#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 -0.29 -0.06 1.61 0.15 -1.26 -5.18 113.70 108.66 2ed9 s SER 2 Ca 0.00 0.43 -0.32 0.00 0.70 0.00 0.00 55.95 56.77 2ed9 s SER 2 Cb 0.00 1.23 0.12 0.00 -1.71 0.00 0.00 66.02 65.66 2ed9 s SER 2 CO 0.00 -0.06 1.24 -0.94 1.20 0.00 0.00 173.24 174.68 2ed9 s SER 3 N 1.68 -0.09 0.00 5.45 1.04 -1.26 -5.18 113.70 115.34 2ed9 s SER 3 Ca -0.05 -0.10 0.00 0.00 0.48 0.00 0.00 55.95 56.28 2ed9 s SER 3 Cb -0.03 0.18 0.00 0.00 0.10 0.00 0.00 66.02 66.26 2ed9 s SER 3 CO -0.14 -0.31 0.00 0.61 0.98 0.00 0.00 173.24 174.38 2ed9 n GLY 4 N -0.36 3.47 3.24 7.32 0.00 -1.26 -5.17 105.19 112.43 2ed9 n GLY 4 Ca -0.06 -0.14 0.03 0.00 0.00 0.00 0.00 46.02 45.86 2ed9 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ed9 s SER 5 N 0.00 -0.31 0.03 1.61 0.15 -1.26 -5.18 113.70 108.73 2ed9 s SER 5 Ca 0.00 0.35 -0.27 0.00 0.70 0.00 0.00 55.95 56.73 2ed9 s SER 5 Cb 0.00 1.32 0.09 0.00 -1.71 0.00 0.00 66.02 65.73 2ed9 s SER 5 CO 0.00 -0.06 1.23 -0.94 1.20 0.00 0.00 173.24 174.67 2ed9 s SER 6 N 2.43 -0.00 0.00 5.45 1.04 -1.26 -5.19 113.70 116.17 2ed9 s SER 6 Ca -0.02 -0.29 0.00 0.00 0.48 0.00 0.00 55.95 56.12 2ed9 s SER 6 Cb -0.05 0.22 0.00 0.00 0.10 0.00 0.00 66.02 66.29 2ed9 s SER 6 CO -0.15 -0.44 0.00 0.61 0.98 0.00 0.00 173.24 174.24 2ed9 n GLY 7 N -0.81 5.14 3.59 7.32 0.00 -1.26 -5.17 105.19 114.00 2ed9 n GLY 7 Ca 0.01 -1.93 -0.06 0.00 0.00 0.00 0.00 46.02 44.04 2ed9 n GLY 7 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2ed9 s ASN 8 N 0.46 -0.20 0.33 1.61 3.84 -1.26 -5.19 114.94 114.54 2ed9 s ASN 8 Ca 0.00 0.11 0.04 0.00 0.21 0.00 0.00 52.86 53.22 2ed9 s ASN 8 Cb 0.00 0.18 0.04 0.00 -0.55 0.00 0.00 41.25 40.92 2ed9 s ASN 8 CO 0.00 -0.26 0.34 0.54 -2.79 0.00 0.00 177.10 174.93 2ed9 n ARG 9 N 0.23 0.91 -4.44 0.43 3.00 -1.26 -5.14 116.66 110.38 2ed9 n ARG 9 Ca -0.03 -1.96 -0.26 0.00 -0.01 0.00 0.00 57.85 55.59 2ed9 n ARG 9 Cb 0.59 0.07 -0.13 0.00 0.00 0.00 0.00 32.46 32.99 2ed9 n ARG 9 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.63 177.16 2ed9 s TYR 10 N -1.42 1.98 -0.21 -1.55 6.14 -1.26 -5.14 117.35 115.90 2ed9 s TYR 10 Ca 0.25 -0.40 -0.31 0.00 0.64 0.00 0.00 57.07 57.25 2ed9 s TYR 10 Cb -0.02 -1.11 0.15 0.00 0.42 0.00 0.00 41.96 41.40 2ed9 s TYR 10 CO 0.16 0.21 1.19 0.20 0.64 0.00 0.00 175.55 177.95 2ed9 s GLY 11 N -1.74 -0.16 0.86 8.97 0.00 -1.26 -5.18 107.32 108.82 2ed9 s GLY 11 Ca 0.09 2.13 -0.14 0.00 0.00 0.00 0.00 44.72 46.79 2ed9 s GLY 11 CO 0.04 0.87 0.76 -1.55 0.00 0.00 0.00 173.10 173.22 2ed9 n PRO 12 N 0.35 -2.52 -3.36 2.90 -0.04 -1.26 -5.09 135.00 125.98 2ed9 n PRO 12 Ca -0.03 -1.22 0.02 0.00 -0.04 0.00 0.00 63.50 62.23 2ed9 n PRO 12 Cb 0.58 -1.15 -0.03 0.00 -0.04 0.00 0.00 33.50 32.87 2ed9 n PRO 12 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2ed9 s GLY 13 N -3.87 -0.56 0.54 0.55 0.00 -1.26 -5.17 107.32 97.55 2ed9 s GLY 13 Ca 0.50 2.52 -0.03 0.00 0.00 0.00 0.00 44.72 47.71 2ed9 s GLY 13 CO 0.38 3.32 0.81 -1.34 0.00 0.00 0.00 173.10 176.27 2ed9 s VAL 14 N 2.76 3.71 0.00 1.40 -7.23 -1.26 -5.10 120.40 114.67 2ed9 s VAL 14 Ca 0.03 -0.22 -0.29 0.00 -1.81 0.00 0.00 61.98 59.68 2ed9 s VAL 14 Cb -0.11 -3.43 0.10 0.00 0.56 0.00 0.00 36.38 33.51 2ed9 s VAL 14 CO -0.18 -0.38 1.11 -0.94 -0.31 0.00 0.00 175.10 174.40 2ed9 s SER 15 N -4.28 -0.16 0.33 4.85 1.04 -1.26 -5.19 113.70 109.02 2ed9 s SER 15 Ca 0.52 -0.16 -0.08 0.00 0.48 0.00 0.00 55.95 56.70 2ed9 s SER 15 Cb -0.10 0.29 0.01 0.00 0.10 0.00 0.00 66.02 66.32 2ed9 s SER 15 CO 0.42 -0.52 0.55 0.42 0.98 0.00 0.00 173.24 175.09 2ed9 s THR 16 N -2.79 0.00 0.08 2.02 -4.23 -1.26 -5.19 115.64 104.27 2ed9 s THR 16 Ca 0.11 -1.40 -0.27 0.00 -1.18 0.00 0.00 61.69 58.95 2ed9 s THR 16 Cb 0.01 -2.57 0.09 0.00 1.34 0.00 0.00 72.50 71.37 2ed9 s THR 16 CO -0.03 0.00 1.13 1.51 -0.54 0.00 0.00 174.62 176.69 2ed9 s ASP 17 N -3.14 -0.08 0.35 3.99 1.47 -1.26 -5.19 116.67 112.81 2ed9 s ASP 17 Ca 0.25 -0.33 0.05 0.00 1.18 0.00 0.00 52.55 53.70 2ed9 s ASP 17 Cb -0.02 0.33 -0.07 0.00 -0.34 0.00 0.00 42.92 42.83 2ed9 s ASP 17 CO 0.15 -0.63 0.04 -0.62 0.68 0.00 0.00 175.17 174.79 2ed9 s ASP 18 N -3.11 2.83 0.07 2.11 2.15 -1.26 -5.16 116.67 114.30 2ed9 s ASP 18 Ca 0.16 -1.37 0.06 0.00 0.43 0.00 0.00 52.55 51.84 2ed9 s ASP 18 Cb 0.01 -0.18 -0.03 0.00 -0.30 0.00 0.00 42.92 42.42 2ed9 s ASP 18 CO 0.00 -0.55 -0.17 0.27 -0.17 0.00 0.00 175.17 174.55 2ed9 s ILE 19 N -3.11 1.40 0.71 4.11 -4.36 -1.26 -5.15 121.20 113.54 2ed9 s ILE 19 Ca 0.36 -1.31 -0.11 0.00 -0.26 0.00 0.00 60.65 59.33 2ed9 s ILE 19 Cb 0.09 -1.28 0.18 0.00 1.25 0.00 0.00 42.46 42.70 2ed9 s ILE 19 CO 0.16 -0.06 0.40 0.35 0.24 0.00 0.00 174.94 176.04 2ed9 n THR 20 N 1.43 0.00 -1.06 8.37 -2.24 -1.26 -4.81 114.28 114.71 2ed9 n THR 20 Ca -0.19 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.23 2ed9 n THR 20 Cb 0.54 -0.46 -0.02 0.00 -2.10 0.00 0.00 70.33 68.29 2ed9 n THR 20 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2ed9 n VAL 21 N -4.28 1.22 -2.21 2.28 0.31 -1.26 -4.90 118.33 109.50 2ed9 n VAL 21 Ca 0.06 -0.39 -0.05 0.00 -0.01 0.00 0.00 64.34 63.96 2ed9 n VAL 21 Cb 0.28 0.00 0.08 0.00 -0.91 0.00 0.00 33.84 33.28 2ed9 n VAL 21 CO 0.00 0.00 0.00 0.55 -1.32 0.00 0.00 176.83 176.06 2ed9 n VAL 22 N -0.25 1.62 -1.44 2.52 3.14 -1.26 -5.05 118.33 117.61 2ed9 n VAL 22 Ca 0.12 -2.99 -0.38 0.00 -2.96 0.00 0.00 64.34 58.13 2ed9 n VAL 22 Cb 0.23 0.12 -0.15 0.00 -1.06 0.00 0.00 33.84 32.99 2ed9 n VAL 22 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 2ed9 n THR 23 N -0.54 0.00 -3.95 1.55 -2.24 -1.26 -4.80 114.28 103.04 2ed9 n THR 23 Ca 0.21 -0.03 -0.11 0.00 -2.27 0.00 0.00 64.05 61.84 2ed9 n THR 23 Cb 0.90 -0.45 -0.01 0.00 -2.10 0.00 0.00 70.33 68.67 2ed9 n THR 23 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2ed9 s LEU 24 N 8.02 0.46 -0.84 3.22 1.43 -1.26 -4.98 118.68 124.72 2ed9 s LEU 24 Ca 1.30 -1.25 -0.00 0.00 -1.03 0.00 0.00 54.13 53.15 2ed9 s LEU 24 Cb -1.18 2.15 -0.00 0.00 0.03 0.00 0.00 46.19 47.19 2ed9 s LEU 24 CO 0.48 -1.46 0.70 -1.20 0.23 0.00 0.00 176.35 175.10 2ed9 n SER 25 N -1.27 -2.29 -1.45 2.29 7.64 -1.26 -4.89 113.62 112.39 2ed9 n SER 25 Ca -0.04 -0.44 -0.06 0.00 1.01 0.00 0.00 58.87 59.34 2ed9 n SER 25 Cb 0.61 -3.79 0.02 0.00 -1.01 0.00 0.00 64.21 60.04 2ed9 n SER 25 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2ed9 n ASP 26 N -2.53 4.48 -4.96 6.43 9.92 -1.26 -4.88 116.55 123.75 2ed9 n ASP 26 Ca -0.19 -2.49 -0.24 0.00 -0.53 0.00 0.00 54.79 51.34 2ed9 n ASP 26 Cb 0.62 -0.83 -0.03 0.00 -0.64 0.00 0.00 41.12 40.24 2ed9 n ASP 26 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 2ed9 s VAL 27 N -0.78 5.29 -0.03 2.53 -7.23 -1.26 -4.65 120.40 114.27 2ed9 s VAL 27 Ca 0.12 -0.81 -0.30 0.00 -1.81 0.00 0.00 61.98 59.18 2ed9 s VAL 27 Cb 0.09 -3.80 -0.05 0.00 0.56 0.00 0.00 36.38 33.18 2ed9 s VAL 27 CO 0.01 -0.21 1.47 -2.16 -0.31 0.00 0.00 175.10 173.90 2ed9 s PRO 28 N -3.60 4.24 -0.15 4.82 0.04 -1.26 -4.91 135.00 134.18 2ed9 s PRO 28 Ca 0.35 2.02 -0.02 0.00 0.04 0.00 0.00 61.00 63.38 2ed9 s PRO 28 Cb -0.10 -3.71 -0.24 0.00 0.04 0.00 0.00 34.50 30.49 2ed9 s PRO 28 CO 0.29 -0.68 0.24 0.43 0.04 0.00 0.00 177.00 177.32 2ed9 n SER 29 N 6.02 1.91 -4.76 6.66 7.64 -1.26 -3.70 113.62 126.13 2ed9 n SER 29 Ca 0.15 0.14 -0.39 0.00 1.01 0.00 0.00 58.87 59.77 2ed9 n SER 29 Cb 0.43 -0.62 -0.05 0.00 -1.01 0.00 0.00 64.21 62.96 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 -2.55 3.31 0.88 -0.43 0.00 -1.26 -4.51 121.76 117.20 2ed9 s ALA 30 Ca -0.23 0.74 -0.11 0.00 0.00 0.00 0.00 51.96 52.35 2ed9 s ALA 30 Cb 0.07 -3.27 0.12 0.00 0.00 0.00 0.00 23.12 20.05 2ed9 s ALA 30 CO 0.74 -0.02 1.09 -1.25 0.00 0.00 0.00 175.76 176.32 2ed9 s PRO 31 N -1.62 1.36 0.58 0.00 0.04 -1.26 -4.84 135.00 129.26 2ed9 s PRO 31 Ca 0.46 0.86 -0.18 0.00 0.04 0.00 0.00 61.00 62.18 2ed9 s PRO 31 Cb -0.27 -1.82 -0.04 0.00 0.04 0.00 0.00 34.50 32.41 2ed9 s PRO 31 CO 0.34 -2.18 1.12 -1.25 0.04 0.00 0.00 177.00 175.07 2ed9 s PRO 32 N -4.93 3.20 0.31 0.56 0.04 -1.26 -4.70 135.00 128.21 2ed9 s PRO 32 Ca 0.63 1.54 0.03 0.00 0.04 0.00 0.00 61.00 63.24 2ed9 s PRO 32 Cb -0.18 -1.99 -0.03 0.00 0.04 0.00 