -1.58 0.00 0.00 0.00 175.76 174.76 3jr2 s HIS 91 N -1.32 2.30 0.54 0.00 5.65 -1.26 -4.80 115.29 116.40 3jr2 s HIS 91 Ca 0.66 1.51 0.21 0.00 0.25 0.00 0.00 55.06 57.69 3jr2 s HIS 91 Cb -0.39 -3.53 1.39 0.00 -1.18 0.00 0.00 32.58 28.87 3jr2 s HIS 91 CO 0.47 -2.41 2.11 0.97 -0.65 0.00 0.00 174.74 175.23 3jr2 h ILE 92 N 0.74 0.83 -0.14 0.89 6.09 -1.95 0.33 117.51 124.30 3jr2 h ILE 92 Ca -0.50 0.00 -0.14 0.00 -1.37 0.00 0.00 64.86 62.85 3jr2 h ILE 92 Cb 1.31 0.90 -0.01 0.00 0.47 0.00 0.00 36.82 39.49 3jr2 h ILE 92 CO 0.54 0.00 -0.51 0.00 -3.07 0.00 0.00 178.15 175.11 3jr2 h ALA 93 N 1.90 0.85 -0.37 0.18 0.00 -1.99 0.16 119.26 119.99 3jr2 h ALA 93 Ca 0.08 -0.49 -0.07 0.00 0.00 0.00 0.00 54.91 54.43 3jr2 h ALA 93 Cb 0.35 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3jr2 h ALA 93 CO -0.00 0.67 -0.06 1.15 0.00 0.00 0.00 179.25 181.02 3jr2 h THR 94 N 0.31 1.27 -0.40 0.00 2.02 -1.34 -1.28 112.91 113.50 3jr2 h THR 94 Ca 0.01 -1.11 -0.00 0.00 0.77 0.00 0.00 66.41 66.08 3jr2 h THR 94 Cb 1.01 1.23 -0.02 0.00 -1.74 0.00 0.00 68.15 68.63 3jr2 h THR 94 CO 0.09 0.37 0.23 0.40 0.37 0.00 0.00 175.52 176.98 3jr2 h ILE 95 N 0.50 1.14 -0.97 3.11 2.04 -0.70 -1.60 117.51 121.04 3jr2 h ILE 95 Ca 0.10 -0.33 0.03 0.00 1.00 0.00 0.00 64.86 65.66 3jr2 h ILE 95 Cb 0.55 0.64 -0.05 0.00 -0.74 0.00 0.00 36.82 37.22 3jr2 h ILE 95 CO 0.03 0.14 0.64 0.00 0.00 0.00 0.00 178.15 178.96 3jr2 h ALA 96 N 1.09 1.36 -0.65 1.87 0.00 -0.66 -0.72 119.26 121.56 3jr2 h ALA 96 Ca 0.14 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 3jr2 h ALA 96 Cb 0.02 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.43 3jr2 h ALA 96 CO -0.03 0.55 0.15 0.00 0.00 0.00 0.00 179.25 179.93 3jr2 h ALA 97 N 1.43 0.85 -0.58 0.00 0.00 -0.68 0.15 119.26 120.44 3jr2 h ALA 97 Ca 0.38 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 3jr2 h ALA 97 Cb -0.02 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 3jr2 h ALA 97 CO -0.11 0.57 0.28 0.00 0.00 0.00 0.00 179.25 179.99 3jr2 h LYS 99 N 0.78 0.99 -0.30 0.00 1.63 -0.74 0.18 116.57 119.12 3jr2 h LYS 99 Ca 0.20 -0.29 0.01 0.00 -0.85 0.00 0.00 60.65 59.72 3jr2 h LYS 99 Cb 0.11 -0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 31.61 3jr2 h LYS 99 CO -0.03 0.96 0.17 -0.22 -3.45 0.00 0.00 179.45 176.89 3jr2 h LYS 100 N 0.92 0.35 -0.46 1.90 3.64 -0.55 -1.01 116.57 121.36 3jr2 h LYS 100 Ca 0.17 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.48 3jr2 h LYS 100 Cb 0.50 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.22 3jr2 h LYS 100 CO 0.02 0.23 0.11 0.28 -2.27 0.00 0.00 179.45 177.82 3jr2 h VAL 101 N 0.36 1.24 -0.78 2.00 2.07 -1.16 -2.63 116.25 117.35 3jr2 h VAL 101 Ca 0.12 -0.83 0.09 0.00 0.82 0.00 0.00 66.70 66.90 3jr2 h VAL 101 Cb -0.00 0.89 -0.07 0.00 -1.52 0.00 0.00 31.29 30.59 3jr2 h VAL 101 CO -0.05 0.29 0.43 0.00 0.02 0.00 0.00 177.57 178.26 3jr2 h ALA 102 N 0.97 1.09 0.00 1.67 0.00 -0.63 -0.35 119.26 122.01 3jr2 h ALA 102 Ca 0.14 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.01 3jr2 h ALA 102 Cb 0.33 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3jr2 h ALA 102 CO 0.00 0.06 -0.38 -0.44 0.00 0.00 0.00 179.25 178.48 3jr2 h ASP 103 N 0.73 0.00 0.07 0.00 3.32 -1.06 0.33 116.42 119.81 3jr2 h ASP 103 Ca 0.37 0.00 -0.28 0.00 0.02 0.00 0.00 57.03 57.15 3jr2 h ASP 103 Cb 0.34 0.00 0.03 0.00 0.22 0.00 0.00 39.33 39.92 3jr2 h ASP 103 CO -0.25 0.38 -1.13 -0.08 -1.72 0.00 0.00 179.24 176.45 3jr2 h GLU 104 N 0.00 0.64 -0.60 3.56 4.81 -0.98 -3.37 114.58 118.64 3jr2 h GLU 104 Ca -0.00 -0.78 -0.22 0.00 -0.13 0.00 0.00 59.36 58.22 3jr2 h GLU 104 Cb 0.76 0.25 -0.13 0.00 0.63 0.00 0.00 28.75 30.26 3jr2 h GLU 104 CO 0.05 1.35 0.20 1.28 -0.73 0.00 0.00 179.01 181.16 3jr2 n LEU 105 N -3.85 5.32 -3.55 1.64 4.77 -0.22 -4.95 117.00 116.16 3jr2 n LEU 105 Ca -0.13 -3.40 -0.22 0.00 -0.03 0.00 0.00 56.01 52.23 3jr2 n LEU 105 Cb 0.93 -0.70 0.08 0.00 -2.33 0.00 0.00 43.42 41.40 3jr2 n LEU 105 CO 0.57 0.95 0.20 -3.20 -1.33 0.00 0.00 177.39 174.57 3jr2 n ASN 106 N -0.65 -4.83 -4.78 -1.43 5.15 -0.81 -5.00 115.26 102.90 3jr2 n ASN 106 Ca 0.39 -0.58 -0.34 0.00 -0.60 0.00 0.00 54.58 53.45 3jr2 n ASN 106 Cb 1.26 -5.03 -0.07 0.00 -0.53 0.00 0.00 39.78 35.42 