#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ed9 s SER 2 N 0.00 4.35 -0.30 1.61 0.15 -1.26 -5.11 113.70 113.13 2ed9 s SER 2 Ca 0.00 -1.10 -0.11 0.00 0.70 0.00 0.00 55.95 55.44 2ed9 s SER 2 Cb 0.00 -0.48 -0.03 0.00 -1.71 0.00 0.00 66.02 63.80 2ed9 s SER 2 CO 0.00 -0.50 0.18 -0.94 1.20 0.00 0.00 173.24 173.18 2ed9 s SER 3 N -3.87 5.82 0.00 5.45 1.04 -1.26 -4.98 113.70 115.90 2ed9 s SER 3 Ca 0.40 -0.30 0.00 0.00 0.48 0.00 0.00 55.95 56.53 2ed9 s SER 3 Cb 0.04 -2.07 0.00 0.00 0.10 0.00 0.00 66.02 64.09 2ed9 s SER 3 CO 0.22 -0.15 0.00 0.61 0.98 0.00 0.00 173.24 174.90 2ed9 n GLY 4 N 5.04 3.81 3.34 7.32 0.00 -1.26 -5.19 105.19 118.25 2ed9 n GLY 4 Ca -0.14 -0.42 -0.10 0.00 0.00 0.00 0.00 46.02 45.37 2ed9 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ed9 s SER 5 N 0.00 0.06 0.02 1.61 1.04 -1.26 -5.08 113.70 110.08 2ed9 s SER 5 Ca 0.00 -0.98 0.00 0.00 0.48 0.00 0.00 55.95 55.45 2ed9 s SER 5 Cb 0.00 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.56 2ed9 s SER 5 CO 0.00 -0.91 0.00 -0.24 0.98 0.00 0.00 173.24 173.07 2ed9 n SER 6 N -0.23 0.02 -0.25 7.02 2.88 -1.26 -5.16 113.62 116.63 2ed9 n SER 6 Ca -0.05 0.03 0.03 0.00 -1.33 0.00 0.00 58.87 57.55 2ed9 n SER 6 Cb 0.63 0.01 -0.01 0.00 -0.75 0.00 0.00 64.21 64.09 2ed9 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ed9 n GLY 7 N 2.07 -1.54 3.53 0.46 0.00 -1.26 -5.05 105.19 103.40 2ed9 n GLY 7 Ca 0.00 -1.46 -0.13 0.00 0.00 0.00 0.00 46.02 44.43 2ed9 n GLY 7 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2ed9 s ASN 8 N -3.48 -0.50 -0.25 1.61 0.01 -1.26 -5.18 114.94 105.89 2ed9 s ASN 8 Ca 0.00 0.43 -0.26 0.00 -0.71 0.00 0.00 52.86 52.31 2ed9 s ASN 8 Cb 0.00 0.43 0.14 0.00 0.41 0.00 0.00 41.25 42.23 2ed9 s ASN 8 CO 0.00 -0.54 1.09 -0.60 -1.51 0.00 0.00 177.10 175.54 2ed9 s ARG 9 N -1.67 0.45 0.36 -0.60 3.52 -1.26 -5.19 118.95 114.56 2ed9 s ARG 9 Ca -0.04 0.39 -0.07 0.00 -0.13 0.00 0.00 55.73 55.88 2ed9 s ARG 9 Cb -0.00 0.22 0.02 0.00 -1.56 0.00 0.00 34.95 33.62 2ed9 s ARG 9 CO 0.02 -0.08 0.59 0.71 -0.81 0.00 0.00 175.30 175.73 2ed9 s TYR 10 N -0.19 0.74 -0.49 5.12 2.02 -1.26 -5.14 117.35 118.17 2ed9 s TYR 10 Ca 0.03 -1.13 0.07 0.00 -0.37 0.00 0.00 57.07 55.66 2ed9 s TYR 10 Cb -0.04 0.24 0.18 0.00 -0.40 0.00 0.00 41.96 41.95 2ed9 s TYR 10 CO -0.06 -1.30 0.66 0.20 -1.57 0.00 0.00 175.55 173.48 2ed9 s GLY 11 N -3.18 -0.96 1.07 0.71 0.00 -1.26 -5.16 107.32 98.54 2ed9 s GLY 11 Ca 0.25 -0.55 -0.15 0.00 0.00 0.00 0.00 44.72 44.28 2ed9 s GLY 11 CO 0.17 3.47 1.10 2.56 0.00 0.00 0.00 173.10 180.40 2ed9 s PRO 12 N 0.97 -0.18 0.03 2.90 0.04 -1.26 -5.09 135.00 132.40 2ed9 s PRO 12 Ca 0.28 0.31 -0.04 0.00 0.04 0.00 0.00 61.00 61.59 2ed9 s PRO 12 Cb -0.01 -1.68 -0.01 0.00 0.04 0.00 0.00 34.50 32.83 2ed9 s PRO 12 CO -0.07 -3.10 0.05 0.20 0.04 0.00 0.00 177.00 174.12 2ed9 s GLY 13 N -3.59 0.20 0.06 0.56 0.00 -1.26 -5.07 107.32 98.22 2ed9 s GLY 13 Ca 0.67 -0.55 -0.37 0.00 0.00 0.00 0.00 44.72 44.48 2ed9 s GLY 13 CO 0.57 -0.66 1.58 -2.08 0.00 0.00 0.00 173.10 172.52 2ed9 h VAL 14 N 4.07 0.08 -4.21 1.40 2.07 -2.08 -3.44 116.25 114.13 2ed9 h VAL 14 Ca -0.32 0.00 -0.50 0.00 0.82 0.00 0.00 66.70 66.70 2ed9 h VAL 14 Cb 1.19 0.08 -0.28 0.00 -1.52 0.00 0.00 31.29 30.76 2ed9 h VAL 14 CO 0.47 0.00 -0.82 -0.44 0.02 0.00 0.00 177.57 176.80 2ed9 s SER 15 N -4.09 1.83 -0.10 0.57 0.01 -1.26 -5.04 113.70 105.62 2ed9 s SER 15 Ca -0.19 -0.32 -0.01 0.00 1.31 0.00 0.00 55.95 56.74 2ed9 s SER 15 Cb 0.02 -0.19 -0.06 0.00 0.21 0.00 0.00 66.02 66.01 2ed9 s SER 15 CO 0.60 0.16 -0.10 1.07 0.41 0.00 0.00 173.24 175.39 2ed9 n THR 16 N 2.53 0.56 -3.26 1.44 5.66 -1.26 -5.05 114.28 114.89 2ed9 n THR 16 Ca -0.15 -0.20 0.03 0.00 -3.05 0.00 0.00 64.05 60.68 2ed9 n THR 16 Cb 0.55 -1.03 -0.03 0.00 -1.55 0.00 0.00 70.33 68.26 2ed9 n THR 16 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2ed9 s ASP 17 N -5.17 -0.34 -0.08 1.09 1.01 -1.26 -5.15 116.67 106.76 2ed9 s ASP 17 Ca -0.13 0.40 -0.03 0.00 0.71 0.00 0.00 52.55 53.50 2ed9 s ASP 17 Cb 0.04 1.36 0.04 0.00 1.01 0.00 0.00 42.92 45.38 2ed9 s ASP 17 CO 0.21 -0.07 0.10 -0.62 0.21 0.00 0.00 175.17 