#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c02 s LYS 1 N 0.00 1.46 0.76 3.17 -2.85 -1.26 -4.83 119.74 116.19 2c02 s LYS 1 Ca 0.00 -1.07 -0.14 0.00 -1.00 0.00 0.00 55.97 53.76 2c02 s LYS 1 Cb 0.00 -1.66 0.06 0.00 -2.06 0.00 0.00 37.83 34.16 2c02 s LYS 1 CO 0.00 0.42 1.18 -2.14 0.10 0.00 0.00 175.35 174.90 2c02 s PRO 2 N -1.41 2.00 0.48 1.78 0.02 -1.26 -4.92 135.00 131.69 2c02 s PRO 2 Ca 0.09 1.64 0.21 0.00 0.02 0.00 0.00 61.00 62.96 2c02 s PRO 2 Cb -0.09 -1.83 1.23 0.00 0.02 0.00 0.00 34.50 33.83 2c02 s PRO 2 CO 0.03 -1.92 2.03 -1.00 -0.33 0.00 0.00 177.00 175.81 2c02 h PRO 3 N -0.63 0.00 0.00 5.54 0.13 -2.00 -2.98 132.00 132.06 2c02 h PRO 3 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2c02 h PRO 3 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 2c02 h PRO 3 CO 0.49 0.16 0.00 0.00 -0.23 0.00 0.00 178.00 178.41 2c02 n GLN 4 N -3.98 0.19 -4.35 0.86 0.00 -1.26 -4.76 117.38 104.08 2c02 n GLN 4 Ca -0.02 0.14 -0.35 0.00 0.00 0.00 0.00 57.00 56.77 2c02 n GLN 4 Cb 0.24 -1.50 -0.09 0.00 0.00 0.00 0.00 30.24 28.89 2c02 n GLN 4 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.06 177.00 2c02 s PHE 5 N -2.67 3.18 0.73 2.61 0.40 -1.13 -5.09 117.98 116.02 2c02 s PHE 5 Ca 0.14 0.21 -0.07 0.00 -0.60 0.00 0.00 56.93 56.61 2c02 s PHE 5 Cb 0.11 -1.79 0.08 0.00 0.51 0.00 0.00 43.02 41.93 2c02 s PHE 5 CO 0.27 0.48 1.05 0.95 0.70 0.00 0.00 175.22 178.67 2c02 s THR 6 N -0.89 2.23 0.30 0.64 -4.23 -1.26 -4.87 115.64 107.55 2c02 s THR 6 Ca 0.13 -0.26 0.01 0.00 -1.18 0.00 0.00 61.69 60.40 2c02 s THR 6 Cb -0.11 -2.97 0.13 0.00 1.34 0.00 0.00 72.50 70.88 2c02 s THR 6 CO 0.02 0.00 1.81 -0.50 -0.54 0.00 0.00 174.62 175.41 2c02 h TRP 7 N -0.70 0.67 -0.58 3.99 4.06 -1.94 -1.75 115.95 119.70 2c02 h TRP 7 Ca -0.44 -0.09 -0.09 0.00 2.06 0.00 0.00 58.89 60.34 2c02 h TRP 7 Cb 1.31 -0.19 -0.02 0.00 -1.00 0.00 0.00 29.16 29.26 2c02 h TRP 7 CO 0.18 0.66 0.03 0.00 -3.56 0.00 0.00 178.44 175.74 2c02 h ALA 8 N 1.37 0.77 -0.15 1.49 0.00 -1.88 -0.27 119.26 120.59 2c02 h ALA 8 Ca 0.12 -0.29 -0.12 0.00 0.00 0.00 0.00 54.91 54.62 2c02 h ALA 8 Cb 0.42 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2c02 h ALA 8 CO 0.02 0.58 -0.44 1.96 0.00 0.00 0.00 179.25 181.37 2c02 h GLN 9 N 0.89 0.37 -0.21 0.00 4.20 -1.82 -1.48 115.11 117.07 2c02 h GLN 9 Ca 0.17 -0.19 -0.16 0.00 0.06 0.00 0.00 58.65 58.53 2c02 h GLN 9 Cb 0.51 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.29 2c02 h GLN 9 CO 0.02 0.74 -0.52 2.35 -0.67 0.00 0.00 178.83 180.76 2c02 h TRP 10 N 0.30 0.72 -0.37 2.96 -0.00 -1.10 -0.21 115.95 118.26 2c02 h TRP 10 Ca 0.02 -0.24 -0.03 0.00 -0.00 0.00 0.00 58.89 58.64 2c02 h TRP 10 Cb 0.90 -0.14 -0.02 0.00 -0.00 0.00 0.00 29.16 29.90 2c02 h TRP 10 CO 0.02 0.97 0.12 0.35 -0.00 0.00 0.00 178.44 179.91 2c02 h PHE 11 N 0.45 0.59 -0.54 2.65 3.57 -0.81 -0.57 116.94 122.28 2c02 h PHE 11 Ca 0.02 -0.06 -0.03 0.00 3.53 0.00 0.00 57.97 61.43 2c02 h PHE 11 Cb 1.06 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 39.60 2c02 h PHE 11 CO 0.05 0.56 0.22 1.49 -2.23 0.00 0.00 178.31 178.40 2c02 h GLU 12 N 0.44 0.81 -0.54 1.11 4.81 -1.10 0.23 114.58 120.35 2c02 h GLU 12 Ca 0.12 -0.14 -0.06 0.00 -0.13 0.00 0.00 59.36 59.14 2c02 h GLU 12 Cb 0.25 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.47 2c02 h GLU 12 CO -0.00 0.70 0.09 1.15 -0.73 0.00 0.00 179.01 180.21 2c02 h THR 13 N 0.74 1.24 0.02 0.32 2.02 -0.82 0.48 112.91 116.89 2c02 h THR 13 Ca 0.18 -0.90 -0.28 0.00 0.77 0.00 0.00 66.41 66.18 2c02 h THR 13 Cb 0.19 0.73 -0.04 0.00 -1.74 0.00 0.00 68.15 67.29 2c02 h THR 13 CO -0.02 0.33 -1.59 1.56 0.37 0.00 0.00 175.52 176.18 2c02 h GLN 14 N 0.81 0.03 0.00 6.66 4.20 -0.88 -3.41 115.11 122.53 2c02 h GLN 14 Ca 0.17 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.83 2c02 h GLN 14 Cb 0.36 0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.16 2c02 h GLN 14 CO 0.01 0.67 0.00 0.72 -0.67 0.00 0.00 178.83 179.55 2c02 n HIS 15 N -3.15 0.00 0.00 2.96 8.25 0.80 -4.60 115.22 119.48 2c02 n HIS 15 Ca -0.15 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.31 2c02 n HIS 15 Cb 1.03 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.14 2c02 n HIS 15 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 2c02 n ILE 16 N -0.00 0.00 -2.30 1.59 2.08 -0.66 -0.20 119.36 119.88 2c02 n ILE 16 Ca 0.00 