#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eec s SER 2 N 0.00 -0.51 0.08 1.61 0.15 -1.26 -5.18 113.70 108.58 2eec s SER 2 Ca 0.00 0.74 -0.26 0.00 0.70 0.00 0.00 55.95 57.13 2eec s SER 2 Cb 0.00 0.67 0.09 0.00 -1.71 0.00 0.00 66.02 65.07 2eec s SER 2 CO 0.00 -0.34 1.17 -0.94 1.20 0.00 0.00 173.24 174.33 2eec s SER 3 N -0.57 -0.01 -0.27 5.45 1.04 -1.26 -5.19 113.70 112.90 2eec s SER 3 Ca -0.02 -0.40 -0.26 0.00 0.48 0.00 0.00 55.95 55.75 2eec s SER 3 Cb -0.02 0.31 0.12 0.00 0.10 0.00 0.00 66.02 66.53 2eec s SER 3 CO 0.01 -0.61 1.02 -0.83 0.98 0.00 0.00 173.24 173.81 2eec s GLY 4 N -3.52 -0.18 0.17 7.32 0.00 -1.26 -5.18 107.32 104.67 2eec s GLY 4 Ca 0.24 2.58 -0.13 0.00 0.00 0.00 0.00 44.72 47.41 2eec s GLY 4 CO 0.02 1.74 0.39 -0.45 0.00 0.00 0.00 173.10 174.80 2eec s SER 5 N 0.08 -0.11 0.29 1.64 0.15 -1.26 -5.17 113.70 109.33 2eec s SER 5 Ca 0.02 -0.65 -0.12 0.00 0.70 0.00 0.00 55.95 55.90 2eec s SER 5 Cb -0.04 0.50 -0.08 0.00 -1.71 0.00 0.00 66.02 64.68 2eec s SER 5 CO -0.05 -0.95 0.66 -0.94 1.20 0.00 0.00 173.24 173.16 2eec s SER 6 N -2.91 6.69 0.00 5.45 1.04 -1.26 -5.09 113.70 117.63 2eec s SER 6 Ca 0.12 1.12 0.00 0.00 0.48 0.00 0.00 55.95 57.67 2eec s SER 6 Cb 0.01 -2.31 0.00 0.00 0.10 0.00 0.00 66.02 63.83 2eec s SER 6 CO -0.03 -0.17 0.00 0.61 0.98 0.00 0.00 173.24 174.64 2eec n GLY 7 N -0.34 0.41 2.72 7.32 0.00 -1.26 -5.03 105.19 109.00 2eec n GLY 7 Ca 0.02 -0.05 -0.28 0.00 0.00 0.00 0.00 46.02 45.70 2eec n GLY 7 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2eec s PHE 8 N 0.00 1.13 0.47 1.61 0.08 -1.26 -5.12 117.98 114.89 2eec s PHE 8 Ca 0.00 -1.08 -0.19 0.00 0.12 0.00 0.00 56.93 55.78 2eec s PHE 8 Cb 0.00 -1.18 -0.15 0.00 -0.57 0.00 0.00 43.02 41.12 2eec s PHE 8 CO 0.00 -0.70 -0.01 0.36 -0.10 0.00 0.00 175.22 174.77 2eec n LYS 9 N 5.02 0.03 -4.43 0.44 0.00 -1.26 -4.98 118.16 112.98 2eec n LYS 9 Ca -0.07 0.01 -0.20 0.00 -0.00 0.00 0.00 58.31 58.05 2eec n LYS 9 Cb 0.45 -1.04 -0.15 0.00 -0.00 0.00 0.00 35.03 34.29 2eec n LYS 9 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.40 177.54 2eec s VAL 10 N -1.88 0.81 0.06 0.58 -7.23 -1.26 -5.15 120.40 106.33 2eec s VAL 10 Ca 0.58 -0.41 0.02 0.00 -1.81 0.00 0.00 61.98 60.36 2eec s VAL 10 Cb -0.54 -0.70 -0.04 0.00 0.56 0.00 0.00 36.38 35.66 2eec s VAL 10 CO 0.64 0.24 0.08 -0.13 -0.31 0.00 0.00 175.10 175.63 2eec s ARG 11 N -0.04 2.95 0.19 4.82 1.81 -1.26 -5.12 118.95 122.30 2eec s ARG 11 Ca 0.01 -0.63 0.06 0.00 -1.72 0.00 0.00 55.73 53.44 2eec s ARG 11 Cb -0.06 -2.77 -0.04 0.00 -0.45 0.00 0.00 34.95 31.63 2eec s ARG 11 CO 0.00 0.59 0.14 0.54 -0.68 0.00 0.00 175.30 175.89 2eec s VAL 12 N -1.34 4.42 0.00 3.52 0.11 -1.26 -4.89 120.40 120.95 2eec s VAL 12 Ca 0.28 -1.19 0.00 0.00 -2.93 0.00 0.00 61.98 58.14 2eec s VAL 12 Cb -0.12 -3.29 0.00 0.00 -1.53 0.00 0.00 36.38 31.44 2eec s VAL 12 CO 0.20 -0.17 0.00 0.61 -3.33 0.00 0.00 175.10 172.41 2eec n GLY 13 N -0.55 0.06 3.87 6.54 0.00 -1.26 -5.15 105.19 108.70 2eec n GLY 13 Ca -0.08 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.63 2eec n GLY 13 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2eec s GLU 14 N 0.00 3.86 0.95 1.61 -1.05 -1.26 -5.07 118.70 117.73 2eec s GLU 14 Ca 0.00 0.53 -0.12 0.00 -0.15 0.00 0.00 54.97 55.23 2eec s GLU 14 Cb 0.00 -2.41 0.16 0.00 -0.44 0.00 0.00 34.13 31.44 2eec s GLU 14 CO 0.00 0.04 1.09 -1.25 0.95 0.00 0.00 175.26 176.10 2eec s PRO 15 N -3.51 0.83 0.09 -4.83 0.04 -1.26 -4.95 135.00 121.41 2eec s PRO 15 Ca 0.52 0.67 0.00 0.00 0.04 0.00 0.00 61.00 62.23 2eec s PRO 15 Cb -0.10 -1.77 0.00 0.00 0.04 0.00 0.00 34.50 32.67 2eec s PRO 15 CO 0.26 -2.50 0.00 0.41 0.04 0.00 0.00 177.00 175.21 2eec n GLY 16 N -1.10 -0.92 2.63 0.56 0.00 -1.26 -5.05 105.19 100.06 2eec n GLY 16 Ca 0.06 0.27 -0.27 0.00 0.00 0.00 0.00 46.02 46.08 2eec n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2eec n GLN 17 N -2.68 1.50 -1.52 1.61 0.00 -1.26 -5.10 117.38 109.94 2eec n GLN 17 Ca 0.00 -4.12 -0.50 0.00 0.00 0.00 0.00 57.00 52.39 2eec n GLN 17 Cb 0.00 -2.05 -0.04 