175.00 2ed9 s ASP 18 N 2.42 1.30 0.06 0.27 2.15 -1.26 -5.15 116.67 116.46 2ed9 s ASP 18 Ca -0.01 -0.01 -0.00 0.00 0.43 0.00 0.00 52.55 52.95 2ed9 s ASP 18 Cb -0.05 -0.04 -0.04 0.00 -0.30 0.00 0.00 42.92 42.49 2ed9 s ASP 18 CO -0.15 -0.27 -0.04 0.27 -0.17 0.00 0.00 175.17 174.81 2ed9 s ILE 19 N 2.20 0.34 0.34 4.11 -4.36 -1.26 -5.18 121.20 117.39 2ed9 s ILE 19 Ca 0.04 -1.79 0.04 0.00 -0.26 0.00 0.00 60.65 58.68 2ed9 s ILE 19 Cb -0.13 -1.49 -0.04 0.00 1.25 0.00 0.00 42.46 42.05 2ed9 s ILE 19 CO -0.05 -0.94 0.15 0.42 0.24 0.00 0.00 174.94 174.76 2ed9 s THR 20 N -3.69 0.48 -0.13 8.37 -4.23 -1.26 -5.17 115.64 110.00 2ed9 s THR 20 Ca 0.07 -2.00 -0.09 0.00 -1.18 0.00 0.00 61.69 58.49 2ed9 s THR 20 Cb 0.06 -2.49 0.05 0.00 1.34 0.00 0.00 72.50 71.45 2ed9 s THR 20 CO -0.08 0.00 0.33 0.54 -0.54 0.00 0.00 174.62 174.87 2ed9 s VAL 21 N -3.45 -0.02 -0.82 2.29 0.11 -1.26 -5.07 120.40 112.18 2ed9 s VAL 21 Ca 0.33 0.08 0.01 0.00 -2.93 0.00 0.00 61.98 59.46 2ed9 s VAL 21 Cb 0.05 -0.49 0.34 0.00 -1.53 0.00 0.00 36.38 34.74 2ed9 s VAL 21 CO 0.17 0.03 1.53 0.52 -3.33 0.00 0.00 175.10 174.02 2ed9 n VAL 22 N 3.78 4.56 -3.98 2.04 0.31 -1.26 -5.02 118.33 118.76 2ed9 n VAL 22 Ca -0.20 -5.55 -0.33 0.00 -0.01 0.00 0.00 64.34 58.24 2ed9 n VAL 22 Cb 0.55 -1.44 -0.06 0.00 -0.91 0.00 0.00 33.84 31.99 2ed9 n VAL 22 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2ed9 s THR 23 N -4.58 5.15 0.67 2.52 2.01 -1.26 -5.08 115.64 115.06 2ed9 s THR 23 Ca 0.45 -0.24 -0.17 0.00 0.31 0.00 0.00 61.69 62.03 2ed9 s THR 23 Cb 0.27 -3.38 -0.02 0.00 0.01 0.00 0.00 72.50 69.38 2ed9 s THR 23 CO -0.18 0.35 1.01 0.18 -0.69 0.00 0.00 174.62 175.29 2ed9 n LEU 24 N 1.10 3.97 -3.69 4.42 4.32 -1.26 -5.02 117.00 120.84 2ed9 n LEU 24 Ca -0.12 0.74 -0.04 0.00 -0.02 0.00 0.00 56.01 56.57 2ed9 n LEU 24 Cb 0.53 -1.42 -0.01 0.00 -1.62 0.00 0.00 43.42 40.89 2ed9 n LEU 24 CO 0.41 -1.83 0.73 -0.94 -1.22 0.00 0.00 177.39 174.54 2ed9 s SER 25 N -1.45 -0.21 -0.28 -1.43 1.04 -1.26 -5.03 113.70 105.08 2ed9 s SER 25 Ca 0.76 -0.30 0.12 0.00 0.48 0.00 0.00 55.95 57.01 2ed9 s SER 25 Cb -0.38 0.45 0.70 0.00 0.10 0.00 0.00 66.02 66.89 2ed9 s SER 25 CO 0.47 -0.81 1.69 0.47 0.98 0.00 0.00 173.24 176.05 2ed9 n ASP 26 N -0.42 4.62 -4.77 7.02 8.00 -1.26 -5.00 116.55 124.73 2ed9 n ASP 26 Ca -0.07 -3.18 -0.36 0.00 0.71 0.00 0.00 54.79 51.89 2ed9 n ASP 26 Cb 0.61 -0.69 -0.01 0.00 -0.02 0.00 0.00 41.12 41.02 2ed9 n ASP 26 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2ed9 s VAL 27 N -2.95 3.18 0.46 2.53 -7.23 -1.26 -4.64 120.40 110.49 2ed9 s VAL 27 Ca 0.52 0.83 -0.23 0.00 -1.81 0.00 0.00 61.98 61.29 2ed9 s VAL 27 Cb 0.41 -3.40 -0.07 0.00 0.56 0.00 0.00 36.38 33.89 2ed9 s VAL 27 CO 0.12 -0.06 1.16 -2.16 -0.31 0.00 0.00 175.10 173.85 2ed9 s PRO 28 N -2.88 3.75 -0.05 4.82 0.04 -1.26 -4.92 135.00 134.50 2ed9 s PRO 28 Ca 0.66 1.77 0.06 0.00 0.04 0.00 0.00 61.00 63.53 2ed9 s PRO 28 Cb -0.26 -2.40 -0.09 0.00 0.04 0.00 0.00 34.50 31.79 2ed9 s PRO 28 CO 0.31 -0.56 0.06 0.43 0.04 0.00 0.00 177.00 177.29 2ed9 n SER 29 N -0.51 3.33 -4.69 6.66 7.64 -1.26 -3.52 113.62 121.28 2ed9 n SER 29 Ca 0.07 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.54 2ed9 n SER 29 Cb 0.48 0.86 -0.03 0.00 -1.01 0.00 0.00 64.21 64.51 2ed9 n SER 29 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ed9 s ALA 30 N -2.26 3.41 0.83 -0.43 0.00 -1.26 -4.54 121.76 117.50 2ed9 s ALA 30 Ca -0.03 0.25 -0.11 0.00 0.00 0.00 0.00 51.96 52.06 2ed9 s ALA 30 Cb 0.03 -3.29 0.09 0.00 0.00 0.00 0.00 23.12 19.94 2ed9 s ALA 30 CO 0.29 -0.52 1.09 -1.25 0.00 0.00 0.00 175.76 175.37 2ed9 s PRO 31 N 1.80 1.81 1.05 0.00 0.04 -1.26 -4.74 135.00 133.70 2ed9 s PRO 31 Ca 0.44 1.01 -0.14 0.00 0.04 0.00 0.00 61.00 62.35 2ed9 s PRO 31 Cb -0.18 -1.86 0.22 0.00 0.04 0.00 0.00 34.50 32.72 2ed9 s PRO 31 CO 0.17 -1.91 1.10 -1.25 0.04 0.00 0.00 177.00 175.15 2ed9 s PRO 32 N -4.92 -0.01 0.38 0.56 0.04 -1.26 -4.48 135.00 125.31 2ed9 s PRO 32 Ca 0.62 0.36 0.08 0.00 0.04 0.00 0.00 61.00 62.10 2ed9 s PRO 32 Cb -0.17 -1.70 -0.05 0.00 0.04 0.00 0.00 34.50 32.61 2ed9 s PRO 32 CO 0.56 -3.00 0.12 -0.65 0.04 0.00 