0.00 -0.43 0.00 0.56 0.00 0.00 62.75 62.88 2c02 n ILE 16 Cb 0.05 -1.12 0.00 0.00 -0.75 0.00 0.00 39.64 37.83 2c02 n ILE 16 CO 0.00 0.00 0.00 0.59 0.56 0.00 0.00 176.55 177.70 2c02 n ASN 17 N -2.78 4.82 -4.57 4.38 3.02 0.07 -4.82 115.26 115.38 2c02 n ASN 17 Ca 0.00 -3.02 -0.41 0.00 -0.03 0.00 0.00 54.58 51.12 2c02 n ASN 17 Cb 0.39 -1.55 -0.03 0.00 -0.61 0.00 0.00 39.78 37.98 2c02 n ASN 17 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 2c02 s MET 18 N 1.42 3.12 0.19 3.52 1.75 -1.26 -4.83 119.30 123.21 2c02 s MET 18 Ca 0.43 0.46 0.16 0.00 -1.25 0.00 0.00 55.69 55.49 2c02 s MET 18 Cb 0.09 -4.20 0.77 0.00 2.84 0.00 0.00 34.83 34.33 2c02 s MET 18 CO -0.01 -2.16 1.48 0.25 -0.65 0.00 0.00 175.02 173.93 2c02 n THR 19 N 6.92 1.23 -3.69 10.11 -2.24 -1.26 -4.66 114.28 120.68 2c02 n THR 19 Ca 0.14 0.51 -0.15 0.00 -2.27 0.00 0.00 64.05 62.28 2c02 n THR 19 Cb 0.50 -1.47 -0.08 0.00 -2.10 0.00 0.00 70.33 67.18 2c02 n THR 19 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2c02 s SER 20 N -3.70 -0.37 0.00 3.42 0.15 -1.26 -4.96 113.70 106.97 2c02 s SER 20 Ca 0.01 0.43 0.22 0.00 0.70 0.00 0.00 55.95 57.31 2c02 s SER 20 Cb 0.06 0.51 1.20 0.00 -1.71 0.00 0.00 66.02 66.08 2c02 s SER 20 CO 0.20 -0.43 1.73 0.00 1.20 0.00 0.00 173.24 175.94 2c02 n GLN 21 N 1.51 0.45 -3.87 5.44 6.02 -1.26 -4.52 117.38 121.15 2c02 n GLN 21 Ca -0.19 0.05 -0.36 0.00 -0.01 0.00 0.00 57.00 56.50 2c02 n GLN 21 Cb 0.56 -1.50 -0.11 0.00 1.02 0.00 0.00 30.24 30.22 2c02 n GLN 21 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2c02 s GLN 22 N -2.38 3.90 0.17 -1.09 -1.52 -1.26 -5.01 119.66 112.47 2c02 s GLN 22 Ca 0.25 -0.37 -0.14 0.00 -1.95 0.00 0.00 55.36 53.16 2c02 s GLN 22 Cb 0.15 -3.32 0.11 0.00 -0.22 0.00 0.00 33.01 29.73 2c02 s GLN 22 CO 0.31 0.09 1.78 0.00 -0.25 0.00 0.00 175.29 177.23 2c02 h THR 24 N 0.47 0.81 0.03 0.00 2.02 -1.91 0.51 112.91 114.84 2c02 h THR 24 Ca 0.20 -0.29 -0.13 0.00 0.77 0.00 0.00 66.41 66.96 2c02 h THR 24 Cb 0.11 -0.11 0.01 0.00 -1.74 0.00 0.00 68.15 66.42 2c02 h THR 24 CO -0.14 0.15 -0.54 0.78 0.37 0.00 0.00 175.52 176.15 2c02 h ASN 25 N 0.85 0.42 -0.78 4.18 2.35 -1.85 -3.25 115.58 117.49 2c02 h ASN 25 Ca 0.52 -0.82 -0.02 0.00 -0.55 0.00 0.00 56.30 55.42 2c02 h ASN 25 Cb 0.65 -0.13 -0.04 0.00 0.05 0.00 0.00 38.32 38.86 2c02 h ASN 25 CO -0.32 1.19 0.40 0.00 -1.65 0.00 0.00 177.43 177.04 2c02 h ALA 26 N 0.24 1.01 0.00 -0.83 0.00 -0.50 -2.66 119.26 116.52 2c02 h ALA 26 Ca -0.08 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2c02 h ALA 26 Cb 1.30 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.78 2c02 h ALA 26 CO 0.10 0.55 0.00 0.52 0.00 0.00 0.00 179.25 180.43 2c02 h MET 27 N 1.10 0.00 -0.26 0.00 2.86 -0.11 -2.94 114.93 115.58 2c02 h MET 27 Ca 0.27 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.87 2c02 h MET 27 Cb 0.09 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.73 2c02 h MET 27 CO -0.04 0.00 -0.04 1.96 1.06 0.00 0.00 176.91 179.85 2c02 h GLN 28 N 0.00 0.40 0.10 1.72 4.20 -1.51 0.21 115.11 120.23 2c02 h GLN 28 Ca 0.00 -0.08 -0.00 0.00 0.06 0.00 0.00 58.65 58.62 2c02 h GLN 28 Cb 0.32 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.04 2c02 h GLN 28 CO 0.00 0.46 -0.05 0.28 -0.67 0.00 0.00 178.83 178.85 2c02 h VAL 29 N 0.38 1.03 -0.45 -0.54 2.07 -1.67 0.35 116.25 117.42 2c02 h VAL 29 Ca 0.08 -0.49 -0.02 0.00 0.82 0.00 0.00 66.70 67.10 2c02 h VAL 29 Cb 0.32 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 31.41 2c02 h VAL 29 CO 0.01 0.12 0.21 0.40 0.02 0.00 0.00 177.57 178.33 2c02 h ILE 30 N -0.36 1.18 -0.21 4.57 2.04 -1.62 -2.51 117.51 120.60 2c02 h ILE 30 Ca -0.01 -0.53 -0.11 0.00 1.00 0.00 0.00 64.86 65.21 2c02 h ILE 30 Cb 0.30 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.08 2c02 h ILE 30 CO 0.02 0.20 -0.33 0.78 0.00 0.00 0.00 178.15 178.83 2c02 h ASN 31 N 0.58 0.45 0.67 1.72 2.35 -0.92 -0.91 115.58 119.52 2c02 h ASN 31 Ca 0.15 -0.17 -0.10 0.00 -0.55 0.00 0.00 56.30 55.63 2c02 h ASN 31 Cb 0.13 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 2c02 h ASN 31 CO -0.02 0.76 -0.46 0.78 -1.65 0.00 0.00 177.43 176.84 2c02 h ASN 32 N 0.38 0.00 0.53 5.81 2.35 -0.80 0.85 115.58 124.70 2c02 h ASN 32 Ca 0.05 0.00 -0.29 0.00 -0.55 0.00 0.00 56.30 55.50 2c02 h ASN 32 Cb 0.77 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.14 2c02 h