#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kb4 s GLU 3 N 0.00 2.50 0.18 9.51 0.41 -1.26 -5.03 118.70 125.02 3kb4 s GLU 3 Ca 0.00 1.53 0.03 0.00 -0.41 0.00 0.00 54.97 56.12 3kb4 s GLU 3 Cb 0.00 -1.90 -0.03 0.00 -1.78 0.00 0.00 34.13 30.42 3kb4 s GLU 3 CO 0.00 -1.51 0.31 0.95 -0.49 0.00 0.00 175.26 174.52 3kb4 s THR 4 N -2.22 5.29 -0.30 3.63 -4.23 -1.26 -5.07 115.64 111.49 3kb4 s THR 4 Ca 0.70 -0.79 0.00 0.00 -1.18 0.00 0.00 61.69 60.42 3kb4 s THR 4 Cb -0.24 -3.78 0.09 0.00 1.34 0.00 0.00 72.50 69.92 3kb4 s THR 4 CO 0.43 -0.17 0.06 -0.51 -0.54 0.00 0.00 174.62 173.89 3kb4 s ILE 5 N -1.82 1.28 0.98 2.99 2.07 -1.26 -5.12 121.20 120.32 3kb4 s ILE 5 Ca 0.34 -1.52 -0.11 0.00 -1.41 0.00 0.00 60.65 57.95 3kb4 s ILE 5 Cb -0.10 -1.88 0.18 0.00 0.13 0.00 0.00 42.46 40.79 3kb4 s ILE 5 CO 0.29 -0.53 1.10 0.42 -1.91 0.00 0.00 174.94 174.31 3kb4 s THR 6 N 1.43 2.22 0.25 4.00 -4.23 -1.26 -4.75 115.64 113.31 3kb4 s THR 6 Ca 0.07 0.07 -0.05 0.00 -1.18 0.00 0.00 61.69 60.60 3kb4 s THR 6 Cb -0.18 -2.20 0.23 0.00 1.34 0.00 0.00 72.50 71.69 3kb4 s THR 6 CO -0.17 -0.09 1.89 -0.61 -0.54 0.00 0.00 174.62 175.10 3kb4 h GLN 7 N -2.03 1.21 -0.25 3.99 5.75 -2.00 0.10 115.11 121.89 3kb4 h GLN 7 Ca -0.50 -0.12 -0.14 0.00 -0.15 0.00 0.00 58.65 57.74 3kb4 h GLN 7 Cb 1.29 -0.25 -0.01 0.00 1.07 0.00 0.00 27.48 29.58 3kb4 h GLN 7 CO 0.47 0.86 -0.43 0.66 -2.65 0.00 0.00 178.83 177.74 3kb4 h SER 8 N 1.23 0.66 -0.57 -0.69 4.64 -2.00 -2.21 113.55 114.60 3kb4 h SER 8 Ca 0.32 -0.31 -0.11 0.00 -0.47 0.00 0.00 61.79 61.22 3kb4 h SER 8 Cb -0.03 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 61.86 3kb4 h SER 8 CO -0.06 1.01 -0.06 1.56 -0.87 0.00 0.00 176.83 178.41 3kb4 h GLN 9 N 0.50 1.05 -0.43 4.77 4.20 -1.74 -1.65 115.11 121.83 3kb4 h GLN 9 Ca 0.04 -0.37 0.02 0.00 0.06 0.00 0.00 58.65 58.40 3kb4 h GLN 9 Cb 0.95 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.62 3kb4 h GLN 9 CO 0.09 1.06 0.24 1.49 -0.67 0.00 0.00 178.83 181.04 3kb4 h GLU 10 N 0.94 0.47 -0.40 1.46 4.81 -0.83 0.70 114.58 121.74 3kb4 h GLU 10 Ca 0.16 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.35 3kb4 h GLU 10 Cb 0.63 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.88 3kb4 h GLU 10 CO 0.04 0.31 0.21 1.15 -0.73 0.00 0.00 179.01 179.99 3kb4 h THR 11 N 0.49 1.16 -0.69 0.32 2.02 -1.23 -1.00 112.91 113.98 3kb4 h THR 11 Ca 0.17 -0.44 -0.08 0.00 0.77 0.00 0.00 66.41 66.84 3kb4 h THR 11 Cb 0.03 0.72 -0.03 0.00 -1.74 0.00 0.00 68.15 67.13 3kb4 h THR 11 CO -0.09 0.17 0.14 0.00 0.37 0.00 0.00 175.52 176.11 3kb4 h ALA 12 N 1.06 0.93 -0.13 6.16 0.00 -0.97 -1.36 119.26 124.95 3kb4 h ALA 12 Ca 0.14 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 3kb4 h ALA 12 Cb 0.09 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 3kb4 h ALA 12 CO -0.02 0.67 0.01 0.82 0.00 0.00 0.00 179.25 180.73 3kb4 h ILE 13 N 1.06 1.23 -0.80 0.00 2.04 -0.62 -2.43 117.51 117.99 3kb4 h ILE 13 Ca 0.21 -0.74 -0.02 0.00 1.00 0.00 0.00 64.86 65.32 3kb4 h ILE 13 Cb 0.41 1.47 -0.04 0.00 -0.74 0.00 0.00 36.82 37.92 3kb4 h ILE 13 CO 0.01 0.22 0.43 -0.07 0.00 0.00 0.00 178.15 178.74 3kb4 h LEU 14 N -0.02 0.99 -0.42 1.44 4.07 -1.06 -0.60 115.31 119.71 3kb4 h LEU 14 Ca 0.04 -0.08 -0.00 0.00 0.08 0.00 0.00 57.88 57.91 3kb4 h LEU 14 Cb 0.32 -0.25 -0.02 0.00 1.08 0.00 0.00 40.66 41.79 3kb4 h LEU 14 CO 0.00 0.80 0.24 -0.08 -1.08 0.00 0.00 178.44 178.32 3kb4 h GLU 15 N 1.11 0.58 -0.55 1.13 4.57 -1.17 -1.58 114.58 118.67 3kb4 h GLU 15 Ca 0.28 -0.06 -0.09 0.00 -1.18 0.00 0.00 59.36 58.31 3kb4 h GLU 15 Cb 0.03 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 28.48 3kb4 h GLU 15 CO -0.05 0.44 -0.00 0.77 -1.18 0.00 0.00 179.01 179.00 3kb4 h SER 16 N 0.55 0.96 -0.63 1.04 0.02 -0.98 -2.74 113.55 111.76 3kb4 h SER 16 Ca 0.15 -0.31 0.01 0.00 -0.84 0.00 0.00 61.79 60.80 3kb4 h SER 16 Cb 0.02 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.27 3kb4 h SER 16 CO -0.03 1.03 0.41 0.15 -1.14 0.00 0.00 176.83 177.26 3kb4 h PHE 17 N 0.86 0.78 -0.91 3.45 3.57 -0.91 -1.80 116.94 121.98 3kb4 h PHE 17 Ca 0.16 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.68 3kb4 h PHE 17 Cb 0.54 -0.26 -0.04 0.00 2.79 0.00 0.00 35.95 38.97 3kb4 h PHE 17 CO 0.04 0.48 0.58 -0.07 -2.23 0.00 0.00 178.31 177.12 3kb4 h LEU 18 N 0.84 1.07 -0.82 0.59 4.07 -1.14 -1.42 115.31 118.50 3kb4 h LEU 18 Ca 0.24 -0.05 -0.07 0.00 0.08 0.00 0.00 57.88 58.08 3kb4 h LEU 18 Cb -0.08 -0.27 -0.03 0.00 1.08 0.00 0.00 40.66 41.37 3kb4 h LEU 18 CO -0.06 0.80 0.10 -0.33 -1.08 0.00 0.00 178.44 177.87 3kb4 h GLU 19 N 1.25 0.99 -0.02 1.13 5.08 -1.13 -1.59 114.58 120.29 3kb4 h GLU 19 Ca 0.33 -0.25 -0.09 0.00 -1.00 0.00 0.00 59.36 58.36 3kb4 h GLU 19 Cb -0.10 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.01 3kb4 h GLU 19 CO -0.07 0.91 -0.41 -0.07 -1.00 0.00 0.00 179.01 178.38 3kb4 h LEU 20 N 0.94 0.03 -0.57 1.33 3.38 -0.87 -1.41 115.31 118.14 3kb4 h LEU 20 Ca 0.19 -0.01 -0.16 0.00 0.09 0.00 0.00 57.88 57.99 3kb4 h LEU 20 Cb 0.40 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 3kb4 h LEU 20 CO 0.01 0.44 -0.65 0.58 0.09 0.00 0.00 178.44 178.91 3kb4 h VAL 21 N 0.03 1.40 0.00 1.22 2.07 -0.63 -3.04 116.25 117.30 3kb4 h VAL 21 Ca -0.00 -2.08 0.00 0.00 0.82 0.00 0.00 66.70 65.44 3kb4 h VAL 21 Cb 0.74 2.07 0.00 0.00 -1.52 0.00 0.00 31.29 32.58 3kb4 h VAL 21 CO 0.05 0.62 -0.39 0.29 0.02 0.00 0.00 177.57 178.16 3kb4 n LYS 22 N -3.84 0.00 -3.95 1.57 5.02 -0.66 -4.88 118.16 111.42 3kb4 n LYS 22 Ca -0.03 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 55.99 3kb4 n LYS 22 Cb 0.65 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 34.13 3kb4 n LYS 22 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3kb4 s SER 23 N -3.01 6.25 0.79 4.39 0.15 -0.55 -5.09 113.70 116.63 3kb4 s SER 23 Ca 0.12 0.16 -0.12 0.00 0.70 0.00 0.00 55.95 56.81 3kb4 s SER 23 Cb 0.18 -1.87 0.07 0.00 -1.71 0.00 0.00 66.02 62.69 3kb4 s SER 23 CO 0.66 0.08 1.11 -2.16 1.20 0.00 0.00 173.24 174.14 3kb4 s PRO 24 N -3.05 2.11 1.06 5.44 0.04 -1.26 -4.89 135.00 134.44 3kb4 s PRO 24 Ca 0.34 0.48 -0.13 0.00 0.04 0.00 0.00 61.00 61.73 3kb4 s PRO 24 Cb -0.11 -1.93 0.17 0.00 0.04 0.00 0.00 34.50 32.66 3kb4 s PRO 24 CO 0.28 -1.57 0.74 0.66 0.04 0.00 0.00 177.00 177.15 3kb4 n TYR 25 N -3.37 -0.75 -1.17 0.56 4.02 -1.26 -3.67 117.16 111.52 3kb4 n TYR 25 Ca 0.07 0.12 -0.06 0.00 -0.01 0.00 0.00 57.90 58.02 3kb4 n TYR 25 Cb 0.57 -1.77 -0.03 0.00 -0.02 0.00 0.00 39.34 38.10 3kb4 n TYR 25 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3kb4 n GLY 26 N 1.10 0.82 2.60 2.72 0.00 -1.26 -4.93 105.19 106.24 3kb4 n GLY 26 Ca 0.06 -0.49 -0.41 0.00 0.00 0.00 0.00 46.02 45.17 3kb4 n GLY 26 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3kb4 n ASN 27 N 0.40 6.01 0.21 1.61 4.05 -1.24 -4.71 115.26 121.59 3kb4 n ASN 27 Ca -0.06 -2.85 0.17 0.00 0.45 0.00 0.00 54.58 52.29 3kb4 n ASN 27 Cb 0.25 -1.56 0.71 0.00 1.23 0.00 0.00 39.78 40.40 3kb4 n ASN 27 