0.00 34.50 32.34 2ed9 s PRO 32 CO 0.57 -0.96 0.47 -0.65 0.04 0.00 0.00 177.00 176.47 2ed9 s GLN 33 N -3.53 3.41 -1.01 4.56 -0.21 -0.53 -4.46 119.66 117.90 2ed9 s GLN 33 Ca 0.71 -0.58 -0.07 0.00 0.02 0.00 0.00 55.36 55.45 2ed9 s GLN 33 Cb -0.23 -2.76 0.01 0.00 1.00 0.00 0.00 33.01 31.02 2ed9 s GLN 33 CO 0.31 0.24 0.88 -1.71 -2.12 0.00 0.00 175.29 172.89 2ed9 n ASN 34 N -1.63 -5.23 -4.47 5.90 5.15 -1.26 0.10 115.26 113.82 2ed9 n ASN 34 Ca -0.06 -0.40 -0.43 0.00 -0.60 0.00 0.00 54.58 53.08 2ed9 n ASN 34 Cb 0.57 -3.88 -0.05 0.00 -0.53 0.00 0.00 39.78 35.88 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 -3.24 4.69 0.17 3.44 1.01 -1.26 -3.69 120.40 121.52 2ed9 s VAL 35 Ca 0.43 -0.28 -0.18 0.00 0.00 0.00 0.00 61.98 61.96 2ed9 s VAL 35 Cb -0.19 -4.41 0.03 0.00 0.00 0.00 0.00 36.38 31.82 2ed9 s VAL 35 CO 0.54 -0.96 0.49 -0.55 0.00 0.00 0.00 175.10 174.62 2ed9 s SER 36 N 2.85 -0.28 -0.13 3.32 0.15 -1.25 -5.07 113.70 113.29 2ed9 s SER 36 Ca 0.20 -0.38 0.00 0.00 0.70 0.00 0.00 55.95 56.47 2ed9 s SER 36 Cb -0.17 0.54 -0.01 0.00 -1.71 0.00 0.00 66.02 64.67 2ed9 s SER 36 CO 0.14 -0.98 -0.14 -0.76 1.20 0.00 0.00 173.24 172.70 2ed9 s LEU 37 N -2.84 2.67 -0.18 3.45 1.43 -1.26 -3.91 118.68 118.04 2ed9 s LEU 37 Ca 0.06 -0.35 -0.02 0.00 -1.03 0.00 0.00 54.13 52.79 2ed9 s LEU 37 Cb 0.00 -1.60 -0.01 0.00 0.03 0.00 0.00 46.19 44.61 2ed9 s LEU 37 CO -0.07 0.15 -0.08 -0.70 0.23 0.00 0.00 176.35 175.88 2ed9 s GLU 38 N 0.41 3.37 -0.33 1.70 2.56 -0.88 -5.06 118.70 120.48 2ed9 s GLU 38 Ca -0.11 -0.65 -0.24 0.00 0.00 0.00 0.00 54.97 53.97 2ed9 s GLU 38 Cb -0.16 -2.84 0.01 0.00 2.00 0.00 0.00 34.13 33.13 2ed9 s GLU 38 CO 0.05 -0.03 0.84 0.08 -0.56 0.00 0.00 175.26 175.64 2ed9 s VAL 39 N 1.01 4.72 -0.22 3.70 1.01 -1.26 -1.67 120.40 127.69 2ed9 s VAL 39 Ca -0.00 1.19 -0.11 0.00 0.00 0.00 0.00 61.98 63.05 2ed9 s VAL 39 Cb -0.15 -4.22 -0.19 0.00 0.00 0.00 0.00 36.38 31.83 2ed9 s VAL 39 CO -0.01 -0.36 0.01 0.52 0.00 0.00 0.00 175.10 175.27 2ed9 n VAL 40 N 5.69 1.59 -4.00 2.92 0.31 -1.15 -4.96 118.33 118.73 2ed9 n VAL 40 Ca 0.05 -0.38 -0.13 0.00 -0.01 0.00 0.00 64.34 63.86 2ed9 n VAL 40 Cb 0.48 -1.80 -0.02 0.00 -0.91 0.00 0.00 33.84 31.59 2ed9 n VAL 40 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2ed9 n ASN 41 N -3.92 -1.42 0.22 4.52 3.02 0.06 -4.97 115.26 112.77 2ed9 n ASN 41 Ca -0.41 -2.77 0.11 0.00 -0.03 0.00 0.00 54.58 51.48 2ed9 n ASN 41 Cb 0.89 2.59 0.41 0.00 -0.61 0.00 0.00 39.78 43.05 2ed9 n ASN 41 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 2ed9 h SER 42 N 1.88 0.00 0.00 6.41 4.64 -1.91 -3.15 113.55 121.42 2ed9 h SER 42 Ca -0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 2ed9 h SER 42 Cb 1.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 2ed9 h SER 42 CO 0.36 0.19 -0.09 -2.11 -0.87 0.00 0.00 176.83 174.31 2ed9 n ARG 43 N -3.28 1.15 -3.74 4.77 1.85 -1.26 -4.13 116.66 112.02 2ed9 n ARG 43 Ca 0.01 -2.15 -0.12 0.00 -1.00 0.00 0.00 57.85 54.59 2ed9 n ARG 43 Cb 0.46 -1.25 -0.12 0.00 -1.05 0.00 0.00 32.46 30.50 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 -2.31 -0.31 -0.03 2.89 0.01 -1.19 -0.49 113.70 112.27 2ed9 s SER 44 Ca 0.23 0.59 -0.01 0.00 1.31 0.00 0.00 55.95 58.07 2ed9 s SER 44 Cb 0.20 0.51 0.03 0.00 0.21 0.00 0.00 66.02 66.97 2ed9 s SER 44 CO 0.02 -0.14 0.05 -0.63 0.41 0.00 0.00 173.24 172.95 2ed9 s ILE 45 N 0.88 -0.07 -0.02 1.44 1.01 -0.63 -0.76 121.20 123.04 2ed9 s ILE 45 Ca -0.06 0.26 -0.10 0.00 0.00 0.00 0.00 60.65 60.75 2ed9 s ILE 45 Cb -0.07 -0.11 -0.05 0.00 0.01 0.00 0.00 42.46 42.23 2ed9 s ILE 45 CO -0.06 0.11 0.30 -0.75 0.00 0.00 0.00 174.94 174.53 2ed9 s LYS 46 N 1.31 3.68 -0.13 2.79 2.20 -0.67 -2.04 119.74 126.88 2ed9 s LYS 46 Ca -0.06 0.11 -0.00 0.00 -0.36 0.00 0.00 55.97 55.65 2ed9 s LYS 46 Cb -0.13 -3.15 0.03 0.00 -1.51 0.00 0.00 37.83 33.07 2ed9 s LYS 46 CO -0.03 0.69 -0.08 0.08 -0.36 0.00 0.00 175.35 175.65 2ed9 s VAL 47 N -1.16 1.12 0.21 4.02 1.01 -0.43 -2.07 120.40 123.11 2ed9 s VAL 47 Ca 0.23 -0.42 0.10 0.00 0.00 0.00 0.00 61.98 61.90 2ed9 s VAL 47 Cb -0.14 -1.16 -0.04 