ASN 32 CO 0.06 0.46 -1.38 1.88 -1.65 0.00 0.00 177.43 176.80 2c02 h TYR 33 N 0.00 0.51 -0.00 1.19 0.05 -1.16 -3.32 116.97 114.23 2c02 h TYR 33 Ca -0.00 -0.37 0.00 0.00 0.05 0.00 0.00 58.73 58.40 2c02 h TYR 33 Cb 0.92 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 38.64 2c02 h TYR 33 CO 0.00 1.34 -0.39 1.04 -1.05 0.00 0.00 178.16 179.10 2c02 n GLN 34 N -3.51 0.19 -3.58 4.88 6.02 -0.37 -4.55 117.38 116.46 2c02 n GLN 34 Ca -0.12 -0.10 -0.23 0.00 -0.01 0.00 0.00 57.00 56.54 2c02 n GLN 34 Cb 1.04 -1.50 0.08 0.00 1.02 0.00 0.00 30.24 30.88 2c02 n GLN 34 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2c02 n ARG 35 N -1.32 -7.81 -3.62 -1.09 5.12 0.26 -4.97 116.66 103.23 2c02 n ARG 35 Ca 0.07 0.83 -0.03 0.00 -1.93 0.00 0.00 57.85 56.80 2c02 n ARG 35 Cb 0.33 -5.89 -0.02 0.00 -1.16 0.00 0.00 32.46 25.73 2c02 n ARG 35 CO 0.00 0.00 0.00 -0.98 -1.93 0.00 0.00 177.63 174.72 2c02 s ARG 36 N -6.19 0.15 -0.45 5.56 3.03 -1.01 -5.06 118.95 114.98 2c02 s ARG 36 Ca 0.51 -0.06 -0.20 0.00 2.03 0.00 0.00 55.73 58.01 2c02 s ARG 36 Cb -0.22 0.07 0.03 0.00 -1.03 0.00 0.00 34.95 33.79 2c02 s ARG 36 CO 0.73 -0.06 0.63 0.00 -1.13 0.00 0.00 175.30 175.47 2c02 s LYS 38 N 2.79 4.13 0.32 0.00 2.20 -1.26 -4.89 119.74 123.02 2c02 s LYS 38 Ca 0.21 2.59 0.02 0.00 -0.36 0.00 0.00 55.97 58.43 2c02 s LYS 38 Cb -0.15 -3.26 0.58 0.00 -1.51 0.00 0.00 37.83 33.50 2c02 s LYS 38 CO 0.18 -0.77 1.92 -0.97 -0.36 0.00 0.00 175.35 175.35 2c02 h ASN 39 N 7.42 0.85 -5.00 1.43 -0.00 -1.95 -3.42 115.58 114.90 2c02 h ASN 39 Ca -0.44 0.01 -0.05 0.00 -0.00 0.00 0.00 56.30 55.82 2c02 h ASN 39 Cb 1.21 -0.17 -0.17 0.00 -0.00 0.00 0.00 38.32 39.19 2c02 h ASN 39 CO 0.95 0.54 0.18 0.00 -0.00 0.00 0.00 177.43 179.10 2c02 s GLN 40 N -5.85 1.12 -0.26 6.67 -2.07 -1.26 -0.69 119.66 117.32 2c02 s GLN 40 Ca -0.11 -0.01 -0.25 0.00 -1.82 0.00 0.00 55.36 53.17 2c02 s GLN 40 Cb 0.20 0.52 0.07 0.00 -1.09 0.00 0.00 33.01 32.71 2c02 s GLN 40 CO 0.79 -0.40 0.72 1.21 -1.32 0.00 0.00 175.29 176.29 2c02 s ASN 41 N -1.72 -0.74 -0.17 12.60 2.47 -0.56 -4.99 114.94 121.82 2c02 s ASN 41 Ca -0.07 1.42 -0.06 0.00 0.42 0.00 0.00 52.86 54.57 2c02 s ASN 41 Cb -0.00 1.43 -0.04 0.00 -1.45 0.00 0.00 41.25 41.19 2c02 s ASN 41 CO 0.02 -0.26 0.03 -0.89 -3.72 0.00 0.00 177.10 172.28 2c02 s THR 42 N 0.33 4.49 -0.28 -5.21 2.01 -1.26 -0.42 115.64 115.29 2c02 s THR 42 Ca -0.00 -0.14 -0.07 0.00 0.31 0.00 0.00 61.69 61.79 2c02 s THR 42 Cb -0.05 -3.01 -0.00 0.00 0.01 0.00 0.00 72.50 69.45 2c02 s THR 42 CO 0.01 0.47 0.07 -0.36 -0.69 0.00 0.00 174.62 174.12 2c02 s PHE 43 N 0.38 3.11 -0.19 4.92 0.08 0.00 -4.34 117.98 121.93 2c02 s PHE 43 Ca 0.01 -0.78 -0.23 0.00 0.12 0.00 0.00 56.93 56.04 2c02 s PHE 43 Cb -0.13 -2.24 -0.02 0.00 -0.57 0.00 0.00 43.02 40.06 2c02 s PHE 43 CO 0.01 -0.50 0.75 -0.51 -0.10 0.00 0.00 175.22 174.87 2c02 s LEU 44 N 1.54 4.15 -1.38 -0.37 1.43 0.72 -1.21 118.68 123.56 2c02 s LEU 44 Ca 0.04 1.01 -0.13 0.00 -1.03 0.00 0.00 54.13 54.02 2c02 s LEU 44 Cb -0.16 -3.08 0.09 0.00 0.03 0.00 0.00 46.19 43.06 2c02 s LEU 44 CO 0.03 -0.37 2.04 0.18 0.23 0.00 0.00 176.35 178.46 2c02 n LEU 45 N 5.29 6.60 -4.10 1.79 4.77 -0.06 -4.56 117.00 126.73 2c02 n LEU 45 Ca 0.02 -4.31 -0.14 0.00 -0.03 0.00 0.00 56.01 51.55 2c02 n LEU 45 Cb 0.49 -1.60 -0.05 0.00 -2.33 0.00 0.00 43.42 39.93 2c02 n LEU 45 CO 0.46 1.12 0.09 0.28 -1.33 0.00 0.00 177.39 178.01 2c02 s THR 46 N 2.22 0.00 0.40 -5.08 -1.32 -1.26 -4.40 115.64 106.20 2c02 s THR 46 Ca 0.45 -1.64 -0.01 0.00 -1.21 0.00 0.00 61.69 59.27 2c02 s THR 46 Cb 0.11 -2.55 -0.03 0.00 -1.51 0.00 0.00 72.50 68.52 2c02 s THR 46 CO -0.04 0.00 0.63 0.42 -2.21 0.00 0.00 174.62 173.42 2c02 s THR 47 N -3.34 4.97 0.20 5.08 -4.23 -1.26 -4.96 115.64 112.10 2c02 s THR 47 Ca 0.31 -0.25 -0.09 0.00 -1.18 0.00 0.00 61.69 60.48 2c02 s THR 47 Cb 0.01 -3.84 0.13 0.00 1.34 0.00 0.00 72.50 70.13 2c02 s THR 47 CO 0.18 -0.64 1.74 0.15 -0.54 0.00 0.00 174.62 175.51 2c02 h PHE 48 N 0.55 1.16 -0.93 3.99 3.57 -1.98 -2.41 116.94 120.89 2c02 h PHE 48 Ca -0.49 -0.11 0.03 0.00 3.53 0.00 0.00 57.97 60.94 2c02 h PHE 48 Cb 1.22 -0.34 -0.05 0.00 2.79 0.00 0.00 35.95 39.56 2c02 h PHE 48 CO 0.53 0.91 0.60 0.00 -2.23 0.00 0.00 178.31 178.12 2c02 h ALA 49 N 1.12 1.23 -0.71 2.41 0.00 -1.99 -0.06 119.26 121.25 2c02 h ALA 49 Ca 0.24 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 