CO 0.00 0.00 0.00 -0.26 -3.05 0.00 0.00 177.26 173.95 3kb4 h PHE 28 N 5.50 0.00 0.13 1.20 0.04 -1.94 -0.46 116.94 121.41 3kb4 h PHE 28 Ca 0.64 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 61.41 3kb4 h PHE 28 Cb 0.49 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.64 3kb4 h PHE 28 CO 1.56 0.00 -0.06 0.00 -0.60 0.00 0.00 178.31 179.21 3kb4 h ALA 29 N 1.25 -0.43 -0.06 2.45 0.00 -2.01 -2.86 119.26 117.60 3kb4 h ALA 29 Ca 0.10 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.99 3kb4 h ALA 29 Cb 1.06 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 3kb4 h ALA 29 CO -0.00 -0.41 0.05 1.03 0.00 0.00 0.00 179.25 179.92 3kb4 h SER 30 N -0.39 0.00 0.08 0.00 0.87 -1.84 0.14 113.55 112.41 3kb4 h SER 30 Ca -0.02 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.49 3kb4 h SER 30 Cb 0.13 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.08 3kb4 h SER 30 CO 0.03 0.00 -0.16 0.40 -0.53 0.00 0.00 176.83 176.57 3kb4 h ILE 31 N 0.00 1.17 -0.21 2.23 2.04 -1.18 -1.99 117.51 119.57 3kb4 h ILE 31 Ca 0.03 -0.78 -0.17 0.00 1.00 0.00 0.00 64.86 64.94 3kb4 h ILE 31 Cb 0.13 1.27 -0.00 0.00 -0.74 0.00 0.00 36.82 37.48 3kb4 h ILE 31 CO -0.00 0.24 -0.56 1.23 0.00 0.00 0.00 178.15 179.06 3kb4 h GLY 32 N 0.72 0.70 1.02 5.37 0.00 -0.49 -1.88 103.07 108.51 3kb4 h GLY 32 Ca 0.03 -0.82 -0.06 0.00 0.00 0.00 0.00 47.33 46.48 3kb4 h GLY 32 CO 0.02 0.74 0.13 1.70 0.00 0.00 0.00 176.54 179.13 3kb4 h LYS 33 N 0.49 0.96 -0.49 4.80 3.64 -1.17 -0.86 116.57 123.94 3kb4 h LYS 33 Ca 0.01 -0.24 -0.03 0.00 -1.27 0.00 0.00 60.65 59.12 3kb4 h LYS 33 Cb 1.12 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.80 3kb4 h LYS 33 CO 0.11 0.89 0.19 1.25 -2.27 0.00 0.00 179.45 179.62 3kb4 h LEU 34 N 0.87 0.68 -0.56 5.20 5.85 -1.31 -2.70 115.31 123.35 3kb4 h LEU 34 Ca 0.18 -0.17 0.02 0.00 0.84 0.00 0.00 57.88 58.74 3kb4 h LEU 34 Cb 0.38 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.20 3kb4 h LEU 34 CO 0.01 0.67 0.35 -1.28 -0.34 0.00 0.00 178.44 177.85 3kb4 h SER 35 N 0.65 0.59 -0.71 1.25 0.87 -1.08 0.38 113.55 115.51 3kb4 h SER 35 Ca 0.16 -0.01 0.07 0.00 -1.23 0.00 0.00 61.79 60.79 3kb4 h SER 35 Cb 0.21 -0.14 -0.06 0.00 -0.44 0.00 0.00 62.40 61.97 3kb4 h SER 35 CO -0.01 0.42 0.39 -0.74 -0.53 0.00 0.00 176.83 176.36 3kb4 h HIS 36 N 0.71 0.71 0.11 2.24 -0.00 -0.93 0.61 115.15 118.60 3kb4 h HIS 36 Ca 0.21 0.03 -0.30 0.00 -0.00 0.00 0.00 60.37 60.31 3kb4 h HIS 36 Cb -0.03 -0.21 -0.01 0.00 -0.00 0.00 0.00 27.41 27.15 3kb4 h HIS 36 CO -0.05 0.32 -1.50 0.28 -0.00 0.00 0.00 177.93 176.98 3kb4 h VAL 37 N 0.70 1.18 0.16 5.26 2.07 -1.16 -3.39 116.25 121.07 3kb4 h VAL 37 Ca 0.33 -2.83 -0.01 0.00 0.82 0.00 0.00 66.70 65.01 3kb4 h VAL 37 Cb 0.25 2.75 0.00 0.00 -1.52 0.00 0.00 31.29 32.77 3kb4 h VAL 37 CO -0.21 0.81 -0.08 0.25 0.02 0.00 0.00 177.57 178.37 3kb4 h LEU 38 N 0.06 -0.18 -7.13 2.57 6.46 -0.09 -3.38 115.31 113.62 3kb4 h LEU 38 Ca -0.23 -0.11 -0.71 0.00 -0.12 0.00 0.00 57.88 56.70 3kb4 h LEU 38 Cb 2.00 0.05 -0.11 0.00 -0.73 0.00 0.00 40.66 41.87 3kb4 h LEU 38 CO 0.16 0.34 2.19 0.59 -0.62 0.00 0.00 178.44 181.10 3kb4 n ASN 39 N -4.91 4.78 -4.74 1.25 5.03 0.19 -4.94 115.26 111.93 3kb4 n ASN 39 Ca -0.04 -2.95 -0.29 0.00 0.87 0.00 0.00 54.58 52.17 3kb4 n ASN 39 Cb 0.14 -1.64 0.14 0.00 -1.02 0.00 0.00 39.78 37.41 3kb4 n ASN 39 CO 0.00 0.00 0.00 1.51 -1.83 0.00 0.00 177.26 176.94 3kb4 s ASP 40 N 3.04 3.38 0.32 6.41 1.47 -1.26 -4.60 116.67 125.42 3kb4 s ASP 40 Ca 0.47 1.23 0.08 0.00 1.18 0.00 0.00 52.55 55.52 3kb4 s ASP 40 Cb 0.06 -1.89 0.90 0.00 -0.34 0.00 0.00 42.92 41.65 3kb4 s ASP 40 CO 0.01 -2.67 1.66 -0.65 0.68 0.00 0.00 175.17 174.20 3kb4 h PRO 41 N -1.57 0.28 -0.64 2.11 0.11 -1.93 0.03 132.00 130.38 3kb4 h PRO 41 Ca -0.51 -0.02 0.05 0.00 0.11 0.00 0.00 66.00 65.64 3kb4 h PRO 41 Cb 1.31 -0.06 -0.05 0.00 0.11 0.00 0.00 31.00 32.30 3kb4 h PRO 41 CO 0.58 0.18 0.36 -0.44 -0.21 0.00 0.00 178.00 178.47 3kb4 h ASP 42 N 0.29 0.54 -0.24 -2.05 3.32 -1.98 0.21 116.42 116.49 3kb4 h ASP 42 Ca 0.65 0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.67 3kb4 h ASP 42 Cb 1.39 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.85 3kb4 h ASP 42 CO -0.62 0.35 -0.05 0.74 -1.72 0.00 0.00 179.24 177.94 3kb4 h THR 43 N 0.67 1.28 -0.89 0.35 2.02 -1.37 -2.70 112.91 112.27 3kb4 h THR 43 Ca 0.28 -1.04 0.06 0.00 0.77 0.00 0.00 66.41 66.49 3kb4 h THR 43 Cb 0.16 1.47 -0.06 0.00 -1.74 0.00 0.00 68.15 67.98 3kb4 h THR 43 CO -0.17 0.32 0.56 -0.07 0.37 0.00 0.00 175.52 176.53 3kb4 h LEU 44 N 0.20 0.88 -0.67 2.58 4.07 -0.58 -0.65 115.31 121.14 3kb4 h LEU 44 Ca 0.06 0.02 -0.03 0.00 0.08 0.00 0.00 57.88 58.01 3kb4 h LEU 44 Cb 0.50 -0.17 -0.03 0.00 1.08 0.00 0.00 40.66 42.04 3kb4 h LEU 44 CO 0.02 0.56 0.31 -0.61 -1.08 0.00 0.00 178.44 177.65 3kb4 h GLN 45 N 1.01 0.97 -0.23 1.13 5.75 -0.51 -0.28 115.11 122.96 3kb4 h GLN 45 Ca 0.39 -0.15 -0.10 0.00 -0.15 0.00 0.00 58.65 58.64 3kb4 h GLN 45 Cb 0.17 -0.17 -0.01 0.00 1.07 0.00 0.00 27.48 28.54 3kb4 h GLN 45 CO -0.17 0.78 -0.28 0.87 -2.65 0.00 0.00 178.83 177.37 3kb4 h LYS 46 N 0.93 0.44 -0.33 1.69 1.57 -1.02 -1.42 116.57 118.43 3kb4 h LYS 46 Ca 0.23 -0.17 -0.10 0.00 -1.87 0.00 0.00 60.65 58.73 3kb4 h LYS 46 Cb 0.13 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 3kb4 h LYS 46 CO -0.03 0.68 -0.20 0.28 -0.57 0.00 0.00 179.45 179.62 3kb4 h VAL 47 N 0.39 1.29 -0.38 0.50 2.07 -0.74 -0.93 116.25 118.44 3kb4 h VAL 47 Ca 0.05 -1.33 -0.01 0.00 0.82 0.00 0.00 66.70 66.23 3kb4 h VAL 47 Cb 0.69 1.44 -0.02 0.00 -1.52 0.00 0.00 31.29 31.89 3kb4 h VAL 47 CO 0.05 0.43 0.19 0.58 0.02 0.00 0.00 177.57 178.84 3kb4 h VAL 48 N 0.48 1.17 -0.30 2.57 2.07 -0.87 -1.64 116.25 119.72 3kb4 h VAL 48 Ca 0.07 -0.46 0.00 0.00 0.82 0.00 0.00 66.70 67.13 3kb4 h VAL 48 Cb 0.75 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 31.27 3kb4 h VAL 48 CO 0.06 0.18 0.19 0.00 0.02 0.00 0.00 177.57 178.02 3kb4 h ALA 49 N 1.04 0.39 -0.70 1.67 0.00 -1.17 -1.49 119.26 119.00 3kb4 h ALA 49 Ca 0.13 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 3kb4 h ALA 49 Cb 0.11 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 3kb4 h ALA 49 CO -0.02 -0.13 0.25 0.28 0.00 0.00 0.00 179.25 179.63 3kb4 h VAL 50 N 0.40 1.25 0.00 0.00 2.07 -1.03 -2.47 116.25 116.47 3kb4 h VAL 50 Ca 0.11 -0.82 -0.05 0.00 0.82 0.00 0.00 66.70 66.76 3kb4 h VAL 50 Cb -0.02 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.19 3kb4 h VAL 50 CO -0.02 0.32 -0.25 -0.07 0.02 0.00 0.00 177.57 177.57 3kb4 h LEU 51 N 1.02 0.00 -0.66 2.57 3.38 -1.07 -2.94 115.31 117.61 3kb4 h LEU 51 Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.20 3kb4 h LEU 51 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 3kb4 h LEU 51 CO -0.01 0.25 0.00 -1.20 0.09 0.00 0.00 178.44 177.57 3kb4 n SER 52 N -3.44 0.99 0.16 -0.43 7.64 -0.58 -3.78 113.62 114.18 3kb4 n SER 52 Ca -0.00 -1.61 0.13 0.00 1.01 0.00 0.00 58.87 58.40 3kb4 n SER 52 Cb 0.44 -0.06 0.44 