#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wif s SER 2 N 0.00 -0.03 0.43 1.61 0.01 -1.26 -5.18 113.70 109.28 1wif s SER 2 Ca 0.00 -0.03 0.07 0.00 1.31 0.00 0.00 55.95 57.31 1wif s SER 2 Cb 0.00 0.04 -0.02 0.00 0.21 0.00 0.00 66.02 66.25 1wif s SER 2 CO 0.00 -0.00 0.33 -0.94 0.41 0.00 0.00 173.24 173.04 1wif s SER 3 N 1.59 4.84 0.16 2.44 1.04 -1.26 -5.14 113.70 117.37 1wif s SER 3 Ca 0.17 -0.88 -0.22 0.00 0.48 0.00 0.00 55.95 55.50 1wif s SER 3 Cb 0.09 -0.45 0.08 0.00 0.10 0.00 0.00 66.02 65.84 1wif s SER 3 CO -0.15 -0.67 1.06 0.61 0.98 0.00 0.00 173.24 175.07 1wif n GLY 4 N -1.49 0.55 3.55 7.32 0.00 -1.26 -5.19 105.19 108.67 1wif n GLY 4 Ca 0.02 -1.14 -0.09 0.00 0.00 0.00 0.00 46.02 44.81 1wif n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wif s SER 5 N -3.48 -0.35 0.16 1.61 0.15 -1.26 -5.19 113.70 105.33 1wif s SER 5 Ca 0.24 0.24 -0.25 0.00 0.70 0.00 0.00 55.95 56.88 1wif s SER 5 Cb -0.03 0.32 0.06 0.00 -1.71 0.00 0.00 66.02 64.67 1wif s SER 5 CO 0.05 -0.43 0.95 -0.94 1.20 0.00 0.00 173.24 174.07 1wif s SER 6 N -1.64 -0.18 0.00 5.45 1.04 -1.26 -5.18 113.70 111.93 1wif s SER 6 Ca 0.01 -0.41 0.00 0.00 0.48 0.00 0.00 55.95 56.03 1wif s SER 6 Cb -0.01 0.50 0.00 0.00 0.10 0.00 0.00 66.02 66.61 1wif s SER 6 CO -0.02 -0.92 0.00 0.61 0.98 0.00 0.00 173.24 173.89 1wif n GLY 7 N -0.47 -2.49 2.47 7.32 0.00 -1.26 -4.61 105.19 106.15 1wif n GLY 7 Ca -0.06 -1.22 -0.33 0.00 0.00 0.00 0.00 46.02 44.41 1wif n GLY 7 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1wif n SER 8 N 0.00 0.30 -3.66 1.61 2.88 -1.26 -4.87 113.62 108.62 1wif n SER 8 Ca 0.00 0.23 -0.11 0.00 -1.33 0.00 0.00 58.87 57.66 1wif n SER 8 Cb 0.00 -0.66 0.04 0.00 -0.75 0.00 0.00 64.21 62.84 1wif n SER 8 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1wif n LYS 9 N 5.92 0.74 -0.75 -1.46 4.81 -1.26 -5.01 118.16 121.15 1wif n LYS 9 Ca 0.45 -1.77 0.06 0.00 -0.87 0.00 0.00 58.31 56.19 1wif n LYS 9 Cb 0.01 -0.15 0.34 0.00 0.02 0.00 0.00 35.03 35.25 1wif n LYS 9 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1wif n ASN 10 N -2.64 4.97 -0.57 3.14 2.85 -1.26 -4.11 115.26 117.63 1wif n ASN 10 Ca 0.09 -2.76 -0.02 0.00 -0.11 0.00 0.00 54.58 51.79 1wif n ASN 10 Cb 0.34 -0.65 -0.02 0.00 1.24 0.00 0.00 39.78 40.69 1wif n ASN 10 CO 0.00 0.00 0.00 -1.84 -2.11 0.00 0.00 177.26 173.31 1wif n GLU 11 N 0.56 0.00 -4.02 1.20 0.28 -1.26 -5.14 120.64 112.26 1wif n GLU 11 Ca 0.23 -0.25 -0.08 0.00 -0.16 0.00 0.00 57.16 56.91 1wif n GLU 11 Cb 1.04 0.14 -0.10 0.00 1.43 0.00 0.00 31.44 33.96 1wif n GLU 11 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 1wif s LYS 12 N 0.00 0.59 0.53 3.44 1.02 -1.26 -5.17 119.74 118.89 1wif s LYS 12 Ca 0.00 -1.01 0.06 0.00 0.02 0.00 0.00 55.97 55.04 1wif s LYS 12 Cb 0.00 0.21 0.09 0.00 -0.52 0.00 0.00 37.83 37.62 1wif s LYS 12 CO 0.00 -0.12 0.74 0.39 -0.92 0.00 0.00 175.35 175.43 1wif n GLU 13 N 0.44 0.49 -1.88 1.68 4.71 -1.26 -4.36 120.64 120.46 1wif n GLU 13 Ca -0.17 -2.62 0.00 0.00 -0.01 0.00 0.00 57.16 54.37 1wif n GLU 13 Cb 0.60 -0.30 0.00 0.00 -1.01 0.00 0.00 31.44 30.73 1wif n GLU 13 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 1wif n GLN 14 N -2.22 -5.26 0.03 3.49 6.02 -1.26 -4.85 117.38 113.33 1wif n GLN 14 Ca 0.14 3.80 -0.01 0.00 -0.01 0.00 0.00 57.00 60.92 1wif n GLN 14 Cb 0.52 -4.19 -0.00 0.00 1.02 0.00 0.00 30.24 27.58 1wif n GLN 14 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1wif n LEU 15 N 0.50 1.18 -4.45 1.08 7.99 -1.26 -4.10 117.00 117.94 1wif n LEU 15 Ca 0.00 0.16 -0.22 0.00 -0.01 0.00 0.00 56.01 55.94 1wif n LEU 15 Cb 0.00 -0.38 -0.10 0.00 -0.11 0.00 0.00 43.42 42.83 1wif n LEU 15 CO 0.00 -0.69 -0.33 -0.44 -1.51 0.00 0.00 177.39 174.42 1wif s SER 16 N -5.97 2.73 0.17 -1.43 0.01 -1.26 -4.35 113.70 103.61 1wif s SER 16 Ca -0.03 -1.25 0.02 0.00 1.31 0.00 0.00 55.95 56.00 1wif s SER 16 Cb 0.00 -0.16 -0.04 0.00 0.21 0.00 0.00 66.02 66.04 1wif s SER 16 CO 0.05 -0.42 0.32 -0.54 0.41 0.00 0.00 173.24 173.05 1wif s LYS 17 N -3.77 3.45 -0.49 12.44 1.02 -1.26 -5.08 119.74 126.05 1wif s LYS 17 Ca 0.32 -0.58 0.06 0.00 0.02 0.00 0.00 55.97 55.79 1wif s LYS 17 Cb 0.06 -2.93 0.18 0.00 -0.52 0.00 0.00 37.83 34.62 1wif s LYS 17 CO 0.13 0.48 0.63 0.00 -0.92 0.00 0.00 175.35 175.68 1wif s ALA 18 N -1.81 -1.30 0.34 5.17 0.00 -1.26 -5.15 121.76 117.75 1wif s ALA 18 Ca 0.35 -0.86 0.01 0.00 0.00 0.00 0.00 51.96 51.46 1wif s ALA 18 Cb -0.11 -2.45 -0.00 0.00 0.00 0.00 0.00 23.12 20.56 1wif s ALA 18 CO 0.29 -2.18 0.04 1.17 0.00 0.00 0.00 175.76 175.08 1wif n LYS 19 N 3.00 0.94 -1.41 0.00 3.00 -1.26 -5.16 118.16 117.27 1wif n LYS 19 Ca 0.20 -2.58 -0.25 0.00 -0.00 0.00 0.00 58.31 55.68 1wif n LYS 19 Cb 0.54 0.97 0.19 0.00 0.00 0.00 0.00 35.03 36.72 1wif n LYS 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1wif n ALA 20 N -1.75 -1.75 -1.10 3.14 0.00 -1.26 -4.86 120.51 112.93 