0.00 0.00 0.00 0.00 36.38 35.03 2ed9 s VAL 47 CO 0.12 0.33 -0.15 -0.94 0.00 0.00 0.00 175.10 174.46 2ed9 s SER 48 N 1.66 3.91 0.27 3.32 1.04 -1.25 -1.02 113.70 121.63 2ed9 s SER 48 Ca 0.04 -0.76 -0.17 0.00 0.48 0.00 0.00 55.95 55.55 2ed9 s SER 48 Cb -0.13 -0.51 0.01 0.00 0.10 0.00 0.00 66.02 65.48 2ed9 s SER 48 CO -0.08 0.09 0.61 -1.66 0.98 0.00 0.00 173.24 173.17 2ed9 s TRP 49 N -1.90 0.09 0.04 5.02 -2.14 -0.96 -3.84 118.94 115.25 2ed9 s TRP 49 Ca 0.25 -0.51 -0.00 0.00 2.66 0.00 0.00 56.10 58.50 2ed9 s TRP 49 Cb -0.08 0.46 -0.03 0.00 -3.10 0.00 0.00 33.47 30.73 2ed9 s TRP 49 CO 0.14 -1.13 -0.03 -0.51 -2.66 0.00 0.00 176.95 172.75 2ed9 s LEU 50 N -2.97 2.38 0.76 -4.66 1.43 0.28 -4.87 118.68 111.02 2ed9 s LEU 50 Ca 0.17 -0.78 -0.11 0.00 -1.03 0.00 0.00 54.13 52.38 2ed9 s LEU 50 Cb -0.03 0.13 0.05 0.00 0.03 0.00 0.00 46.19 46.37 2ed9 s LEU 50 CO 0.08 -0.46 1.09 -2.16 0.23 0.00 0.00 176.35 175.14 2ed9 s PRO 51 N -2.81 2.33 1.00 1.29 0.04 -1.26 -1.45 135.00 134.14 2ed9 s PRO 51 Ca -0.03 1.20 -0.12 0.00 0.04 0.00 0.00 61.00 62.09 2ed9 s PRO 51 Cb -0.00 -1.90 0.19 0.00 0.04 0.00 0.00 34.50 32.82 2ed9 s PRO 51 CO -0.06 -1.59 1.09 -1.25 0.04 0.00 0.00 177.00 175.23 2ed9 s PRO 52 N -4.79 0.41 0.61 0.56 0.04 -1.26 -4.07 135.00 126.49 2ed9 s PRO 52 Ca 0.62 0.52 -0.17 0.00 0.04 0.00 0.00 61.00 62.01 2ed9 s PRO 52 Cb -0.18 -1.73 -0.03 0.00 0.04 0.00 0.00 34.50 32.60 2ed9 s PRO 52 CO 0.54 -2.75 1.12 -1.25 0.04 0.00 0.00 177.00 174.70 2ed9 s PRO 53 N -4.96 3.05 0.62 0.56 0.04 -1.26 -4.80 135.00 128.25 2ed9 s PRO 53 Ca 0.65 1.49 0.29 0.00 0.04 0.00 0.00 61.00 63.48 2ed9 s PRO 53 Cb -0.19 -1.98 1.58 0.00 0.04 0.00 0.00 34.50 33.96 2ed9 s PRO 53 CO 0.58 -1.07 1.96 0.77 0.04 0.00 0.00 177.00 179.28 2ed9 h SER 54 N 0.57 0.00 0.15 6.66 0.02 -1.95 -1.04 113.55 117.96 2ed9 h SER 54 Ca -0.48 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.47 2ed9 h SER 54 Cb 1.25 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.76 2ed9 h SER 54 CO 0.55 0.00 -0.40 1.23 -1.14 0.00 0.00 176.83 177.08 2ed9 h GLY 55 N 0.00 -1.17 1.49 -3.77 0.00 -2.04 -2.96 103.07 94.63 2ed9 h GLY 55 Ca 0.11 0.60 -0.00 0.00 0.00 0.00 0.00 47.33 48.04 2ed9 h GLY 55 CO -0.00 -0.32 -0.51 0.00 0.00 0.00 0.00 176.54 175.70 2ed9 h THR 56 N -0.61 0.01 -0.24 4.70 1.03 -1.86 -3.44 112.91 112.51 2ed9 h THR 56 Ca -0.01 -1.02 -0.22 0.00 -0.01 0.00 0.00 66.41 65.15 2ed9 h THR 56 Cb 0.59 1.76 -0.06 0.00 -1.07 0.00 0.00 68.15 69.37 2ed9 h THR 56 CO -0.18 0.01 1.11 1.67 -0.01 0.00 0.00 175.52 178.12 2ed9 n GLN 57 N -2.89 0.30 -2.16 0.00 7.27 -0.43 -4.69 117.38 114.79 2ed9 n GLN 57 Ca 0.02 -0.38 -0.22 0.00 0.07 0.00 0.00 57.00 56.49 2ed9 n GLN 57 Cb 0.55 -2.35 0.02 0.00 2.41 0.00 0.00 30.24 30.86 2ed9 n GLN 57 CO 0.00 0.00 0.00 -1.71 0.07 0.00 0.00 177.06 175.42 2ed9 n ASN 58 N 12.21 4.55 0.00 1.69 5.15 -1.26 -4.92 115.26 132.68 2ed9 n ASN 58 Ca 0.57 -3.57 0.00 0.00 -0.60 0.00 0.00 54.58 50.98 2ed9 n ASN 58 Cb 0.28 -0.37 0.00 0.00 -0.53 0.00 0.00 39.78 39.16 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 -0.67 1.66 3.57 8.20 0.00 -1.26 -4.88 105.19 111.81 2ed9 n GLY 59 Ca 0.40 0.07 -0.41 0.00 0.00 0.00 0.00 46.02 46.08 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 -0.88 1.87 0.40 1.61 5.36 -1.26 -4.74 117.98 120.33 2ed9 s PHE 60 Ca 0.00 0.67 -0.24 0.00 -0.96 0.00 0.00 56.93 56.40 2ed9 s PHE 60 Cb 0.00 -4.17 -0.12 0.00 -0.34 0.00 0.00 43.02 38.39 2ed9 s PHE 60 CO 0.00 -2.42 0.76 -0.89 -1.46 0.00 0.00 175.22 171.21 2ed9 n ILE 61 N 7.20 2.07 0.00 3.12 -0.00 -1.26 -3.26 119.36 127.24 2ed9 n ILE 61 Ca 0.19 -0.50 0.00 0.00 -0.00 0.00 0.00 62.75 62.44 2ed9 n ILE 61 Cb 0.50 -0.78 0.00 0.00 -0.00 0.00 0.00 39.64 39.36 2ed9 n ILE 61 CO 0.00 0.00 0.00 0.35 -0.00 0.00 0.00 176.55 176.90 2ed9 n THR 62 N -0.60 0.00 -2.81 1.39 -2.24 -0.18 -4.90 114.28 104.93 2ed9 n THR 62 Ca 0.11 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.89 2ed9 n THR 62 Cb 0.38 0.15 0.00 0.00 -2.10 0.00 0.00 70.33 68.76 2ed9 n THR 62 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ed9 n GLY 