0.00 0.00 0.00 0.00 30.24 28.15 2eec n GLN 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2eec n ALA 18 N 1.90 -1.82 -2.82 2.61 0.00 -1.26 -3.05 120.51 116.07 2eec n ALA 18 Ca 0.24 0.47 -0.07 0.00 0.00 0.00 0.00 53.44 54.09 2eec n ALA 18 Cb 0.41 -1.86 0.03 0.00 0.00 0.00 0.00 19.45 18.03 2eec n ALA 18 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2eec n GLY 19 N 1.82 -0.87 3.40 0.00 0.00 -1.26 -4.98 105.19 103.29 2eec n GLY 19 Ca 0.16 0.38 -0.44 0.00 0.00 0.00 0.00 46.02 46.11 2eec n GLY 19 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2eec s ASN 20 N -3.08 6.15 0.26 1.61 3.84 -1.17 -4.93 114.94 117.62 2eec s ASN 20 Ca 0.20 -1.25 0.04 0.00 0.21 0.00 0.00 52.86 52.07 2eec s ASN 20 Cb -0.03 -2.19 0.35 0.00 -0.55 0.00 0.00 41.25 38.83 2eec s ASN 20 CO 0.59 -0.65 1.64 1.55 -2.79 0.00 0.00 177.10 177.44 2eec h PRO 21 N 8.77 0.32 -0.47 0.43 0.13 -1.91 -3.18 132.00 136.09 2eec h PRO 21 Ca -0.28 -0.17 0.04 0.00 -0.87 0.00 0.00 66.00 64.72 2eec h PRO 21 Cb 1.11 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.21 2eec h PRO 21 CO 0.87 0.72 0.24 0.00 -0.23 0.00 0.00 178.00 179.60 2eec h ALA 22 N 1.26 0.59 -0.81 -0.56 0.00 -1.92 -2.25 119.26 115.58 2eec h ALA 22 Ca 0.02 0.02 0.12 0.00 0.00 0.00 0.00 54.91 55.07 2eec h ALA 22 Cb 0.90 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.54 2eec h ALA 22 CO 0.07 -0.11 0.42 -0.07 0.00 0.00 0.00 179.25 179.56 2eec h LEU 23 N 0.47 0.53 -9.58 0.00 3.38 -1.97 -3.38 115.31 104.76 2eec h LEU 23 Ca 0.20 0.08 -0.59 0.00 0.09 0.00 0.00 57.88 57.66 2eec h LEU 23 Cb 0.11 -0.01 0.10 0.00 0.09 0.00 0.00 40.66 40.95 2eec h LEU 23 CO -0.14 0.26 0.39 0.52 0.09 0.00 0.00 178.44 179.55 2eec n VAL 24 N -4.85 1.64 -4.16 1.22 0.31 -0.85 -4.90 118.33 106.74 2eec n VAL 24 Ca 0.15 -0.41 -0.10 0.00 -0.01 0.00 0.00 64.34 63.97 2eec n VAL 24 Cb 0.36 -1.29 -0.10 0.00 -0.91 0.00 0.00 33.84 31.90 2eec n VAL 24 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 2eec s SER 25 N -0.22 0.93 -0.03 4.52 0.01 -1.17 -4.33 113.70 113.42 2eec s SER 25 Ca 0.61 -1.06 -0.01 0.00 1.31 0.00 0.00 55.95 56.80 2eec s SER 25 Cb -0.66 0.14 0.02 0.00 0.21 0.00 0.00 66.02 65.74 2eec s SER 25 CO 0.57 -0.54 0.06 0.00 0.41 0.00 0.00 173.24 173.74 2eec s ALA 26 N -3.74 -0.05 0.10 1.44 0.00 -1.26 0.84 121.76 119.08 2eec s ALA 26 Ca 0.15 0.30 -0.12 0.00 0.00 0.00 0.00 51.96 52.29 2eec s ALA 26 Cb 0.06 -0.22 0.01 0.00 0.00 0.00 0.00 23.12 22.98 2eec s ALA 26 CO -0.03 -0.08 0.28 1.52 0.00 0.00 0.00 175.76 177.44 2eec s TYR 27 N 0.68 -0.01 -3.95 0.00 -0.85 -0.93 -4.99 117.35 107.31 2eec s TYR 27 Ca -0.06 -0.37 0.00 0.00 -0.52 0.00 0.00 57.07 56.13 2eec s TYR 27 Cb -0.08 0.08 0.00 0.00 0.38 0.00 0.00 41.96 42.34 2eec s TYR 27 CO -0.02 -0.61 0.00 0.41 -1.52 0.00 0.00 175.55 173.81 2eec n GLY 28 N -0.09 -0.53 0.08 5.49 0.00 -1.26 -1.25 105.19 107.63 2eec n GLY 28 Ca -0.16 -0.86 -0.09 0.00 0.00 0.00 0.00 46.02 44.90 2eec n GLY 28 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2eec n THR 29 N 7.11 1.12 0.28 2.61 -1.04 -1.20 -4.38 114.28 118.78 2eec n THR 29 Ca 0.00 -0.62 0.13 0.00 -2.04 0.00 0.00 64.05 61.52 2eec n THR 29 Cb 0.00 -0.73 0.61 0.00 -1.82 0.00 0.00 70.33 68.39 2eec n THR 29 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 2eec h GLY 30 N 2.78 0.00 1.41 3.41 0.00 -1.85 -1.40 103.07 107.42 2eec h GLY 30 Ca -0.44 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 46.88 2eec h GLY 30 CO 0.00 0.00 -0.63 1.41 0.00 0.00 0.00 176.54 177.33 2eec h LEU 31 N 0.00 0.00 -1.54 3.11 3.38 -1.94 -3.30 115.31 115.02 2eec h LEU 31 Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 2eec h LEU 31 Cb 0.19 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 2eec h LEU 31 CO 0.00 0.04 -0.18 -0.33 0.09 0.00 0.00 178.44 178.06 2eec h GLU 32 N 0.00 0.07 0.00 1.13 4.39 -1.47 -3.48 114.58 115.22 2eec h GLU 32 Ca -0.01 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.68 2eec h GLU 32 Cb 1.04 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.68 2eec h GLU 32 CO 0.00 0.25 0.00 0.41 -1.16 