2c02 h ALA 49 Cb 0.28 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 2c02 h ALA 49 CO -0.01 0.48 0.32 -0.91 0.00 0.00 0.00 179.25 179.13 2c02 h ASN 50 N 1.17 0.93 -0.28 0.00 2.35 -1.84 -1.10 115.58 116.82 2c02 h ASN 50 Ca 0.37 -0.11 -0.15 0.00 -0.55 0.00 0.00 56.30 55.86 2c02 h ASN 50 Cb -0.00 -0.24 -0.00 0.00 0.05 0.00 0.00 38.32 38.12 2c02 h ASN 50 CO -0.12 0.81 -0.40 0.58 -1.65 0.00 0.00 177.43 176.65 2c02 h VAL 51 N 1.02 1.29 -0.77 2.81 2.07 -0.94 -1.91 116.25 119.83 2c02 h VAL 51 Ca 0.24 -1.59 0.08 0.00 0.82 0.00 0.00 66.70 66.25 2c02 h VAL 51 Cb 0.14 1.63 -0.06 0.00 -1.52 0.00 0.00 31.29 31.47 2c02 h VAL 51 CO -0.03 0.51 0.44 0.58 0.02 0.00 0.00 177.57 179.09 2c02 h VAL 52 N 0.53 0.95 -0.13 2.57 2.07 -0.67 0.09 116.25 121.65 2c02 h VAL 52 Ca 0.03 -0.26 -0.07 0.00 0.82 0.00 0.00 66.70 67.21 2c02 h VAL 52 Cb 1.00 0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 2c02 h VAL 52 CO 0.09 0.14 -0.24 0.78 0.02 0.00 0.00 177.57 178.36 2c02 h ASN 53 N 0.77 0.22 0.17 0.57 2.35 -1.00 -1.32 115.58 117.33 2c02 h ASN 53 Ca 0.36 -0.06 -0.05 0.00 -0.55 0.00 0.00 56.30 55.99 2c02 h ASN 53 Cb 0.27 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.57 2c02 h ASN 53 CO -0.21 0.47 -0.20 0.58 -1.65 0.00 0.00 177.43 176.41 2c02 h VAL 54 N 0.20 1.17 0.00 2.81 2.07 -0.20 0.16 116.25 122.46 2c02 h VAL 54 Ca 0.03 -0.80 -0.00 0.00 0.82 0.00 0.00 66.70 66.75 2c02 h VAL 54 Cb 0.55 1.37 -0.00 0.00 -1.52 0.00 0.00 31.29 31.69 2c02 h VAL 54 CO 0.04 0.24 -0.00 0.00 0.02 0.00 0.00 177.57 177.86 2c02 n GLY 56 N -0.98 -1.49 3.76 0.00 0.00 0.54 -4.87 105.19 102.15 2c02 n GLY 56 Ca -0.03 -0.14 -0.29 0.00 0.00 0.00 0.00 46.02 45.56 2c02 n GLY 56 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2c02 s ASN 57 N -3.37 3.76 0.35 1.61 0.01 -0.07 -4.95 114.94 112.27 2c02 s ASN 57 Ca 0.12 1.26 -0.26 0.00 -0.71 0.00 0.00 52.86 53.27 2c02 s ASN 57 Cb 0.17 -1.94 -0.13 0.00 0.41 0.00 0.00 41.25 39.76 2c02 s ASN 57 CO 0.58 -2.43 1.02 -2.65 -1.51 0.00 0.00 177.10 172.11 2c02 n PRO 58 N -3.72 1.41 -2.39 -0.60 -0.02 -1.26 -4.91 135.00 123.50 2c02 n PRO 58 Ca 0.07 0.50 -0.37 0.00 -2.02 0.00 0.00 63.50 61.67 2c02 n PRO 58 Cb 0.57 -1.96 -0.03 0.00 -0.02 0.00 0.00 33.50 32.07 2c02 n PRO 58 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 2c02 s ASN 59 N -0.61 6.54 0.15 2.55 -0.87 -1.26 -4.42 114.94 117.02 2c02 s ASN 59 Ca 0.60 2.20 -0.07 0.00 -1.57 0.00 0.00 52.86 54.02 2c02 s ASN 59 Cb -0.63 -2.60 -0.01 0.00 -0.02 0.00 0.00 41.25 37.99 2c02 s ASN 59 CO 0.59 -0.65 0.22 0.00 -2.57 0.00 0.00 177.10 174.69 2c02 s MET 60 N -2.47 1.06 0.27 -0.60 0.23 -0.36 -4.99 119.30 112.44 2c02 s MET 60 Ca 0.59 -1.20 -0.29 0.00 -1.03 0.00 0.00 55.69 53.75 2c02 s MET 60 Cb -0.26 0.34 -0.09 0.00 -1.53 0.00 0.00 34.83 33.29 2c02 s MET 60 CO 0.33 -0.37 1.17 0.99 -2.03 0.00 0.00 175.02 175.11 2c02 s THR 61 N -3.97 3.33 -0.11 3.16 2.01 -1.26 -2.84 115.64 115.97 2c02 s THR 61 Ca 0.17 1.28 -0.30 0.00 0.31 0.00 0.00 61.69 63.15 2c02 s THR 61 Cb 0.04 -3.82 -0.03 0.00 0.01 0.00 0.00 72.50 68.71 2c02 s THR 61 CO -0.01 0.28 1.29 0.00 -0.69 0.00 0.00 174.62 175.49 2c02 h PRO 63 N 8.07 0.36 -0.05 0.00 0.11 -1.92 -1.90 132.00 136.66 2c02 h PRO 63 Ca -0.31 -0.02 -0.19 0.00 0.11 0.00 0.00 66.00 65.59 2c02 h PRO 63 Cb 1.13 -0.08 0.01 0.00 0.11 0.00 0.00 31.00 32.18 2c02 h PRO 63 CO 0.94 0.24 -0.73 0.66 -0.21 0.00 0.00 178.00 178.89 2c02 h SER 64 N 0.37 0.73 -3.57 -2.05 4.64 -1.91 -3.42 113.55 108.33 2c02 h SER 64 Ca 0.57 -0.70 -0.62 0.00 -0.47 0.00 0.00 61.79 60.56 2c02 h SER 64 Cb 1.49 -0.22 -0.39 0.00 -0.31 0.00 0.00 62.40 62.98 2c02 h SER 64 CO -0.25 1.33 -0.76 0.21 -0.87 0.00 0.00 176.83 176.48 2c02 s ASN 65 N -6.94 4.16 0.00 4.97 3.84 -0.71 -4.98 114.94 115.27 2c02 s ASN 65 Ca -0.12 -1.54 0.04 0.00 0.21 0.00 0.00 52.86 51.46 2c02 s ASN 65 Cb 0.06 -1.26 0.23 0.00 -0.55 0.00 0.00 41.25 39.73 2c02 s ASN 65 CO 0.86 -0.31 0.58 2.29 -2.79 0.00 0.00 177.10 177.74 2c02 n LYS 66 N 4.58 0.26 0.00 0.43 2.85 -1.24 -1.43 118.16 123.61 2c02 n LYS 66 Ca -0.06 0.00 0.06 0.00 -1.05 0.00 0.00 58.31 57.26 2c02 n LYS 66 Cb 0.43 -1.24 -0.05 0.00 -0.65 0.00 0.00 35.03 33.53 2c02 n LYS 66 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 2c02 n THR 67 N -0.74 0.00 -3.95 0.58 -2.24 -1.26 -4.96 114.28 101.72 2c02 n THR 67 