63 N 2.27 1.58 3.23 3.38 0.00 -1.23 -4.79 105.19 109.64 2ed9 n GLY 63 Ca 0.00 -0.73 -0.13 0.00 0.00 0.00 0.00 46.02 45.16 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 -3.17 -0.29 -0.24 1.61 1.51 -1.26 -2.51 117.35 113.00 2ed9 s TYR 64 Ca 0.00 0.65 -0.11 0.00 -1.01 0.00 0.00 57.07 56.60 2ed9 s TYR 64 Cb 0.00 0.11 -0.05 0.00 -0.11 0.00 0.00 41.96 41.91 2ed9 s TYR 64 CO 0.00 -0.26 0.16 0.21 -1.11 0.00 0.00 175.55 174.55 2ed9 s LYS 65 N -0.42 4.08 -0.28 -0.62 2.20 -0.68 -3.56 119.74 120.47 2ed9 s LYS 65 Ca -0.05 -0.26 0.03 0.00 -0.36 0.00 0.00 55.97 55.32 2ed9 s LYS 65 Cb -0.04 -3.53 0.07 0.00 -1.51 0.00 0.00 37.83 32.83 2ed9 s LYS 65 CO 0.02 0.08 -0.05 0.42 -0.36 0.00 0.00 175.35 175.46 2ed9 s ILE 66 N 1.01 2.01 -0.18 5.43 1.01 0.47 -2.56 121.20 128.38 2ed9 s ILE 66 Ca 0.08 -1.72 -0.09 0.00 0.00 0.00 0.00 60.65 58.92 2ed9 s ILE 66 Cb -0.13 -2.25 -0.05 0.00 0.01 0.00 0.00 42.46 40.04 2ed9 s ILE 66 CO 0.04 -0.22 0.12 -0.60 0.00 0.00 0.00 174.94 174.28 2ed9 s ARG 67 N 1.13 4.02 0.08 2.79 6.06 -1.17 -1.78 118.95 130.08 2ed9 s ARG 67 Ca -0.02 -0.22 0.03 0.00 -2.50 0.00 0.00 55.73 53.01 2ed9 s ARG 67 Cb -0.19 -3.35 -0.03 0.00 0.06 0.00 0.00 34.95 31.44 2ed9 s ARG 67 CO -0.07 0.39 -0.08 -3.38 -2.50 0.00 0.00 175.30 169.65 2ed9 s HIS 68 N 0.10 0.89 0.13 5.12 -3.43 -1.18 -2.30 115.29 114.62 2ed9 s HIS 68 Ca 0.09 -0.68 -0.24 0.00 -0.80 0.00 0.00 55.06 53.43 2ed9 s HIS 68 Cb -0.11 -0.51 0.08 0.00 -1.43 0.00 0.00 32.58 30.61 2ed9 s HIS 68 CO -0.01 -0.07 1.11 -0.98 -2.00 0.00 0.00 174.74 172.79 2ed9 s ARG 69 N -2.70 1.05 0.14 -0.38 1.70 -1.22 -3.33 118.95 114.21 2ed9 s ARG 69 Ca 0.02 -0.68 0.06 0.00 -0.47 0.00 0.00 55.73 54.66 2ed9 s ARG 69 Cb -0.03 0.29 -0.04 0.00 -0.57 0.00 0.00 34.95 34.61 2ed9 s ARG 69 CO -0.01 -0.49 0.04 0.21 -1.08 0.00 0.00 175.30 173.96 2ed9 s LYS 70 N -2.12 2.60 0.23 3.89 2.47 -1.26 -1.61 119.74 123.94 2ed9 s LYS 70 Ca 0.24 -0.93 0.15 0.00 -1.56 0.00 0.00 55.97 53.87 2ed9 s LYS 70 Cb -0.02 -2.51 0.80 0.00 -1.46 0.00 0.00 37.83 34.64 2ed9 s LYS 70 CO 0.04 0.50 1.43 -2.37 0.16 0.00 0.00 175.35 175.10 2ed9 n THR 71 N 0.11 1.21 -4.02 3.43 5.66 -1.25 -4.59 114.28 114.83 2ed9 n THR 71 Ca -0.10 0.67 -0.21 0.00 -3.05 0.00 0.00 64.05 61.36 2ed9 n THR 71 Cb 0.54 -1.67 -0.03 0.00 -1.55 0.00 0.00 70.33 67.61 2ed9 n THR 71 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 2ed9 s THR 72 N -3.36 4.90 -0.31 1.09 -1.32 -1.26 -5.02 115.64 110.37 2ed9 s THR 72 Ca -0.02 -1.16 -0.31 0.00 -1.21 0.00 0.00 61.69 58.99 2ed9 s THR 72 Cb 0.04 -3.67 -0.08 0.00 -1.51 0.00 0.00 72.50 67.28 2ed9 s THR 72 CO 0.13 -0.33 2.23 -1.14 -2.21 0.00 0.00 174.62 173.30 2ed9 n ARG 73 N -1.32 1.46 -3.75 7.08 3.00 -1.26 -4.92 116.66 116.95 2ed9 n ARG 73 Ca -0.08 0.37 -0.13 0.00 -0.00 0.00 0.00 57.85 58.01 2ed9 n ARG 73 Cb 0.57 -2.87 -0.10 0.00 0.00 0.00 0.00 32.46 30.06 2ed9 n ARG 73 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 2ed9 s ARG 74 N 6.49 0.45 -0.39 -0.14 1.81 -1.26 -5.08 118.95 120.82 2ed9 s ARG 74 Ca 1.05 0.45 -0.32 0.00 -1.72 0.00 0.00 55.73 55.19 2ed9 s ARG 74 Cb -0.58 0.22 -0.10 0.00 -0.45 0.00 0.00 34.95 34.03 2ed9 s ARG 74 CO 0.41 -0.06 2.27 0.41 -0.68 0.00 0.00 175.30 177.65 2ed9 n GLY 75 N 2.74 0.46 3.52 -3.53 0.00 -1.26 -4.83 105.19 102.29 2ed9 n GLY 75 Ca -0.14 0.89 -0.50 0.00 0.00 0.00 0.00 46.02 46.27 2ed9 n GLY 75 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ed9 n GLU 76 N 8.43 0.66 -4.03 1.61 1.02 -1.26 -4.95 120.64 122.12 2ed9 n GLU 76 Ca 0.41 0.24 -0.31 0.00 -0.02 0.00 0.00 57.16 57.47 2ed9 n GLU 76 Cb 0.30 -1.58 -0.15 0.00 -0.02 0.00 0.00 31.44 29.99 2ed9 n GLU 76 CO 0.00 0.00 0.00 1.41 1.18 0.00 0.00 177.13 179.72 2ed9 s MET 77 N -0.65 2.02 0.11 3.49 1.75 -1.21 -5.09 119.30 119.71 2ed9 s MET 77 Ca 0.72 -1.31 -0.14 0.00 -1.25 0.00 0.00 55.69 53.71 2ed9 s MET 77 Cb -0.92 -2.84 -0.07 0.00 2.84 0.00 0.00 34.83 33.84 2ed9 s MET 77 CO 0.55 -0.61 0.52 -2.00 -0.65 0.00 0.00 175.02 172.83 2ed9 s GLU 78 N 1.16 3.97 -0.17 4.11 2.12 -1.26 -3.11 118.70 125.51 2ed9 s GLU 78 Ca -0.06 0.47 -0.15 0.00 