0.00 0.00 179.01 178.52 2eec n GLY 33 N -0.93 -1.56 3.35 -3.84 0.00 -1.24 -4.96 105.19 96.01 2eec n GLY 33 Ca -0.02 -1.05 -0.44 0.00 0.00 0.00 0.00 46.02 44.51 2eec n GLY 33 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2eec s GLY 34 N 0.00 2.04 -0.42 -0.02 0.00 -0.69 -4.74 107.32 103.49 2eec s GLY 34 Ca 0.00 -2.18 -0.16 0.00 0.00 0.00 0.00 44.72 42.38 2eec s GLY 34 CO 0.00 1.05 0.34 -0.51 0.00 0.00 0.00 173.10 173.98 2eec s THR 35 N 1.58 5.21 -0.07 0.90 -4.23 -1.26 -2.71 115.64 115.07 2eec s THR 35 Ca 0.04 -0.60 -0.29 0.00 -1.18 0.00 0.00 61.69 59.65 2eec s THR 35 Cb -0.25 -3.97 -0.02 0.00 1.34 0.00 0.00 72.50 69.60 2eec s THR 35 CO 0.05 -0.35 0.98 -0.89 -0.54 0.00 0.00 174.62 173.86 2eec s THR 36 N 1.80 4.83 0.00 3.99 2.01 -1.26 -3.45 115.64 123.55 2eec s THR 36 Ca 0.07 2.01 0.00 0.00 0.31 0.00 0.00 61.69 64.07 2eec s THR 36 Cb -0.19 -4.30 0.00 0.00 0.01 0.00 0.00 72.50 68.03 2eec s THR 36 CO 0.11 0.07 0.00 0.61 -0.69 0.00 0.00 174.62 174.72 2eec n GLY 37 N 3.04 2.95 3.95 4.40 0.00 -1.22 -5.05 105.19 113.26 2eec n GLY 37 Ca 0.07 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.87 2eec n GLY 37 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2eec s ILE 38 N -2.87 5.18 -0.36 -0.61 1.01 -1.22 -5.07 121.20 117.25 2eec s ILE 38 Ca 0.00 -0.98 -0.05 0.00 0.00 0.00 0.00 60.65 59.61 2eec s ILE 38 Cb 0.00 -3.79 0.07 0.00 0.01 0.00 0.00 42.46 38.75 2eec s ILE 38 CO 0.00 -0.29 0.14 -1.58 0.00 0.00 0.00 174.94 173.21 2eec s GLN 39 N -3.83 2.44 0.58 2.79 0.74 -1.26 -4.62 119.66 116.50 2eec s GLN 39 Ca 0.34 -1.40 -0.06 0.00 0.05 0.00 0.00 55.36 54.29 2eec s GLN 39 Cb -0.09 -3.50 0.00 0.00 1.10 0.00 0.00 33.01 30.52 2eec s GLN 39 CO 0.28 -0.81 0.90 -1.54 -0.55 0.00 0.00 175.29 173.57 2eec s SER 40 N 1.63 5.69 -0.15 6.67 1.04 -1.26 -5.00 113.70 122.33 2eec s SER 40 Ca 0.01 0.78 -0.06 0.00 0.48 0.00 0.00 55.95 57.15 2eec s SER 40 Cb -0.21 -1.80 0.07 0.00 0.10 0.00 0.00 66.02 64.17 2eec s SER 40 CO 0.00 -1.01 0.33 -1.83 0.98 0.00 0.00 173.24 171.72 2eec s GLU 41 N -4.98 0.26 -0.08 4.02 1.03 -1.26 -3.81 118.70 113.88 2eec s GLU 41 Ca 0.53 0.78 0.02 0.00 0.03 0.00 0.00 54.97 56.33 2eec s GLU 41 Cb -0.11 0.04 0.01 0.00 -0.80 0.00 0.00 34.13 33.28 2eec s GLU 41 CO 0.46 -0.22 -0.12 -0.59 -1.33 0.00 0.00 175.26 173.45 2eec s PHE 42 N 1.97 1.57 0.61 4.83 -0.12 -0.95 -3.24 117.98 122.64 2eec s PHE 42 Ca -0.04 -0.63 -0.04 0.00 -0.05 0.00 0.00 56.93 56.16 2eec s PHE 42 Cb -0.11 -1.16 0.03 0.00 -0.63 0.00 0.00 43.02 41.16 2eec s PHE 42 CO -0.11 -0.34 0.89 -0.06 -0.05 0.00 0.00 175.22 175.56 2eec s PHE 43 N 0.84 3.02 -0.14 3.49 0.40 -0.38 -2.27 117.98 122.94 2eec s PHE 43 Ca -0.11 0.37 0.01 0.00 -0.60 0.00 0.00 56.93 56.60 2eec s PHE 43 Cb -0.15 -2.88 0.02 0.00 0.51 0.00 0.00 43.02 40.51 2eec s PHE 43 CO 0.02 -1.02 -0.16 0.42 0.70 0.00 0.00 175.22 175.17 2eec s ILE 44 N -3.00 1.65 -1.10 0.64 1.01 -1.24 -2.19 121.20 116.97 2eec s ILE 44 Ca 0.57 -0.71 -0.21 0.00 0.00 0.00 0.00 60.65 60.29 2eec s ILE 44 Cb -0.11 -1.52 -0.08 0.00 0.01 0.00 0.00 42.46 40.77 2eec s ILE 44 CO 0.43 0.47 1.92 -3.20 0.00 0.00 0.00 174.94 174.56 2eec n ASN 45 N 4.47 3.20 -2.53 3.58 5.15 0.25 -4.50 115.26 124.89 2eec n ASN 45 Ca -0.18 -2.73 -0.32 0.00 -0.60 0.00 0.00 54.58 50.75 2eec n ASN 45 Cb 0.51 -1.56 0.03 0.00 -0.53 0.00 0.00 39.78 38.22 2eec n ASN 45 CO 0.00 0.00 0.00 0.41 1.40 0.00 0.00 177.26 179.07 2eec n THR 46 N 7.00 3.01 -0.09 -0.44 -1.04 -1.26 -3.04 114.28 118.42 2eec n THR 46 Ca 0.47 -4.28 -0.17 0.00 -2.04 0.00 0.00 64.05 58.03 2eec n THR 46 Cb 0.44 -1.22 -0.07 0.00 -1.82 0.00 0.00 70.33 67.66 2eec n THR 46 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 2eec n THR 47 N -0.61 0.99 0.57 12.58 -2.24 -1.26 -3.97 114.28 120.34 2eec n THR 47 Ca 0.49 -0.29 0.13 0.00 -2.27 0.00 0.00 64.05 62.11 2eec n THR 47 Cb 0.57 -1.56 0.44 0.00 -2.10 0.00 0.00 70.33 67.68 2eec n THR 47 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 2eec n ARG 48 N -3.58 0.23 -0.06 -0.78 0.00 -1.26 -3.57 116.66 107.64 2eec n ARG 48 Ca -0.34 