0.00 177.00 174.08 2ed9 s GLN 33 N -5.06 2.18 -1.20 4.56 -0.21 0.86 -4.74 119.66 116.05 2ed9 s GLN 33 Ca 0.67 -1.81 -0.03 0.00 0.02 0.00 0.00 55.36 54.21 2ed9 s GLN 33 Cb -0.17 -1.96 0.00 0.00 1.00 0.00 0.00 33.01 31.88 2ed9 s GLN 33 CO 0.57 -0.02 1.02 -1.71 -2.12 0.00 0.00 175.29 173.03 2ed9 n ASN 34 N -1.13 -3.41 -4.38 5.90 5.15 -1.26 0.11 115.26 116.23 2ed9 n ASN 34 Ca -0.02 -0.57 -0.45 0.00 -0.60 0.00 0.00 54.58 52.94 2ed9 n ASN 34 Cb 0.64 -4.92 -0.04 0.00 -0.53 0.00 0.00 39.78 34.93 2ed9 n ASN 34 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2ed9 s VAL 35 N -3.33 4.83 0.11 3.44 1.01 -1.26 -3.83 120.40 121.37 2ed9 s VAL 35 Ca 0.19 -1.08 -0.17 0.00 0.00 0.00 0.00 61.98 60.92 2ed9 s VAL 35 Cb -0.08 -4.52 0.04 0.00 0.00 0.00 0.00 36.38 31.81 2ed9 s VAL 35 CO 0.70 -1.17 0.41 -0.55 0.00 0.00 0.00 175.10 174.49 2ed9 s SER 36 N 3.56 -0.26 0.17 3.32 0.15 -1.26 -5.05 113.70 114.33 2ed9 s SER 36 Ca 0.14 -0.23 0.04 0.00 0.70 0.00 0.00 55.95 56.60 2ed9 s SER 36 Cb -0.22 0.47 -0.04 0.00 -1.71 0.00 0.00 66.02 64.52 2ed9 s SER 36 CO 0.05 -0.82 0.19 -0.76 1.20 0.00 0.00 173.24 173.10 2ed9 s LEU 37 N -2.63 3.98 -0.18 3.45 1.43 -1.26 -4.14 118.68 119.33 2ed9 s LEU 37 Ca 0.01 -0.05 -0.04 0.00 -1.03 0.00 0.00 54.13 53.02 2ed9 s LEU 37 Cb 0.01 -2.56 0.06 0.00 0.03 0.00 0.00 46.19 43.73 2ed9 s LEU 37 CO -0.10 0.05 0.08 -0.70 0.23 0.00 0.00 176.35 175.91 2ed9 s GLU 38 N -3.24 0.22 -0.74 1.70 2.12 -1.05 -5.06 118.70 112.65 2ed9 s GLU 38 Ca 0.32 -0.19 -0.26 0.00 0.36 0.00 0.00 54.97 55.21 2ed9 s GLU 38 Cb -0.10 -1.89 -0.03 0.00 0.26 0.00 0.00 34.13 32.36 2ed9 s GLU 38 CO 0.25 -0.67 1.91 0.08 -0.54 0.00 0.00 175.26 176.29 2ed9 s VAL 39 N 2.06 3.39 -0.08 3.70 1.01 -1.26 -2.36 120.40 126.85 2ed9 s VAL 39 Ca 0.01 -0.06 -0.24 0.00 0.00 0.00 0.00 61.98 61.70 2ed9 s VAL 39 Cb -0.16 -3.94 -0.19 0.00 0.00 0.00 0.00 36.38 32.08 2ed9 s VAL 39 CO -0.09 -0.90 0.85 0.58 0.00 0.00 0.00 175.10 175.54 2ed9 h VAL 40 N 7.08 1.27 -3.96 2.92 2.07 -1.92 -3.49 116.25 120.22 2ed9 h VAL 40 Ca -0.10 -1.59 -0.22 0.00 0.82 0.00 0.00 66.70 65.61 2ed9 h VAL 40 Cb 1.09 2.24 -0.07 0.00 -1.52 0.00 0.00 31.29 33.03 2ed9 h VAL 40 CO 1.21 0.37 -0.15 0.20 0.02 0.00 0.00 177.57 179.22 2ed9 s ASN 41 N -5.82 0.67 0.24 0.57 0.01 -0.74 -4.99 114.94 104.89 2ed9 s ASN 41 Ca -0.15 -1.37 -0.06 0.00 -0.71 0.00 0.00 52.86 50.57 2ed9 s ASN 41 Cb -0.01 0.66 0.23 0.00 0.41 0.00 0.00 41.25 42.55 2ed9 s ASN 41 CO 0.57 -1.30 1.84 0.77 -1.51 0.00 0.00 177.10 177.46 2ed9 h SER 42 N 2.13 1.08 -0.49 -1.22 4.64 -1.91 -2.94 113.55 114.85 2ed9 h SER 42 Ca -0.29 -0.12 -0.33 0.00 -0.47 0.00 0.00 61.79 60.58 2ed9 h SER 42 Cb 1.24 -0.28 -0.23 0.00 -0.31 0.00 0.00 62.40 62.83 2ed9 h SER 42 CO 0.39 0.90 -0.40 -2.11 -0.87 0.00 0.00 176.83 174.74 2ed9 n ARG 43 N -4.31 2.58 -3.67 4.77 1.85 -1.26 -4.30 116.66 112.32 2ed9 n ARG 43 Ca 0.08 -3.63 -0.14 0.00 -1.00 0.00 0.00 57.85 53.16 2ed9 n ARG 43 Cb 0.13 -2.00 -0.08 0.00 -1.05 0.00 0.00 32.46 29.46 2ed9 n ARG 43 CO 0.00 0.00 0.00 -1.12 -0.01 0.00 0.00 177.63 176.50 2ed9 s SER 44 N -3.08 -0.53 -0.07 2.89 0.01 -1.11 -0.22 113.70 111.59 2ed9 s SER 44 Ca 0.47 0.87 -0.09 0.00 1.31 0.00 0.00 55.95 58.52 2ed9 s SER 44 Cb 0.41 0.88 0.02 0.00 0.21 0.00 0.00 66.02 67.54 2ed9 s SER 44 CO -0.00 -0.31 0.23 -0.63 0.41 0.00 0.00 173.24 172.94 2ed9 s ILE 45 N -0.24 0.01 -0.13 1.44 1.01 0.41 -1.79 121.20 121.91 2ed9 s ILE 45 Ca -0.04 -0.12 -0.01 0.00 0.00 0.00 0.00 60.65 60.48 2ed9 s ILE 45 Cb -0.03 -0.37 -0.02 0.00 0.01 0.00 0.00 42.46 42.05 2ed9 s ILE 45 CO 0.03 -0.07 -0.09 -0.75 0.00 0.00 0.00 174.94 174.06 2ed9 s LYS 46 N -0.17 3.45 -0.09 2.79 2.36 -1.00 -0.64 119.74 126.45 2ed9 s LYS 46 Ca -0.03 -0.62 0.02 0.00 -2.55 0.00 0.00 55.97 52.80 2ed9 s LYS 46 Cb -0.03 -2.73 0.01 0.00 -1.05 0.00 0.00 37.83 34.03 2ed9 s LYS 46 CO 0.01 0.25 -0.15 0.08 1.55 0.00 0.00 175.35 177.09 2ed9 s VAL 47 N 0.28 1.44 0.27 4.02 1.01 -1.13 -2.54 120.40 123.75 2ed9 s VAL 47 Ca -0.07 -0.64 0.05 0.00 0.00 0.00 0.00 61.98 61.32 2ed9 s VAL 47 Cb -0.15 -1.30 -0.06 0.00 0.00 0.00 0.00 36.38 34.87 2ed9 s VAL 47 CO 0.04 0.43 -0.02 -0.55 