0.00 -1.01 0.00 0.00 64.21 64.02 3kb4 n SER 52 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 3kb4 h LEU 53 N 1.30 0.00 -9.78 -3.43 3.38 -1.44 -3.35 115.31 101.99 3kb4 h LEU 53 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 3kb4 h LEU 53 Cb 0.29 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.97 3kb4 h LEU 53 CO 0.00 0.00 -0.56 0.42 0.09 0.00 0.00 178.44 178.39 3kb4 s THR 54 N -3.28 3.75 0.09 0.22 -4.23 -1.25 -5.02 115.64 105.92 3kb4 s THR 54 Ca 0.06 -1.63 -0.36 0.00 -1.18 0.00 0.00 61.69 58.58 3kb4 s THR 54 Cb 0.10 -3.11 -0.17 0.00 1.34 0.00 0.00 72.50 70.66 3kb4 s THR 54 CO 0.53 -0.31 1.56 1.55 -0.54 0.00 0.00 174.62 177.41 3kb4 h PRO 55 N 1.62 -0.98 0.00 3.99 0.13 -1.91 -1.44 132.00 133.40 3kb4 h PRO 55 Ca -0.46 0.07 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 3kb4 h PRO 55 Cb 1.25 0.22 0.00 0.00 0.13 0.00 0.00 31.00 32.60 3kb4 h PRO 55 CO 0.61 -0.66 0.00 -0.56 -0.23 0.00 0.00 178.00 177.16 3kb4 h GLN 56 N -1.02 0.00 0.34 0.86 3.07 -1.95 -2.40 115.11 114.01 3kb4 h GLN 56 Ca -0.06 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.66 3kb4 h GLN 56 Cb 0.89 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.45 3kb4 h GLN 56 CO -0.07 0.00 -0.16 0.78 0.09 0.00 0.00 178.83 179.47 3kb4 h GLY 57 N 0.82 -0.48 1.01 0.06 0.00 -1.43 -1.82 103.07 101.24 3kb4 h GLY 57 Ca 0.00 0.18 -0.00 0.00 0.00 0.00 0.00 47.33 47.50 3kb4 h GLY 57 CO 0.00 -0.17 0.49 0.07 0.00 0.00 0.00 176.54 176.93 3kb4 h LYS 58 N -0.67 1.09 -0.90 4.80 2.10 -1.34 -2.30 116.57 119.35 3kb4 h LYS 58 Ca -0.05 -0.09 0.07 0.00 -2.00 0.00 0.00 60.65 58.58 3kb4 h LYS 58 Cb 0.35 -0.23 -0.06 0.00 -0.90 0.00 0.00 32.23 31.38 3kb4 h LYS 58 CO 0.08 0.76 0.57 0.37 -2.00 0.00 0.00 179.45 179.22 3kb4 h GLN 59 N 1.10 0.99 -0.27 0.07 4.15 -1.53 -1.12 115.11 118.49 3kb4 h GLN 59 Ca 0.29 -0.06 -0.03 0.00 0.77 0.00 0.00 58.65 59.62 3kb4 h GLN 59 Cb -0.05 -0.22 -0.02 0.00 0.21 0.00 0.00 27.48 27.40 3kb4 h GLN 59 CO -0.06 0.65 0.04 0.00 -1.93 0.00 0.00 178.83 177.54 3kb4 h ALA 60 N 1.43 1.56 0.02 3.38 0.00 -0.74 0.36 119.26 125.27 3kb4 h ALA 60 Ca 0.40 -0.14 -0.21 0.00 0.00 0.00 0.00 54.91 54.96 3kb4 h ALA 60 Cb 0.20 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3kb4 h ALA 60 CO -0.18 0.33 -0.98 0.74 0.00 0.00 0.00 179.25 179.16 3kb4 h PHE 61 N 0.39 0.16 0.18 0.00 0.04 -1.07 -0.16 116.94 116.48 3kb4 h PHE 61 Ca 0.09 -0.10 -0.28 0.00 2.80 0.00 0.00 57.97 60.48 3kb4 h PHE 61 Cb 0.20 -0.01 0.02 0.00 2.20 0.00 0.00 35.95 38.36 3kb4 h PHE 61 CO 0.01 1.01 -1.28 1.05 -0.60 0.00 0.00 178.31 178.49 3kb4 h GLU 62 N 0.04 0.39 0.00 1.51 4.11 -1.01 -3.34 114.58 116.28 3kb4 h GLU 62 Ca -0.04 -0.66 -0.14 0.00 0.07 0.00 0.00 59.36 58.59 3kb4 h GLU 62 Cb 1.68 0.25 -0.02 0.00 0.50 0.00 0.00 28.75 31.16 3kb4 h GLU 62 CO 0.14 1.32 -0.72 -0.44 0.07 0.00 0.00 179.01 179.38 3kb4 h ASP 63 N -0.12 0.00 -6.14 3.06 3.45 -1.05 -3.49 116.42 112.13 3kb4 h ASP 63 Ca -0.24 0.00 -0.41 0.00 0.43 0.00 0.00 57.03 56.81 3kb4 h ASP 63 Cb 1.91 0.00 0.10 0.00 -0.56 0.00 0.00 39.33 40.78 3kb4 h ASP 63 CO 0.18 0.65 -0.93 0.54 -1.57 0.00 0.00 179.24 178.11 3kb4 n ARG 64 N -3.24 -1.34 -1.06 3.56 1.74 -0.07 -5.06 116.66 111.19 3kb4 n ARG 64 Ca 0.00 0.50 -0.29 0.00 -0.77 0.00 0.00 57.85 57.30 3kb4 n ARG 64 Cb 0.80 -4.31 0.20 0.00 -1.02 0.00 0.00 32.46 28.14 3kb4 n ARG 64 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 3kb4 s PRO 65 N -5.81 -0.07 -0.25 5.56 0.04 -1.25 -5.04 135.00 128.17 3kb4 s PRO 65 Ca 0.47 0.46 -0.16 0.00 0.04 0.00 0.00 61.00 61.82 3kb4 s PRO 65 Cb -0.16 -1.68 -0.13 0.00 0.04 0.00 0.00 34.50 32.57 3kb4 s PRO 65 CO 0.85 -3.06 -0.21 1.28 0.04 0.00 0.00 177.00 175.90 3kb4 n LEU 67 N -4.39 1.93 0.00 -3.56 4.77 -1.26 -4.96 117.00 109.52 3kb4 n LEU 67 Ca 0.05 0.37 0.00 0.00 -0.03 0.00 0.00 56.01 56.40 3kb4 n LEU 67 Cb 0.57 -0.85 0.00 0.00 -2.33 0.00 0.00 43.42 40.81 3kb4 n LEU 67 CO 0.56 0.41 0.00 0.61 -1.33 0.00 0.00 177.39 177.64 3kb4 n GLY 68 N 1.32 -3.13 3.74 -0.72 0.00 -1.26 -4.82 105.19 100.33 3kb4 n GLY 68 Ca -0.45 -1.84 -0.42 0.00 0.00 0.00 0.00 46.02 43.32 3kb4 n GLY 68 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3kb4 s LYS 69 N -0.80 4.20 -0.05 1.61 2.47 -1.26 -5.00 119.74 120.91 3kb4 s LYS 69 Ca 0.00 2.44 0.05 0.00 -1.56 0.00 0.00 55.97 56.90 3kb4 s LYS 69 Cb 0.00 -3.08 -0.02 0.00 -1.46 0.00 0.00 37.83 33.27 3kb4 s LYS 69 CO 0.00 -0.54 -0.21 -1.50 0.16 0.00 0.00 175.35 173.26 3kb4 s ILE 70 N 0.19 2.49 -0.48 5.43 1.10 -1.26 -5.09 121.20 123.59 3kb4 s ILE 70 Ca 0.63 -0.93 -0.02 0.00 -0.51 0.00 0.00 60.65 59.82 3kb4 s ILE 70 Cb -0.45 -1.93 0.13 0.00 0.15 0.00 0.00 42.46 40.35 3kb4 s ILE 70 CO 0.43 0.58 0.27 -0.62 -2.11 0.00 0.00 174.94 173.49 3kb4 s ASP 71 N -0.46 5.21 0.11 4.50 3.68 -1.26 -4.99 116.67 123.45 3kb4 s ASP 71 Ca 0.05 -2.31 -0.27 0.00 2.13 0.00 0.00 52.55 52.14 3kb4 s ASP 71 Cb -0.12 -1.83 -0.09 0.00 -1.45 0.00 0.00 42.92 39.44 3kb4 s ASP 71 CO 0.01 -0.48 1.64 -0.07 0.13 0.00 0.00 175.17 176.40 3kb4 h LEU 72 N 7.68 -0.74 -1.64 -1.34 3.38 -1.98 -1.81 115.31 118.85 3kb4 h LEU 72 Ca -0.09 0.08 0.16 0.00 0.09 0.00 0.00 57.88 58.12 3kb4 h LEU 72 Cb 1.01 0.28 -0.05 0.00 0.09 0.00 0.00 40.66 41.99 3kb4 h LEU 72 CO 0.70 -0.36 0.50 1.05 0.09 0.00 0.00 178.44 180.42 3kb4 h GLU 73 N -0.49 0.34 0.00 1.13 -0.00 -1.96 0.25 114.58 113.85 3kb4 h GLU 73 Ca 0.02 -0.02 -0.16 0.00 -0.00 0.00 0.00 59.36 59.20 3kb4 h GLU 73 Cb 0.50 -0.08 -0.02 0.00 -0.00 0.00 0.00 28.75 29.16 3kb4 h GLU 73 CO -0.13 0.22 -0.78 0.37 -0.00 0.00 0.00 179.01 178.69 3kb4 h GLN 74 N 0.35 0.00 0.00 1.06 4.15 -1.88 -3.10 115.11 115.69 3kb4 h GLN 74 Ca 0.36 0.00 -0.13 0.00 0.77 0.00 0.00 58.65 59.65 3kb4 h GLN 74 Cb 0.92 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.59 3kb4 h GLN 74 CO -0.10 0.78 -0.63 -0.07 -1.93 0.00 0.00 178.83 176.88 3kb4 h LEU 75 N 0.00 0.00 0.00 -2.39 3.38 0.03 -3.06 115.31 113.27 3kb4 h LEU 75 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3kb4 h LEU 75 Cb 1.