0.27 -0.22 0.00 -0.00 0.00 0.00 57.85 57.56 2eec n ARG 48 Cb 0.77 -1.81 -0.13 0.00 -0.00 0.00 0.00 32.46 31.30 2eec n ARG 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2eec h ALA 49 N 2.47 0.30 0.00 2.89 0.00 -1.83 -3.50 119.26 119.59 2eec h ALA 49 Ca 0.00 -1.24 0.00 0.00 0.00 0.00 0.00 54.91 53.67 2eec h ALA 49 Cb 0.61 0.69 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2eec h ALA 49 CO 0.00 0.89 0.00 0.41 0.00 0.00 0.00 179.25 180.55 2eec n GLY 50 N 1.64 3.79 3.56 0.00 0.00 -1.23 -4.71 105.19 108.24 2eec n GLY 50 Ca -0.31 -1.52 -0.31 0.00 0.00 0.00 0.00 46.02 43.88 2eec n GLY 50 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2eec s PRO 51 N -4.40 2.58 0.00 1.61 0.04 -1.26 -4.85 135.00 128.72 2eec s PRO 51 Ca 0.00 0.01 0.00 0.00 0.04 0.00 0.00 61.00 61.05 2eec s PRO 51 Cb 0.00 -4.84 0.00 0.00 0.04 0.00 0.00 34.50 29.70 2eec s PRO 51 CO 0.00 -3.17 0.00 0.41 0.04 0.00 0.00 177.00 174.28 2eec n GLY 52 N 6.47 6.65 3.81 0.56 0.00 -1.26 -5.14 105.19 116.28 2eec n GLY 52 Ca 0.34 -1.81 -0.36 0.00 0.00 0.00 0.00 46.02 44.19 2eec n GLY 52 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2eec s THR 53 N 0.77 5.46 0.31 2.61 2.01 -1.26 -5.10 115.64 120.44 2eec s THR 53 Ca 0.00 0.20 0.08 0.00 0.31 0.00 0.00 61.69 62.29 2eec s THR 53 Cb 0.00 -3.43 -0.06 0.00 0.01 0.00 0.00 72.50 69.02 2eec s THR 53 CO 0.00 0.54 -0.09 -1.48 -0.69 0.00 0.00 174.62 172.90 2eec s LEU 54 N -0.38 2.60 -0.12 4.42 0.05 -1.26 -4.04 118.68 119.96 2eec s LEU 54 Ca 0.12 -1.18 -0.01 0.00 0.05 0.00 0.00 54.13 53.11 2eec s LEU 54 Cb -0.12 -0.83 0.04 0.00 -2.05 0.00 0.00 46.19 43.23 2eec s LEU 54 CO 0.01 -0.25 -0.01 -0.55 -0.55 0.00 0.00 176.35 175.00 2eec s SER 55 N -3.52 2.16 -0.23 1.48 0.15 -0.96 -5.01 113.70 107.78 2eec s SER 55 Ca 0.31 -0.37 -0.07 0.00 0.70 0.00 0.00 55.95 56.52 2eec s SER 55 Cb 0.02 -0.62 -0.03 0.00 -1.71 0.00 0.00 66.02 63.68 2eec s SER 55 CO 0.14 -0.20 0.07 -0.69 1.20 0.00 0.00 173.24 173.76 2eec s VAL 56 N 1.85 4.49 -0.16 4.45 1.01 -1.26 -2.50 120.40 128.27 2eec s VAL 56 Ca 0.03 -0.12 -0.02 0.00 0.00 0.00 0.00 61.98 61.87 2eec s VAL 56 Cb -0.14 -3.07 0.05 0.00 0.00 0.00 0.00 36.38 33.22 2eec s VAL 56 CO -0.07 0.38 0.02 -0.89 0.00 0.00 0.00 175.10 174.54 2eec s THR 57 N 1.19 0.51 -0.01 3.92 2.01 -0.95 -5.01 115.64 117.31 2eec s THR 57 Ca 0.05 -0.38 0.01 0.00 0.31 0.00 0.00 61.69 61.68 2eec s THR 57 Cb -0.14 -0.91 -0.04 0.00 0.01 0.00 0.00 72.50 71.42 2eec s THR 57 CO 0.03 -0.07 -0.01 -0.63 -0.69 0.00 0.00 174.62 173.25 2eec s ILE 58 N 1.88 4.09 0.45 1.82 1.01 -1.26 -0.60 121.20 128.59 2eec s ILE 58 Ca 0.01 -0.59 0.00 0.00 0.00 0.00 0.00 60.65 60.07 2eec s ILE 58 Cb -0.16 -2.81 -0.00 0.00 0.01 0.00 0.00 42.46 39.50 2eec s ILE 58 CO -0.07 0.40 0.01 -1.84 0.00 0.00 0.00 174.94 173.44 2eec n GLU 59 N 1.49 0.87 0.00 2.79 0.28 -0.26 -4.94 120.64 120.87 2eec n GLU 59 Ca -0.15 -3.30 0.00 0.00 -0.16 0.00 0.00 57.16 53.55 2eec n GLU 59 Cb 0.53 0.97 0.00 0.00 1.43 0.00 0.00 31.44 34.36 2eec n GLU 59 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2eec n GLY 60 N -0.45 2.61 0.24 -1.84 0.00 -1.26 -3.19 105.19 101.30 2eec n GLY 60 Ca -0.18 -1.63 -0.10 0.00 0.00 0.00 0.00 46.02 44.11 2eec n GLY 60 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eec h PRO 61 N 0.00 0.73 -6.61 1.61 0.13 -1.91 -3.44 132.00 122.50 2eec h PRO 61 Ca 0.00 -0.38 -0.66 0.00 -0.87 0.00 0.00 66.00 64.08 2eec h PRO 61 Cb 0.00 0.01 -0.17 0.00 0.13 0.00 0.00 31.00 30.98 2eec h PRO 61 CO 0.00 1.00 -0.76 -1.12 -0.23 0.00 0.00 178.00 176.89 2eec s SER 62 N -6.85 4.14 0.16 1.44 0.01 -1.26 -5.11 113.70 106.23 2eec s SER 62 Ca -0.09 -0.50 -0.30 0.00 1.31 0.00 0.00 55.95 56.37 2eec s SER 62 Cb 0.12 -0.68 -0.07 0.00 0.21 0.00 0.00 66.02 65.59 2eec s SER 62 CO 0.85 0.16 1.00 -0.75 0.41 0.00 0.00 173.24 174.91 2eec s LYS 63 N -2.30 4.70 -0.18 12.44 2.47 -1.26 -5.00 119.74 130.61 2eec s LYS 63 Ca 0.21 1.55 -0.02 0.00 -1.56 0.00 0.00 55.97 56.14 2eec s LYS 63 Cb -0.10 -3.32 -0.01 0.00 -1.46 0.00 0.00 37.83 32.94 2eec s LYS 63 CO 0.12 0.24 -0.08 0.14 0.16 0.00 0.00 175.35 175.93 2eec s VAL 64 N -0.37 3.20 -0.79 4.02 -7.23 -1.26 -4.80 120.40 113.18 2eec s VAL 64 Ca 0.46 -0.57 -0.24 0.00 -1.81 0.00 0.00 61.98 59.82 2eec s VAL 64 Cb -0.26 -2.41 -0.18 0.00 0.56 0.00 0.00 36.38 34.09 2eec s VAL 64 CO 0.32 0.47 1.89 1.17 -0.31 0.00 0.00 175.10 178.64 2eec n LYS 65 N 4.27 1.17 -1.61 4.82 4.81 -1.26 -4.92 118.16 125.44 2eec n LYS 65 Ca -0.18 -1.88 -0.34 0.00 -0.87 0.00 0.00 58.31 55.04 2eec n LYS 65 Cb 0.51 -3.17 0.07 0.00 0.02 0.00 0.00 35.03 32.47 2eec n LYS 65 CO 0.00 0.00 0.00 1.41 1.17 0.00 0.00 177.40 179.98 2eec s MET 66 N 6.04 2.46 -0.01 1.64 -2.45 -1.26 -4.76 119.30 120.96 2eec s MET 66 Ca 0.64 1.64 0.00 0.00 -1.25 0.00 0.00 55.69 56.72 2eec s MET 66 Cb 0.09 -1.89 0.01 0.00 1.25 0.00 0.00 34.83 34.29 2eec s MET 66 CO 0.17 -1.56 -0.00 -0.51 1.05 0.00 0.00 175.02 174.17 2eec s ASP 67 N -2.17 0.13 0.05 1.11 1.11 -1.24 -5.09 116.67 110.56 2eec s ASP 67 Ca 0.72 -0.01 -0.19 0.00 0.18 0.00 0.00 52.55 53.26 2eec s ASP 67 Cb -0.26 -0.04 -0.06 0.00 1.07 0.00 0.00 42.92 43.62 2eec s ASP 67 CO 0.42 -0.03 0.54 0.00 1.18 0.00 0.00 175.17 177.28 2eec s GLN 69 N -0.97 0.60 0.05 0.00 2.00 -1.21 -5.07 119.66 115.06 2eec s GLN 69 Ca 0.28 0.05 -0.29 0.00 -2.00 0.00 0.00 55.36 53.40 2eec s GLN 69 Cb -0.19 -0.84 -0.04 0.00 0.80 0.00 0.00 33.01 32.74 2eec s GLN 69 CO 0.18 -0.21 0.94 -2.00 -0.50 0.00 0.00 175.29 173.69 2eec s GLU 70 N 1.53 4.61 0.07 1.67 2.12 -1.26 -2.31 118.70 125.12 2eec s GLU 70 Ca -0.02 1.38 0.03 0.00 0.36 0.00 0.00 54.97 56.72 2eec s GLU 70 Cb -0.13 -3.42 -0.03 0.00 0.26 0.00 0.00 34.13 30.81 2eec s GLU 70 CO -0.03 0.09 -0.10 0.95 -0.54 0.00 0.00 175.26 175.63 2eec s THR 71 N 0.51 0.81 -1.41 -1.70 -4.23 -1.19 -4.91 115.64 103.52 2eec s THR 71 Ca 0.48 -1.38 0.15 0.00 -1.18 0.00 0.00 61.69 59.76 2eec s THR 71 Cb -0.22 -1.04 0.25 0.00 1.34 0.00 0.00 72.50 72.84 2eec s THR 71 CO 0.28 -0.44 1.41 -0.81 -0.54 0.00 0.00 174.62 174.52 2eec n PRO 72 N 1.02 0.20 -0.01 3.99 -0.04 -1.26 -2.25 135.00 136.65 2eec n PRO 72 Ca -0.19 0.15 0.06 0.00 -0.04 0.00 0.00 63.50 63.48 2eec n PRO 72 Cb 0.56 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.42 2eec n PRO 72 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2eec n GLU 73 N -1.30 0.40 0.00 0.54 4.71 -1.26 -5.08 120.64 118.65 2eec n GLU 73 Ca 0.07 -0.11 0.00 0.00 -0.01 0.00 0.00 57.16 57.10 2eec n GLU 73 Cb 0.12 -1.30 0.00 0.00 -1.01 0.00 0.00 31.44 29.25 2eec n GLU 73 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2eec n GLY 74 N 1.78 -1.22 3.51 0.62 0.00 -0.95 -4.10 105.19 104.83 2eec n GLY 74 Ca -0.02 0.50 -0.02 0.00 0.00 0.00 0.00 46.02 46.48 2eec n GLY 74 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2eec s TYR 75 N 0.00 -1.27 -0.24 1.61 1.51 -1.26 -3.20 117.35 114.49 2eec s TYR 75 Ca 0.00 2.10 -0.23 0.00 -1.01 0.00 0.00 57.07 57.93 2eec s TYR 75 Cb 0.00 0.68 -0.01 0.00 -0.11 0.00 0.00 41.96 42.52 2eec s TYR 75 CO 0.00 -0.66 0.74 0.21 -1.11 0.00 0.00 175.55 174.72 2eec s LYS 76 N 2.84 4.16 -0.17 -0.62 2.20 -0.98 -3.72 119.74 123.45 2eec s LYS 76 Ca -0.02 0.77 -0.05 0.00 -0.36 0.00 0.00 55.97 56.31 2eec s LYS 76 Cb -0.12 -3.64 -0.03 0.00 -1.51 0.00 0.00 37.83 32.53 2eec s LYS 76 CO -0.18 -0.45 -0.01 0.08 -0.36 0.00 0.00 175.35 174.43 2eec s VAL 77 N 2.60 3.99 0.06 4.02 1.01 -0.96 -3.34 120.40 127.79 2eec s VAL 77 Ca 0.31 -0.31 0.06 0.00 0.00 0.00 0.00 61.98 62.04 2eec s VAL 77 Cb -0.15 -2.78 -0.03 0.00 0.00 0.00 0.00 36.38 33.42 2eec s VAL 77 CO 0.08 0.47 -0.16 -0.04 0.00 0.00 0.00 175.10 175.44 2eec s MET 78 N 0.61 0.99 -0.15 2.72 -1.94 -1.26 -2.24 119.30 118.03 2eec s MET 78 Ca -0.01 -0.93 -0.06 0.00 -1.71 0.00 0.00 55.69 52.98 2eec s MET 78 Cb -0.14 -1.06 0.07 0.00 2.01 0.00 0.00 34.83 35.70 2eec s MET 78 CO 0.02 0.25 0.31 1.52 -0.01 0.00 0.00 175.02 177.12 2eec s TYR 79 N -1.06 -0.52 -0.58 -0.03 1.13 -1.25 -3.68 117.35 111.36 2eec s TYR 79 Ca 0.02 1.12 -0.08 0.00 -1.41 0.00 0.00 57.07 56.72 2eec s TYR 79 Cb -0.09 0.08 0.15 0.00 -1.10 0.00 0.00 41.96 41.00 2eec s