0.00 0.00 0.00 175.10 175.00 2ed9 s SER 48 N 0.74 2.43 0.33 3.32 0.15 -1.26 -1.80 113.70 117.60 2ed9 s SER 48 Ca -0.12 -1.23 -0.18 0.00 0.70 0.00 0.00 55.95 55.11 2ed9 s SER 48 Cb -0.16 -0.10 0.03 0.00 -1.71 0.00 0.00 66.02 64.08 2ed9 s SER 48 CO 0.03 -0.44 0.74 -1.66 1.20 0.00 0.00 173.24 173.11 2ed9 s TRP 49 N -3.18 -0.03 0.04 3.44 -2.14 -1.15 -4.24 118.94 111.69 2ed9 s TRP 49 Ca 0.30 -0.52 -0.05 0.00 2.66 0.00 0.00 56.10 58.49 2ed9 s TRP 49 Cb 0.05 0.75 -0.01 0.00 -3.10 0.00 0.00 33.47 31.16 2ed9 s TRP 49 CO 0.11 -1.38 0.09 -0.51 -2.66 0.00 0.00 176.95 172.61 2ed9 s LEU 50 N -2.99 1.83 0.67 -4.66 1.43 0.30 -4.93 118.68 110.34 2ed9 s LEU 50 Ca 0.13 -0.60 -0.14 0.00 -1.03 0.00 0.00 54.13 52.49 2ed9 s LEU 50 Cb -0.05 0.61 0.01 0.00 0.03 0.00 0.00 46.19 46.78 2ed9 s LEU 50 CO 0.09 -0.54 1.11 -2.16 0.23 0.00 0.00 176.35 175.08 2ed9 s PRO 51 N -2.89 2.73 0.99 1.29 0.04 -1.26 -0.10 135.00 135.80 2ed9 s PRO 51 Ca -0.03 1.37 -0.12 0.00 0.04 0.00 0.00 61.00 62.26 2ed9 s PRO 51 Cb 0.01 -1.94 0.18 0.00 0.04 0.00 0.00 34.50 32.78 2ed9 s PRO 51 CO -0.06 -1.30 1.09 -1.25 0.04 0.00 0.00 177.00 175.52 2ed9 s PRO 52 N -4.19 0.53 0.53 0.56 0.04 -1.26 -4.18 135.00 127.03 2ed9 s PRO 52 Ca 0.66 0.56 -0.20 0.00 0.04 0.00 0.00 61.00 62.06 2ed9 s PRO 52 Cb -0.20 -1.75 -0.06 0.00 0.04 0.00 0.00 34.50 32.53 2ed9 s PRO 52 CO 0.43 -2.68 1.13 -1.25 0.04 0.00 0.00 177.00 174.68 2ed9 s PRO 53 N -4.96 3.41 1.11 0.56 0.04 -1.26 -4.88 135.00 129.01 2ed9 s PRO 53 Ca 0.65 1.63 -0.19 0.00 0.04 0.00 0.00 61.00 63.13 2ed9 s PRO 53 Cb -0.18 -2.05 0.08 0.00 0.04 0.00 0.00 34.50 32.38 2ed9 s PRO 53 CO 0.58 -0.81 -0.11 -1.13 0.04 0.00 0.00 177.00 175.56 2ed9 n SER 54 N -1.20 -2.43 0.00 6.66 3.41 -1.26 -3.11 113.62 115.70 2ed9 n SER 54 Ca 0.11 -0.10 0.00 0.00 -0.26 0.00 0.00 58.87 58.62 2ed9 n SER 54 Cb 0.51 -0.93 0.00 0.00 -0.26 0.00 0.00 64.21 63.53 2ed9 n SER 54 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ed9 n GLY 55 N 2.13 1.63 0.18 5.00 0.00 -1.26 -4.55 105.19 108.32 2ed9 n GLY 55 Ca 0.01 -0.11 -0.21 0.00 0.00 0.00 0.00 46.02 45.71 2ed9 n GLY 55 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2ed9 h THR 56 N 0.00 1.30 -0.02 2.61 1.35 -1.94 -3.44 112.91 112.77 2ed9 h THR 56 Ca 0.00 -2.31 -0.56 0.00 -0.55 0.00 0.00 66.41 62.99 2ed9 h THR 56 Cb 0.00 2.54 -0.08 0.00 -1.73 0.00 0.00 68.15 68.88 2ed9 h THR 56 CO 0.00 0.71 1.67 0.00 -0.25 0.00 0.00 175.52 177.64 2ed9 n GLN 57 N -3.88 0.02 -3.02 4.72 6.02 -1.25 -4.80 117.38 115.19 2ed9 n GLN 57 Ca -0.12 0.00 -0.39 0.00 -0.01 0.00 0.00 57.00 56.48 2ed9 n GLN 57 Cb 0.90 -1.53 -0.01 0.00 1.02 0.00 0.00 30.24 30.63 2ed9 n GLN 57 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 2ed9 n ASN 58 N 9.94 6.03 0.00 1.08 5.15 -1.26 -4.98 115.26 131.22 2ed9 n ASN 58 Ca 0.63 -3.48 0.00 0.00 -0.60 0.00 0.00 54.58 51.14 2ed9 n ASN 58 Cb 0.02 -1.12 0.00 0.00 -0.53 0.00 0.00 39.78 38.15 2ed9 n ASN 58 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2ed9 n GLY 59 N 0.95 1.56 3.66 8.20 0.00 -1.26 -4.60 105.19 113.70 2ed9 n GLY 59 Ca 0.30 -2.22 -0.43 0.00 0.00 0.00 0.00 46.02 43.68 2ed9 n GLY 59 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2ed9 s PHE 60 N -1.38 3.32 -0.91 1.61 5.36 -1.26 -4.88 117.98 119.84 2ed9 s PHE 60 Ca 0.00 1.41 -0.25 0.00 -0.96 0.00 0.00 56.93 57.13 2ed9 s PHE 60 Cb 0.00 -3.30 -0.12 0.00 -0.34 0.00 0.00 43.02 39.25 2ed9 s PHE 60 CO 0.00 -0.51 2.19 0.42 -1.46 0.00 0.00 175.22 175.86 2ed9 s ILE 61 N 3.23 3.18 0.12 3.12 1.01 -1.26 -2.13 121.20 128.47 2ed9 s ILE 61 Ca 0.43 -0.20 -0.30 0.00 0.00 0.00 0.00 60.65 60.59 2ed9 s ILE 61 Cb -0.15 -3.59 -0.08 0.00 0.01 0.00 0.00 42.46 38.65 2ed9 s ILE 61 CO 0.07 -0.37 1.59 0.71 0.00 0.00 0.00 174.94 176.94 2ed9 h THR 62 N 7.28 0.17 -1.14 2.92 1.35 -1.49 -3.48 112.91 118.52 2ed9 h THR 62 Ca 0.05 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.91 2ed9 h THR 62 Cb 1.00 0.17 0.00 0.00 -1.73 0.00 0.00 68.15 67.59 2ed9 h THR 62 CO 1.08 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.96 2ed9 n GLY 63 N -1.45 3.20 2.90 5.82 0.00 -1.22 -4.78 105.19 109.67 2ed9 n GLY 63 Ca -0.06 -0.90 -0.22 0.00 0.00 0.00 0.00 46.02 44.85 2ed9 n GLY 63 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2ed9 s TYR 64 N -3.44 0.91 -0.16 1.61 1.51 -1.26 -2.92 117.35 113.61 2ed9 s TYR 64 Ca 0.00 -0.30 -0.29 0.00 -1.01 0.00 0.00 57.07 55.47 2ed9 s TYR 64 Cb 0.00 -0.79 -0.00 0.00 -0.11 0.00 0.00 41.96 41.05 2ed9 s TYR 64 CO 0.00 -0.25 1.04 0.21 -1.11 0.00 0.00 175.55 175.44 2ed9 s LYS 65 N 1.06 4.34 -0.30 -0.62 2.47 -1.01 -3.60 119.74 122.08 2ed9 s LYS 65 Ca -0.09 1.40 0.01 0.00 -1.56 0.00 0.00 55.97 55.74 2ed9 s LYS 65 Cb -0.14 -3.59 0.07 0.00 -1.46 0.00 0.00 37.83 32.70 2ed9 s LYS 65 CO -0.01 -0.47 -0.02 0.42 0.16 0.00 0.00 175.35 175.43 2ed9 s ILE 66 N 2.59 2.53 -0.15 5.43 1.01 0.12 -2.92 121.20 129.81 2ed9 s ILE 66 Ca 0.47 -1.74 -0.02 0.00 0.00 0.00 0.00 60.65 59.36 2ed9 s ILE 66 Cb -0.17 -2.58 -0.02 0.00 0.01 0.00 0.00 42.46 39.71 2ed9 s ILE 66 CO 0.13 -0.22 -0.09 -0.60 0.00 0.00 0.00 174.94 174.15 2ed9 s ARG 67 N 1.11 3.47 -0.06 2.79 3.52 -1.08 -0.68 118.95 128.01 2ed9 s ARG 67 Ca -0.02 -0.63 0.03 0.00 -0.13 0.00 0.00 55.73 54.97 2ed9 s ARG 67 Cb -0.20 -2.76 0.01 0.00 -1.56 0.00 0.00 34.95 30.43 2ed9 s ARG 67 CO -0.04 0.16 -0.13 -3.38 -0.81 0.00 0.00 175.30 171.10 2ed9 s HIS 68 N 0.51 1.50 0.01 5.12 -3.43 -1.22 -1.05 115.29 116.74 2ed9 s HIS 68 Ca -0.07 -0.52 0.02 0.00 -0.80 0.00 0.00 55.06 53.69 2ed9 s HIS 68 Cb -0.15 -1.08 -0.01 0.00 -1.43 0.00 0.00 32.58 29.91 2ed9 s HIS 68 CO 0.04 -0.25 -0.07 -0.98 -2.00 0.00 0.00 174.74 171.48 2ed9 s ARG 69 N 0.50 0.52 0.07 -0.38 1.70 -1.08 -2.97 118.95 117.31 2ed9 s ARG 69 Ca -0.12 -0.33 0.01 0.00 -0.47 0.00 0.00 55.73 54.82 2ed9 s ARG 69 Cb -0.15 -0.46 -0.04 0.00 -0.57 0.00 0.00 34.95 33.73 2ed9 s ARG 69 CO 0.03 0.12 0.17 0.21 -1.08 0.00 0.00 175.30 174.76 2ed9 s LYS 70 N -0.43 3.26 0.14 3.89 2.20 -1.26 -0.74 119.74 126.79 2ed9 s LYS 70 Ca 0.00 -0.53 -0.32 0.00 -0.36 0.00 0.00 55.97 54.75 2ed9 s LYS 70 Cb -0.04 -2.93 -0.10 0.00 -1.51 0.00 0.00 37.83 33.25 2ed9 s LYS 70 CO -0.00 0.59 1.55 1.79 -0.36 0.00 0.00 175.35 178.92 2ed9 h THR 71 N 2.21 0.01 -1.29 3.43 1.35 -1.81 -3.43 112.91 113.38 2ed9 h THR 71 Ca -0.46 0.00 -0.47 0.00 -0.55 0.00 0.00 66.41 64.94 2ed9 h THR 71 Cb 1.16 0.01 0.04 0.00 -1.73 0.00 0.00 68.15 67.63 2ed9 h THR 71 CO 0.72 0.00 -0.09 0.42 -0.25 0.00 0.00 175.52 176.32 2ed9 s THR 72 N -5.64 2.36 -0.85 6.82 -4.23 -1.26 -4.67 115.64 108.15 2ed9 s THR 72 Ca -0.14 -0.90 -0.01 0.00 -1.18 0.00 0.00 61.69 59.46 2ed9 s THR 72 Cb 0.09 -2.45 0.00 0.00 1.34 0.00 0.00 72.50 71.48 2ed9 s THR 72 CO 0.62 0.00 0.71 -1.14 -0.54 0.00 0.00 174.62 174.27 2ed9 n ARG 73 N -2.28 -4.74 -1.25 3.99 3.00 -1.26 -4.80 116.66 109.32 2ed9 n ARG 73 Ca 0.13 0.59 -0.56 0.00 -0.00 0.00 0.00 57.85 58.01 2ed9 n ARG 73 Cb 0.61 -4.86 -0.10 0.00 0.00 0.00 0.00 32.46 28.10 2ed9 n ARG 73 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.63 180.52 2ed9 n ARG 74 N -3.24 0.00 0.00 -0.14 1.85 -1.26 -4.54 116.66 109.33 2ed9 n ARG 74 Ca -0.18 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.67 2ed9 n ARG 74 Cb 0.61 -1.36 0.00 0.00 -1.05 0.00 0.00 32.46 30.66 2ed9 n ARG 74 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2ed9 n GLY 75 N 6.02 0.00 3.39 2.89 0.00 -1.26 -5.16 105.19 111.07 2ed9 n GLY 75 Ca 0.45 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.14 2ed9 n GLY 75 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2ed9 n GLU 76 N 0.00 -0.38 -4.52 1.61 0.00 -1.26 -5.02 120.64 111.08 2ed9 n GLU 76 Ca 0.00 -0.07 -0.23 0.00 0.00 0.00 0.00 57.16 56.86 2ed9 n GLU 76 Cb 0.00 -1.81 -0.16 0.00 0.00 0.00 0.00 31.44 29.47 2ed9 n GLU 76 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.13 178.54 2ed9 s MET 77 N -3.55 1.42 -0.12 3.44 1.75 -1.16 -5.04 119.30 116.05 2ed9 s MET 77 Ca 0.56 -0.37 -0.17 0.00 -1.25 0.00 0.00 55.69 54.46 2ed9 s MET 77 Cb -0.20 -1.23 -0.04 0.00 2.84 0.00 0.00 34.83 36.20 2ed9 s MET 77 CO 0.68 0.06 0.44 -2.00 -0.65 0.00 0.00 175.02 173.55 2ed9 s GLU 78 N 0.51 4.30 -0.02 4.11 2.56 -1.26 -3.39 118.70 125.51 2ed9 s GLU 78 Ca -0.10 0.39 -0.04 0.00 0.00 0.00 0.00 54.97 55.22 2ed9 s GLU 78 Cb -0.13 -3.42 0.00 0.00 2.00 0.00 0.00 34.13 32.58 2ed9 s GLU 78 CO 0.02 0.21 0.09 0.99 -0.56 0.00 0.00 175.26 176.01 2ed9 s THR 79 N 0.47 0.04 -0.00 -1.70 2.01 0.14 -5.02 115.64 111.57 2ed9 s THR 79 Ca 0.24 -0.31 0.02 0.00 0.31 0.00 0.00 61.69 61.95 2ed9 s THR 79 Cb -0.15 -0.23 -0.00 0.00 0.01 0.00 0.00 72.50 72.12 2ed9 s THR 79 CO 0.09 -0.17 -0.06 -1.48 -0.69 0.00 0.00 174.62 172.32 2ed9 s LEU 80 N -0.53 2.01 -0.30 4.42 0.05 -1.26 0.12 118.68 123.19 2ed9 s LEU 80 Ca -0.06 -0.10 -0.00 0.00 0.05 0.00 0.00 54.13 54.01 2ed9 s LEU 80 Cb -0.04 -0.29 0.09 0.00 -2.05 0.00 0.00 46.19 43.90 2ed9 s LEU 80 CO 0.00 0.07 0.08 -0.70 -0.55 0.00 0.00 176.35 175.25 2ed9 s GLU 81 N -0.13 0.85 0.18 1.48 2.56 -1.24 -4.99 118.70 117.41 2ed9 s GLU 81 Ca 0.02 -1.09 -0.06 0.00 0.00 0.00 0.00 54.97 53.84 2ed9 s GLU 81 Cb -0.02 -2.16 0.09 0.00 2.00 0.00 0.00 34.13 34.03 2ed9 s GLU 81 CO -0.00 -0.92 1.53 -1.00 -0.56 0.00 0.00 175.26 174.31 2ed9 h PRO 82 N 8.04 0.74 -0.08 4.30 0.13 -1.87 -3.34 132.00 139.93 2ed9 h PRO 82 Ca -0.13 -0.39 0.01 0.00 -0.87 0.00 0.00 66.00 64.62 2ed9 h PRO 82 Cb 1.03 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.16 2ed9 h PRO 82 CO 0.46 1.01 -0.05 0.09 -0.23 0.00 0.00 178.00 179.29 2ed9 n ASN 83 N -4.04 -0.08 -4.74 1.44 5.03 -1.26 -4.68 115.26 106.93 2ed9 n ASN 83 Ca -0.02 0.95 -0.29 0.00 0.87 0.00 0.00 54.58 56.09 2ed9 n ASN 83 Cb 0.54 -0.43 -0.08 0.00 -1.02 0.00 0.00 39.78 38.79 2ed9 n ASN 83 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.26 175.63 2ed9 s ASN 84 N -3.21 4.19 -0.26 6.41 0.01 -1.25 -5.04 114.94 115.79 2ed9 s ASN 84 Ca -0.01 -1.41 0.13 0.00 -0.71 0.00 0.00 52.86 50.86 2ed9 s ASN 84 Cb 0.01 0.06 0.80 0.00 0.41 0.00 0.00 41.25 42.53 2ed9 s ASN 84 CO 0.05 -0.72 1.76 0.18 -1.51 0.00 0.00 177.10 176.86 2ed9 n LEU 85 N -1.25 5.77 -3.93 0.60 4.77 -1.26 -4.79 117.00 116.91 2ed9 n LEU 85 Ca -0.09 -3.01 -0.10 0.00 -0.03 0.00 0.00 56.01 52.77 2ed9 n LEU 85 Cb 0.66 -0.70 -0.12 0.00 -2.33 0.00 0.00 43.42 40.94 2ed9 n LEU 85 CO 0.43 0.67 -0.34 -1.66 -1.33 0.00 0.00 177.39 175.16 2ed9 s TRP 86 N -2.83 0.14 -0.11 -1.77 1.48 -1.26 -2.91 118.94 111.68 2ed9 s TRP 86 Ca 0.54 -0.29 -0.03 0.00 -1.06 0.00 0.00 56.10 55.26 2ed9 s TRP 86 Cb 0.42 -0.11 0.05 0.00 -1.16 0.00 0.00 33.47 32.67 2ed9 s TRP 86 CO 0.15 -0.13 0.15 -0.47 -4.06 0.00 0.00 176.95 172.58 2ed9 s TYR 87 N -0.92 -0.11 -0.25 1.66 6.14 -0.74 -5.02 117.35 118.10 2ed9 s TYR 87 Ca -0.10 0.39 -0.17 0.00 0.64 0.00 0.00 57.07 57.83 2ed9 s TYR 87 Cb -0.06 -0.36 -0.03 0.00 0.42 0.00 0.00 41.96 41.92 2ed9 s TYR 87 CO -0.00 -0.34 0.45 -1.17 0.64 0.00 0.00 175.55 175.13 2ed9 s LEU 88 N 2.26 4.07 -0.27 6.97 2.96 -1.26 -2.84 118.68 130.57 2ed9 s LEU 88 Ca 0.04 0.46 -0.11 0.00 -0.22 0.00 0.00 54.13 54.30 2ed9 s LEU 88 Cb -0.13 -2.57 -0.05 0.00 0.50 0.00 0.00 46.19 43.94 2ed9 s LEU 88 CO -0.07 -0.22 0.18 -0.36 -1.32 0.00 0.00 176.35 174.56 2ed9 s PHE 89 N 2.05 3.23 0.36 5.38 0.08 0.19 -4.93 117.98 124.33 2ed9 s PHE 89 Ca 0.19 0.11 0.08 0.00 0.12 0.00 0.00 56.93 57.44 2ed9 s PHE 89 Cb -0.16 -2.35 -0.05 0.00 -0.57 0.00 0.00 43.02 39.89 2ed9 s PHE 89 CO 0.09 -0.13 0.05 0.95 -0.10 0.00 0.00 175.22 176.08 2ed9 s THR 90 N 1.63 2.54 -0.07 0.64 -4.23 -1.26 -0.44 115.64 114.45 2ed9 s THR 90 Ca 0.07 -1.91 -0.00 0.00 -1.18 0.00 0.00 61.69 58.67 2ed9 s THR 90 Cb -0.16 -2.86 -0.00 0.00 1.34 0.00 0.00 72.50 70.82 2ed9 s THR 90 CO 0.10 -0.15 0.06 0.61 -0.54 0.00 0.00 174.62 174.70 2ed9 n GLY 91 N -1.02 0.71 3.46 3.99 0.00 0.69 -4.94 105.19 108.08 2ed9 n GLY 91 Ca -0.04 -0.27 -0.31 0.00 0.00 0.00 0.00 46.02 45.41 2ed9 n GLY 91 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ed9 s LEU 92 N -2.97 2.62 -0.47 0.99 1.43 -1.23 -5.03 118.68 114.03 2ed9 s LEU 92 Ca 0.02 -0.41 -0.29 0.00 -1.03 0.00 0.00 54.13 52.43 2ed9 s LEU 92 Cb -0.00 -1.53 0.03 0.00 0.03 0.00 0.00 46.19 44.72 2ed9 s LEU 92 CO 0.05 0.26 1.11 -0.70 0.23 0.00 0.00 176.35 177.30 2ed9 s GLU 93 N -1.39 3.71 0.60 1.70 2.56 -1.26 -4.25 118.70 120.36 2ed9 s GLU 93 Ca 0.14 0.53 -0.18 0.00 0.00 0.00 0.00 54.97 55.47 2ed9 s GLU 93 Cb -0.10 -3.91 -0.13 0.00 2.00 0.00 0.00 