0.36 0.00 0.00 54.97 55.59 2ed9 s GLU 78 Cb -0.20 -3.01 0.05 0.00 0.26 0.00 0.00 34.13 31.23 2ed9 s GLU 78 CO -0.06 0.53 0.45 0.99 -0.54 0.00 0.00 175.26 176.63 2ed9 s THR 79 N -1.37 -0.00 -0.01 -1.70 2.01 -0.73 -5.03 115.64 108.81 2ed9 s THR 79 Ca 0.35 0.01 0.02 0.00 0.31 0.00 0.00 61.69 62.37 2ed9 s THR 79 Cb -0.16 -0.63 -0.00 0.00 0.01 0.00 0.00 72.50 71.72 2ed9 s THR 79 CO 0.18 0.00 -0.06 -1.48 -0.69 0.00 0.00 174.62 172.58 2ed9 s LEU 80 N 0.34 1.95 -0.29 4.42 0.05 -1.26 -0.40 118.68 123.48 2ed9 s LEU 80 Ca -0.01 -0.10 -0.01 0.00 0.05 0.00 0.00 54.13 54.06 2ed9 s LEU 80 Cb -0.04 -0.30 0.09 0.00 -2.05 0.00 0.00 46.19 43.90 2ed9 s LEU 80 CO -0.01 0.06 0.09 -0.70 -0.55 0.00 0.00 176.35 175.24 2ed9 s GLU 81 N -0.04 0.70 0.40 1.48 2.12 -1.23 -4.99 118.70 117.15 2ed9 s GLU 81 Ca 0.01 -0.96 0.19 0.00 0.36 0.00 0.00 54.97 54.57 2ed9 s GLU 81 Cb -0.03 -1.97 0.84 0.00 0.26 0.00 0.00 34.13 33.23 2ed9 s GLU 81 CO -0.00 -0.94 1.82 -1.00 -0.54 0.00 0.00 175.26 174.60 2ed9 h PRO 82 N 8.12 0.00 -0.32 4.30 0.13 -1.86 -3.33 132.00 139.04 2ed9 h PRO 82 Ca -0.14 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 65.01 2ed9 h PRO 82 Cb 1.03 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.12 2ed9 h PRO 82 CO 0.45 0.32 -0.19 0.09 -0.23 0.00 0.00 178.00 178.45 2ed9 n ASN 83 N -3.67 -0.34 -2.56 1.44 3.02 -1.26 -4.77 115.26 107.12 2ed9 n ASN 83 Ca -0.01 1.12 -0.13 0.00 -0.03 0.00 0.00 54.58 55.53 2ed9 n ASN 83 Cb 0.43 -0.35 -0.04 0.00 -0.61 0.00 0.00 39.78 39.21 2ed9 n ASN 83 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2ed9 n ASN 84 N -3.68 0.21 -1.75 6.41 3.02 -1.25 -5.04 115.26 113.19 2ed9 n ASN 84 Ca 0.01 -2.30 0.03 0.00 -0.03 0.00 0.00 54.58 52.29 2ed9 n ASN 84 Cb 0.08 0.84 0.33 0.00 -0.61 0.00 0.00 39.78 40.42 2ed9 n ASN 84 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2ed9 n LEU 85 N 0.00 5.23 -4.06 3.41 4.77 -1.26 -4.86 117.00 120.22 2ed9 n LEU 85 Ca 0.01 -2.67 -0.15 0.00 -0.03 0.00 0.00 56.01 53.17 2ed9 n LEU 85 Cb 0.36 -0.68 -0.13 0.00 -2.33 0.00 0.00 43.42 40.65 2ed9 n LEU 85 CO 0.19 0.62 -0.42 -1.66 -1.33 0.00 0.00 177.39 174.79 2ed9 s TRP 86 N -2.56 0.78 -0.05 -1.77 1.48 -1.26 -2.27 118.94 113.29 2ed9 s TRP 86 Ca 0.47 -0.37 0.01 0.00 -1.06 0.00 0.00 56.10 55.15 2ed9 s TRP 86 Cb 0.37 -0.47 0.02 0.00 -1.16 0.00 0.00 33.47 32.23 2ed9 s TRP 86 CO 0.13 -0.03 -0.05 -0.47 -4.06 0.00 0.00 176.95 172.47 2ed9 s TYR 87 N -0.97 0.85 -0.39 1.66 6.14 -0.19 -4.98 117.35 119.47 2ed9 s TYR 87 Ca -0.04 -0.26 -0.09 0.00 0.64 0.00 0.00 57.07 57.31 2ed9 s TYR 87 Cb -0.08 -0.75 0.06 0.00 0.42 0.00 0.00 41.96 41.61 2ed9 s TYR 87 CO 0.01 -0.23 0.21 -1.17 0.64 0.00 0.00 175.55 175.01 2ed9 s LEU 88 N 1.04 4.86 -0.01 6.97 1.98 -1.26 -1.31 118.68 130.95 2ed9 s LEU 88 Ca -0.09 -1.28 -0.06 0.00 -2.89 0.00 0.00 54.13 49.81 2ed9 s LEU 88 Cb -0.14 -1.97 -0.04 0.00 0.66 0.00 0.00 46.19 44.69 2ed9 s LEU 88 CO -0.01 -0.45 0.23 -0.36 -1.89 0.00 0.00 176.35 173.88 2ed9 s PHE 89 N 1.46 3.58 0.01 5.38 0.08 -0.86 -4.98 117.98 122.64 2ed9 s PHE 89 Ca 0.02 0.52 -0.07 0.00 0.12 0.00 0.00 56.93 57.52 2ed9 s PHE 89 Cb -0.21 -1.95 -0.00 0.00 -0.57 0.00 0.00 43.02 40.29 2ed9 s PHE 89 CO 0.04 0.64 0.12 0.95 -0.10 0.00 0.00 175.22 176.87 2ed9 s THR 90 N -1.27 0.09 0.00 0.64 -4.23 -1.26 -1.61 115.64 108.00 2ed9 s THR 90 Ca 0.26 -0.78 0.00 0.00 -1.18 0.00 0.00 61.69 59.99 2ed9 s THR 90 Cb -0.13 -0.52 0.00 0.00 1.34 0.00 0.00 72.50 73.19 2ed9 s THR 90 CO 0.15 -0.43 0.00 0.61 -0.54 0.00 0.00 174.62 174.41 2ed9 n GLY 91 N 1.31 0.86 3.40 3.99 0.00 0.35 -4.99 105.19 110.11 2ed9 n GLY 91 Ca -0.22 -0.62 -0.21 0.00 0.00 0.00 0.00 46.02 44.97 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 -0.71 2.56 -0.14 0.99 1.43 -1.25 -5.07 118.68 116.49 2ed9 s LEU 92 Ca 0.00 -1.01 -0.29 0.00 -1.03 0.00 0.00 54.13 51.80 2ed9 s LEU 92 Cb 0.00 -0.87 -0.01 0.00 0.03 0.00 0.00 46.19 45.34 2ed9 s LEU 92 CO 0.00 -0.07 0.99 -0.70 0.23 0.00 0.00 176.35 176.80 2ed9 s GLU 93 N -3.50 4.37 0.45 1.70 2.56 -1.26 -4.52 118.70 118.50 2ed9 s GLU 93 Ca 0.25 1.33 -0.24 0.00 