3jr2 n ASN 106 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3jr2 n GLY 107 N -1.71 3.54 3.16 8.20 0.00 0.11 -4.92 105.19 113.57 3jr2 n GLY 107 Ca -0.09 -2.38 -0.17 0.00 0.00 0.00 0.00 46.02 43.38 3jr2 n GLY 107 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3jr2 s GLU 108 N -3.91 0.79 -0.09 1.61 0.41 -0.43 -4.41 118.70 112.67 3jr2 s GLU 108 Ca 0.00 -0.99 -0.05 0.00 -0.41 0.00 0.00 54.97 53.52 3jr2 s GLU 108 Cb -0.00 -0.69 -0.04 0.00 -1.78 0.00 0.00 34.13 31.62 3jr2 s GLU 108 CO 0.00 0.14 0.12 0.42 -0.49 0.00 0.00 175.26 175.46 3jr2 s ILE 109 N -1.58 5.28 -0.10 -1.63 -1.09 -1.26 -1.86 121.20 118.97 3jr2 s ILE 109 Ca -0.01 0.05 0.03 0.00 -2.23 0.00 0.00 60.65 58.49 3jr2 s ILE 109 Cb -0.08 -3.33 0.01 0.00 -1.58 0.00 0.00 42.46 37.48 3jr2 s ILE 109 CO 0.02 0.56 -0.19 -1.10 -1.23 0.00 0.00 174.94 172.99 3jr2 s GLN 110 N -1.19 2.58 -0.19 2.79 -0.21 -0.15 -4.24 119.66 119.04 3jr2 s GLN 110 Ca 0.17 -0.71 -0.21 0.00 0.02 0.00 0.00 55.36 54.63 3jr2 s GLN 110 Cb -0.12 -2.03 -0.02 0.00 1.00 0.00 0.00 33.01 31.84 3jr2 s GLN 110 CO 0.07 0.08 0.65 0.42 -2.12 0.00 0.00 175.29 174.39 3jr2 s ILE 111 N 0.58 5.01 -0.21 1.08 -1.09 -0.59 -0.53 121.20 125.45 3jr2 s ILE 111 Ca -0.14 1.24 -0.27 0.00 -2.23 0.00 0.00 60.65 59.25 3jr2 s ILE 111 Cb -0.17 -3.97 -0.00 0.00 -1.58 0.00 0.00 42.46 36.74 3jr2 s ILE 111 CO 0.05 0.10 0.92 -1.61 -1.23 0.00 0.00 174.94 173.17 3jr2 s GLU 112 N 1.93 4.25 -0.56 2.79 0.41 0.19 -0.31 118.70 127.39 3jr2 s GLU 112 Ca 0.30 1.14 -0.27 0.00 -0.41 0.00 0.00 54.97 55.73 3jr2 s GLU 112 Cb -0.16 -3.62 0.03 0.00 -1.78 0.00 0.00 34.13 28.60 3jr2 s GLU 112 CO 0.11 -0.50 1.09 0.42 -0.49 0.00 0.00 175.26 175.88 3jr2 s ILE 113 N 2.76 4.19 0.06 -1.63 1.01 -0.61 -1.42 121.20 125.56 3jr2 s ILE 113 Ca 0.40 0.71 -0.06 0.00 0.00 0.00 0.00 60.65 61.69 3jr2 s ILE 113 Cb -0.16 -4.64 -0.01 0.00 0.01 0.00 0.00 42.46 37.67 3jr2 s ILE 113 CO 0.09 -1.21 0.12 -0.31 0.00 0.00 0.00 174.94 173.63 3jr2 s TYR 114 N 4.50 0.24 0.00 3.97 2.02 -1.26 -4.73 117.35 122.09 3jr2 s TYR 114 Ca 0.39 -0.64 0.00 0.00 -0.37 0.00 0.00 57.07 56.44 3jr2 s TYR 114 Cb -0.09 -0.15 0.00 0.00 -0.40 0.00 0.00 41.96 41.32 3jr2 s TYR 114 CO 0.24 -0.45 0.00 0.41 -1.57 0.00 0.00 175.55 174.18 3jr2 n GLY 115 N 0.25 -1.86 2.45 0.71 0.00 -1.26 -4.25 105.19 101.23 3jr2 n GLY 115 Ca -0.16 -1.46 -0.33 0.00 0.00 0.00 0.00 46.02 44.07 3jr2 n GLY 115 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3jr2 n ASN 116 N 0.55 7.34 -4.77 1.61 5.03 -1.26 -4.97 115.26 118.79 3jr2 n ASN 116 Ca 0.00 -3.10 -0.36 0.00 0.87 0.00 0.00 54.58 51.99 3jr2 n ASN 116 Cb 0.00 -1.33 -0.01 0.00 -1.02 0.00 0.00 39.78 37.43 3jr2 n ASN 116 CO 0.00 0.00 0.00 -1.66 -1.83 0.00 0.00 177.26 173.77 3jr2 s TRP 117 N -1.06 2.80 0.00 3.10 1.48 -1.26 -5.12 118.94 118.88 3jr2 s TRP 117 Ca 0.58 1.54 0.00 0.00 -1.06 0.00 0.00 56.10 57.16 3jr2 s TRP 117 Cb 0.27 -3.32 0.00 0.00 -1.16 0.00 0.00 33.47 29.26 3jr2 s TRP 117 CO -0.14 -1.48 0.00 0.25 -4.06 0.00 0.00 176.95 171.52 3jr2 n THR 118 N -0.86 0.00 0.00 0.66 -2.24 -1.26 -5.03 114.28 105.55 3jr2 n THR 118 Ca 0.09 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 3jr2 n THR 118 Cb 0.50 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.73 3jr2 n THR 118 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3jr2 n GLN 120 N 0.00 0.00 -0.16 -0.78 6.02 -1.26 -1.73 117.38 119.47 3jr2 n GLN 120 Ca 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 57.00 56.91 3jr2 n GLN 120 Cb 0.00 0.00 0.01 0.00 1.02 0.00 0.00 30.24 31.27 3jr2 n GLN 120 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.06 175.61 3jr2 h ASP 121 N 0.00 0.58 -0.79 1.08 3.32 -1.99 -1.94 116.42 116.67 3jr2 h ASP 121 Ca 0.00 -0.10 -0.02 0.00 0.02 0.00 0.00 57.03 56.93 3jr2 h ASP 121 Cb 0.00 -0.15 -0.04 0.00 0.22 0.00 0.00 39.33 39.37 3jr2 h ASP 121 CO 0.00 0.51 0.40 0.00 -1.72 0.00 0.00 179.24 178.43 3jr2 h ALA 122 N 1.09 1.02 -0.64 3.45 0.00 -1.76 -1.00 119.26 121.42 3jr2 h ALA 122 Ca 0.16 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3jr2 h ALA 122 Cb 0.06 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 3jr2 h ALA 122 CO -0.03 0.57 0.40 0.87 0.00 0.00 0.00 179.25 181.07 3jr2 h LYS 123 N 1.11 0.86 -0.71 