1wif n ALA 20 Ca -0.14 -1.45 -0.43 0.00 0.00 0.00 0.00 53.44 51.43 1wif n ALA 20 Cb 0.45 -0.08 -0.06 0.00 0.00 0.00 0.00 19.45 19.76 1wif n ALA 20 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1wif n SER 21 N -3.97 2.48 -4.81 0.00 2.88 -1.26 -4.88 113.62 104.06 1wif n SER 21 Ca 0.14 -2.66 -0.26 0.00 -1.33 0.00 0.00 58.87 54.76 1wif n SER 21 Cb 0.49 -1.08 -0.05 0.00 -0.75 0.00 0.00 64.21 62.82 1wif n SER 21 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1wif s VAL 22 N 5.07 4.53 0.00 2.46 1.01 -1.26 -5.05 120.40 127.16 1wif s VAL 22 Ca 0.57 -1.09 0.00 0.00 0.00 0.00 0.00 61.98 61.46 1wif s VAL 22 Cb 0.14 -3.33 0.00 0.00 0.00 0.00 0.00 36.38 33.19 1wif s VAL 22 CO 0.13 -0.14 0.00 -1.20 0.00 0.00 0.00 175.10 173.89 1wif n SER 23 N -0.46 0.00 -2.51 3.32 7.64 -1.26 -5.07 113.62 115.28 1wif n SER 23 Ca -0.08 0.00 -0.03 0.00 1.01 0.00 0.00 58.87 59.77 1wif n SER 23 Cb 0.55 0.00 0.09 0.00 -1.01 0.00 0.00 64.21 63.84 1wif n SER 23 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1wif n SER 24 N 0.00 -1.34 -4.75 6.43 2.88 -1.26 -5.15 113.62 110.43 1wif n SER 24 Ca 0.00 -2.04 -0.37 0.00 -1.33 0.00 0.00 58.87 55.13 1wif n SER 24 Cb 0.00 0.72 0.03 0.00 -0.75 0.00 0.00 64.21 64.21 1wif n SER 24 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1wif s LEU 25 N -3.04 3.73 -0.22 2.46 1.02 -1.26 -5.02 118.68 116.34 1wif s LEU 25 Ca 0.11 2.48 0.00 0.00 0.02 0.00 0.00 54.13 56.74 1wif s LEU 25 Cb 0.33 -4.50 0.05 0.00 0.02 0.00 0.00 46.19 42.09 1wif s LEU 25 CO -0.09 -1.56 -0.06 0.20 0.02 0.00 0.00 176.35 174.86 1wif s ASN 26 N -1.42 3.59 -0.11 2.29 0.01 -1.26 -5.12 114.94 112.92 1wif s ASN 26 Ca 0.75 -1.04 -0.03 0.00 -0.71 0.00 0.00 52.86 51.84 1wif s ASN 26 Cb -0.33 -1.13 -0.03 0.00 0.41 0.00 0.00 41.25 40.17 1wif s ASN 26 CO 0.37 -0.21 -0.02 -0.75 -1.51 0.00 0.00 177.10 174.98 1wif s LYS 27 N 1.44 3.27 0.00 -0.60 2.20 -1.26 -5.11 119.74 119.68 1wif s LYS 27 Ca -0.04 -0.46 -0.01 0.00 -0.36 0.00 0.00 55.97 55.10 1wif s LYS 27 Cb -0.18 -2.84 -0.04 0.00 -1.51 0.00 0.00 37.83 33.26 1wif s LYS 27 CO -0.07 0.51 0.12 0.08 -0.36 0.00 0.00 175.35 175.63 1wif s VAL 28 N -0.35 5.01 -0.13 4.02 1.01 -1.26 -4.45 120.40 124.24 1wif s VAL 28 Ca 0.06 -0.34 -0.19 0.00 0.00 0.00 0.00 61.98 61.52 1wif s VAL 28 Cb -0.12 -3.32 -0.04 0.00 0.00 0.00 0.00 36.38 32.90 1wif s VAL 28 CO 0.02 0.32 0.50 -0.63 0.00 0.00 0.00 175.10 175.31 1wif s ILE 29 N -1.27 5.16 -0.23 