0.00 0.00 0.00 54.97 56.31 2ed9 s GLU 93 Cb -0.03 -3.57 -0.09 0.00 2.00 0.00 0.00 34.13 32.44 2ed9 s GLU 93 CO 0.10 -0.39 1.26 0.36 -0.56 0.00 0.00 175.26 176.03 2ed9 n LYS 94 N 5.34 1.82 -2.84 4.30 2.85 -1.26 -3.81 118.16 124.56 2ed9 n LYS 94 Ca 0.09 0.65 -0.00 0.00 -1.05 0.00 0.00 58.31 58.00 2ed9 n LYS 94 Cb 0.48 -2.39 0.00 0.00 -0.65 0.00 0.00 35.03 32.47 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 0.84 -1.12 3.74 2.58 0.00 -1.23 -4.96 105.19 105.04 2ed9 n GLY 95 Ca 0.08 0.40 -0.08 0.00 0.00 0.00 0.00 46.02 46.41 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 -2.85 -0.10 -0.06 1.61 0.01 -1.25 -4.98 113.70 106.09 2ed9 s SER 96 Ca 0.01 -0.85 0.03 0.00 1.31 0.00 0.00 55.95 56.45 2ed9 s SER 96 Cb -0.00 0.69 -0.03 0.00 0.21 0.00 0.00 66.02 66.89 2ed9 s SER 96 CO 0.65 -1.32 -0.12 -1.58 0.41 0.00 0.00 173.24 171.28 2ed9 s GLN 97 N -3.69 2.61 0.04 12.44 0.74 -1.26 -1.70 119.66 128.84 2ed9 s GLN 97 Ca 0.17 -0.65 0.02 0.00 0.05 0.00 0.00 55.36 54.94 2ed9 s GLN 97 Cb -0.04 -2.45 -0.02 0.00 1.10 0.00 0.00 33.01 31.60 2ed9 s GLN 97 CO 0.09 0.62 -0.07 0.71 -0.55 0.00 0.00 175.29 176.09 2ed9 s TYR 98 N -0.71 0.59 0.24 1.67 2.02 -0.89 -3.86 117.35 116.41 2ed9 s TYR 98 Ca 0.11 -0.52 0.08 0.00 -0.37 0.00 0.00 57.07 56.36 2ed9 s TYR 98 Cb -0.11 -0.36 -0.04 0.00 -0.40 0.00 0.00 41.96 41.05 2ed9 s TYR 98 CO 0.01 -0.11 0.11 -1.12 -1.57 0.00 0.00 175.55 172.87 2ed9 s SER 99 N -1.61 5.16 0.25 2.29 0.01 -0.64 -1.54 113.70 117.61 2ed9 s SER 99 Ca -0.10 -0.38 -0.11 0.00 1.31 0.00 0.00 55.95 56.67 2ed9 s SER 99 Cb -0.09 -1.20 -0.01 0.00 0.21 0.00 0.00 66.02 64.93 2ed9 s SER 99 CO -0.00 -0.01 0.45 -0.36 0.41 0.00 0.00 173.24 173.73 2ed9 s PHE 100 N -2.13 0.47 -0.17 2.43 0.40 -0.68 -3.38 117.98 114.91 2ed9 s PHE 100 Ca 0.32 -0.82 -0.30 0.00 -0.60 0.00 0.00 56.93 55.53 2ed9 s PHE 100 Cb -0.08 0.11 0.13 0.00 0.51 0.00 0.00 43.02 43.70 2ed9 s PHE 100 CO 0.23 -0.97 1.04 -1.14 0.70 0.00 0.00 175.22 175.07 2ed9 s GLN 101 N -3.97 0.53 0.03 0.44 0.74 -0.97 -2.97 119.66 113.49 2ed9 s GLN 101 Ca 0.24 0.13 0.03 0.00 0.05 0.00 0.00 55.36 55.81 2ed9 s GLN 101 Cb 0.00 0.25 -0.02 0.00 1.10 0.00 0.00 33.01 34.34 2ed9 s GLN 101 CO 0.10 -0.17 -0.10 0.08 -0.55 0.00 0.00 175.29 174.65 2ed9 s VAL 102 N -1.11 0.76 -0.22 1.34 1.01 -1.25 -3.06 120.40 117.87 2ed9 s VAL 102 Ca -0.00 -0.86 -0.08 0.00 0.00 0.00 0.00 61.98 61.04 2ed9 s VAL 102 Cb -0.01 -0.73 0.10 0.00 0.00 0.00 0.00 36.38 35.74 2ed9 s VAL 102 CO 0.00 -0.10 0.48 -0.55 0.00 0.00 0.00 175.10 174.93 2ed9 s SER 103 N -1.07 -0.48 -0.05 3.32 0.15 -1.06 -3.33 113.70 111.18 2ed9 s SER 103 Ca -0.02 1.13 -0.30 0.00 0.70 0.00 0.00 55.95 57.46 2ed9 s SER 103 Cb -0.07 1.53 -0.04 0.00 -1.71 0.00 0.00 66.02 65.72 2ed9 s SER 103 CO 0.01 -0.23 1.26 0.00 1.20 0.00 0.00 173.24 175.48 2ed9 s ALA 104 N 2.58 3.53 -0.18 5.45 0.00 -1.26 -1.69 121.76 130.19 2ed9 s ALA 104 Ca -0.03 0.69 -0.07 0.00 0.00 0.00 0.00 51.96 52.54 2ed9 s ALA 104 Cb -0.12 -3.55 -0.04 0.00 0.00 0.00 0.00 23.12 19.42 2ed9 s ALA 104 CO -0.14 -0.83 0.06 -1.64 0.00 0.00 0.00 175.76 173.21 2ed9 s MET 105 N 2.36 3.95 0.45 0.00 -1.94 -1.05 -3.54 119.30 119.53 2ed9 s MET 105 Ca 0.58 -0.34 0.07 0.00 -1.71 0.00 0.00 55.69 54.29 2ed9 s MET 105 Cb -0.26 -3.21 -0.02 0.00 2.01 0.00 0.00 34.83 33.35 2ed9 s MET 105 CO 0.23 0.29 0.26 0.95 -0.01 0.00 0.00 175.02 176.74 2ed9 s THR 106 N 0.31 2.15 0.48 2.05 -4.23 -0.18 -1.02 115.64 115.20 2ed9 s THR 106 Ca 0.03 -1.59 0.16 0.00 -1.18 0.00 0.00 61.69 59.11 2ed9 s THR 106 Cb -0.12 -2.74 0.32 0.00 1.34 0.00 0.00 72.50 71.30 2ed9 s THR 106 CO 0.00 0.00 2.04 1.62 -0.54 0.00 0.00 174.62 177.74 2ed9 h VAL 107 N 1.18 0.91 0.11 2.29 3.04 -1.84 -2.66 116.25 119.27 2ed9 h VAL 107 Ca -0.41 -0.08 -0.01 0.00 -1.01 0.00 0.00 66.70 65.20 2ed9 h VAL 107 Cb 1.27 0.66 0.00 0.00 -2.01 0.00 0.00 31.29 31.22 2ed9 h VAL 107 CO 0.65 0.04 -0.05 0.78 -1.01 0.00 0.00 177.57 177.97 2ed9 h ASN 108 N 0.22 -0.12 -0.08 3.17 -0.26 -1.91 -3.50 115.58 113.10 2ed9 h ASN 108 Ca 0.19 -0.45 0.00 0.00 -0.56 0.00 0.00 56.30 55.48 2ed9 h ASN 