34.13 31.99 2ed9 s GLU 93 CO 0.05 -1.36 -0.09 0.36 -0.56 0.00 0.00 175.26 173.66 2ed9 n LYS 94 N 7.75 0.08 -2.96 4.30 2.85 -1.26 -3.47 118.16 125.45 2ed9 n LYS 94 Ca 0.11 0.04 -0.12 0.00 -1.05 0.00 0.00 58.31 57.29 2ed9 n LYS 94 Cb 0.49 -1.15 0.06 0.00 -0.65 0.00 0.00 35.03 33.78 2ed9 n LYS 94 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2ed9 n GLY 95 N 2.49 -0.48 3.14 2.58 0.00 -1.25 -4.98 105.19 106.69 2ed9 n GLY 95 Ca 0.07 0.22 -0.11 0.00 0.00 0.00 0.00 46.02 46.20 2ed9 n GLY 95 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ed9 s SER 96 N -3.62 0.04 -0.37 1.61 0.01 -1.23 -5.02 113.70 105.12 2ed9 s SER 96 Ca 0.21 -0.29 -0.12 0.00 1.31 0.00 0.00 55.95 57.06 2ed9 s SER 96 Cb -0.03 0.24 0.02 0.00 0.21 0.00 0.00 66.02 66.46 2ed9 s SER 96 CO 0.57 -0.46 0.22 -1.58 0.41 0.00 0.00 173.24 172.41 2ed9 s GLN 97 N -1.94 3.01 0.14 12.44 0.74 -1.26 -3.04 119.66 129.75 2ed9 s GLN 97 Ca -0.10 -0.96 0.07 0.00 0.05 0.00 0.00 55.36 54.42 2ed9 s GLN 97 Cb -0.04 -3.77 -0.04 0.00 1.10 0.00 0.00 33.01 30.25 2ed9 s GLN 97 CO -0.01 -0.64 -0.07 0.71 -0.55 0.00 0.00 175.29 174.73 2ed9 s TYR 98 N 1.61 2.75 0.26 1.67 2.02 -1.05 -2.08 117.35 122.53 2ed9 s TYR 98 Ca 0.04 -0.16 0.08 0.00 -0.37 0.00 0.00 57.07 56.66 2ed9 s TYR 98 Cb -0.19 -1.39 -0.05 0.00 -0.40 0.00 0.00 41.96 39.93 2ed9 s TYR 98 CO 0.08 0.47 -0.11 -1.12 -1.57 0.00 0.00 175.55 173.30 2ed9 s SER 99 N -2.54 2.88 0.20 2.29 0.01 0.08 -1.45 113.70 115.18 2ed9 s SER 99 Ca 0.24 -1.11 -0.04 0.00 1.31 0.00 0.00 55.95 56.35 2ed9 s SER 99 Cb -0.10 -0.19 -0.03 0.00 0.21 0.00 0.00 66.02 65.91 2ed9 s SER 99 CO 0.15 -0.22 0.22 -0.36 0.41 0.00 0.00 173.24 173.44 2ed9 s PHE 100 N -2.90 0.89 -0.12 2.43 0.40 -0.83 -2.64 117.98 115.21 2ed9 s PHE 100 Ca 0.27 -1.17 -0.29 0.00 -0.60 0.00 0.00 56.93 55.14 2ed9 s PHE 100 Cb 0.01 -0.34 0.08 0.00 0.51 0.00 0.00 43.02 43.27 2ed9 s PHE 100 CO 0.11 -0.72 0.74 -1.14 0.70 0.00 0.00 175.22 174.91 2ed9 s GLN 101 N -4.10 0.94 0.01 0.44 0.74 -0.21 -3.32 119.66 114.15 2ed9 s GLN 101 Ca 0.32 0.44 0.01 0.00 0.05 0.00 0.00 55.36 56.18 2ed9 s GLN 101 Cb 0.05 0.45 -0.01 0.00 1.10 0.00 0.00 33.01 34.60 2ed9 s GLN 101 CO 0.10 -0.25 -0.03 0.08 -0.55 0.00 0.00 175.29 174.63 2ed9 s VAL 102 N -0.75 0.24 -0.17 1.34 1.01 -1.25 -2.64 120.40 118.19 2ed9 s VAL 102 Ca -0.07 -0.33 -0.08 0.00 0.00 0.00 0.00 61.98 61.50 2ed9 s VAL 102 Cb -0.01 -0.25 0.06 0.00 0.00 0.00 0.00 36.38 36.18 2ed9 s VAL 102 CO 0.06 -0.06 0.39 -0.55 0.00 0.00 0.00 175.10 174.94 2ed9 s SER 103 N -0.42 -0.41 -0.32 3.32 0.15 -1.15 -2.49 113.70 112.39 2ed9 s SER 103 Ca -0.02 0.85 -0.29 0.00 0.70 0.00 0.00 55.95 57.19 2ed9 s SER 103 Cb -0.03 0.81 0.00 0.00 -1.71 0.00 0.00 66.02 65.10 2ed9 s SER 103 CO -0.00 -0.20 1.28 0.00 1.20 0.00 0.00 173.24 175.52 2ed9 s ALA 104 N 1.61 3.35 0.02 5.45 0.00 -1.26 -2.40 121.76 128.54 2ed9 s ALA 104 Ca -0.08 0.05 0.05 0.00 0.00 0.00 0.00 51.96 51.97 2ed9 s ALA 104 Cb -0.09 -3.78 -0.03 0.00 0.00 0.00 0.00 23.12 19.21 2ed9 s ALA 104 CO -0.12 -1.80 -0.10 0.00 0.00 0.00 0.00 175.76 173.74 2ed9 s MET 105 N 4.17 2.38 0.30 0.00 0.23 -1.15 -3.12 119.30 122.11 2ed9 s MET 105 Ca 0.55 -0.82 0.01 0.00 -1.03 0.00 0.00 55.69 54.40 2ed9 s MET 105 Cb -0.16 -2.40 0.01 0.00 -1.53 0.00 0.00 34.83 30.76 2ed9 s MET 105 CO 0.23 0.58 0.09 0.25 -2.03 0.00 0.00 175.02 174.13 2ed9 n THR 106 N 1.48 0.00 0.27 3.16 -2.24 0.25 -1.39 114.28 115.81 2ed9 n THR 106 Ca -0.15 -1.32 0.18 0.00 -2.27 0.00 0.00 64.05 60.49 2ed9 n THR 106 Cb 0.52 0.08 0.88 0.00 -2.10 0.00 0.00 70.33 69.71 2ed9 n THR 106 CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 2ed9 h VAL 107 N 0.94 0.15 0.13 2.28 -1.51 -1.76 -2.46 116.25 114.02 2ed9 h VAL 107 Ca -0.22 0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 65.24 2ed9 h VAL 107 Cb 0.72 0.75 0.00 0.00 -2.13 0.00 0.00 31.29 30.64 2ed9 h VAL 107 CO 0.37 0.00 -0.06 0.78 -1.23 0.00 0.00 177.57 177.42 2ed9 h ASN 108 N 0.00 -0.15 -0.09 4.19 4.21 -1.88 -3.51 115.58 118.36 2ed9 h ASN 108 Ca 0.05 -0.02 0.00 0.00 1.21 0.00 0.00 56.30 57.54 2ed9 h ASN 108 Cb 0.59 0.04 0.00 0.00 -1.12 0.00 0.00 38.32 37.83 2ed9 h ASN 