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.16 3kb4 h LEU 75 CO 0.10 0.63 0.00 1.57 0.09 0.00 0.00 178.44 180.83 3kb4 n HIS 76 N -3.26 0.00 0.53 1.13 -0.00 0.63 -2.33 115.22 111.92 3kb4 n HIS 76 Ca 0.01 0.00 0.12 0.00 0.46 0.00 0.00 57.72 58.32 3kb4 n HIS 76 Cb 0.79 -0.37 0.22 0.00 -0.12 0.00 0.00 29.99 30.50 3kb4 n HIS 76 CO 0.00 0.00 0.00 1.96 0.46 0.00 0.00 176.34 178.76 3kb4 h GLN 77 N 0.00 0.00 -7.35 1.57 1.08 -1.55 -3.47 115.11 105.39 3kb4 h GLN 77 Ca 0.00 0.00 -0.49 0.00 -1.45 0.00 0.00 58.65 56.71 3kb4 h GLN 77 Cb 0.24 0.00 0.14 0.00 -0.05 0.00 0.00 27.48 27.81 3kb4 h GLN 77 CO 0.00 0.00 0.28 -0.51 -0.95 0.00 0.00 178.83 177.65 3kb4 s LEU 78 N -4.49 2.48 0.36 1.46 1.02 -0.98 -4.96 118.68 113.57 3kb4 s LEU 78 Ca 0.07 1.51 -0.27 0.00 0.02 0.00 0.00 54.13 55.46 3kb4 s LEU 78 Cb 0.12 -4.03 -0.12 0.00 0.02 0.00 0.00 46.19 42.18 3kb4 s LEU 78 CO 0.69 -2.37 1.27 -2.65 0.02 0.00 0.00 176.35 173.31 3kb4 n PRO 79 N -3.71 2.04 0.16 1.29 -0.02 -1.26 -4.77 135.00 128.74 3kb4 n PRO 79 Ca 0.07 0.72 0.17 0.00 -2.02 0.00 0.00 63.50 62.45 3kb4 n PRO 79 Cb 0.55 -2.32 0.65 0.00 -0.02 0.00 0.00 33.50 32.37 3kb4 n PRO 79 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 3kb4 h ASN 80 N 2.41 0.00 -0.06 2.55 2.35 -1.93 -1.07 115.58 119.82 3kb4 h ASN 80 Ca -0.46 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.29 3kb4 h ASN 80 Cb 1.29 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.66 3kb4 h ASN 80 CO 0.62 0.00 0.00 0.00 -1.65 0.00 0.00 177.43 176.40 3kb4 n TYR 81 N -3.23 0.06 -2.78 1.19 4.11 -1.26 -4.89 117.16 110.36 3kb4 n TYR 81 Ca 0.05 -0.03 -0.27 0.00 -0.00 0.00 0.00 57.90 57.66 3kb4 n TYR 81 Cb 0.69 0.00 -0.00 0.00 -0.00 0.00 0.00 39.34 40.03 3kb4 n TYR 81 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.86 177.81 3kb4 s THR 82 N -1.94 4.88 0.10 -3.48 -4.23 -0.41 -1.01 115.64 109.55 3kb4 s THR 82 Ca 0.35 0.04 -0.25 0.00 -1.18 0.00 0.00 61.69 60.65 3kb4 s THR 82 Cb 0.20 -3.84 -0.12 0.00 1.34 0.00 0.00 72.50 70.09 3kb4 s THR 82 CO 0.32 -0.77 1.69 0.25 -0.54 0.00 0.00 174.62 175.57 3kb4 h LEU 83 N 0.31 -0.35 -0.66 4.79 6.46 -1.22 -2.83 115.31 121.81 3kb4 h LEU 83 Ca -0.47 0.04 0.14 0.00 -0.12 0.00 0.00 57.88 57.46 3kb4 h LEU 83 Cb 1.21 0.13 -0.12 0.00 -0.73 0.00 0.00 40.66 41.15 3kb4 h LEU 83 CO 0.61 -0.20 -0.09 1.23 -0.62 0.00 0.00 178.44 179.38 3kb4 h GLY 84 N -0.28 0.59 -1.69 3.75 0.00 -1.22 0.26 103.07 104.47 3kb4 h GLY 84 Ca 0.01 0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.50 3kb4 h GLY 84 CO -0.04 -0.25 0.00 2.98 0.00 0.00 0.00 176.54 179.23 3kb4 n TYR 85 N -5.38 0.00 0.00 5.60 4.19 -1.07 -1.25 117.16 119.25 3kb4 n TYR 85 Ca 0.09 -0.17 0.00 0.00 3.31 0.00 0.00 57.90 61.13 3kb4 n TYR 85 Cb 0.37 -0.14 0.00 0.00 0.49 0.00 0.00 39.34 40.06 3kb4 n TYR 85 CO 0.00 0.00 0.00 0.98 0.91 0.00 0.00 176.86 178.75 3kb4 n TYR 87 N 0.60 0.00 -0.30 2.98 4.19 0.91 0.21 117.16 125.76 3kb4 n TYR 87 Ca 0.00 0.00 0.06 0.00 3.31 0.00 0.00 57.90 61.27 3kb4 n TYR 87 Cb 0.21 0.00 0.20 0.00 0.49 0.00 0.00 39.34 40.24 3kb4 n TYR 87 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 3kb4 h ALA 88 N 0.00 1.25 -0.74 2.98 0.00 -1.39 -0.48 119.26 120.88 3kb4 h ALA 88 Ca 0.00 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 3kb4 h ALA 88 Cb 0.00 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 3kb4 h ALA 88 CO 0.00 -0.02 0.36 0.22 0.00 0.00 0.00 179.25 179.81 3kb4 h ASP 89 N 0.69 0.97 0.00 0.00 3.58 -0.47 -0.39 116.42 120.79 3kb4 h ASP 89 Ca 0.44 -0.13 0.00 0.00 0.42 0.00 0.00 57.03 57.76 3kb4 h ASP 89 Cb 0.55 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 41.35 3kb4 h ASP 89 CO -0.32 0.83 0.00 1.57 -2.88 0.00 0.00 179.24 178.44 3kb4 n HIS 90 N -4.41 0.00 0.00 0.28 -0.00 -0.19 -1.18 115.22 109.72 3kb4 n HIS 90 Ca 0.06 -0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.24 3kb4 n HIS 90 Cb 0.13 -0.02 0.00 0.00 -0.12 0.00 0.00 29.99 29.98 3kb4 n HIS 90 CO 0.00 0.00 0.00 -0.89 0.46 0.00 0.00 176.34 175.91 3kb4 n ILE 92 N 0.47 0.00 -0.12 3.57 5.41 -0.16 -2.55 119.36 125.99 3kb4 n ILE 92 Ca 0.00 0.00 -0.04 0.00 1.00 0.00 0.00 62.75 63.71 3kb4 n ILE 92 Cb 0.03 0.00 0.03 0.00 -0.71 0.00 0.00 39.64 38.99 3kb4 n ILE 92 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 176.55 176.46 3kb4 h ARG 93 N 0.00 0.17 -0.09 0.38 2.43 -1.39 -1.50 114.38 114.38 3kb4 h ARG 93 Ca 0.00 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 3kb4 h ARG 93 Cb 0.00 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.51 3kb4 h ARG 93 CO 0.00 0.12 0.00 0.09 -1.51 0.00 0.00 179.97 178.67 3kb4 n ASN 94 N -5.13 1.29 -3.98 -3.80 3.02 -1.06 -4.94 115.26 100.66 3kb4 n ASN 94 Ca 0.03 -1.56 -0.26 0.00 -0.03 0.00 0.00 54.58 52.76 3kb4 n ASN 94 Cb 0.20 -0.05 -0.02 0.00 -0.61 0.00 0.00 39.78 39.29 3kb4 n ASN 94 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3kb4 n GLN 95 N 0.04 -3.29 -3.97 3.52 6.02 -0.57 -4.93 117.38 114.21 3kb4 n GLN 95 Ca 0.17 0.40 -0.31 0.00 -0.01 0.00 0.00 57.00 57.26 3kb4 n GLN 95 Cb 0.29 -4.58 -0.15 0.00 1.02 0.00 0.00 30.24 26.82 3kb4 n GLN 95 CO 0.00 0.00 0.00 -0.48 -1.01 0.00 0.00 177.06 175.57 3kb4 s LEU 96 N -7.01 4.36 0.71 1.08 0.05 -1.26 -5.04 118.68 111.56 3kb4 s LEU 96 Ca 0.08 -2.24 -0.16 0.00 0.05 0.00 0.00 54.13 51.86 3kb4 s LEU 96 Cb -0.04 -1.53 0.02 0.00 -2.05 0.00 0.00 46.19 42.59 3kb4 s LEU 96 CO 0.89 -0.36 1.16 1.07 -0.55 0.00 0.00 176.35 178.56 3kb4 n THR 97 N 4.13 3.51 -0.17 5.48 5.66 -1.26 -4.88 114.28 126.75 3kb4 n THR 97 Ca 0.04 -0.38 0.00 0.00 -3.05 0.00 0.00 64.05 60.65 3kb4 n THR 97 Cb 0.40 -1.29 0.00 0.00 -1.55 0.00 0.00 70.33 67.90 3kb4 n THR 97 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 3kb4 n PRO 98 N -2.23 0.58 -1.63 1.09 -0.04 -1.26 -5.20 135.00 126.31 3kb4 n PRO 98 Ca 0.14 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.26 3kb4 n PRO 98 Cb 0.49 0.00 0.07 0.00 -0.04 0.00 0.00 33.50 34.02 3kb4 n PRO 98 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3kb4 s ASN 104 N -1.33 4.58 -0.32 3.54 4.22 -1.26 -5.07 114.94 119.30 3kb4 s ASN 104 Ca 0.00 2.32 0.18 0.00 -2.14 0.00 0.00 52.86 53.22 3kb4 s ASN 104 Cb 0.00 -2.59 0.46 0.00 1.28 0.00 0.00 41.25 40.41 3kb4 s ASN 104 CO 0.00 -2.00 0.97 1.33 -2.04 0.00 0.00 177.10 175.36 3kb4 n VAL 105 N -2.38 1.04 -0.13 3.54 0.24 -1.26 -4.71 118.33 114.66 3kb4 n VAL 105 Ca 0.13 -3.06 -0.10 0.00 -2.04 0.00 0.00 64.34 59.27 3kb4 n VAL 105 Cb 0.50 0.71 -0.01 0.00 -1.47 0.00 0.00 33.84 33.57 3kb4 n VAL 105 CO 0.00 0.00 0.00 0.78 -2.14 0.00 0.00 176.83 175.47 3kb4 h ASN 106 N 2.95 0.59 -2.82 -1.34 2.35 -2.00 -3.41 115.58 111.89 3kb4 h ASN 106 Ca -0.10 -0.23 -0.64 0.00 -0.55 0.00 0.00 56.30 54.78 3kb4 h ASN 106 Cb 1.19 -0.16 -0.05 0.00 0.05 0.00 0.00 38.32 39.35 3kb4 h ASN 106 CO 0.47 0.67 -0.48 -1.00 -1.65 0.00 0.00 177.43 175.44 3kb4 s HIS 107 N -5.30 3.55 0.16 1.19 3.76 -1.26 -5.00 115.29 112.40 3kb4 s HIS 107 Ca -0.13 0.37 -0.24 0.00 -0.15 0.00 0.00 55.06 54.91 3kb4 s HIS 107 Cb 0.10 -1.84 0.04 0.00 1.11 0.00 0.00 32.58 31.99 3kb4 s HIS 107 CO 0.77 0.64 1.59 -1.35 -0.85 0.00 0.00 174.74 175.53 3kb4 h PRO 108 N 3.79 -0.26 -1.34 8.40 0.11 -1.92 -1.56 132.00 139.22 3kb4 h PRO 108 Ca -0.49 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3kb4 h PRO 108 Cb 1.19 0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3kb4 h PRO 108 CO 0.69 -0.17 0.00 1.19 -0.21 0.00 0.00 178.00 179.50 3kb4 n PHE 109 N -5.42 0.00 0.00 0.65 3.72 -1.26 -1.02 117.46 114.13 3kb4 n PHE 109 Ca 0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.41 3kb4 n PHE 109 Cb 0.35 -0.06 0.00 0.00 -0.94 0.00 0.00 39.48 38.82 3kb4 n PHE 109 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3kb4 n PHE 111 N 0.79 0.00 -0.14 1.38 7.35 -0.59 -2.53 117.46 123.73 3kb4 n PHE 111 Ca 0.00 0.00 -0.04 0.00 -0.76 0.00 0.00 57.45 56.65 3kb4 n PHE 111 Cb 0.00 0.00 0.04 0.00 0.35 0.00 0.00 39.48 39.87 3kb4 n PHE 111 CO 0.00 0.00 0.00 