TYR 79 CO 0.02 -0.37 0.45 0.99 -2.51 0.00 0.00 175.55 174.13 2eec s THR 80 N 2.27 4.28 0.27 -3.49 2.01 -1.26 -4.27 115.64 115.45 2eec s THR 80 Ca -0.02 -2.29 -0.29 0.00 0.31 0.00 0.00 61.69 59.40 2eec s THR 80 Cb -0.12 -3.78 -0.09 0.00 0.01 0.00 0.00 72.50 68.52 2eec s THR 80 CO -0.10 -0.85 1.26 -2.16 -0.69 0.00 0.00 174.62 172.08 2eec s PRO 81 N 0.69 4.43 -0.06 4.92 0.04 -1.26 -4.64 135.00 139.12 2eec s PRO 81 Ca 0.12 2.06 0.15 0.00 0.04 0.00 0.00 61.00 63.36 2eec s PRO 81 Cb -0.21 -3.15 -0.22 0.00 0.04 0.00 0.00 34.50 30.96 2eec s PRO 81 CO -0.03 -0.12 0.56 -0.12 0.04 0.00 0.00 177.00 177.33 2eec n MET 82 N 1.62 0.64 -4.77 4.56 1.56 -1.26 -3.38 117.12 116.09 2eec n MET 82 Ca 0.02 0.21 -0.26 0.00 -0.27 0.00 0.00 57.70 57.41 2eec n MET 82 Cb 0.43 -1.73 -0.15 0.00 2.15 0.00 0.00 33.22 33.92 2eec n MET 82 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 2eec s ALA 83 N -2.65 1.66 1.25 -5.12 0.00 -1.26 -2.85 121.76 112.79 2eec s ALA 83 Ca -0.06 -0.94 -0.21 0.00 0.00 0.00 0.00 51.96 50.76 2eec s ALA 83 Cb 0.08 -0.37 0.31 0.00 0.00 0.00 0.00 23.12 23.14 2eec s ALA 83 CO 0.83 0.39 1.10 -0.35 0.00 0.00 0.00 175.76 177.73 2eec n PRO 84 N 2.21 -3.16 0.00 0.00 -0.04 -1.26 -4.86 135.00 127.90 2eec n PRO 84 Ca -0.16 -1.77 0.00 0.00 -0.04 0.00 0.00 63.50 61.53 2eec n PRO 84 Cb 0.53 -1.65 0.00 0.00 -0.04 0.00 0.00 33.50 32.34 2eec n PRO 84 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2eec n GLY 85 N -4.82 0.41 2.81 0.55 0.00 -0.57 -4.91 105.19 98.67 2eec n GLY 85 Ca 0.15 -1.30 -0.25 0.00 0.00 0.00 0.00 46.02 44.63 2eec n GLY 85 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2eec s ASN 86 N -4.00 1.95 0.33 1.61 2.20 -1.26 0.54 114.94 116.31 2eec s ASN 86 Ca 0.00 -0.25 0.09 0.00 -0.94 0.00 0.00 52.86 51.75 2eec s ASN 86 Cb 0.00 -0.58 -0.05 0.00 -2.00 0.00 0.00 41.25 38.62 2eec s ASN 86 CO 0.00 -0.19 0.08 -0.31 -2.94 0.00 0.00 177.10 173.75 2eec s TYR 87 N 1.88 2.65 0.05 1.54 1.51 -0.95 -4.35 117.35 119.67 2eec s TYR 87 Ca 0.04 -0.39 0.03 0.00 -1.01 0.00 0.00 57.07 55.74 2eec s TYR 87 Cb -0.13 -1.54 -0.02 0.00 -0.11 0.00 0.00 41.96 40.15 2eec s TYR 87 CO -0.06 0.42 -0.09 -1.17 -1.11 0.00 0.00 175.55 173.53 2eec s LEU 88 N -3.78 2.26 -0.19 -1.29 0.20 -1.19 -1.73 118.68 112.95 2eec s LEU 88 Ca 0.36 -0.56 -0.02 0.00 0.69 0.00 0.00 54.13 54.60 2eec s LEU 88 Cb -0.02 -0.23 0.06 0.00 -0.43 0.00 0.00 46.19 45.57 2eec s LEU 88 CO 0.21 -0.18 0.00 -0.63 -0.29 0.00 0.00 176.35 175.46 2eec s ILE 89 N -1.36 0.83 -0.18 6.68 1.01 -0.64 -1.10 121.20 126.44 2eec s ILE 89 Ca -0.09 -0.68 -0.09 0.00 0.00 0.00 0.00 60.65 59.79 2eec s ILE 89 Cb -0.10 -1.22 -0.05 0.00 0.01 0.00 0.00 42.46 41.11 2eec s ILE 89 CO 0.01 -0.11 0.13 -0.44 0.00 0.00 0.00 174.94 174.52 2eec s SER 90 N 1.73 6.20 -0.25 3.58 0.01 0.23 -2.49 113.70 122.72 2eec s SER 90 Ca -0.02 0.27 0.00 0.00 1.31 0.00 0.00 55.95 57.52 2eec s SER 90 Cb -0.17 -2.07 0.07 0.00 0.21 0.00 0.00 66.02 64.05 2eec s SER 90 CO -0.07 0.23 -0.02 -0.69 0.41 0.00 0.00 173.24 173.10 2eec s VAL 91 N 0.08 1.40 0.12 3.43 1.01 -1.26 -2.23 120.40 122.94 2eec s VAL 91 Ca 0.09 -1.25 0.05 0.00 0.00 0.00 0.00 61.98 60.87 2eec s VAL 91 Cb -0.11 -1.76 -0.04 0.00 0.00 0.00 0.00 36.38 34.47 2eec s VAL 91 CO -0.01 -0.22 0.04 -0.54 0.00 0.00 0.00 175.10 174.37 2eec s LYS 92 N 1.44 2.63 -0.25 2.72 1.02 -1.04 -2.91 119.74 123.35 2eec s LYS 92 Ca -0.02 -0.88 -0.04 0.00 0.02 0.00 0.00 55.97 55.05 2eec s LYS 92 Cb -0.18 -2.55 0.13 0.00 -0.52 0.00 0.00 37.83 34.71 2eec s LYS 92 CO -0.09 0.52 0.45 -0.47 -0.92 0.00 0.00 175.35 174.84 2eec s TYR 93 N -1.48 -1.00 -0.41 3.18 6.14 -1.23 -2.26 117.35 120.27 2eec s TYR 93 Ca 0.27 1.29 -0.03 0.00 0.64 0.00 0.00 57.07 59.24 2eec s TYR 93 Cb -0.11 0.26 0.00 0.00 0.42 0.00 0.00 41.96 42.53 2eec s TYR 93 CO 0.20 -0.68 0.43 0.41 0.64 0.00 0.00 175.55 176.54 2eec n GLY 94 N 5.39 -0.96 0.00 8.97 0.00 -1.26 -4.46 105.19 112.87 2eec n GLY 94 Ca -0.05 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.37 2eec n GLY 94 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2eec