Ca 0.03 -0.26 -0.36 0.00 -2.27 0.00 0.00 64.05 61.19 2c02 n THR 67 Cb 0.01 1.06 -0.08 0.00 -2.10 0.00 0.00 70.33 69.22 2c02 n THR 67 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2c02 s ARG 68 N -1.97 3.68 -0.13 -0.78 1.81 -0.51 -4.99 118.95 116.05 2c02 s ARG 68 Ca 0.07 -0.24 0.18 0.00 -1.72 0.00 0.00 55.73 54.02 2c02 s ARG 68 Cb 0.10 -3.19 0.29 0.00 -0.45 0.00 0.00 34.95 31.70 2c02 s ARG 68 CO 0.44 0.54 1.15 1.17 -0.68 0.00 0.00 175.30 177.92 2c02 n LYS 69 N 2.73 1.27 -1.00 3.54 3.00 -1.26 -1.68 118.16 124.77 2c02 n LYS 69 Ca -0.18 -2.60 -0.10 0.00 -0.00 0.00 0.00 58.31 55.43 2c02 n LYS 69 Cb 0.53 -1.48 0.24 0.00 0.00 0.00 0.00 35.03 34.33 2c02 n LYS 69 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67 2c02 n ASN 70 N -1.37 3.93 -4.94 3.14 6.94 -1.26 -4.14 115.26 117.57 2c02 n ASN 70 Ca 0.16 -3.44 -0.25 0.00 -0.02 0.00 0.00 54.58 51.02 2c02 n ASN 70 Cb 0.65 -0.74 -0.02 0.00 -2.36 0.00 0.00 39.78 37.31 2c02 n ASN 70 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2c02 s HIS 72 N -2.08 -0.13 0.00 0.00 3.76 0.44 -1.23 115.29 116.05 2c02 s HIS 72 Ca 0.39 0.34 -0.19 0.00 -0.15 0.00 0.00 55.06 55.44 2c02 s HIS 72 Cb -0.10 0.03 -0.06 0.00 1.11 0.00 0.00 32.58 33.57 2c02 s HIS 72 CO 0.32 -0.07 0.56 -1.58 -0.85 0.00 0.00 174.74 173.11 2c02 s HIS 73 N 0.16 3.70 0.52 1.40 2.46 -1.26 -1.83 115.29 120.44 2c02 s HIS 73 Ca -0.01 1.16 0.41 0.00 0.47 0.00 0.00 55.06 57.10 2c02 s HIS 73 Cb -0.02 -2.54 2.22 0.00 -0.13 0.00 0.00 32.58 32.11 2c02 s HIS 73 CO -0.00 0.42 2.26 0.66 -2.47 0.00 0.00 174.74 175.61 2c02 h SER 74 N 5.39 0.00 0.00 9.88 4.64 -1.41 -3.46 113.55 128.59 2c02 h SER 74 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 2c02 h SER 74 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 2c02 h SER 74 CO 0.68 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.25 2c02 n GLY 75 N -1.05 1.70 3.30 -0.77 0.00 -1.26 -4.90 105.19 102.21 2c02 n GLY 75 Ca -0.03 -0.22 -0.16 0.00 0.00 0.00 0.00 46.02 45.62 2c02 n GLY 75 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2c02 s SER 76 N 0.00 1.03 0.47 1.61 1.04 -1.26 -5.12 113.70 111.47 2c02 s SER 76 Ca 0.00 -1.39 -0.10 0.00 0.48 0.00 0.00 55.95 54.94 2c02 s SER 76 Cb 0.00 0.20 -0.06 0.00 0.10 0.00 0.00 66.02 66.27 2c02 s SER 76 CO 0.00 -0.75 0.84 -1.10 0.98 0.00 0.00 173.24 173.20 2c02 s GLN 77 N -4.05 3.71 0.03 4.02 -0.21 -1.26 -4.51 119.66 117.40 2c02 s GLN 77 Ca 0.38 0.50 -0.01 0.00 0.02 0.00 0.00 55.36 56.24 2c02 s GLN 77 Cb 0.08 -2.31 -0.02 0.00 1.00 0.00 0.00 33.01 31.75 2c02 s GLN 77 CO 0.13 -0.18 -0.01 0.14 -2.12 0.00 0.00 175.29 173.26 2c02 s VAL 78 N -2.61 0.15 0.47 1.09 -7.23 0.13 -4.87 120.40 107.53 2c02 s VAL 78 Ca 0.52 -1.24 -0.23 0.00 -1.81 0.00 0.00 61.98 59.22 2c02 s VAL 78 Cb -0.10 -0.80 -0.07 0.00 0.56 0.00 0.00 36.38 35.97 2c02 s VAL 78 CO 0.38 -0.68 1.18 -2.84 -0.31 0.00 0.00 175.10 172.83 2c02 s PRO 79 N -2.49 3.67 0.10 4.82 0.02 -1.26 -1.92 135.00 137.94 2c02 s PRO 79 Ca -0.06 1.81 -0.16 0.00 0.02 0.00 0.00 61.00 62.61 2c02 s PRO 79 Cb -0.02 -2.37 0.03 0.00 0.02 0.00 0.00 34.50 32.16 2c02 s PRO 79 CO -0.05 -0.64 0.40 -0.48 -0.33 0.00 0.00 177.00 175.90 2c02 s LEU 80 N -3.12 0.44 -0.12 -5.54 0.05 0.20 -0.88 118.68 109.72 2c02 s LEU 80 Ca 0.65 -0.23 0.02 0.00 0.05 0.00 0.00 54.13 54.62 2c02 s LEU 80 Cb -0.30 1.77 0.01 0.00 -2.05 0.00 0.00 46.19 45.63 2c02 s LEU 80 CO 0.36 -0.79 -0.16 -0.63 -0.55 0.00 0.00 176.35 174.58 2c02 s ILE 81 N -3.37 1.61 -0.18 1.48 1.01 -0.35 -0.76 121.20 120.63 2c02 s ILE 81 Ca 0.00 -0.71 -0.07 0.00 0.00 0.00 0.00 60.65 59.87 2c02 s ILE 81 Cb 0.01 -1.46 -0.04 0.00 0.01 0.00 0.00 42.46 40.98 2c02 s ILE 81 CO -0.09 0.46 0.06 -2.28 0.00 0.00 0.00 174.94 173.10 2c02 s HIS 82 N 0.98 3.26 -0.18 3.97 2.46 0.75 -0.82 115.29 125.70 2c02 s HIS 82 Ca -0.06 0.09 -0.07 0.00 0.47 0.00 0.00 55.06 55.48 2c02 s HIS 82 Cb -0.15 -2.08 -0.04 0.00 -0.13 0.00 0.00 32.58 30.18 2c02 s HIS 82 CO -0.02 0.17 0.05 0.00 -2.47 0.00 0.00 174.74 172.47 2c02 s ASN 84 N 0.36 2.85 0.12 0.00 0.01 -0.80 -1.49 114.94 115.98 2c02 s ASN 84 Ca 0.02 -0.52 -0.31 0.00 -0.71 0.00 0.00 52.86 51.34 2c02 s ASN 84 Cb -0.12 -1.31 -0.08 0.00 0.41 0.00 0.00 41.25 40.15 2c02 s ASN 84 CO 0.00 0.11 1.43 -0.22 -1.51 0.00 0.00 177.10 176.92 2c02 s LEU 85 N 0.54 4.37 -0.01 0.60 2.96 0.13 -0.30 118.68 126.97 2c02 