1.25 -0.76 0.00 0.00 176.76 177.25 3kb4 h LEU 112 N 0.00 -0.23 -0.62 -2.13 5.85 -1.34 0.53 115.31 117.37 3kb4 h LEU 112 Ca 0.00 0.11 -0.15 0.00 0.84 0.00 0.00 57.88 58.68 3kb4 h LEU 112 Cb 0.00 0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 3kb4 h LEU 112 CO 0.00 -0.08 -0.58 0.00 -0.34 0.00 0.00 178.44 177.44 3kb4 h ALA 113 N 1.40 0.81 -0.02 1.25 0.00 -1.74 -2.51 119.26 118.45 3kb4 h ALA 113 Ca 0.22 -0.53 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 3kb4 h ALA 113 Cb 0.32 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 3kb4 h ALA 113 CO -0.38 0.71 -0.01 0.00 0.00 0.00 0.00 179.25 179.56 3kb4 h ALA 114 N 1.13 0.02 0.33 0.00 0.00 -1.58 -1.75 119.26 117.41 3kb4 h ALA 114 Ca -0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 3kb4 h ALA 114 Cb 1.09 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 3kb4 h ALA 114 CO 0.10 -0.22 -0.24 1.25 0.00 0.00 0.00 179.25 180.14 3kb4 h HIS 115 N -0.43 -0.63 -0.30 0.00 6.17 -0.02 -0.64 115.15 119.30 3kb4 h HIS 115 Ca 0.00 -0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.08 3kb4 h HIS 115 Cb 0.50 0.23 -0.02 0.00 2.52 0.00 0.00 27.41 30.64 3kb4 h HIS 115 CO 0.09 -0.36 0.19 -0.07 0.71 0.00 0.00 177.93 178.49 3kb4 h LEU 116 N -0.57 0.35 -0.12 0.26 3.38 -1.54 -1.19 115.31 115.89 3kb4 h LEU 116 Ca -0.03 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 3kb4 h LEU 116 Cb 0.49 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 3kb4 h LEU 116 CO 0.01 0.26 -0.02 1.23 0.09 0.00 0.00 178.44 180.01 3kb4 h GLY 117 N 0.43 0.24 2.00 0.83 0.00 -0.76 -2.68 103.07 103.14 3kb4 h GLY 117 Ca 0.11 -0.19 -0.14 0.00 0.00 0.00 0.00 47.33 47.11 3kb4 h GLY 117 CO -0.02 0.18 -0.66 1.05 0.00 0.00 0.00 176.54 177.08 3kb4 h GLU 118 N -0.08 0.00 -0.04 4.80 4.11 -0.86 -3.21 114.58 119.29 3kb4 h GLU 118 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.46 3kb4 h GLU 118 Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 3kb4 h GLU 118 CO 0.01 0.66 0.00 0.25 0.07 0.00 0.00 179.01 180.00 3kb4 n THR 119 N -3.36 0.04 -0.15 -1.06 -2.24 -0.47 -4.32 114.28 102.71 3kb4 n THR 119 Ca 0.01 -0.24 -0.02 0.00 -2.27 0.00 0.00 64.05 61.52 3kb4 n THR 119 Cb 0.76 0.37 0.05 0.00 -2.10 0.00 0.00 70.33 69.41 3kb4 n THR 119 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 3kb4 h HIS 120 N 2.06 -0.08 -0.04 4.78 6.17 -1.48 -0.05 115.15 126.51 3kb4 h HIS 120 Ca 0.00 0.04 -0.05 0.00 0.71 0.00 0.00 60.37 61.06 3kb4 h HIS 120 Cb 0.44 0.11 -0.01 0.00 2.52 0.00 0.00 27.41 30.47 3kb4 h HIS 120 CO 0.02 -0.14 -0.23 -0.44 0.71 0.00 0.00 177.93 177.86 3kb4 h ASP 121 N 0.09 0.06 -0.25 3.26 3.45 -1.84 -2.50 116.42 118.70 3kb4 h ASP 121 Ca 0.25 -0.02 -0.12 0.00 0.43 0.00 0.00 57.03 57.57 3kb4 h ASP 121 Cb 0.37 -0.02 -0.00 0.00 -0.56 0.00 0.00 39.33 39.12 3kb4 h ASP 121 CO -0.43 0.30 -0.32 0.40 -1.57 0.00 0.00 179.24 177.62 3kb4 h ILE 122 N 0.06 1.31 -0.45 0.35 2.04 -1.36 -2.81 117.51 116.66 3kb4 h ILE 122 Ca 0.01 -1.51 0.04 0.00 1.00 0.00 0.00 64.86 64.40 3kb4 h ILE 122 Cb 0.44 1.70 -0.02 0.00 -0.74 0.00 0.00 36.82 38.20 3kb4 h ILE 122 CO 0.03 0.48 0.30 -0.50 0.00 0.00 0.00 178.15 178.45 3kb4 h TRP 123 N 0.38 0.45 -0.02 1.37 4.06 -0.76 0.31 115.95 121.72 3kb4 h TRP 123 Ca 0.03 0.01 0.00 0.00 2.06 0.00 0.00 58.89 60.99 3kb4 h TRP 123 Cb 0.90 -0.15 -0.00 0.00 -1.00 0.00 0.00 29.16 28.91 3kb4 h TRP 123 CO 0.08 0.26 0.01 1.25 -3.56 0.00 0.00 178.44 176.48 3kb4 h HIS 124 N 0.46 0.03 0.18 0.49 2.76 -1.21 -1.48 115.15 116.38 3kb4 h HIS 124 Ca 0.18 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.34 3kb4 h HIS 124 Cb 0.15 -0.01 0.00 0.00 1.55 0.00 0.00 27.41 29.11 3kb4 h HIS 124 CO -0.00 0.03 -0.09 0.28 -1.30 0.00 0.00 177.93 176.85 3kb4 h VAL 125 N 0.02 0.93 -0.52 5.26 2.07 -1.03 -0.61 116.25 122.36 3kb4 h VAL 125 Ca 0.01 -0.58 0.03 0.00 0.82 0.00 0.00 66.70 66.98 3kb4 h VAL 125 Cb 0.01 1.27 -0.03 0.00 -1.52 0.00 0.00 31.29 31.02 3kb4 h VAL 125 CO -0.00 0.13 0.35 0.58 0.02 0.00 0.00 177.57 178.65 3kb4 h VAL 126 N -0.53 1.06 0.00 2.57 2.07 -1.01 -1.85 116.25 118.56 3kb4 h VAL 126 Ca -0.02 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.29 3kb4 h VAL 126 Cb 0.40 0.41 0.00 0.00 -1.52 0.00 0.00 31.29 30.58 3kb4 h VAL 126 CO 0.04 0.11 -0.69 1.07 0.02 0.00 0.00 177.57 178.11 3kb4 n THR 127 N -4.47 0.30 -2.09 2.57 5.66 -0.56 -4.86 114.28 110.84 3kb4 n THR 127 Ca 0.06 -0.25 -0.07 0.00 -3.05 0.00 0.00 64.05 60.73 3kb4 n THR 127 Cb 0.14 -0.05 -0.01 0.00 -1.55 0.00 0.00 70.33 68.87 3kb4 n THR 127 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3kb4 n GLY 128 N 1.35 0.12 3.73 1.09 0.00 -0.33 -4.88 105.19 106.27 3kb4 n GLY 128 Ca 0.03 -0.59 -0.39 0.00 0.00 0.00 0.00 46.02 45.07 3kb4 n GLY 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kb4 s ASP 130 N 0.46 1.22 0.00 0.00 -0.00 -1.26 -4.80 116.67 112.30 3kb4 s ASP 130 Ca 0.36 1.59 0.25 0.00 -0.00 0.00 0.00 52.55 54.75 3kb4 s ASP 130 Cb -0.18 -2.33 0.50 0.00 -0.00 0.00 0.00 42.92 40.91 3kb4 s ASP 130 CO 0.18 -4.06 1.41 1.07 -0.00 0.00 0.00 175.17 173.77 3kb4 n THR 131 N -4.83 0.00 -1.02 -1.27 5.66 -1.26 -4.13 114.28 107.44 3kb4 n THR 131 Ca 0.04 -0.02 -0.30 0.00 -3.05 0.00 0.00 64.05 60.72 3kb4 n THR 131 Cb 0.54 0.31 0.26 0.00 -1.55 0.00 0.00 70.33 69.89 3kb4 n THR 131 CO 0.00 0.00 0.00 1.51 -3.05 0.00 0.00 175.07 173.53 3kb4 s ASP 132 N -2.93 0.44 0.14 1.09 1.47 -1.26 -4.74 116.67 110.89 3kb4 s ASP 132 Ca 0.13 0.53 -0.17 0.00 1.18 0.00 0.00 52.55 54.22 3kb4 s ASP 132 Cb 0.18 -0.69 -0.01 0.00 -0.34 0.00 0.00 42.92 42.05 3kb4 s ASP 132 CO 0.68 -4.41 1.79 0.11 0.68 0.00 0.00 175.17 174.02 3kb4 h LYS 133 N -2.78 0.46 0.00 2.11 1.57 -2.00 -1.79 116.57 114.15 3kb4 h LYS 133 Ca -0.42 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.30 3kb4 h LYS 133 Cb 1.29 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 33.49 3kb4 h LYS 133 CO 0.29 0.33 -0.07 -1.00 -0.57 0.00 0.00 179.45 178.42 3kb4 h PRO 134 N 0.46 0.00 -0.09 3.15 0.13 -1.92 -1.61 132.00 132.12 3kb4 h PRO 134 Ca 0.13 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 65.07 3kb4 h PRO 134 Cb -0.02 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.10 3kb4 h PRO 134 CO -0.03 0.07 -0.71 0.78 -0.23 0.00 0.00 178.00 177.88 3kb4 h GLY 135 N 0.92 0.49 1.07 1.56 0.00 -1.53 -1.97 103.07 103.62 3kb4 h GLY 135 Ca -0.00 -0.69 -0.11 0.00 0.00 0.00 0.00 47.33 46.53 3kb4 h GLY 135 CO 0.01 0.61 -0.12 0.83 0.00 0.00 0.00 176.54 177.87 3kb4 h GLU 136 N 0.31 0.97 -0.61 4.80 4.39 -0.70 -0.96 114.58 122.79 3kb4 h GLU 136 Ca -0.03 -0.37 -0.06 0.00 0.34 0.00 0.00 59.36 59.24 3kb4 h GLU 136 Cb 1.29 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.86 3kb4 h GLU 136 CO 0.13 1.05 0.14 0.28 -1.16 0.00 0.00 179.01 179.44 3kb4 h VAL 137 N 0.83 1.25 -0.54 3.13 2.07 -1.41 0.19 116.25 121.78 3kb4 h VAL 137 Ca 0.13 -0.93 0.02 0.00 0.82 0.00 0.00 66.70 66.74 3kb4 h VAL 137 Cb 0.69 0.69 -0.03 0.00 -1.52 0.00 0.00 31.29 31.12 3kb4 h VAL 137 CO 0.05 0.35 0.33 