0.00 1.57 -1.80 -1.66 116.57 115.96 3jr2 h LYS 123 Ca 0.27 -0.06 -0.05 0.00 -1.87 0.00 0.00 60.65 58.95 3jr2 h LYS 123 Cb 0.09 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.18 3jr2 h LYS 123 CO -0.04 0.59 0.26 0.00 -0.57 0.00 0.00 179.45 179.70 3jr2 h ALA 124 N 1.56 0.92 -0.32 3.86 0.00 -0.43 0.37 119.26 125.22 3jr2 h ALA 124 Ca 0.23 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 3jr2 h ALA 124 Cb -0.06 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 3jr2 h ALA 124 CO -0.05 0.56 0.19 -1.49 0.00 0.00 0.00 179.25 178.46 3jr2 h TRP 125 N 1.02 0.43 -0.87 0.00 6.55 -0.83 -2.17 115.95 120.08 3jr2 h TRP 125 Ca 0.23 -0.00 -0.02 0.00 0.95 0.00 0.00 58.89 60.05 3jr2 h TRP 125 Cb 0.24 -0.14 -0.04 0.00 -0.86 0.00 0.00 29.16 28.36 3jr2 h TRP 125 CO 0.02 0.33 0.47 0.28 -1.05 0.00 0.00 178.44 178.48 3jr2 h VAL 126 N 0.41 1.25 0.00 1.49 2.07 -0.98 -1.87 116.25 118.61 3jr2 h VAL 126 Ca 0.11 -0.64 -0.01 0.00 0.82 0.00 0.00 66.70 66.99 3jr2 h VAL 126 Cb 0.03 0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 29.89 3jr2 h VAL 126 CO -0.02 0.29 -0.04 -0.78 0.02 0.00 0.00 177.57 177.04 3jr2 h ASP 127 N 1.22 0.00 0.56 0.57 3.58 -0.62 0.83 116.42 122.56 3jr2 h ASP 127 Ca 0.30 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.75 3jr2 h ASP 127 Cb 0.04 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.09 3jr2 h ASP 127 CO -0.05 0.04 0.00 0.18 -2.88 0.00 0.00 179.24 176.53 3jr2 n LEU 128 N -4.40 0.00 0.00 2.28 4.77 -0.77 -4.88 117.00 114.00 3jr2 n LEU 128 Ca -0.03 0.37 0.00 0.00 -0.03 0.00 0.00 56.01 56.32 3jr2 n LEU 128 Cb 0.12 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.85 3jr2 n LEU 128 CO 0.34 -0.09 0.00 0.61 -1.33 0.00 0.00 177.39 176.92 3jr2 n GLY 129 N 0.71 0.75 3.71 -0.72 0.00 0.29 -5.05 105.19 104.88 3jr2 n GLY 129 Ca 0.09 -0.36 -0.37 0.00 0.00 0.00 0.00 46.02 45.37 3jr2 n GLY 129 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3jr2 s ILE 130 N -2.00 5.24 -0.05 -0.61 1.01 -0.82 -4.96 121.20 119.00 3jr2 s ILE 130 Ca 0.00 0.73 0.09 0.00 0.00 0.00 0.00 60.65 61.47 3jr2 s ILE 130 Cb 0.00 -3.72 0.14 0.00 0.01 0.00 0.00 42.46 38.89 3jr2 s ILE 130 CO 0.00 0.33 1.07 0.35 0.00 0.00 0.00 174.94 176.69 3jr2 n THR 131 N 3.83 0.75 -4.91 2.92 -2.24 -1.26 -3.66 114.28 109.72 3jr2 n THR 131 Ca -0.09 -0.98 -0.26 0.00 -2.27 0.00 0.00 64.05 60.45 3jr2 n THR 131 Cb 0.52 0.24 -0.16 0.00 -2.10 0.00 0.00 70.33 68.83 3jr2 n THR 131 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3jr2 s GLN 132 N -1.15 1.56 0.03 -0.78 -0.21 -1.26 -0.31 119.66 117.55 3jr2 s GLN 132 Ca 0.15 -0.67 -0.08 0.00 0.02 0.00 0.00 55.36 54.77 3jr2 s GLN 132 Cb 0.13 -1.49 -0.00 0.00 1.00 0.00 0.00 33.01 32.65 3jr2 s GLN 132 CO -0.00 0.39 0.16 0.00 -2.12 0.00 0.00 175.29 173.72 3jr2 s ALA 133 N -0.39 -0.28 -0.22 6.09 0.00 -1.04 -1.54 121.76 124.38 3jr2 s ALA 133 Ca 0.06 -0.33 -0.04 0.00 0.00 0.00 0.00 51.96 51.65 3jr2 s ALA 133 Cb -0.08 0.25 -0.01 0.00 0.00 0.00 0.00 23.12 23.28 3jr2 s ALA 133 CO -0.00 -0.33 -0.02 0.42 0.00 0.00 0.00 175.76 175.82 3jr2 s ILE 134 N -2.44 3.62 -0.23 0.00 -1.09 0.57 -0.72 121.20 120.91 3jr2 s ILE 134 Ca -0.06 -0.41 -0.01 0.00 -2.23 0.00 0.00 60.65 57.93 3jr2 s ILE 134 Cb -0.02 -2.65 0.02 0.00 -1.58 0.00 0.00 42.46 38.23 3jr2 s ILE 134 CO -0.03 0.41 -0.09 -0.47 -1.23 0.00 0.00 174.94 173.53 3jr2 s TYR 135 N 1.36 3.00 0.08 3.97 5.04 -0.08 -1.57 117.35 129.15 3jr2 s TYR 135 Ca 0.04 -1.53 -0.07 0.00 -2.44 0.00 0.00 57.07 53.08 3jr2 s TYR 135 Cb -0.14 -2.03 -0.05 0.00 0.35 0.00 0.00 41.96 40.08 3jr2 s TYR 135 CO -0.01 -0.73 0.34 -1.58 -1.34 0.00 0.00 175.55 172.24 3jr2 s HIS 136 N 1.33 3.54 0.46 4.97 5.65 -1.26 -2.30 115.29 127.68 3jr2 s HIS 136 Ca 0.01 0.62 -0.22 0.00 0.25 0.00 0.00 55.06 55.72 3jr2 s HIS 136 Cb -0.16 -2.04 -0.10 0.00 -1.18 0.00 0.00 32.58 29.11 3jr2 s HIS 136 CO -0.06 0.52 0.87 -2.13 -0.65 0.00 0.00 174.74 173.29 3jr2 n ARG 137 N 0.65 1.05 -1.68 2.88 0.63 -0.46 -4.79 116.66 114.93 3jr2 n ARG 137 Ca -0.07 0.38 -0.46 0.00 -0.92 0.00 0.00 57.85 56.78 3jr2 n ARG 137 Cb 0.52 -1.93 -0.04 0.00 0.45 0.00 0.00 32.46 31.46 3jr2 n ARG 137 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 3jr2 n SER 138 N 0.44 3.49 0.02 6.15 2.88 -1.26 -4.84 113.62 120.49 3jr2 n SER 138 Ca 0.11 1.00 -0.03 0.00 -1.33 0.00 0.00 58.87 58.61 3jr2 n SER 138 Cb 0.41 -1.42 0.20 0.00 -0.75 0.00 0.00 64.21 62.65 3jr2 n SER 138 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 3jr2 h ARG 139 N 8.29 0.47 -0.46 -1.46 3.08 -1.94 -0.78 114.38 121.57 3jr2 h ARG 139 Ca -0.47 -0.18 0.01 0.00 0.07 0.00 0.00 59.98 59.40 3jr2 h ARG 139 Cb 1.26 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 31.26 3jr2 h ARG 139 CO 0.93 0.70 0.30 -0.44 -1.07 0.00 0.00 179.97 180.39 3jr2 h ASP 140 N 0.41 0.51 -0.55 7.04 3.32 -1.97 -1.35 116.42 123.84 3jr2 h ASP 140 Ca 0.06 -0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.06 3jr2 h ASP 140 Cb 0.69 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.09 3jr2 h ASP 140 CO 0.05 0.37 0.21 0.00 -1.72 0.00 0.00 179.24 178.15 3jr2 h ALA 141 N 1.17 0.71 -0.48 3.45 0.00 -1.78 -3.04 119.26 119.29 3jr2 h ALA 141 Ca 0.17 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3jr2 h ALA 141 Cb -0.06 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 3jr2 h ALA 141 CO -0.04 0.33 0.28 1.49 0.00 0.00 0.00 179.25 181.31 3jr2 h GLU 142 N 0.75 0.65 -0.21 0.00 4.81 -0.86 -0.80 114.58 118.92 3jr2 h GLU 142 Ca 0.18 -0.06 0.06 0.00 -0.13 0.00 0.00 59.36 59.41 3jr2 h GLU 142 Cb 0.21 -0.14 -0.07 0.00 0.63 0.00 0.00 28.75 29.39 3jr2 h GLU 142 CO -0.01 0.48 -0.24 -0.07 -0.73 0.00 0.00 179.01 178.44 3jr2 h LEU 143 N 0.64 -0.75 -0.03 1.64 3.38 -1.21 -0.95 115.31 118.02 3jr2 h LEU 143 Ca 0.17 0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.27 3jr2 h LEU 143 Cb 0.00 0.35 0.00 0.00 0.09 0.00 0.00 40.66 41.10 3jr2 h LEU 143 CO -0.03 -0.28 0.00 0.00 0.09 0.00 0.00 178.44 178.22 3jr2 n ALA 144 N -2.77 1.56 -2.22 1.53 0.00 -0.97 -4.89 120.51 112.74 3jr2 n ALA 144 Ca -0.01 -0.04 -0.04 0.00 0.00 0.00 0.00 53.44 53.35 3jr2 n ALA 144 Cb 0.29 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.53 3jr2 n ALA 144 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3jr2 n GLY 145 N -0.24 0.32 0.51 0.00 0.00 -0.36 -4.98 105.19 100.44 3jr2 n GLY 145 Ca 0.03 -0.67 0.06 0.00 0.00 0.00 0.00 46.02 45.44 3jr2 n GLY 145 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3jr2 n ILE 146 N -3.76 1.43 -1.47 -0.61 -5.35 -0.42 -5.02 119.36 104.17 3jr2 n ILE 146 Ca -0.04 -2.05 0.00 0.00 -0.27 0.00 0.00 62.75 60.39 3jr2 n ILE 146 Cb 0.53 0.05 0.00 0.00 -1.74 0.00 0.00 39.64 38.48 3jr2 n ILE 146 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3jr2 n GLY 147 N -0.83 0.01 3.89 3.28 0.00 -1.26 -4.87 105.19 105.40 3jr2 n GLY 147 Ca 0.13 -1.53 -0.34 0.00 0.00 0.00 0.00 46.02 44.28 3jr2 n GLY 147 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3jr2 s TRP 148 N 0.00 3.56 0.23 1.61 0.52 -1.26 -4.10 118.94 119.49 3jr2 s TRP 148 Ca 0.00 0.57 -0.30 0.00 0.02 0.00 0.00 56.10 56.39 3jr2 s TRP 148 Cb 0.00 -1.99 -0.09 0.00 -1.15 0.00 0.00 33.47 30.24 3jr2 s TRP 148 CO 0.00 0.58 1.02 0.95 0.02 0.00 0.00 176.95 179.52 3jr2 s THR 149 N -1.37 3.89 0.58 2.01 -4.23 -1.26 -4.90 115.64 110.35 3jr2 s THR 149 Ca 0.30 1.81 0.36 0.00 -1.18 0.00 0.00 61.69 62.99 3jr2 s THR 149 Cb -0.13 -4.16 0.39 0.00 1.34 0.00 0.00 72.50 69.95 3jr2 s THR 149 CO 0.18 0.40 2.28 0.71 -0.54 0.00 0.00 174.62 177.65 3jr2 h THR 150 N 3.33 0.27 -0.74 3.99 1.35 -1.99 -1.34 112.91 117.77 3jr2 h THR 150 Ca -0.45 -0.09 -0.04 0.00 -0.55 0.00 0.00 66.41 65.28 3jr2 h THR 150 Cb 1.21 1.07 -0.03 0.00 -1.73 0.00 0.00 68.15 68.66 3jr2 h THR 150 CO 0.69 0.01 0.31 0.44 -0.25 0.00 0.00 175.52 176.73 3jr2 h ASP 151 N 0.00 1.00 0.04 5.36 3.45 -2.00 -1.91 116.42 122.37 3jr2 h ASP 151 Ca -0.00 -0.16 -0.11 0.00 0.43 0.00 0.00 57.03 57.19 3jr2 h ASP 151 Cb 0.07 -0.26 -0.01 0.00 -0.56 0.00 0.00 39.33 38.56 3jr2 h ASP 151 CO 0.00 0.89 -0.33 0.44 -1.57 0.00 0.00 179.24 178.67 3jr2 h ASP 152 N 1.06 0.43 -0.70 6.45 3.45 -1.64 -1.59 116.42 123.87 3jr2 h ASP 152 Ca 0.25 -0.16 -0.03 0.00 0.43 0.00 0.00 57.03 57.52 3jr2 h ASP 152 Cb 0.18 -0.12 -0.03 0.00 -0.56 0.00 0.00 39.33 38.81 3jr2 h ASP 152 CO -0.02 0.73 0.34 -0.07 -1.57 0.00 0.00 179.24 178.65 3jr2 h LEU 153 N 0.36 0.92 -0.54 1.55 3.38 -1.13 -2.44 115.31 117.41 3jr2 h LEU 153 Ca 0.04 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 