s LEU 85 Ca -0.15 2.38 0.02 0.00 -0.22 0.00 0.00 54.13 56.16 2c02 s LEU 85 Cb -0.17 -3.59 -0.03 0.00 0.50 0.00 0.00 46.19 42.91 2c02 s LEU 85 CO 0.05 -0.69 0.03 0.35 -1.32 0.00 0.00 176.35 174.76 2c02 n THR 86 N 3.99 0.06 -3.66 3.68 -2.24 -0.55 -4.88 114.28 110.69 2c02 n THR 86 Ca 0.12 -0.06 -0.29 0.00 -2.27 0.00 0.00 64.05 61.54 2c02 n THR 86 Cb 0.41 -0.25 -0.13 0.00 -2.10 0.00 0.00 70.33 68.26 2c02 n THR 86 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2c02 s THR 87 N -2.09 1.02 0.46 4.28 2.01 -1.03 -4.97 115.64 115.32 2c02 s THR 87 Ca -0.01 -2.12 0.23 0.00 0.31 0.00 0.00 61.69 60.11 2c02 s THR 87 Cb 0.01 -1.73 0.42 0.00 0.01 0.00 0.00 72.50 71.21 2c02 s THR 87 CO 0.08 -0.87 1.85 -0.65 -0.69 0.00 0.00 174.62 174.34 2c02 h PRO 88 N 7.09 0.25 -5.83 4.92 0.11 -1.91 -2.62 132.00 134.01 2c02 h PRO 88 Ca -0.02 -0.01 -0.13 0.00 0.11 0.00 0.00 66.00 65.94 2c02 h PRO 88 Cb 0.96 -0.06 0.01 0.00 0.11 0.00 0.00 31.00 32.02 2c02 h PRO 88 CO 0.43 0.16 -0.95 0.45 -0.21 0.00 0.00 178.00 177.88 2c02 n SER 89 N -4.44 -5.40 -0.13 -2.05 2.88 -1.26 -4.78 113.62 98.44 2c02 n SER 89 Ca 0.20 0.16 -0.10 0.00 -1.33 0.00 0.00 58.87 57.81 2c02 n SER 89 Cb 0.84 -1.38 -0.07 0.00 -0.75 0.00 0.00 64.21 62.84 2c02 n SER 89 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 2c02 h PRO 90 N 2.74 -0.24 -6.12 -1.46 0.11 -1.99 -3.41 132.00 121.63 2c02 h PRO 90 Ca -0.19 0.02 -0.53 0.00 0.11 0.00 0.00 66.00 65.41 2c02 h PRO 90 Cb 1.02 0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 2c02 h PRO 90 CO 0.08 -0.16 -0.42 -1.14 -0.21 0.00 0.00 178.00 176.14 2c02 s GLN 91 N -4.89 3.46 -0.35 1.05 2.00 -1.26 -4.72 119.66 114.95 2c02 s GLN 91 Ca -0.10 -0.55 -0.12 0.00 -2.00 0.00 0.00 55.36 52.58 2c02 s GLN 91 Cb 0.06 -2.92 0.02 0.00 0.80 0.00 0.00 33.01 30.97 2c02 s GLN 91 CO 0.44 0.47 0.46 -1.71 -0.50 0.00 0.00 175.29 174.45 2c02 n ASN 92 N -0.72 -7.06 0.18 6.67 4.05 -1.26 -4.83 115.26 112.29 2c02 n ASN 92 Ca -0.07 0.53 0.13 0.00 0.45 0.00 0.00 54.58 55.63 2c02 n ASN 92 Cb 0.54 -4.73 0.62 0.00 1.23 0.00 0.00 39.78 37.45 2c02 n ASN 92 CO 0.00 0.00 0.00 0.16 -3.05 0.00 0.00 177.26 174.37 2c02 h ILE 93 N 1.78 0.00 0.00 -1.44 3.07 -1.85 -1.80 117.51 117.28 2c02 h ILE 93 Ca 0.00 -0.16 0.00 0.00 1.55 0.00 0.00 64.86 66.25 2c02 h ILE 93 Cb 0.77 0.86 0.00 0.00 -0.27 0.00 0.00 36.82 38.18 2c02 h ILE 93 CO 0.16 0.00 0.00 -1.54 -1.05 0.00 0.00 178.15 175.72 2c02 n SER 94 N -2.43 0.10 -0.54 2.16 3.41 -1.26 -2.11 113.62 112.95 2c02 n SER 94 Ca 0.00 0.52 0.13 0.00 -0.26 0.00 0.00 58.87 59.26 2c02 n SER 94 Cb 0.15 -0.55 0.33 0.00 -0.26 0.00 0.00 64.21 63.89 2c02 n SER 94 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2c02 n ASN 95 N -1.61 1.82 -4.77 4.04 4.13 -0.67 -4.93 115.26 113.26 2c02 n ASN 95 Ca 0.04 -1.49 -0.40 0.00 1.68 0.00 0.00 54.58 54.41 2c02 n ASN 95 Cb 0.20 0.09 -0.02 0.00 -1.54 0.00 0.00 39.78 38.50 2c02 n ASN 95 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2c02 s ARG 97 N -1.80 1.56 0.11 0.00 0.52 -0.99 -4.92 118.95 113.43 2c02 s ARG 97 Ca 0.49 -1.45 0.02 0.00 -0.52 0.00 0.00 55.73 54.27 2c02 s ARG 97 Cb -0.38 -1.90 -0.04 0.00 0.52 0.00 0.00 34.95 33.15 2c02 s ARG 97 CO 0.50 0.42 -0.08 0.71 0.02 0.00 0.00 175.30 176.87 2c02 s TYR 98 N -1.53 0.97 0.24 -0.53 1.51 -1.26 -1.48 117.35 115.27 2c02 s TYR 98 Ca 0.20 -0.85 0.06 0.00 -1.01 0.00 0.00 57.07 55.47 2c02 s TYR 98 Cb -0.09 -0.54 -0.03 0.00 -0.11 0.00 0.00 41.96 41.19 2c02 s TYR 98 CO 0.10 -0.09 0.27 0.00 -1.11 0.00 0.00 175.55 174.71 2c02 s ALA 99 N -3.39 3.75 -0.04 3.71 0.00 0.59 -4.42 121.76 121.96 2c02 s ALA 99 Ca 0.11 -1.31 0.04 0.00 0.00 0.00 0.00 51.96 50.80 2c02 s ALA 99 Cb 0.04 -1.51 -0.00 0.00 0.00 0.00 0.00 23.12 21.65 2c02 s ALA 99 CO -0.03 0.27 -0.15 1.14 0.00 0.00 0.00 175.76 176.99 2c02 s GLN 100 N -3.84 1.60 -0.23 0.00 0.00 -1.26 -1.91 119.66 114.01 2c02 s GLN 100 Ca 0.33 -0.53 0.02 0.00 -0.00 0.00 0.00 55.36 55.18 2c02 s GLN 100 Cb -0.09 -1.40 0.05 0.00 0.00 0.00 0.00 33.01 31.58 2c02 s GLN 100 CO 0.27 0.20 -0.11 0.99 0.00 0.00 0.00 175.29 176.64 2c02 s THR 101 N 0.11 1.90 0.26 3.63 2.01 0.40 -4.94 115.64 119.01 2c02 s THR 101 Ca -0.04 -1.32 -0.21 0.00 0.31 0.00 0.00 61.69 60.42 2c02 s THR 101 Cb -0.11 -2.00 -0.09 0.00 0.01 0.00 0.00 72.50 70.32 2c02 s THR 101 CO 0.02 0.07 0.78 -2.16 -0.69 0.00 0.00 174.62 