n GLY 95 N -1.15 0.67 0.00 -0.02 0.00 -1.26 -4.51 105.19 98.93 2eec n GLY 95 Ca 0.02 -2.02 0.07 0.00 0.00 0.00 0.00 46.02 44.09 2eec n GLY 95 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2eec n PRO 96 N 0.75 0.49 -2.75 1.61 -0.04 -1.26 -4.71 135.00 129.10 2eec n PRO 96 Ca 0.00 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.03 2eec n PRO 96 Cb 0.00 -1.42 -0.03 0.00 -0.04 0.00 0.00 33.50 32.01 2eec n PRO 96 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2eec s ASN 97 N -1.92 7.00 1.06 3.54 0.01 -1.26 -5.01 114.94 118.36 2eec s ASN 97 Ca 0.20 1.25 -0.17 0.00 -0.71 0.00 0.00 52.86 53.43 2eec s ASN 97 Cb 0.09 -2.50 0.23 0.00 0.41 0.00 0.00 41.25 39.48 2eec s ASN 97 CO 0.15 -0.61 1.20 -1.38 -1.51 0.00 0.00 177.10 174.96 2eec s HIS 98 N 3.04 1.20 0.51 2.20 -3.43 -1.26 -3.57 115.29 113.98 2eec s HIS 98 Ca 0.41 0.46 0.06 0.00 -0.80 0.00 0.00 55.06 55.19 2eec s HIS 98 Cb -0.15 -3.73 0.09 0.00 -1.43 0.00 0.00 32.58 27.36 2eec s HIS 98 CO 0.07 -3.17 0.70 0.44 -2.00 0.00 0.00 174.74 170.78 2eec n ILE 99 N -4.22 0.00 -2.32 -5.38 -5.35 -1.14 -4.69 119.36 96.26 2eec n ILE 99 Ca 0.13 -1.53 -0.38 0.00 -0.27 0.00 0.00 62.75 60.70 2eec n ILE 99 Cb 0.59 -0.69 -0.02 0.00 -1.74 0.00 0.00 39.64 37.78 2eec n ILE 99 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 2eec s VAL 100 N -2.11 3.22 0.00 7.28 1.01 -1.26 -3.40 120.40 125.13 2eec s VAL 100 Ca 0.51 1.03 0.00 0.00 0.00 0.00 0.00 61.98 63.52 2eec s VAL 100 Cb -0.04 -3.58 0.00 0.00 0.00 0.00 0.00 36.38 32.76 2eec s VAL 100 CO 0.33 0.10 0.00 0.61 0.00 0.00 0.00 175.10 176.14 2eec n GLY 101 N 0.64 2.35 3.78 4.51 0.00 -1.26 -4.85 105.19 110.37 2eec n GLY 101 Ca 0.04 -0.53 -0.31 0.00 0.00 0.00 0.00 46.02 45.22 2eec n GLY 101 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eec s SER 102 N 0.00 4.71 0.61 1.61 0.01 -1.22 -4.46 113.70 114.96 2eec s SER 102 Ca 0.00 1.67 -0.17 0.00 1.31 0.00 0.00 55.95 58.76 2eec s SER 102 Cb 0.00 -2.43 -0.02 0.00 0.21 0.00 0.00 66.02 63.77 2eec s SER 102 CO 0.00 -1.88 1.12 -2.16 0.41 0.00 0.00 173.24 170.73 2eec s PRO 103 N -4.98 3.03 -0.28 12.44 0.04 -1.26 -4.88 135.00 139.11 2eec s PRO 103 Ca 0.60 1.47 -0.15 0.00 0.04 0.00 0.00 61.00 62.97 2eec s PRO 103 Cb -0.16 -1.97 -0.03 0.00 0.04 0.00 0.00 34.50 32.37 2eec s PRO 103 CO 0.56 -1.08 0.37 -0.06 0.04 0.00 0.00 177.00 176.82 2eec s PHE 104 N -2.12 3.24 -0.38 0.56 0.08 -1.04 -5.00 117.98 113.32 2eec s PHE 104 Ca 0.69 0.33 -0.10 0.00 0.12 0.00 0.00 56.93 57.97 2eec s PHE 104 Cb -0.22 -2.59 0.04 0.00 -0.57 0.00 0.00 43.02 39.69 2eec s PHE 104 CO 0.36 -0.27 0.21 0.15 -0.10 0.00 0.00 175.22 175.58 2eec s LYS 105 N 2.06 2.75 0.23 0.44 1.02 -1.26 -1.62 119.74 123.35 2eec s LYS 105 Ca 0.14 -1.19 0.07 0.00 0.02 0.00 0.00 55.97 55.00 2eec s LYS 105 Cb -0.16 -3.73 -0.04 0.00 -0.52 0.00 0.00 37.83 33.39 2eec s LYS 105 CO 0.10 -0.77 0.17 0.00 -0.92 0.00 0.00 175.35 173.93 2eec s ALA 106 N 1.51 3.56 -0.12 5.17 0.00 -0.71 -5.04 121.76 126.13 2eec s ALA 106 Ca 0.02 -1.37 -0.01 0.00 0.00 0.00 0.00 51.96 50.60 2eec s ALA 106 Cb -0.20 -1.29 0.03 0.00 0.00 0.00 0.00 23.12 21.66 2eec s ALA 106 CO 0.05 0.32 -0.05 0.21 0.00 0.00 0.00 175.76 176.29 2eec s LYS 107 N -3.63 1.29 0.01 0.00 2.20 -1.26 -2.25 119.74 116.10 2eec s LYS 107 Ca 0.32 -0.26 -0.19 0.00 -0.36 0.00 0.00 55.97 55.49 2eec s LYS 107 Cb -0.08 -1.60 -0.06 0.00 -1.51 0.00 0.00 37.83 34.58 2eec s LYS 107 CO 0.24 -0.33 0.54 0.08 -0.36 0.00 0.00 175.35 175.52 2eec s VAL 108 N 1.75 4.90 0.02 4.02 1.01 0.19 -1.70 120.40 130.59 2eec s VAL 108 Ca 0.04 1.13 -0.01 0.00 0.00 0.00 0.00 61.98 63.14 2eec s VAL 108 Cb -0.13 -3.87 -0.02 0.00 0.00 0.00 0.00 36.38 32.36 2eec s VAL 108 CO -0.08 0.48 -0.01 0.42 0.00 0.00 0.00 175.10 175.92 2eec s THR 109 N -0.56 0.11 0.00 3.92 -4.23 -1.10 -1.51 115.64 112.27 2eec s THR 109 Ca 0.28 -0.91 0.00 0.00 -1.18 0.00 0.00 61.69 59.88 2eec s THR 109 Cb -0.18 -0.32 0.00 0.00 1.34 0.00 0.00 72.50 73.34 2eec s THR 109 CO 0.16 -0.50 0.00 0.61 -0.54 0.00 0.00 174.62 174.35 2eec n GLY 110 