108 Cb 0.45 0.03 0.00 0.00 -1.06 0.00 0.00 38.32 37.75 2ed9 h ASN 108 CO -0.03 0.48 0.00 0.61 -1.06 0.00 0.00 177.43 177.42 2ed9 n GLY 109 N 0.73 0.58 3.97 2.83 0.00 -1.00 -4.96 105.19 107.33 2ed9 n GLY 109 Ca -0.08 -0.79 -0.21 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.09 5.01 0.43 2.61 2.01 -1.26 -1.01 115.64 121.34 2ed9 s THR 110 Ca 0.00 -0.89 0.05 0.00 0.31 0.00 0.00 61.69 61.16 2ed9 s THR 110 Cb 0.00 -3.78 0.05 0.00 0.01 0.00 0.00 72.50 68.79 2ed9 s THR 110 CO 0.00 -0.34 0.45 0.61 -0.69 0.00 0.00 174.62 174.65 2ed9 n GLY 111 N -1.53 2.42 3.77 4.40 0.00 -1.23 -4.49 105.19 108.54 2ed9 n GLY 111 Ca -0.07 -2.24 -0.36 0.00 0.00 0.00 0.00 46.02 43.36 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 -3.85 3.52 0.22 1.61 0.04 -1.24 -4.92 135.00 130.37 2ed9 s PRO 112 Ca 0.34 1.68 -0.30 0.00 0.04 0.00 0.00 61.00 62.76 2ed9 s PRO 112 Cb -0.03 -2.17 -0.09 0.00 0.04 0.00 0.00 34.50 32.26 2ed9 s PRO 112 CO 0.22 -0.72 1.28 -1.25 0.04 0.00 0.00 177.00 176.57 2ed9 s PRO 113 N -3.05 4.41 0.78 0.56 0.04 -1.26 -4.74 135.00 131.74 2ed9 s PRO 113 Ca 0.69 2.04 -0.12 0.00 0.04 0.00 0.00 61.00 63.66 2ed9 s PRO 113 Cb -0.26 -3.18 0.06 0.00 0.04 0.00 0.00 34.50 31.16 2ed9 s PRO 113 CO 0.30 -0.19 1.12 -1.54 0.04 0.00 0.00 177.00 176.72 2ed9 s SER 114 N 0.11 4.75 0.10 6.66 1.04 -1.21 -4.94 113.70 120.20 2ed9 s SER 114 Ca 0.54 1.10 -0.36 0.00 0.48 0.00 0.00 55.95 57.71 2ed9 s SER 114 Cb -0.36 -1.79 -0.17 0.00 0.10 0.00 0.00 66.02 63.80 2ed9 s SER 114 CO 0.40 -1.78 1.24 0.59 0.98 0.00 0.00 173.24 174.67 2ed9 n ASN 115 N -3.29 1.28 -4.55 7.02 4.13 -1.26 -4.76 115.26 113.82 2ed9 n ASN 115 Ca 0.07 1.13 -0.38 0.00 1.68 0.00 0.00 54.58 57.08 2ed9 n ASN 115 Cb 0.58 -1.15 -0.03 0.00 -1.54 0.00 0.00 39.78 37.64 2ed9 n ASN 115 CO 0.00 0.00 0.00 0.26 0.28 0.00 0.00 177.26 177.80 2ed9 s TRP 116 N 0.23 1.56 0.04 3.10 0.52 -1.26 -4.82 118.94 118.30 2ed9 s TRP 116 Ca 0.82 0.92 -0.28 0.00 0.02 0.00 0.00 56.10 57.58 2ed9 s TRP 116 Cb -0.97 -4.00 -0.04 0.00 -1.15 0.00 0.00 33.47 27.30 2ed9 s TRP 116 CO 0.50 -2.41 0.90 0.71 0.02 0.00 0.00 176.95 176.66 2ed9 s TYR 117 N 9.45 3.71 0.03 -1.98 1.51 -1.16 -4.87 117.35 124.05 2ed9 s TYR 117 Ca 0.74 1.63 0.01 0.00 -1.01 0.00 0.00 57.07 58.45 2ed9 s TYR 117 Cb -0.14 -3.00 -0.04 0.00 -0.11 0.00 0.00 41.96 38.66 2ed9 s TYR 117 CO 0.23 0.12 0.06 0.99 -1.11 0.00 0.00 175.55 175.84 2ed9 s THR 118 N 0.47 4.52 -0.04 -0.71 2.01 -1.26 -1.69 115.64 118.94 2ed9 s THR 118 Ca 0.46 -0.59 0.00 0.00 0.31 0.00 0.00 61.69 61.87 2ed9 s THR 118 Cb -0.21 -3.10 0.03 0.00 0.01 0.00 0.00 72.50 69.23 2ed9 s THR 118 CO 0.26 0.27 -0.00 0.00 -0.69 0.00 0.00 174.62 174.46 2ed9 s ALA 119 N -1.24 0.45 -0.35 7.40 0.00 -0.59 -4.96 121.76 122.46 2ed9 s ALA 119 Ca 0.24 0.07 -0.13 0.00 0.00 0.00 0.00 51.96 52.15 2ed9 s ALA 119 Cb -0.12 -0.43 -0.01 0.00 0.00 0.00 0.00 23.12 22.56 2ed9 s ALA 119 CO 0.16 -0.16 0.24 -1.21 0.00 0.00 0.00 175.76 174.80 2ed9 s GLU 120 N 1.24 3.33 0.45 0.00 2.02 -1.26 -2.10 118.70 122.38 2ed9 s GLU 120 Ca -0.07 -0.76 -0.24 0.00 0.02 0.00 0.00 54.97 53.92 2ed9 s GLU 120 Cb -0.13 -3.82 -0.07 0.00 0.10 0.00 0.00 34.13 30.20 2ed9 s GLU 120 CO -0.02 -0.52 1.30 0.95 0.02 0.00 0.00 175.26 176.99 2ed9 s THR 121 N 1.69 2.55 0.33 3.63 -4.23 -0.69 -4.94 115.64 113.98 2ed9 s THR 121 Ca 0.05 0.45 -0.28 0.00 -1.18 0.00 0.00 61.69 60.73 2ed9 s THR 121 Cb -0.18 -3.25 -0.10 0.00 1.34 0.00 0.00 72.50 70.31 2ed9 s THR 121 CO 0.10 0.04 1.22 -2.16 -0.54 0.00 0.00 174.62 173.28 2ed9 s PRO 122 N -2.51 4.39 0.43 3.99 0.04 -1.26 -3.64 135.00 136.45 2ed9 s PRO 122 Ca 0.62 2.03 0.24 0.00 0.04 0.00 0.00 61.00 63.93 2ed9 s PRO 122 Cb -0.37 -3.04 0.79 0.00 0.04 0.00 0.00 34.50 31.91 2ed9 s PRO 122 CO 0.46 -0.09 1.77 0.93 0.04 0.00 0.00 177.00 180.11 2ed9 h GLU 123 N 3.39 0.00 -0.02 4.56 5.08 -1.93 -3.27 114.58 122.39 2ed9 h GLU 123 Ca -0.48 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 2ed9 h GLU 123 Cb 1.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 2ed9 h GLU 123 CO 0.65 0.21 0.00 0.09 -1.00 0.00 0.00 179.01 178.96