3jr2 h LEU 153 Cb 0.75 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.24 3jr2 h LEU 153 CO 0.06 0.79 0.33 -0.78 0.09 0.00 0.00 178.44 178.94 3jr2 h ASP 154 N 0.98 0.64 0.00 -0.43 3.58 -1.16 -0.70 116.42 119.33 3jr2 h ASP 154 Ca 0.24 -0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.65 3jr2 h ASP 154 Cb 0.12 -0.16 0.00 0.00 1.72 0.00 0.00 39.33 41.01 3jr2 h ASP 154 CO -0.03 0.49 0.00 0.29 -2.88 0.00 0.00 179.24 177.11 3jr2 n LYS 155 N -4.68 0.16 0.00 0.28 5.02 -0.62 -1.89 118.16 116.43 3jr2 n LYS 155 Ca 0.03 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.32 3jr2 n LYS 155 Cb 0.04 -1.38 0.00 0.00 -0.02 0.00 0.00 35.03 33.67 3jr2 n LYS 155 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3jr2 n ARG 157 N 0.86 0.00 -0.14 1.97 1.74 -0.27 -1.26 116.66 119.55 3jr2 n ARG 157 Ca 0.00 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.98 3jr2 n ARG 157 Cb 0.07 0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 31.50 3jr2 n ARG 157 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 3jr2 h GLN 158 N 0.00 0.68 -0.34 5.56 4.20 -1.65 -0.85 115.11 122.70 3jr2 h GLN 158 Ca 0.00 -0.18 -0.01 0.00 0.06 0.00 0.00 58.65 58.52 3jr2 h GLN 158 Cb 0.00 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 27.68 3jr2 h GLN 158 CO 0.00 0.71 0.18 -0.07 -0.67 0.00 0.00 178.83 178.98 3jr2 h LEU 159 N 0.54 0.44 -0.99 1.46 3.38 -1.47 -2.77 115.31 115.90 3jr2 h LEU 159 Ca 0.13 -0.11 0.11 0.00 0.09 0.00 0.00 57.88 58.10 3jr2 h LEU 159 Cb 0.36 -0.11 -0.08 0.00 0.09 0.00 0.00 40.66 40.91 3jr2 h LEU 159 CO 0.01 0.42 0.62 -1.28 0.09 0.00 0.00 178.44 178.30 3jr2 h SER 160 N 0.42 0.92 0.18 -0.43 0.87 -1.64 -1.60 113.55 112.28 3jr2 h SER 160 Ca 0.12 0.04 -0.02 0.00 -1.23 0.00 0.00 61.79 60.71 3jr2 h SER 160 Cb 0.09 -0.14 -0.00 0.00 -0.44 0.00 0.00 62.40 61.91 3jr2 h SER 160 CO -0.02 0.50 -0.08 0.00 -0.53 0.00 0.00 176.83 176.70 3jr2 h ALA 161 N 1.53 1.48 -0.00 6.23 0.00 -0.87 -0.49 119.26 127.14 3jr2 h ALA 161 Ca 0.49 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.32 3jr2 h ALA 161 Cb 0.45 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.23 3jr2 h ALA 161 CO -0.26 0.10 -0.04 1.28 0.00 0.00 0.00 179.25 180.34 3jr2 n LEU 162 N -3.89 0.25 0.00 0.00 4.77 -0.63 -4.90 117.00 112.60 3jr2 n LEU 162 Ca -0.02 0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 3jr2 n LEU 162 Cb 0.18 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 3jr2 n LEU 162 CO 0.30 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 3jr2 n GLY 163 N 1.21 0.81 3.72 -0.72 0.00 -0.19 -5.04 105.19 104.98 3jr2 n GLY 163 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 3jr2 n GLY 163 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3jr2 s ILE 164 N -2.04 4.88 -0.29 -0.61 1.01 -1.05 -4.85 121.20 118.25 3jr2 s ILE 164 Ca 0.00 1.77 -0.11 0.00 0.00 0.00 0.00 60.65 62.31 3jr2 s ILE 164 Cb 0.00 -4.19 -0.04 0.00 0.01 0.00 0.00 42.46 38.24 3jr2 s ILE 164 CO 0.00 0.24 0.20 -1.61 0.00 0.00 0.00 174.94 173.77 3jr2 s GLU 165 N 0.69 3.85 0.18 2.79 2.02 0.57 -3.98 118.70 124.83 3jr2 s GLU 165 Ca 0.44 -0.39 -0.14 0.00 0.02 0.00 0.00 54.97 54.91 3jr2 s GLU 165 Cb -0.20 -3.69 -0.07 0.00 0.10 0.00 0.00 34.13 30.27 3jr2 s GLU 165 CO 0.24 -0.24 0.57 -0.51 0.02 0.00 0.00 175.26 175.34 3jr2 s LEU 166 N 1.76 4.28 -0.21 1.80 1.43 -0.26 -2.50 118.68 124.98 3jr2 s LEU 166 Ca 0.07 1.08 -0.06 0.00 -1.03 0.00 0.00 54.13 54.18 3jr2 s LEU 166 Cb -0.16 -3.44 -0.03 0.00 0.03 0.00 0.00 46.19 42.59 3jr2 s LEU 166 CO 0.11 0.04 0.04 -0.44 0.23 0.00 0.00 176.35 176.32 3jr2 s SER 167 N -1.90 5.14 -0.16 2.29 0.01 0.10 0.30 113.70 119.48 3jr2 s SER 167 Ca 0.41 -0.12 -0.03 0.00 1.31 0.00 0.00 55.95 57.52 3jr2 s SER 167 Cb -0.14 -1.89 -0.02 0.00 0.21 0.00 0.00 66.02 64.18 3jr2 s SER 167 CO 0.20 0.07 -0.04 -0.63 0.41 0.00 0.00 173.24 173.24 3jr2 s ILE 168 N 0.98 3.78 0.02 1.44 1.01 -0.55 -0.90 121.20 126.97 3jr2 s ILE 168 Ca 0.03 -0.39 -0.12 0.00 0.00 0.00 0.00 60.65 60.16 3jr2 s ILE 168 Cb -0.14 -2.66 0.01 0.00 0.01 0.00 0.00 42.46 39.69 3jr2 s ILE 168 CO 0.02 0.49 0.26 0.28 0.00 0.00 0.00 174.94 175.99 3jr2 s THR 169 N 0.48 0.08 0.00 2.92 -1.32 -0.97 -1.04 115.64 115.78 3jr2 s THR 169 Ca -0.04 -0.66 0.00 0.00 -1.21 0.00 0.00 61.69 59.78 3jr2 s THR 169 Cb -0.14 -0.74 0.00 0.00 -1.51 0.00 0.00 72.50 70.10 3jr2 s THR 169 CO 0.03 -0.36 0.00 0.61 -2.21 0.00 0.00 174.62 172.69 3jr2 n GLY 170 N 0.98 1.46 2.44 6.08 0.00 -1.26 -1.36 105.19 113.53 3jr2 n GLY 170 Ca -0.20 -0.49 -0.19 0.00 0.00 0.00 0.00 46.02 45.14 3jr2 n GLY 170 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3jr2 n GLY 171 N 0.00 0.60 3.70 -0.02 0.00 -1.26 -4.74 105.19 103.47 3jr2 n GLY 171 Ca 0.00 -0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 3jr2 n GLY 171 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3jr2 s ILE 172 N -2.82 2.80 0.14 -0.61 -1.09 -1.26 -5.00 121.20 113.35 3jr2 s ILE 172 Ca 0.00 0.41 0.02 0.00 -2.23 0.00 0.00 60.65 58.86 3jr2 s ILE 172 Cb 0.00 -3.26 -0.04 0.00 -1.58 0.00 0.00 42.46 37.57 3jr2 s ILE 172 CO 0.00 0.01 -0.05 0.68 -1.23 0.00 0.00 174.94 174.35 3jr2 s VAL 173 N 2.05 0.80 0.50 2.92 -7.23 -1.26 -4.94 120.40 113.25 3jr2 s VAL 173 Ca 0.73 -1.98 0.22 0.00 -1.81 0.00 0.00 61.98 59.14 3jr2 s VAL 173 Cb -0.42 -1.87 0.37 0.00 0.56 0.00 0.00 36.38 35.02 3jr2 s VAL 173 CO 0.32 -0.71 1.99 -0.65 -0.31 0.00 0.00 175.10 175.75 3jr2 h PRO 174 N 2.83 0.11 0.00 4.82 0.11 -1.90 -0.35 132.00 137.62 3jr2 h PRO 174 Ca -0.36 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.73 3jr2 h PRO 174 Cb 1.18 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 3jr2 h PRO 174 CO 0.64 0.07 -0.07 0.93 -0.21 0.00 0.00 178.00 179.36 3jr2 h GLU 175 N 0.12 0.00 0.00 1.05 3.07 -1.97 -2.59 114.58 114.25 3jr2 h GLU 175 Ca 0.26 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.12 3jr2 h GLU 175 Cb 0.86 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.77 3jr2 h GLU 175 CO -0.03 0.07 -0.29 -0.44 -1.40 0.00 0.00 179.01 176.92 3jr2 h ASP 176 N 0.00 0.00 -0.73 1.42 3.32 -1.45 -3.41 116.42 115.57 3jr2 h ASP 176 Ca -0.00 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.98 3jr2 h ASP 176 Cb 0.45 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.97 3jr2 h ASP 176 CO 0.01 0.04 0.46 0.40 -1.72 0.00 0.00 179.24 178.42 3jr2 h ILE 177 N 0.00 1.20 -0.20 0.35 1.08 -1.51 -1.87 117.51 116.55 3jr2 h ILE 177 Ca 0.00 -0.40 0.06 0.00 -0.39 0.00 0.00 64.86 64.12 3jr2 h ILE 177 Cb 0.80 0.16 -0.01 0.00 -3.07 0.00 0.00 36.82 34.70 3jr2 h ILE 177 CO 0.00 0.20 0.18 0.10 -0.69 0.00 0.00 178.15 177.94 3jr2 h TYR 178 N 0.99 0.00 -0.31 1.37 -0.00 -1.80 -2.01 116.97 115.21 3jr2 h TYR 178 Ca 0.26 0.00 0.09 0.00 0.00 0.00 0.00 58.73 59.08 3jr2 h TYR 178 Cb -0.07 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 36.65 3jr2 h TYR 178 CO -0.02 0.00 0.30 -0.07 -0.00 0.00 0.00 178.16 178.38 3jr2 h LEU 179 N 0.00 0.00 -2.60 0.10 3.38 -1.64 -2.49 115.31 112.05 3jr2 h LEU 179 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 3jr2 h LEU 179 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 3jr2 h LEU 179 CO -0.00 0.00 0.00 0.49 0.09 0.00 0.00 178.44 179.02 3jr2 n PHE 180 N -3.92 0.63 -1.64 1.13 3.72 -0.75 -4.97 117.46 111.66 3jr2 n PHE 180 Ca 0.05 -0.41 -0.46 0.00 -0.05 0.00 0.00 57.45 56.58 3jr2 n PHE 180 Cb 0.46 -0.01 -0.03 0.00 -0.94 0.00 0.00 39.48 38.96 3jr2 n PHE 180 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 3jr2 n GLU 181 N 1.17 1.72 -0.10 -1.08 2.13 -0.94 -1.82 120.64 121.72 3jr2 n GLU 181 Ca 0.18 0.61 0.00 0.00 0.66 0.00 0.00 57.16 58.61 3jr2 n GLU 181 Cb 0.53 -2.21 0.00 0.00 0.27 0.00 0.00 31.44 30.03 3jr2 n GLU 181 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3jr2 n GLY 182 N 2.11 0.91 3.72 8.31 0.00 -1.26 -5.03 105.19 113.95 3jr2 n GLY 182 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 3jr2 n GLY 182 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3jr2 s ILE 183 N -2.44 5.35 -0.03 -0.61 1.01 -0.75 -5.00 121.20 118.72 3jr2 s ILE 183 Ca 0.00 0.36 -0.30 0.00 0.00 0.00 0.00 60.65 60.72 3jr2 s ILE 183 Cb 0.00 -3.55 -0.06 0.00 0.01 0.00 0.00 42.46 38.85 3jr2 s ILE 183 CO 0.00 0.40 1.74 -0.54 0.00 0.00 0.00 174.94 176.54 3jr2 s LYS 184 N 0.50 4.16 -0.08 2.79 1.02 -1.26 -4.95 119.74 121.91 3jr2 s LYS 184 Ca 0.12 2.29 0.00 0.00 0.02 0.00 0.00 55.97 58.40 3jr2 s LYS 184 Cb -0.12 -4.04 0.02 0.00 -0.52 0.00 0.00 37.83 33.18 3jr2 s LYS 184 CO 0.01 -0.89 -0.06 0.99 -0.92 0.00 0.00 175.35 174.49 3jr2 s THR 185 N 4.20 0.77 -0.10 2.17 2.01 -1.26 -1.10 115.64 122.33 3jr2 s THR 185 Ca 0.78 -0.18 -0.15 0.00 0.31 0.00 0.00 61.69 62.44 3jr2 s THR 185 Cb -0.36 -0.81 -0.28 0.00 0.01 0.00 0.00 72.50 71.07 3jr2 s THR 185 CO 0.33 0.31 0.57 0.50 -0.69 0.00 0.00 174.62 175.64 3jr2 h LYS 186 N 7.80 0.26 -3.43 4.92 1.63 -0.38 -3.31 116.57 124.05 3jr2 h LYS 186 Ca -0.29 -0.45 -0.08 0.00 -0.85 0.00 0.00 60.65 58.98 3jr2 h LYS 186 Cb 1.14 0.17 -0.15 0.00 -0.60 0.00 0.00 32.23 32.79 3jr2 h LYS 186 CO 0.40 1.21 -0.24 0.95 -3.45 0.00 0.00 179.45 178.32 3jr2 s THR 187 N -2.49 0.09 -0.13 1.00 -4.23 -1.22 -4.41 115.64 104.27 3jr2 s THR 187 Ca -0.19 -0.77 -0.04 0.00 -1.18 0.00 0.00 61.69 59.51 3jr2 s THR 187 Cb 0.04 -1.08 -0.03 0.00 1.34 0.00 0.00 72.50 72.77 3jr2 s THR 187 CO 0.78 -0.43 0.02 -0.36 -0.54 0.00 0.00 174.62 174.09 3jr2 s PHE 188 N -3.10 3.19 -0.09 3.99 0.40 -1.26 -1.48 117.98 119.63 3jr2 s PHE 188 Ca -0.01 0.09 0.03 0.00 -0.60 0.00 0.00 56.93 56.44 3jr2 s PHE 188 Cb 0.01 -1.91 -0.01 0.00 0.51 0.00 0.00 43.02 41.62 3jr2 s PHE 188 CO -0.07 0.31 -0.18 0.42 0.70 0.00 0.00 175.22 176.40 3jr2 s ILE 189 N -0.33 2.66 0.20 0.64 1.01 -0.21 -1.38 121.20 123.78 3jr2 s ILE 189 Ca 0.07 -0.83 -0.04 0.00 0.00 0.00 0.00 60.65 59.85 3jr2 s ILE 189 Cb -0.12 -2.05 -0.03 0.00 0.01 0.00 0.00 42.46 40.27 3jr2 s ILE 189 CO 0.02 0.56 0.19 0.00 0.00 0.00 0.00 174.94 175.71 3jr2 s ALA 190 N -0.08 0.79 0.00 9.38 0.00 -0.67 -4.35 121.76 126.84 3jr2 s ALA 190 Ca -0.04 -1.46 0.00 0.00 0.00 0.00 0.00 51.96 50.46 3jr2 s ALA 190 Cb -0.14 1.22 0.00 0.00 0.00 0.00 0.00 23.12 24.20 3jr2 s ALA 190 CO 0.04 -0.63 0.00 0.41 0.00 0.00 0.00 175.76 175.58 3jr2 n GLY 191 N -0.26 0.75 0.33 0.00 0.00 -1.26 -1.11 105.19 103.65 3jr2 n GLY 191 Ca -0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 3jr2 n GLY 191 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3jr2 h ARG 192 N 0.00 0.28 -0.02 1.61 3.08 -1.96 -1.64 114.38 115.73 3jr2 h ARG 192 Ca 0.00 -0.02 0.01 0.00 0.07 0.00 0.00 59.98 60.04 3jr2 h ARG 192 Cb 0.00 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 29.99 3jr2 h ARG 192 CO 0.00 0.18 0.04 0.00 -1.07 0.00 0.00 179.97 179.12 3jr2 h ALA 193 N 1.77 1.44 -0.02 0.04 0.00 -1.96 -1.56 119.26 118.98 3jr2 h ALA 193 Ca 0.20 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.11 3jr2 h ALA 193 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3jr2 h ALA 193 CO -0.04 -0.05 -0.03 1.28 0.00 0.00 0.00 179.25 180.41 3jr2 n LEU 194 N -3.65 1.64 0.00 0.00 4.77 -0.61 -4.32 117.00 114.82 3jr2 n LEU 194 Ca -0.02 -0.54 -0.12 0.00 -0.03 0.00 0.00 56.01 55.30 3jr2 n LEU 194 Cb 0.12 -0.01 -0.01 0.00 -2.33 0.00 0.00 43.42 41.19 3jr2 n LEU 194 CO 0.25 0.28 -0.02 0.00 -1.33 0.00 0.00 177.39 176.57 3jr2 n ALA 195 N 0.23 0.29 -0.65 -1.18 0.00 -0.59 -4.42 120.51 114.20 3jr2 n ALA 195 Ca 0.18 -0.94 0.00 0.00 0.00 0.00 0.00 53.44 52.68 3jr2 n ALA 195 Cb 0.38 0.44 0.00 0.00 0.00 0.00 0.00 19.45 20.27 3jr2 n ALA 195 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3jr2 n GLY 196 N 2.30 -0.14 0.14 0.00 0.00 -1.26 -2.40 105.19 103.83 3jr2 n GLY 196 Ca -0.04 -1.02 -0.01 0.00 0.00 0.00 0.00 46.02 44.95 3jr2 n GLY 196 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jr2 h ALA 197 N -0.65 0.95 -0.53 4.61 0.00 -1.97 -3.06 119.26 118.63 3jr2 h ALA 197 Ca 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.35 3jr2 h ALA 197 Cb 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.69 3jr2 h ALA 197 CO 0.00 0.76 0.00 0.39 0.00 0.00 0.00 179.25 180.40 3jr2 n GLU 198 N -3.76 3.00 -0.05 0.00 1.02 -1.26 -4.59 120.64 114.99 3jr2 n GLU 198 Ca -0.01 -2.48 -0.12 0.00 -0.02 0.00 0.00 57.16 54.53 3jr2 n GLU 198 Cb 0.62 -1.53 -0.06 0.00 -0.02 0.00 0.00 31.44 30.44 3jr2 n GLU 198 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 3jr2 h GLY 199 N 3.14 0.32 1.00 0.62 0.00 -1.36 -1.52 103.07 105.28 3jr2 h GLY 199 Ca 0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 47.33 47.06 3jr2 h GLY 199 CO 0.06 0.24 0.41 -1.61 0.00 0.00 0.00 176.54 175.64 3jr2 h GLN 200 N 0.00 0.97 -0.36 4.80 4.15 -1.80 0.01 115.11 122.87 3jr2 h GLN 200 Ca 0.04 -0.10 -0.11 0.00 0.77 0.00 0.00 58.65 