N 1.54 3.84 3.57 3.99 0.00 -1.26 -4.39 105.19 112.47 2eec n GLY 110 Ca -0.24 -1.67 -0.42 0.00 0.00 0.00 0.00 46.02 43.70 2eec n GLY 110 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2eec n GLN 111 N -1.43 1.14 -2.08 1.61 0.00 -1.26 -4.61 117.38 110.75 2eec n GLN 111 Ca 0.00 0.41 -0.40 0.00 0.00 0.00 0.00 57.00 57.01 2eec n GLN 111 Cb 0.00 -1.89 -0.01 0.00 0.00 0.00 0.00 30.24 28.33 2eec n GLN 111 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.06 176.08 2eec s ARG 112 N -1.88 4.17 -0.46 2.61 1.70 -1.26 -4.86 118.95 118.97 2eec s ARG 112 Ca 0.63 2.20 -0.15 0.00 -0.47 0.00 0.00 55.73 57.95 2eec s ARG 112 Cb -0.58 -2.93 0.07 0.00 -0.57 0.00 0.00 34.95 30.94 2eec s ARG 112 CO 0.57 -0.34 0.37 -0.51 -1.08 0.00 0.00 175.30 174.32 2eec s LEU 113 N -2.09 5.53 0.62 -1.89 1.43 -1.13 -5.07 118.68 116.08 2eec s LEU 113 Ca 0.53 -1.31 -0.09 0.00 -1.03 0.00 0.00 54.13 52.22 2eec s LEU 113 Cb -0.39 -2.16 -0.00 0.00 0.03 0.00 0.00 46.19 43.66 2eec s LEU 113 CO 0.51 -0.62 0.98 0.68 0.23 0.00 0.00 176.35 178.14 2eec s VAL 114 N 1.62 3.97 0.32 -1.59 -7.23 -1.26 -4.82 120.40 111.41 2eec s VAL 114 Ca 0.04 0.38 -0.22 0.00 -1.81 0.00 0.00 61.98 60.36 2eec s VAL 114 Cb -0.24 -3.60 -0.15 0.00 0.56 0.00 0.00 36.38 32.95 2eec s VAL 114 CO 0.06 -0.71 0.21 -1.20 -0.31 0.00 0.00 175.10 173.15 2eec n SER 115 N -2.73 -2.24 -0.01 4.85 7.64 -1.26 -4.89 113.62 114.97 2eec n SER 115 Ca 0.05 0.87 -0.13 0.00 1.01 0.00 0.00 58.87 60.67 2eec n SER 115 Cb 0.56 -0.86 -0.10 0.00 -1.01 0.00 0.00 64.21 62.80 2eec n SER 115 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 2eec h PRO 116 N 0.51 -0.00 0.00 1.43 0.13 -2.06 -3.49 132.00 128.52 2eec h PRO 116 Ca -0.32 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 2eec h PRO 116 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 2eec h PRO 116 CO 0.48 0.48 0.00 0.41 -0.23 0.00 0.00 178.00 179.14 2eec n GLY 117 N 0.22 0.41 2.60 1.56 0.00 -1.26 -4.92 105.19 103.80 2eec n GLY 117 Ca -0.08 -0.73 -0.28 0.00 0.00 0.00 0.00 46.02 44.92 2eec n GLY 117 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2eec n SER 118 N 0.00 -0.01 -4.56 1.61 7.64 -1.26 -4.70 113.62 112.34 2eec n SER 118 Ca 0.00 0.04 -0.38 0.00 1.01 0.00 0.00 58.87 59.54 2eec n SER 118 Cb 0.00 -0.63 -0.03 0.00 -1.01 0.00 0.00 64.21 62.54 2eec n SER 118 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2eec s ALA 119 N 5.53 1.95 0.00 -0.43 0.00 -1.26 -4.94 121.76 122.62 2eec s ALA 119 Ca 1.01 -0.20 0.08 0.00 0.00 0.00 0.00 51.96 52.85 2eec s ALA 119 Cb -0.88 -4.30 -0.02 0.00 0.00 0.00 0.00 23.12 17.91 2eec s ALA 119 CO 0.37 -4.07 -0.24 1.21 0.00 0.00 0.00 175.76 173.04 2eec s ASN 120 N 10.10 2.78 -0.03 0.00 2.47 -1.26 -5.13 114.94 123.86 2eec s ASN 120 Ca 0.85 -0.47 -0.01 0.00 0.42 0.00 0.00 52.86 53.65 2eec s ASN 120 Cb -0.16 -0.29 0.03 0.00 -1.45 0.00 0.00 41.25 39.38 2eec s ASN 120 CO 0.25 0.26 0.06 -1.61 -3.72 0.00 0.00 177.10 172.34 2eec s GLU 121 N -0.79 -0.00 0.61 0.43 2.02 -1.26 -5.14 118.70 114.57 2eec s GLU 121 Ca 0.09 0.23 -0.18 0.00 0.02 0.00 0.00 54.97 55.14 2eec s GLU 121 Cb -0.09 -0.23 -0.11 0.00 0.10 0.00 0.00 34.13 33.81 2eec s GLU 121 CO 0.00 -0.17 0.18 -2.37 0.02 0.00 0.00 175.26 172.93 2eec n THR 122 N 4.17 1.15 -3.95 3.63 5.66 -1.26 -5.00 114.28 118.67 2eec n THR 122 Ca -0.27 -0.48 -0.09 0.00 -3.05 0.00 0.00 64.05 60.16 2eec n THR 122 Cb 0.51 -0.39 -0.04 0.00 -1.55 0.00 0.00 70.33 68.85 2eec n THR 122 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 2eec s SER 123 N -1.16 -0.14 0.41 1.09 0.15 -1.26 -5.18 113.70 107.61 2eec s SER 123 Ca 0.61 -0.83 0.07 0.00 0.70 0.00 0.00 55.95 56.51 2eec s SER 123 Cb -0.42 0.61 -0.04 0.00 -1.71 0.00 0.00 66.02 64.46 2eec s SER 123 CO 0.62 -1.18 0.24 -0.94 1.20 0.00 0.00 173.24 173.18 2eec s SER 124 N -2.99 4.63 0.00 5.45 1.04 -1.26 -5.36 113.70 115.21 2eec s SER 124 Ca 0.19 -0.96 0.00 0.00 0.48 0.00 0.00 55.95 55.66 2eec s SER 124 Cb -0.02 -0.52 0.00 0.00 0.10 0.00 0.00 66.02 65.58 2eec s SER 124 CO 0.08 -0.57 0.11 0.00 0.98 0.00 0.00 173.24 173.84