172.64 2c02 s PRO 102 N 1.25 4.32 0.11 4.92 0.04 -1.26 -0.18 135.00 144.20 2c02 s PRO 102 Ca -0.05 0.97 -0.26 0.00 0.04 0.00 0.00 61.00 61.71 2c02 s PRO 102 Cb -0.18 -2.82 0.07 0.00 0.04 0.00 0.00 34.50 31.61 2c02 s PRO 102 CO -0.07 0.34 0.87 0.00 0.04 0.00 0.00 177.00 178.19 2c02 s ALA 103 N -1.59 -1.67 -0.28 8.56 0.00 0.06 -4.97 121.76 121.88 2c02 s ALA 103 Ca 0.46 0.45 0.02 0.00 0.00 0.00 0.00 51.96 52.88 2c02 s ALA 103 Cb -0.17 0.61 0.08 0.00 0.00 0.00 0.00 23.12 23.64 2c02 s ALA 103 CO 0.21 -0.88 -0.02 -0.80 0.00 0.00 0.00 175.76 174.27 2c02 s ASN 104 N -2.75 4.26 0.24 0.00 -0.87 -1.26 0.61 114.94 115.16 2c02 s ASN 104 Ca 0.08 -1.55 0.01 0.00 -1.57 0.00 0.00 52.86 49.83 2c02 s ASN 104 Cb -0.02 -1.35 -0.05 0.00 -0.02 0.00 0.00 41.25 39.82 2c02 s ASN 104 CO -0.03 -0.28 0.10 -0.04 -2.57 0.00 0.00 177.10 174.28 2c02 s MET 105 N 1.22 1.33 0.49 -0.60 -1.94 -0.81 -4.76 119.30 114.22 2c02 s MET 105 Ca -0.00 -1.71 -0.05 0.00 -1.71 0.00 0.00 55.69 52.22 2c02 s MET 105 Cb -0.19 -0.09 -0.03 0.00 2.01 0.00 0.00 34.83 36.53 2c02 s MET 105 CO -0.09 -0.32 0.78 -0.06 -0.01 0.00 0.00 175.02 175.33 2c02 s PHE 106 N -3.89 3.52 0.05 -0.03 0.08 0.14 -0.70 117.98 117.16 2c02 s PHE 106 Ca 0.38 0.76 -0.00 0.00 0.12 0.00 0.00 56.93 58.18 2c02 s PHE 106 Cb 0.08 -2.33 -0.04 0.00 -0.57 0.00 0.00 43.02 40.16 2c02 s PHE 106 CO 0.13 -0.32 -0.04 1.52 -0.10 0.00 0.00 175.22 176.41 2c02 s TYR 107 N -2.74 0.55 -0.12 0.36 1.13 -1.26 -0.15 117.35 115.11 2c02 s TYR 107 Ca 0.48 -0.91 0.01 0.00 -1.41 0.00 0.00 57.07 55.23 2c02 s TYR 107 Cb -0.10 -0.38 0.02 0.00 -1.10 0.00 0.00 41.96 40.40 2c02 s TYR 107 CO 0.44 -0.29 -0.13 0.42 -2.51 0.00 0.00 175.55 173.49 2c02 s ILE 108 N -3.27 1.38 0.11 -3.49 1.01 0.72 -0.98 121.20 116.68 2c02 s ILE 108 Ca 0.03 -0.54 0.10 0.00 0.00 0.00 0.00 60.65 60.24 2c02 s ILE 108 Cb 0.03 -1.30 -0.04 0.00 0.01 0.00 0.00 42.46 41.17 2c02 s ILE 108 CO -0.07 0.42 -0.26 0.68 0.00 0.00 0.00 174.94 175.72 2c02 s VAL 109 N 1.28 2.13 -0.12 2.92 -7.23 -0.76 -0.73 120.40 117.89 2c02 s VAL 109 Ca -0.01 -1.67 -0.09 0.00 -1.81 0.00 0.00 61.98 58.40 2c02 s VAL 109 Cb -0.14 -1.88 -0.04 0.00 0.56 0.00 0.00 36.38 34.88 2c02 s VAL 109 CO -0.06 0.09 0.17 0.00 -0.31 0.00 0.00 175.10 175.00 2c02 s ALA 110 N -1.05 3.81 0.11 1.32 0.00 0.38 -0.42 121.76 125.92 2c02 s ALA 110 Ca 0.12 -0.60 0.07 0.00 0.00 0.00 0.00 51.96 51.55 2c02 s ALA 110 Cb -0.10 -2.07 -0.04 0.00 0.00 0.00 0.00 23.12 20.92 2c02 s ALA 110 CO 0.05 0.50 -0.16 0.00 0.00 0.00 0.00 175.76 176.15 2c02 s ASP 112 N -2.22 0.81 0.58 0.00 1.01 -0.65 -4.86 116.67 111.33 2c02 s ASP 112 Ca 0.07 -1.48 -0.18 0.00 0.71 0.00 0.00 52.55 51.67 2c02 s ASP 112 Cb -0.07 0.53 -0.04 0.00 1.01 0.00 0.00 42.92 44.34 2c02 s ASP 112 CO 0.04 -1.05 1.13 0.20 0.21 0.00 0.00 175.17 175.69 2c02 s ASN 113 N -3.23 5.50 0.88 0.27 0.01 -1.26 -1.57 114.94 115.55 2c02 s ASN 113 Ca 0.36 2.15 -0.11 0.00 -0.71 0.00 0.00 52.86 54.55 2c02 s ASN 113 Cb 0.03 -2.57 0.12 0.00 0.41 0.00 0.00 41.25 39.24 2c02 s ASN 113 CO 0.19 -1.37 1.11 0.00 -1.51 0.00 0.00 177.10 175.52 2c02 s ARG 114 N -3.51 1.31 -0.24 -0.60 1.70 -0.25 -4.79 118.95 112.57 2c02 s ARG 114 Ca 0.72 1.22 -0.29 0.00 -0.47 0.00 0.00 55.73 56.90 2c02 s ARG 114 Cb -0.23 -1.79 -0.03 0.00 -0.57 0.00 0.00 34.95 32.33 2c02 s ARG 114 CO 0.31 -2.32 1.71 0.34 -1.08 0.00 0.00 175.30 174.26 2c02 s ASP 115 N -3.05 6.20 0.30 -2.89 -1.08 -1.26 -4.87 116.67 110.02 2c02 s ASP 115 Ca 0.64 1.57 0.06 0.00 -0.52 0.00 0.00 52.55 54.30 2c02 s ASP 115 Cb -0.20 -2.53 0.76 0.00 -1.46 0.00 0.00 42.92 39.49 2c02 s ASP 115 CO 0.58 -1.42 1.74 1.56 0.52 0.00 0.00 175.17 178.15 2c02 h GLN 116 N 11.54 0.59 0.03 4.34 1.08 -1.91 -1.71 115.11 129.08 2c02 h GLN 116 Ca -0.35 -0.04 -0.30 0.00 -1.45 0.00 0.00 58.65 56.52 2c02 h GLN 116 Cb 1.16 -0.13 -0.04 0.00 -0.05 0.00 0.00 27.48 28.42 2c02 h GLN 116 CO 1.01 0.39 -1.68 0.00 -0.95 0.00 0.00 178.83 177.60 2c02 h ARG 117 N 0.61 0.07 0.00 1.46 -0.00 -2.04 -3.43 114.38 111.05 2c02 h ARG 117 Ca 0.58 -0.12 -0.13 0.00 -0.50 0.00 0.00 59.98 59.81 2c02 h ARG 117 Cb 1.01 0.05 -0.02 0.00 0.00 0.00 0.00 29.97 31.00 2c02 h ARG 117 CO -0.44 0.72 -1.61 0.54 0.00 0.00 0.00 179.97 179.18 2c02 n ARG 118 N -3.19 1.81 -2.76 0.04 1.74 -1.13 -5.01 116.66 108.16 2c02 n ARG 118 Ca -0.18 -0.03 -0.37 0.00 -0.77 0.00 0.00 57.85 56.50 