0.50 0.02 0.00 0.00 177.57 178.82 3kb4 h LYS 138 N 0.89 0.64 -0.54 1.57 3.64 -1.12 0.13 116.57 121.78 3kb4 h LYS 138 Ca 0.19 -0.04 -0.12 0.00 -1.27 0.00 0.00 60.65 59.41 3kb4 h LYS 138 Cb 0.36 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.02 3kb4 h LYS 138 CO 0.00 0.42 -0.13 1.25 -2.27 0.00 0.00 179.45 178.73 3kb4 h LEU 139 N 0.66 1.04 -1.03 5.20 6.46 -0.73 -2.13 115.31 124.78 3kb4 h LEU 139 Ca 0.21 -0.36 -0.02 0.00 -0.12 0.00 0.00 57.88 57.59 3kb4 h LEU 139 Cb 0.00 -0.28 -0.04 0.00 -0.73 0.00 0.00 40.66 39.61 3kb4 h LEU 139 CO -0.09 1.16 0.40 -0.33 -0.62 0.00 0.00 178.44 178.96 3kb4 h GLU 140 N 0.91 1.08 -0.65 1.25 5.08 0.12 -0.69 114.58 121.68 3kb4 h GLU 140 Ca 0.14 -0.13 -0.08 0.00 -1.00 0.00 0.00 59.36 58.29 3kb4 h GLU 140 Cb 0.70 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.72 3kb4 h GLU 140 CO 0.05 0.81 0.11 0.00 -1.00 0.00 0.00 179.01 178.98 3kb4 h ALA 141 N 1.36 0.97 -0.58 3.43 0.00 -0.53 -1.15 119.26 122.74 3kb4 h ALA 141 Ca 0.27 -0.26 0.03 0.00 0.00 0.00 0.00 54.91 54.94 3kb4 h ALA 141 Cb 0.06 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 3kb4 h ALA 141 CO -0.04 0.65 0.36 0.35 0.00 0.00 0.00 179.25 180.57 3kb4 h PHE 142 N 0.99 0.67 -0.15 0.00 3.57 -0.65 -1.82 116.94 119.54 3kb4 h PHE 142 Ca 0.20 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.71 3kb4 h PHE 142 Cb 0.42 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.94 3kb4 h PHE 142 CO 0.03 0.38 0.07 1.88 -2.23 0.00 0.00 178.31 178.44 3kb4 h TYR 143 N 0.70 0.23 -0.10 0.41 -1.99 -0.74 -2.27 116.97 113.21 3kb4 h TYR 143 Ca 0.23 -0.01 -0.01 0.00 2.00 0.00 0.00 58.73 60.94 3kb4 h TYR 143 Cb 0.02 -0.07 -0.01 0.00 2.00 0.00 0.00 36.73 38.67 3kb4 h TYR 143 CO -0.06 0.27 0.03 1.79 -0.00 0.00 0.00 178.16 180.19 3kb4 h THR 144 N 0.12 1.05 -0.42 -2.88 1.35 -0.82 0.21 112.91 111.52 3kb4 h THR 144 Ca 0.05 -0.16 -0.14 0.00 -0.55 0.00 0.00 66.41 65.61 3kb4 h THR 144 Cb 0.13 0.94 -0.01 0.00 -1.73 0.00 0.00 68.15 67.48 3kb4 h THR 144 CO -0.01 0.06 -0.30 0.00 -0.25 0.00 0.00 175.52 175.02 3kb4 h ALA 145 N 1.90 0.67 0.00 6.62 0.00 -1.08 -3.30 119.26 124.06 3kb4 h ALA 145 Ca 0.04 -0.42 -0.13 0.00 0.00 0.00 0.00 54.91 54.40 3kb4 h ALA 145 Cb 0.05 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3kb4 h ALA 145 CO -0.00 0.67 -1.14 1.96 0.00 0.00 0.00 179.25 180.74 3kb4 h GLN 146 N 0.78 0.00 -0.62 0.00 4.20 -0.55 -3.38 115.11 115.54 3kb4 h GLN 146 Ca 0.08 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.79 3kb4 h GLN 146 Cb 0.88 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.66 3kb4 h GLN 146 CO 0.08 0.29 0.00 1.28 -0.67 0.00 0.00 178.83 179.81 3kb4 n LEU 147 N -2.94 5.28 -4.65 1.46 7.99 0.59 -4.99 117.00 119.74 3kb4 n LEU 147 Ca -0.06 -2.67 -0.44 0.00 -0.01 0.00 0.00 56.01 52.83 3kb4 n LEU 147 Cb 0.77 -0.64 -0.02 0.00 -0.11 0.00 0.00 43.42 43.43 3kb4 n LEU 147 CO 0.42 0.72 0.82 -0.38 -1.51 0.00 0.00 177.39 177.46 3kb4 n ILE 148 N 0.89 1.61 -1.47 -0.08 5.41 -1.24 -0.07 119.36 124.42 3kb4 n ILE 148 Ca 0.27 -0.40 -0.28 0.00 1.00 0.00 0.00 62.75 63.33 3kb4 n ILE 148 Cb 1.05 -1.32 -0.01 0.00 -0.71 0.00 0.00 39.64 38.65 3kb4 n ILE 148 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 3kb4 n PRO 149 N 1.11 2.40 -0.92 0.38 -0.04 -1.26 -4.85 135.00 131.82 3kb4 n PRO 149 Ca 0.09 -2.52 -0.31 0.00 -0.04 0.00 0.00 63.50 60.71 3kb4 n PRO 149 Cb 0.33 -2.10 0.14 0.00 -0.04 0.00 0.00 33.50 31.83 3kb4 n PRO 149 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 3kb4 s ASP 150 N -0.12 3.46 0.00 3.54 -1.08 0.90 -4.93 116.67 118.45 3kb4 s ASP 150 Ca 0.54 2.11 0.00 0.00 -0.52 0.00 0.00 52.55 54.68 3kb4 s ASP 150 Cb 0.38 -2.56 0.00 0.00 -1.46 0.00 0.00 42.92 39.29 3kb4 s ASP 150 CO -0.21 -2.74 0.00 0.54 0.52 0.00 0.00 175.17 173.28 3kb4 n ARG 151 N -3.90 2.15 0.21 4.34 1.74 -1.26 -4.78 116.66 115.16 3kb4 n ARG 151 Ca 0.11 0.00 -0.15 0.00 -0.77 0.00 0.00 57.85 57.04 3kb4 n ARG 151 Cb 0.52 -0.99 -0.07 0.00 -1.02 0.00 0.00 32.46 30.90 3kb4 n ARG 151 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 3kb4 h LEU 152 N 0.00 -0.71 -1.55 0.55 5.85 -1.93 -2.55 115.31 114.97 3kb4 h LEU 152 Ca 0.00 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 3kb4 h LEU 152 Cb 0.52 0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.77 3kb4 h LEU 152 CO 0.00 -0.40 0.18 -0.26 -0.34 0.00 0.00 178.44 177.61 3kb4 h PHE 153 N -0.61 0.47 -0.43 1.25 0.04 -1.92 0.04 116.94 115.77 3kb4 h PHE 153 Ca -0.02 -0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.70 3kb4 h PHE 153 Cb 0.54 -0.15 -0.02 0.00 2.20 0.00 0.00 35.95 38.52 3kb4 h PHE 153 CO -0.15 0.34 0.12 1.25 -0.60 0.00 0.00 178.31 179.27 3kb4 h LEU 154 N 0.49 0.65 -1.13 1.54 6.46 -1.84 -1.77 115.31 119.71 3kb4 h LEU 154 Ca 0.13 -0.22 -0.05 0.00 -0.12 0.00 0.00 57.88 57.61 3kb4 h LEU 154 Cb 0.04 -0.17 -0.02 0.00 -0.73 0.00 0.00 40.66 39.78 3kb4 h LEU 154 CO -0.02 0.70 0.04 0.00 -0.62 0.00 0.00 178.44 178.54 3kb4 h ALA 155 N 0.97 1.29 -0.53 1.25 0.00 -0.80 -1.25 119.26 120.19 3kb4 h ALA 155 Ca 0.14 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 3kb4 h ALA 155 Cb 0.30 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3kb4 h ALA 155 CO -0.00 0.48 0.10 -0.07 0.00 0.00 0.00 179.25 179.77 3kb4 h LEU 156 N 0.62 0.77 -0.48 0.00 4.07 -0.66 0.15 115.31 119.78 3kb4 h LEU 156 Ca 0.13 -0.15 -0.12 0.00 0.08 0.00 0.00 57.88 57.82 3kb4 h LEU 156 Cb 0.34 -0.20 -0.01 0.00 1.08 0.00 0.00 40.66 41.86 3kb4 h LEU 156 CO 0.01 0.78 -0.18 -0.07 -1.08 0.00 0.00 178.44 177.89 3kb4 h LEU 157 N 0.79 0.99 -0.46 1.67 3.38 -0.69 -1.72 115.31 119.27 3kb4 h LEU 157 Ca 0.17 -0.39 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 3kb4 h LEU 157 Cb 0.33 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 3kb4 h LEU 157 CO 0.00 1.16 0.28 0.00 0.09 0.00 0.00 178.44 179.97 3kb4 h ALA 158 N 0.87 0.59 -0.26 1.53 0.00 -0.08 -0.96 119.26 120.95 3kb4 h ALA 158 Ca 0.11 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 3kb4 h ALA 158 Cb 0.76 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 3kb4 h ALA 158 CO 0.06 0.07 -0.21 1.57 0.00 0.00 0.00 179.25 180.73 3kb4 h LYS 159 N 0.61 0.48 -0.01 0.00 5.09 -0.60 -1.83 116.57 120.30 3kb4 h LYS 159 Ca 0.17 -0.17 -0.14 0.00 0.09 0.00 0.00 60.65 60.60 3kb4 h LYS 159 Cb -0.02 -0.04 -0.02 0.00 0.10 0.00 0.00 32.23 32.26 3kb4 h LYS 159 CO -0.03 0.67 -0.65 -0.91 -2.09 0.00 0.00 179.45 176.43 3kb4 h ASN 160 N 0.43 0.07 -0.16 7.07 2.35 -0.89 -1.02 115.58 123.42 3kb4 h ASN 160 Ca 0.07 -0.04 -0.16 0.00 -0.55 0.00 0.00 56.30 55.61 3kb4 h ASN 160 Cb 0.61 -0.02 -0.00 0.00 0.05 0.00 0.00 38.32 38.96 3kb4 h ASN 160 CO 0.04 0.70 -0.49 -0.07 -1.65 0.00 0.00 177.43 175.96 3kb4 h LEU 161 N 0.04 0.80 -0.52 1.61 3.38 -0.91 -1.74 115.31 117.98 3kb4 h LEU 161 Ca -0.01 -0.41 -0.09 0.00 0.09 0.00 0.00 57.88 57.46 3kb4 h LEU 161 Cb 1.16 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.66 3kb4 h LEU 161 CO 0.09 1.16 -0.04 0.25 0.09 0.00 0.00 178.44 179.98 3kb4 h LEU 162 N 0.58 0.93 -0.87 1.67 5.85 -1.18 -1.56 115.31 120.74 3kb4 h LEU 162 Ca 0.03 -0.33 -0.04 0.00 0.84 0.00 0.00 57.88 58.38 3kb4 h LEU 162 Cb 1.06 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.80 3kb4 h LEU 162 CO 0.10 1.04 0.31 0.11 -0.34 0.00 0.00 178.44 179.66 3kb4 h LYS 163 N 0.81 1.14 -0.41 1.25 1.57 -1.10 -2.65 116.57 117.18 3kb4 h LYS 163 Ca 0.14 -0.20 -0.04 0.00 -1.87 0.00 0.00 60.65 58.68 3kb4 h LYS 163 Cb 0.58 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.69 3kb4 h LYS 163 CO 0.04 0.92 0.08 1.15 -0.57 0.00 0.00 179.45 181.06 3kb4 h THR 164 N 1.12 1.24 0.00 -0.16 2.02 -1.10 0.25 112.91 116.27 3kb4 h THR 164 Ca 0.26 -0.84 0.00 0.00 0.77 0.00 0.00 66.41 66.60 3kb4 h THR 164 Cb 0.20 1.