108 CO -0.00 0.34 0.00 0.61 -1.29 0.00 0.00 177.43 177.09 2ed9 n GLY 109 N 1.32 1.46 3.44 2.83 0.00 -0.93 -4.92 105.19 108.39 2ed9 n GLY 109 Ca -0.02 -0.71 -0.38 0.00 0.00 0.00 0.00 46.02 44.91 2ed9 n GLY 109 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ed9 s THR 110 N -2.39 4.52 0.36 2.61 2.01 -1.26 -0.58 115.64 120.91 2ed9 s THR 110 Ca 0.00 -0.35 -0.06 0.00 0.31 0.00 0.00 61.69 61.59 2ed9 s THR 110 Cb 0.00 -3.25 0.09 0.00 0.01 0.00 0.00 72.50 69.35 2ed9 s THR 110 CO 0.00 0.15 0.21 0.61 -0.69 0.00 0.00 174.62 174.90 2ed9 n GLY 111 N 4.96 -3.72 3.77 4.40 0.00 -1.18 -4.87 105.19 108.54 2ed9 n GLY 111 Ca -0.14 -1.22 -0.38 0.00 0.00 0.00 0.00 46.02 44.27 2ed9 n GLY 111 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ed9 s PRO 112 N -3.46 4.00 0.37 1.61 0.04 -1.23 -4.88 135.00 131.45 2ed9 s PRO 112 Ca 0.16 1.86 -0.27 0.00 0.04 0.00 0.00 61.00 62.80 2ed9 s PRO 112 Cb -0.03 -2.64 -0.09 0.00 0.04 0.00 0.00 34.50 31.78 2ed9 s PRO 112 CO 0.14 -0.37 1.20 -1.25 0.04 0.00 0.00 177.00 176.75 2ed9 s PRO 113 N -2.35 4.19 0.79 0.56 0.04 -1.26 -4.70 135.00 132.28 2ed9 s PRO 113 Ca 0.58 1.95 -0.11 0.00 0.04 0.00 0.00 61.00 63.45 2ed9 s PRO 113 Cb -0.31 -2.84 0.07 0.00 0.04 0.00 0.00 34.50 31.46 2ed9 s PRO 113 CO 0.39 -0.23 1.16 -1.54 0.04 0.00 0.00 177.00 176.82 2ed9 s SER 114 N -0.92 4.59 0.40 6.66 1.04 -1.04 -4.98 113.70 119.46 2ed9 s SER 114 Ca 0.53 0.76 -0.22 0.00 0.48 0.00 0.00 55.95 57.51 2ed9 s SER 114 Cb -0.34 -1.29 -0.14 0.00 0.10 0.00 0.00 66.02 64.35 2ed9 s SER 114 CO 0.43 -1.84 0.33 0.59 0.98 0.00 0.00 173.24 173.72 2ed9 n ASN 115 N -3.26 -1.85 -4.51 7.02 3.02 -1.26 -4.75 115.26 109.67 2ed9 n ASN 115 Ca 0.08 0.87 -0.42 0.00 -0.03 0.00 0.00 54.58 55.08 2ed9 n ASN 115 Cb 0.61 -1.00 -0.04 0.00 -0.61 0.00 0.00 39.78 38.75 2ed9 n ASN 115 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 2ed9 s TRP 116 N -1.55 2.60 0.31 3.10 0.52 -1.26 -4.80 118.94 117.85 2ed9 s TRP 116 Ca 0.61 -0.18 -0.11 0.00 0.02 0.00 0.00 56.10 56.45 2ed9 s TRP 116 Cb -0.63 -4.34 -0.07 0.00 -1.15 0.00 0.00 33.47 27.27 2ed9 s TRP 116 CO 0.60 -1.67 0.66 0.71 0.02 0.00 0.00 176.95 177.27 2ed9 s TYR 117 N 4.55 3.42 0.01 -1.98 1.51 -1.21 -4.97 117.35 118.69 2ed9 s TYR 117 Ca 0.30 1.00 0.01 0.00 -1.01 0.00 0.00 57.07 57.37 2ed9 s TYR 117 Cb -0.12 -2.37 -0.01 0.00 -0.11 0.00 0.00 41.96 39.34 2ed9 s TYR 117 CO 0.15 0.11 -0.05 0.99 -1.11 0.00 0.00 175.55 175.65 2ed9 s THR 118 N -2.04 0.32 -0.01 -0.71 2.01 -1.26 -1.97 115.64 111.97 2ed9 s THR 118 Ca 0.50 -0.56 -0.01 0.00 0.31 0.00 0.00 61.69 61.93 2ed9 s THR 118 Cb -0.11 -0.34 0.01 0.00 0.01 0.00 0.00 72.50 72.07 2ed9 s THR 118 CO 0.23 -0.17 0.03 0.00 -0.69 0.00 0.00 174.62 174.03 2ed9 s ALA 119 N -0.71 -0.07 -0.16 7.40 0.00 -0.53 -4.99 121.76 122.69 2ed9 s ALA 119 Ca -0.05 0.12 -0.06 0.00 0.00 0.00 0.00 51.96 51.97 2ed9 s ALA 119 Cb -0.05 -0.08 -0.04 0.00 0.00 0.00 0.00 23.12 22.95 2ed9 s ALA 119 CO -0.00 -0.03 0.04 -1.21 0.00 0.00 0.00 175.76 174.57 2ed9 s GLU 120 N 0.14 3.80 0.32 0.00 8.01 -1.26 -2.54 118.70 127.17 2ed9 s GLU 120 Ca -0.01 -0.36 -0.27 0.00 0.01 0.00 0.00 54.97 54.34 2ed9 s GLU 120 Cb -0.02 -3.12 -0.09 0.00 -4.31 0.00 0.00 34.13 26.59 2ed9 s GLU 120 CO -0.00 0.34 0.99 0.95 0.01 0.00 0.00 175.26 177.55 2ed9 s THR 121 N 0.16 3.98 -0.06 3.63 -4.23 -1.17 -5.00 115.64 112.95 2ed9 s THR 121 Ca 0.04 1.72 -0.30 0.00 -1.18 0.00 0.00 61.69 61.97 2ed9 s THR 121 Cb -0.12 -3.99 -0.05 0.00 1.34 0.00 0.00 72.50 69.68 2ed9 s THR 121 CO 0.01 0.21 1.49 -2.16 -0.54 0.00 0.00 174.62 173.63 2ed9 s PRO 122 N -1.90 4.22 0.31 3.99 0.04 -1.26 -3.76 135.00 136.64 2ed9 s PRO 122 Ca 0.49 2.01 0.08 0.00 0.04 0.00 0.00 61.00 63.63 2ed9 s PRO 122 Cb -0.23 -3.80 0.85 0.00 0.04 0.00 0.00 34.50 31.37 2ed9 s PRO 122 CO 0.29 -0.73 1.71 0.93 0.04 0.00 0.00 177.00 179.23 2ed9 h GLU 123 N 8.69 0.48 0.00 4.56 4.39 -1.94 -3.42 114.58 127.34 2ed9 h GLU 123 Ca -0.36 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.31 2ed9 h GLU 123 Cb 1.16 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.70 2ed9 h GLU 123 CO 0.94 0.32 0.00 0.27 -1.16 0.00 0.00 179.01 179.38