59.25 3jr2 h GLN 200 Cb 0.46 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 27.93 3jr2 h GLN 200 CO 0.01 0.70 -0.24 0.37 -1.93 0.00 0.00 178.83 177.75 3jr2 h GLN 201 N 0.96 0.72 -0.47 1.69 4.15 -1.84 -1.87 115.11 118.45 3jr2 h GLN 201 Ca 0.25 -0.29 -0.06 0.00 0.77 0.00 0.00 58.65 59.32 3jr2 h GLN 201 Cb -0.01 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 27.63 3jr2 h GLN 201 CO -0.04 0.89 0.06 1.15 -1.93 0.00 0.00 178.83 178.96 3jr2 h THR 202 N 0.63 1.25 -0.50 2.39 2.02 -0.99 -0.50 112.91 117.22 3jr2 h THR 202 Ca 0.09 -0.94 0.02 0.00 0.77 0.00 0.00 66.41 66.35 3jr2 h THR 202 Cb 0.74 0.94 -0.03 0.00 -1.74 0.00 0.00 68.15 68.05 3jr2 h THR 202 CO 0.06 0.33 0.30 0.00 0.37 0.00 0.00 175.52 176.58 3jr2 h ALA 203 N 0.95 0.63 -0.74 6.16 0.00 -0.80 0.57 119.26 126.04 3jr2 h ALA 203 Ca 0.14 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 3jr2 h ALA 203 Cb 0.41 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 3jr2 h ALA 203 CO 0.01 0.00 0.42 0.00 0.00 0.00 0.00 179.25 179.68 3jr2 h ALA 204 N 1.22 0.95 -0.76 0.00 0.00 -1.17 -1.39 119.26 118.11 3jr2 h ALA 204 Ca 0.20 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 3jr2 h ALA 204 Cb 0.01 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.47 3jr2 h ALA 204 CO -0.09 0.45 0.43 0.00 0.00 0.00 0.00 179.25 180.04 3jr2 h ALA 205 N 1.21 0.98 -0.33 0.00 0.00 -0.60 -0.49 119.26 120.03 3jr2 h ALA 205 Ca 0.26 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 3jr2 h ALA 205 Cb 0.02 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 3jr2 h ALA 205 CO -0.04 0.47 0.09 -0.07 0.00 0.00 0.00 179.25 179.70 3jr2 h LEU 206 N 1.05 0.49 -1.14 0.00 3.38 -0.67 -2.47 115.31 115.96 3jr2 h LEU 206 Ca 0.27 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3jr2 h LEU 206 Cb 0.01 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 3jr2 h LEU 206 CO -0.05 0.58 0.55 0.03 0.09 0.00 0.00 178.44 179.64 3jr2 h ARG 207 N 0.37 1.13 -0.73 1.13 3.08 -0.97 -0.05 114.38 118.35 3jr2 h ARG 207 Ca 0.10 -0.08 -0.04 0.00 0.07 0.00 0.00 59.98 60.03 3jr2 h ARG 207 Cb 0.27 -0.25 -0.03 0.00 0.08 0.00 0.00 29.97 30.04 3jr2 h ARG 207 CO -0.00 0.76 0.29 1.49 -1.07 0.00 0.00 179.97 181.44 3jr2 h GLU 208 N 1.16 1.10 -0.26 0.04 4.81 -0.91 -1.03 114.58 119.48 3jr2 h GLU 208 Ca 0.31 -0.20 -0.14 0.00 -0.13 0.00 0.00 59.36 59.20 3jr2 h GLU 208 Cb -0.11 -0.18 -0.00 0.00 0.63 0.00 0.00 28.75 29.09 3jr2 h GLU 208 CO -0.06 0.90 -0.37 1.96 -0.73 0.00 0.00 179.01 180.71 3jr2 h GLN 209 N 1.05 0.71 -0.69 1.92 1.08 -0.95 -3.16 115.11 115.07 3jr2 h GLN 209 Ca 0.24 -0.42 0.04 0.00 -1.45 0.00 0.00 58.65 57.07 3jr2 h GLN 209 Cb 0.22 0.03 -0.05 0.00 -0.05 0.00 0.00 27.48 27.64 3jr2 h GLN 209 CO -0.02 1.04 0.41 0.82 -0.95 0.00 0.00 178.83 180.13 3jr2 h ILE 210 N 0.44 1.05 -0.18 2.54 2.04 -0.81 -0.77 117.51 121.81 3jr2 h ILE 210 Ca 0.03 -0.27 0.05 0.00 1.00 0.00 0.00 64.86 65.67 3jr2 h ILE 210 Cb 0.96 0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 3jr2 h ILE 210 CO 0.09 0.14 0.23 0.44 0.00 0.00 0.00 178.15 179.05 3jr2 h ASP 211 N 0.79 0.00 0.64 1.72 3.32 -1.16 -1.52 116.42 120.22 3jr2 h ASP 211 Ca 0.29 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 57.18 3jr2 h ASP 211 Cb 0.08 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 3jr2 h ASP 211 CO -0.14 0.00 -0.72 0.03 -1.72 0.00 0.00 179.24 176.69 3jr2 h ARG 212 N 0.00 0.06 0.00 3.56 3.08 -1.14 -3.39 114.38 116.55 3jr2 h ARG 212 Ca 0.09 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.08 3jr2 h ARG 212 Cb 0.55 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.62 3jr2 h ARG 212 CO -0.00 0.75 -0.60 1.19 -1.07 0.00 0.00 179.97 180.25 3jr2 n PHE 213 N -3.72 0.00 -4.17 3.04 3.72 -0.62 -5.00 117.46 110.71 3jr2 n PHE 213 Ca -0.02 0.00 -0.18 0.00 -0.05 0.00 0.00 57.45 57.20 3jr2 n PHE 213 Cb 0.70 -0.04 -0.12 0.00 -0.94 0.00 0.00 39.48 39.08 3jr2 n PHE 213 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 3jr2 s TRP 214 N -1.74 1.21 -2.00 1.38 0.51 -0.88 -4.66 118.94 112.77 3jr2 s TRP 214 Ca 0.00 -0.46 0.21 0.00 -2.12 0.00 0.00 56.10 53.73 3jr2 s TRP 214 Cb 0.03 -0.68 1.26 0.00 -0.81 0.00 0.00 33.47 33.26 3jr2 s TRP 214 CO 0.16 0.06 1.64 -2.30 -0.51 0.00 0.00 176.95 175.99