2c02 n ARG 118 Cb 1.04 -1.25 -0.06 0.00 -1.02 0.00 0.00 32.46 31.17 2c02 n ARG 118 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2c02 s ASP 119 N -3.91 7.32 0.29 0.55 1.01 -0.66 -5.01 116.67 116.26 2c02 s ASP 119 Ca -0.05 1.85 -0.29 0.00 0.71 0.00 0.00 52.55 54.78 2c02 s ASP 119 Cb 0.04 -2.58 -0.10 0.00 1.01 0.00 0.00 42.92 41.29 2c02 s ASP 119 CO 0.41 -0.08 1.31 -2.16 0.21 0.00 0.00 175.17 174.86 2c02 s PRO 120 N -2.05 4.37 0.33 8.23 0.04 -1.26 -4.83 135.00 139.82 2c02 s PRO 120 Ca 0.50 2.18 0.19 0.00 0.04 0.00 0.00 61.00 63.91 2c02 s PRO 120 Cb -0.19 -3.10 1.02 0.00 0.04 0.00 0.00 34.50 32.27 2c02 s PRO 120 CO 0.24 -0.21 1.54 -0.35 0.04 0.00 0.00 177.00 178.26 2c02 n PRO 121 N 1.36 0.12 -0.35 0.56 -0.04 -1.26 -2.65 135.00 132.75 2c02 n PRO 121 Ca 0.02 0.62 0.09 0.00 -0.04 0.00 0.00 63.50 64.18 2c02 n PRO 121 Cb 0.42 -2.01 0.26 0.00 -0.04 0.00 0.00 33.50 32.13 2c02 n PRO 121 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 2c02 h GLN 122 N 0.00 0.87 -4.18 0.54 4.15 -2.03 -3.34 115.11 111.13 2c02 h GLN 122 Ca 0.00 -0.05 -0.66 0.00 0.77 0.00 0.00 58.65 58.71 2c02 h GLN 122 Cb 0.21 -0.20 -0.39 0.00 0.21 0.00 0.00 27.48 27.31 2c02 h GLN 122 CO 0.00 0.58 -0.65 0.71 -1.93 0.00 0.00 178.83 177.54 2c02 s TYR 123 N -5.93 3.54 0.42 3.99 2.02 -1.08 -4.95 117.35 115.35 2c02 s TYR 123 Ca -0.12 -2.98 0.23 0.00 -0.37 0.00 0.00 57.07 53.83 2c02 s TYR 123 Cb 0.23 -2.94 1.28 0.00 -0.40 0.00 0.00 41.96 40.12 2c02 s TYR 123 CO 0.80 -0.88 2.03 -1.00 -1.57 0.00 0.00 175.55 174.94 2c02 h PRO 124 N 7.26 0.00 -5.23 -1.71 0.13 -1.83 -3.41 132.00 127.20 2c02 h PRO 124 Ca -0.06 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.41 2c02 h PRO 124 Cb 0.98 0.00 -0.33 0.00 0.13 0.00 0.00 31.00 31.77 2c02 h PRO 124 CO 0.61 0.15 -0.87 0.08 -0.23 0.00 0.00 178.00 177.74 2c02 s VAL 125 N -4.31 1.95 0.05 1.56 1.01 -1.26 -1.09 120.40 118.31 2c02 s VAL 125 Ca -0.03 -0.95 0.01 0.00 0.00 0.00 0.00 61.98 61.01 2c02 s VAL 125 Cb 0.14 -1.70 -0.03 0.00 0.00 0.00 0.00 36.38 34.79 2c02 s VAL 125 CO 0.62 0.53 -0.06 0.68 0.00 0.00 0.00 175.10 176.88 2c02 s VAL 126 N 0.43 0.41 0.26 2.92 -7.23 -0.61 -4.90 120.40 111.68 2c02 s VAL 126 Ca -0.17 -1.27 -0.29 0.00 -1.81 0.00 0.00 61.98 58.44 2c02 s VAL 126 Cb -0.17 -0.80 -0.09 0.00 0.56 0.00 0.00 36.38 35.87 2c02 s VAL 126 CO 0.07 -0.57 1.15 -2.16 -0.31 0.00 0.00 175.10 173.28 2c02 s PRO 127 N -2.21 4.57 0.00 4.82 0.04 -1.26 -1.64 135.00 139.32 2c02 s PRO 127 Ca -0.06 1.87 0.00 0.00 0.04 0.00 0.00 61.00 62.85 2c02 s PRO 127 Cb -0.05 -3.19 0.00 0.00 0.04 0.00 0.00 34.50 31.30 2c02 s PRO 127 CO -0.02 0.09 0.00 1.33 0.04 0.00 0.00 177.00 178.44 2c02 n VAL 128 N 1.50 0.00 -3.63 -0.36 0.24 0.52 -4.14 118.33 112.45 2c02 n VAL 128 Ca 0.00 -0.35 -0.13 0.00 -2.04 0.00 0.00 64.34 61.82 2c02 n VAL 128 Cb 0.44 1.00 -0.07 0.00 -1.47 0.00 0.00 33.84 33.74 2c02 n VAL 128 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 2c02 s HIS 129 N -0.70 -0.80 -0.45 6.34 5.65 -1.07 -4.75 115.29 119.51 2c02 s HIS 129 Ca 0.00 1.91 -0.18 0.00 0.25 0.00 0.00 55.06 57.04 2c02 s HIS 129 Cb 0.00 0.30 0.04 0.00 -1.18 0.00 0.00 32.58 31.73 2c02 s HIS 129 CO 0.00 -0.39 0.52 -1.17 -0.65 0.00 0.00 174.74 173.05 2c02 s LEU 130 N 0.49 4.90 0.03 8.88 2.96 -1.26 -0.47 118.68 134.20 2c02 s LEU 130 Ca -0.01 -0.74 -0.01 0.00 -0.22 0.00 0.00 54.13 53.14 2c02 s LEU 130 Cb -0.05 -2.44 -0.27 0.00 0.50 0.00 0.00 46.19 43.93 2c02 s LEU 130 CO -0.01 -0.71 0.96 -0.78 -1.32 0.00 0.00 176.35 174.50 2c02 h ASP 131 N 8.83 0.34 -4.07 3.68 1.82 -1.27 -3.49 116.42 122.26 2c02 h ASP 131 Ca -0.27 -0.43 0.19 0.00 -0.39 0.00 0.00 57.03 56.13 2c02 h ASP 131 Cb 1.10 -0.11 -0.21 0.00 0.68 0.00 0.00 39.33 40.80 2c02 h ASP 131 CO 0.87 1.35 0.73 -0.60 -1.61 0.00 0.00 179.24 179.98 2c02 s ARG 132 N -2.64 0.41 0.00 0.28 3.52 -1.00 -4.61 118.95 114.91 2c02 s ARG 132 Ca -0.06 -0.06 0.07 0.00 -0.13 0.00 0.00 55.73 55.55 2c02 s ARG 132 Cb 0.07 0.19 -0.02 0.00 -1.56 0.00 0.00 34.95 33.63 2c02 s ARG 132 CO 0.86 -0.16 -0.22 0.96 -0.81 0.00 0.00 175.30 175.93 2c02 s ILE 133 N -1.98 1.76 0.00 4.11 -4.36 -1.26 -0.20 121.20 119.27 2c02 s ILE 133 Ca 0.06 -1.03 0.00 0.00 -0.26 0.00 0.00 60.65 59.42 2c02 s ILE 133 Cb -0.01 -1.48 0.00 0.00 1.25 0.00 0.00 42.46 42.22 2c02 s ILE 133 CO -0.04 0.43 0.26 -0.38 0.24 0.00 0.00 174.94 175.44