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.61 3kb4 h THR 164 CO -0.02 0.29 0.00 0.00 0.37 0.00 0.00 175.52 176.16 3kb4 n ALA 165 N -2.36 1.49 0.20 6.16 0.00 -0.61 -0.41 120.51 124.98 3kb4 n ALA 165 Ca -0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.44 3kb4 n ALA 165 Cb 0.22 -1.00 0.01 0.00 0.00 0.00 0.00 19.45 18.68 3kb4 n ALA 165 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3kb4 n TYR 167 N 0.13 0.00 -2.93 0.00 4.01 0.87 -4.62 117.16 114.63 3kb4 n TYR 167 Ca 0.00 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.61 3kb4 n TYR 167 Cb 0.05 -0.01 0.03 0.00 -0.31 0.00 0.00 39.34 39.10 3kb4 n TYR 167 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 3kb4 n GLU 168 N -1.82 1.04 0.24 -0.72 1.02 -0.87 -4.95 120.64 114.58 3kb4 n GLU 168 Ca 0.00 -2.82 0.18 0.00 -0.02 0.00 0.00 57.16 54.51 3kb4 n GLU 168 Cb 0.66 -1.28 0.86 0.00 -0.02 0.00 0.00 31.44 31.65 3kb4 n GLU 168 CO 0.00 0.00 0.00 -0.24 1.18 0.00 0.00 177.13 178.07 3kb4 h VAL 169 N 1.98 0.22 -0.39 2.62 3.04 -0.99 -0.41 116.25 122.32 3kb4 h VAL 169 Ca -0.03 0.00 0.07 0.00 -1.01 0.00 0.00 66.70 65.74 3kb4 h VAL 169 Cb 1.07 0.76 -0.02 0.00 -2.01 0.00 0.00 31.29 31.09 3kb4 h VAL 169 CO 0.35 0.00 0.27 -0.33 -1.01 0.00 0.00 177.57 176.84 3kb4 h GLU 170 N 0.00 0.21 0.00 4.17 3.07 -1.93 -0.85 114.58 119.26 3kb4 h GLU 170 Ca 0.07 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.92 3kb4 h GLU 170 Cb 0.62 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.48 3kb4 h GLU 170 CO -0.00 0.14 0.00 1.28 -1.40 0.00 0.00 179.01 179.03 3kb4 n LEU 171 N -4.47 0.00 -0.28 1.33 4.77 -0.16 -4.37 117.00 113.82 3kb4 n LEU 171 Ca 0.05 0.14 -0.04 0.00 -0.03 0.00 0.00 56.01 56.14 3kb4 n LEU 171 Cb 0.31 -0.14 0.01 0.00 -2.33 0.00 0.00 43.42 41.27 3kb4 n LEU 171 CO 0.35 -0.00 0.60 0.00 -1.33 0.00 0.00 177.39 177.01 3kb4 h GLU 173 N -0.10 0.11 -0.16 0.00 4.57 -1.83 -0.69 114.58 116.49 3kb4 h GLU 173 Ca 0.27 -0.01 -0.14 0.00 -1.18 0.00 0.00 59.36 58.30 3kb4 h GLU 173 Cb 0.57 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.13 3kb4 h GLU 173 CO -0.81 0.07 -0.51 1.96 -1.18 0.00 0.00 179.01 178.53 3kb4 h GLN 174 N 0.11 0.44 -0.09 1.92 4.20 -1.45 -1.64 115.11 118.59 3kb4 h GLN 174 Ca 0.21 -0.26 -0.02 0.00 0.06 0.00 0.00 58.65 58.65 3kb4 h GLN 174 Cb 0.31 0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.11 3kb4 h GLN 174 CO -0.36 0.85 -0.01 0.82 -0.67 0.00 0.00 178.83 179.46 3kb4 h ILE 175 N 0.34 1.27 -0.50 2.54 1.08 -0.30 -0.20 117.51 121.74 3kb4 h ILE 175 Ca 0.01 -0.86 -0.10 0.00 -0.39 0.00 0.00 64.86 63.52 3kb4 h ILE 175 Cb 1.02 1.66 -0.02 0.00 -3.07 0.00 0.00 36.82 36.41 3kb4 h ILE 175 CO 0.09 0.24 -0.10 -0.07 -0.69 0.00 0.00 178.15 177.63 3kb4 h LEU 176 N -0.13 0.94 -0.88 1.44 4.07 -1.16 0.20 115.31 119.80 3kb4 h LEU 176 Ca 0.03 -0.35 0.03 0.00 0.08 0.00 0.00 57.88 57.66 3kb4 h LEU 176 Cb 0.38 -0.26 -0.05 0.00 1.08 0.00 0.00 40.66 41.82 3kb4 h LEU 176 CO 0.01 1.07 0.57 0.44 -1.08 0.00 0.00 178.44 179.45 3kb4 h ASP 177 N 0.80 0.96 -0.31 -0.43 3.45 -1.26 0.13 116.42 119.75 3kb4 h ASP 177 Ca 0.13 -0.01 -0.05 0.00 0.43 0.00 0.00 57.03 57.53 3kb4 h ASP 177 Cb 0.65 -0.22 -0.01 0.00 -0.56 0.00 0.00 39.33 39.19 3kb4 h ASP 177 CO 0.04 0.66 0.01 1.23 -1.57 0.00 0.00 179.24 179.62 3kb4 h GLY 178 N 1.12 0.58 0.97 2.75 0.00 -0.69 -1.54 103.07 106.25 3kb4 h GLY 178 Ca 0.34 -0.42 -0.00 0.00 0.00 0.00 0.00 47.33 47.25 3kb4 h GLY 178 CO -0.11 0.38 0.16 -2.00 0.00 0.00 0.00 176.54 174.98 3kb4 h LEU 179 N 0.34 0.32 -0.41 3.11 6.46 -0.42 -0.78 115.31 123.94 3kb4 h LEU 179 Ca 0.09 -0.06 0.04 0.00 -0.12 0.00 0.00 57.88 57.84 3kb4 h LEU 179 Cb 0.41 -0.08 -0.04 0.00 -0.73 0.00 0.00 40.66 40.22 3kb4 h LEU 179 CO 0.01 0.29 0.16 0.74 -0.62 0.00 0.00 178.44 179.02 3kb4 h THR 180 N 0.33 0.91 -0.27 1.05 2.02 -0.65 -0.88 112.91 115.41 3kb4 h THR 180 Ca 0.10 -0.12 -0.02 0.00 0.77 0.00 0.00 66.41 67.14 3kb4 h THR 180 Cb 0.03 0.54 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 3kb4 h THR 180 CO -0.02 0.06 0.10 1.56 0.37 0.00 0.00 175.52 177.59 3kb4 h GLN 181 N 0.34 0.41 -0.50 6.66 4.20 -1.07 -3.10 115.11 122.04 3kb4 h GLN 181 Ca 0.18 -0.08 -0.01 0.00 0.06 0.00 0.00 58.65 58.81 3kb4 h GLN 181 Cb 0.15 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.84 3kb4 h GLN 181 CO -0.17 0.45 0.29 0.78 -0.67 0.00 0.00 178.83 179.51 3kb4 h GLY 182 N 0.28 0.74 -6.57 3.46 0.00 -0.89 -3.40 103.07 96.69 3kb4 h GLY 182 Ca 0.09 -0.32 -0.33 0.00 0.00 0.00 0.00 47.33 46.77 3kb4 h GLY 182 CO -0.01 0.31 1.20 1.87 0.00 0.00 0.00 176.54 179.91 3kb4 n TRP 183 N -4.68 0.00 0.00 5.60 -0.00 -0.36 -3.43 117.44 114.58 3kb4 n TRP 183 Ca 0.02 -0.49 0.00 0.00 -0.00 0.00 0.00 57.50 57.03 3kb4 n TRP 183 Cb 0.07 -0.68 0.00 0.00 -0.00 0.00 0.00 31.31 30.70 3kb4 n TRP 183 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 3kb4 n GLY 186 N 4.55 1.86 0.13 5.87 0.00 -1.26 -4.71 105.19 111.64 3kb4 n GLY 186 Ca 0.26 -0.02 -0.13 0.00 0.00 0.00 0.00 46.02 46.13 3kb4 n GLY 186 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3kb4 h LYS 187 N 0.00 0.31 0.02 1.61 1.57 -1.87 -3.32 116.57 114.89 3kb4 h LYS 187 Ca 0.00 -0.38 -0.21 0.00 -1.87 0.00 0.00 60.65 58.19 3kb4 h LYS 187 Cb 0.00 0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 3kb4 h LYS 187 CO 0.00 1.09 -0.95 -0.09 -0.57 0.00 0.00 179.45 178.93 3kb4 h ARG 188 N 0.15 0.11 -7.32 3.15 2.43 -1.90 -3.46 114.38 107.54 3kb4 h ARG 188 Ca -0.08 -0.15 -0.51 0.00 -0.81 0.00 0.00 59.98 58.43 3kb4 h ARG 188 Cb 1.67 0.05 0.10 0.00 -0.42 0.00 0.00 29.97 31.36 3kb4 h ARG 188 CO 0.17 0.98 0.36 0.00 -1.51 0.00 0.00 179.97 179.96 3kb4 s ALA 189 N -2.98 2.62 0.69 2.80 0.00 -1.23 -4.87 121.76 118.80 3kb4 s ALA 189 Ca -0.01 0.14 -0.11 0.00 0.00 0.00 0.00 51.96 51.97 3kb4 s ALA 189 Cb 0.10 -3.20 0.01 0.00 0.00 0.00 0.00 23.12 20.03 3kb4 s ALA 189 CO 0.83 -1.28 1.08 0.15 0.00 0.00 0.00 175.76 176.54 3kb4 s LYS 190 N -4.95 2.96 0.11 0.00 1.02 0.01 -4.96 119.74 113.94 3kb4 s LYS 190 Ca 0.59 0.54 -0.32 0.00 0.02 0.00 0.00 55.97 56.80 3kb4 s LYS 190 Cb -0.15 -2.03 -0.11 0.00 -0.52 0.00 0.00 37.83 35.02 3kb4 s LYS 190 CO 0.54 -0.98 1.80 -2.30 -0.92 0.00 0.00 175.35 173.48 3kb4 n PRO 191 N -2.99 2.64 0.00 -1.68 -0.02 -1.26 -4.87 135.00 126.83 3kb4 n PRO 191 Ca 0.07 0.96 0.12 0.00 -2.02 0.00 0.00 63.50 62.63 3kb4 n PRO 191 Cb 0.56 -2.83 0.26 0.00 -0.02 0.00 0.00 33.50 31.47 3kb4 n PRO 191 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3kb4 n LEU 192 N 5.31 0.58 -4.76 2.45 4.32 -1.26 -4.92 117.00 118.72 3kb4 n LEU 192 Ca 0.18 -0.05 -0.41 0.00 -0.02 0.00 0.00 56.01 55.72 3kb4 n LEU 192 Cb 0.35 -0.23 -0.03 0.00 -1.62 0.00 0.00 43.42 41.89 3kb4 n LEU 192 CO 0.66 0.14 0.91 0.12 -1.22 0.00 0.00 177.39 178.00 3kb4 s PHE 193 N -2.93 3.28 0.00 -1.77 5.36 -1.26 -3.46 117.98 117.19 3kb4 s PHE 193 Ca 0.13 1.50 0.00 0.00 -0.96 0.00 0.00 56.93 57.60 3kb4 s PHE 193 Cb 0.18 -3.52 0.00 0.00 -0.34 0.00 0.00 43.02 39.34 3kb4 s PHE 193 CO 0.68 -1.35 0.00 0.41 -1.46 0.00 0.00 175.22 173.50 3kb4 n GLY 194 N 1.15 0.55 3.74 13.12 0.00 -1.26 -4.78 105.19 117.69 3kb4 n GLY 194 Ca 0.00 -0.03 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 3kb4 n GLY 194 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kb4 s ILE 195 N -2.00 4.75 -1.08 -0.61 1.09 -1.22 -4.78 121.20 117.35 3kb4 s ILE 195 Ca 0.00 1.70 -0.17 0.00 -1.10 0.00 0.00 60.65 61.08 3kb4 s ILE 195 Cb 0.00 -4.15 0.13 0.00 -1.06 0.00 0.00 42.46 37.38 3kb4 s ILE 195 CO 0.00 0.33 1.33 -1.61 -0.10 0.00 0.00 174.94 174.89 3kb4 s GLU 196 N 0.14 3.82 0.48 2.79 2.02 -1.26 -4.85 118.70 121.84 3kb4 s GLU 196 Ca 0.41 -2.02 0.15 0.00 0.02 0.00 0.00 54.97 53.52 3kb4 s GLU 196 Cb -0.21 -5.08 1.13 0.00 0.10 0.00 0.00 34.13 30.07 3kb4 s GLU 196 CO 0.24 -1.86 2.07 -1.49 0.02 0.00 0.00 175.26 174.24 3kb4 h TRP 197 N 8.19 0.02 0.00 1.61 4.06 -1.97 -2.42 115.95 125.44 3kb4 h TRP 197 Ca 0.25 -0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.20 3kb4 h TRP 197 Cb 0.95 -0.01 0.00 0.00 -1.00 0.00 0.00 29.16 29.10 3kb4 h TRP 197 CO 1.18 0.10 0.00 0.27 -3.56 0.00 0.00 178.44 176.43 3kb4 n ASN 198 N -4.44 0.00 -0.20 -3.49 0.23 -1.26 -0.79 115.26 105.31 3kb4 n ASN 198 Ca -0.03 -0.24 0.08 0.00 -0.53 0.00 0.00 54.58 53.86 3kb4 n ASN 198 Cb 0.16 0.00 0.13 0.00 -2.08 0.00 0.00 39.78 37.99 3kb4 n ASN 198 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 3kb4 n LYS 199 N -0.99 1.95 -0.03 -3.83 5.02 -0.91 -4.55 118.16 114.82 3kb4 n LYS 199 Ca 0.06 -2.38 0.00 0.00 -2.02 0.00 0.00 58.31 53.97 3kb4 n LYS 199 Cb 0.03 -1.44 0.00 0.00 -0.02 0.00 0.00 35.03 33.60 3kb4 n LYS 199 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3kb4 n LEU 200 N -1.02 0.81 -0.32 -0.35 4.77 0.03 -4.86 117.00 116.06 3kb4 n LEU 200 Ca 0.13 -0.88 0.13 0.00 -0.03 0.00 0.00 56.01 55.36 3kb4 n LEU 200 Cb 0.59 -0.01 0.35 0.00 -2.33 0.00 0.00 43.42 42.02 3kb4 n LEU 200 CO 0.03 0.22 1.21 -0.50 -1.33 0.00 0.00 177.39 177.02 3kb4 h TRP 201 N 0.00 0.94 -0.13 -1.77 -0.00 -1.79 -1.52 115.95 111.68 3kb4 h TRP 201 Ca 0.00 0.03 0.00 0.00 -0.00 0.00 0.00 58.89 58.92 3kb4 h TRP 201 Cb 0.84 -0.29 0.00 0.00 -0.00 0.00 0.00 29.16 29.71 3kb4 h TRP 201 CO 0.00 0.28 0.00 0.39 -0.00 0.00 0.00 178.44 179.11 3kb4 n GLU 202 N -4.65 1.72 -2.82 0.49 1.02 -1.26 -0.79 120.64 114.36 3kb4 n GLU 202 Ca 0.21 -1.08 -0.41 0.00 -0.02 0.00 0.00 57.16 55.86 3kb4 n GLU 202 Cb 0.53 -1.42 -0.04 0.00 -0.02 0.00 0.00 31.44 30.50 3kb4 n GLU 202 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 3kb4 s THR 203 N -1.84 4.83 0.12 2.62 2.01 -0.57 -4.85 115.64 117.97 3kb4 s THR 203 Ca 0.34 1.88 -0.32 0.00 0.31 0.00 0.00 61.69 63.90 3kb4 s THR 203 Cb 0.18 -4.24 -0.11 0.00 0.01 0.00 0.00 72.50 68.35 3kb4 s THR 203 CO 0.28 0.23 1.81 -2.65 -0.69 0.00 0.00 174.62 173.61 3kb4 n PRO 204 N 3.55 2.72 -0.17 4.92 -0.02 -1.26 -1.64 135.00 143.10 3kb4 n PRO 204 Ca 0.03 0.99 -0.04 0.00 -2.02 0.00 0.00 63.50 62.46 3kb4 n PRO 204 Cb 0.51 -2.87 0.03 0.00 -0.02 0.00 0.00 33.50 31.15 3kb4 n PRO 204 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3kb4 h LEU 205 N 8.26 -0.80 -1.73 2.45 5.85 -1.32 0.33 115.31 128.35 3kb4 h LEU 205 Ca -0.46 0.19 0.13 0.00 0.84 0.00 0.00 57.88 58.58 3kb4 h LEU 205 Cb 1.23 0.44 -0.04 0.00 0.37 0.00 0.00 40.66 42.66 3kb4 h LEU 205 CO 0.94 -0.25 0.43 -0.33 -0.34 0.00 0.00 178.44 178.89 3kb4 h GLU 206 N -0.10 0.27 0.02 1.25 5.08 -1.90 -0.23 114.58 118.96 3kb4 h GLU 206 Ca 0.24 -0.02 -0.25 0.00 -1.00 0.00 0.00 59.36 58.34 3kb4 h GLU 206 Cb 0.48 -0.06 0.01 0.00 0.50 0.00 0.00 28.75 29.68 3kb4 h GLU 206 CO -0.60 0.18 -1.02 0.93 -1.00 0.00 0.00 179.01 177.50 3kb4 h GLU 207 N 0.28 0.50 -0.69 2.33 5.08 -1.35 -2.64 114.58 118.09 3kb4 h GLU 207 Ca 0.30 -0.57 -0.04 0.00 -1.00 0.00 0.00 59.36 58.06 3kb4 h GLU 207 Cb 0.80 0.17 -0.03 0.00 0.50 0.00 0.00 28.75 30.19 3kb4 h GLU 207 CO -0.07 1.20 0.29 1.25 -1.00 0.00 0.00 179.01 180.68 3kb4 h LEU 208 N 0.27 0.94 -0.16 1.33 6.46 -0.05 -1.99 115.31 122.11 3kb4 h LEU 208 Ca -0.11 -0.16 -0.01 0.00 -0.12 0.00 0.00 57.88 57.48 3kb4 h LEU 208 Cb 1.67 -0.24 -0.01 0.00 -0.73 0.00 0.00 40.66 41.35 3kb4 h LEU 208 CO 0.18 0.84 0.07 1.56 -0.62 0.00 0.00 178.44 180.48 3kb4 h GLN 209 N 0.97 0.23 -0.74 1.25 4.20 -1.12 -1.41 115.11 118.49 3kb4 h GLN 209 Ca 0.23 -0.04 0.04 0.00 0.06 0.00 0.00 58.65 58.94 3kb4 h GLN 209 Cb 0.19 -0.04 -0.05 0.00 0.30 0.00 0.00 27.48 27.88 3kb4 h GLN 209 CO -0.02 0.29 0.46 1.15 -0.67 0.00 0.00 178.83 180.04 3kb4 h THR 210 N 0.11 1.08 0.00 -0.54 2.02 -1.31 0.15 112.91 114.42 3kb4 h THR 210 Ca 0.05 -0.31 0.00 0.00 0.77 0.00 0.00 66.41 66.93 3kb4 h THR 210 Cb 0.15 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 66.67 3kb4 h THR 210 CO -0.01 0.16 0.00 0.77 0.37 0.00 0.00 175.52 176.82 3kb4 h SER 211 N 0.89 0.00 -0.13 4.18 4.64 -1.18 -2.07 113.55 119.88 3kb4 h SER 211 Ca 0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 3kb4 h SER 211 Cb 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 3kb4 h SER 211 CO -0.12 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.02 3kb4 n LEU 212 N -2.76 2.88 -3.43 5.97 4.32 0.02 -4.93 117.00 119.07 3kb4 n LEU 212 Ca 0.02 -1.06 -0.23 0.00 -0.02 0.00 0.00 56.01 54.72 3kb4 n LEU 212 Cb 0.31 -0.07 0.07 0.00 -1.62 0.00 0.00 43.42 42.11 3kb4 n LEU 212 CO 0.26 0.53 0.20 0.59 -1.22 0.00 0.00 177.39 177.74 3kb4 n ASN 213 N 1.20 -6.28 -4.44 -1.43 5.03 0.30 -0.81 115.26 108.83 3kb4 n ASN 213 Ca 0.16 -0.48 -0.41 0.00 0.87 0.00 0.00 54.58 54.72 3kb4 n ASN 213 Cb 0.56 -4.94 -0.11 0.00 -1.02 0.00 0.00 39.78 34.27 3kb4 n ASN 213 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 3kb4 s ILE 214 N -3.29 4.98 -0.49 2.41 1.01 -0.00 -3.56 121.20 122.25 3kb4 s ILE 214 Ca 0.52 -0.61 -0.11 0.00 0.00 0.00 0.00 60.65 60.45 3kb4 s ILE 214 Cb -0.23 -3.71 0.12 0.00 0.01 0.00 0.00 42.46 38.66 3kb4 s ILE 214 CO 0.65 -0.19 0.40 -0.69 0.00 0.00 0.00 174.94 175.11 3kb4 s VAL 215 N 1.64 4.55 -2.00 2.92 1.01 -1.26 -4.40 120.40 122.86 3kb4 s VAL 215 Ca 0.04 -1.69 0.13 0.00 0.00 0.00 0.00 61.98 60.47 3kb4 s VAL 215 Cb -0.19 -3.96 0.37 0.00 0.00 0.00 0.00 36.38 32.60 3kb4 s VAL 215 CO 0.09 -0.80 1.21 -0.81 0.00 0.00 0.00 175.10 174.78