2.22 -1.09 0.18 -4.97 121.20 121.21 1wif s ILE 29 Ca 0.25 0.99 -0.07 0.00 -2.23 0.00 0.00 60.65 59.59 1wif s ILE 29 Cb -0.12 -3.84 0.10 0.00 -1.58 0.00 0.00 42.46 37.03 1wif s ILE 29 CO 0.17 0.29 0.47 0.00 -1.23 0.00 0.00 174.94 174.64 1wif s GLN 30 N 0.83 0.39 0.05 2.79 -2.07 -1.25 -0.02 119.66 120.38 1wif s GLN 30 Ca 0.26 1.11 -0.08 0.00 -1.82 0.00 0.00 55.36 54.84 1wif s GLN 30 Cb -0.15 0.43 -0.00 0.00 -1.09 0.00 0.00 33.01 32.19 1wif s GLN 30 CO 0.11 -0.27 0.15 -0.08 -1.32 0.00 0.00 175.29 173.88 1wif s THR 31 N 2.68 0.13 -0.39 3.63 -1.32 -1.17 -4.97 115.64 114.24 1wif s THR 31 Ca -0.01 -1.07 -0.16 0.00 -1.21 0.00 0.00 61.69 59.24 1wif s THR 31 Cb -0.12 -1.03 0.01 0.00 -1.51 0.00 0.00 72.50 69.85 1wif s THR 31 CO -0.15 -0.59 0.39 -0.54 -2.21 0.00 0.00 174.62 171.53 1wif s LYS 32 N -2.93 3.26 0.08 7.08 3.01 -1.26 -2.34 119.74 126.64 1wif s LYS 32 Ca -0.02 -0.66 -0.15 0.00 -1.01 0.00 0.00 55.97 54.13 1wif s LYS 32 Cb 0.01 -3.91 -0.06 0.00 -1.01 0.00 0.00 37.83 32.86 1wif s LYS 32 CO -0.06 -0.72 0.49 -0.51 0.51 0.00 0.00 175.35 175.06 1wif s LEU 33 N 2.03 4.42 -0.78 3.17 1.43 -1.22 -4.92 118.68 122.81 1wif s LEU 33 Ca 0.11 1.03 -0.17 0.00 -1.03 0.00 0.00 54.13 54.07 1wif s LEU 33 Cb -0.17 -2.94 0.15 0.00 0.03 0.00 0.00 46.19 43.26 1wif s LEU 33 CO 0.12 0.21 0.86 -0.89 0.23 0.00 0.00 176.35 176.89 1wif s THR 34 N -1.27 5.07 0.27 5.49 2.01 -1.26 -3.97 115.64 121.98 1wif s THR 34 Ca 0.31 -1.69 -0.26 0.00 0.31 0.00 0.00 61.69 60.36 1wif s THR 34 Cb -0.16 -4.57 -0.16 0.00 0.01 0.00 0.00 72.50 67.61 1wif s THR 34 CO 0.17 -1.21 0.42 0.52 -0.69 0.00 0.00 174.62 173.83 1wif n VAL 35 N 4.99 1.60 -4.11 3.82 0.31 -1.24 -4.63 118.33 119.07 1wif n VAL 35 Ca 0.09 -0.50 -0.26 0.00 -0.01 0.00 0.00 64.34 63.66 1wif n VAL 35 Cb 0.46 -0.08 -0.02 0.00 -0.91 0.00 0.00 33.84 33.29 1wif n VAL 35 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1wif n GLY 36 N 2.05 3.01 0.27 2.92 0.00 -1.26 -2.21 105.19 109.97 1wif n GLY 36 Ca 0.15 -2.31 0.05 0.00 0.00 0.00 0.00 46.02 43.91 1wif n GLY 36 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1wif h ASN 37 N 0.77 0.28 0.23 1.61 2.35 -1.93 0.44 115.58 119.33 1wif h ASN 37 Ca -0.35 0.10 0.00 0.00 -0.55 0.00 0.00 56.30 55.51 1wif h ASN 37 Cb 1.19 0.08 0.00 0.00 0.05 0.00 0.00 38.32 39.64 1wif h ASN 37 CO 0.55 0.12 -0.46 0.18 -1.65 0.00 0.00 177.43 176.17 1wif n LEU 38 N -4.99 1.07 -1.15 1.61 4.32 -1.26 -4.96 117.00 111.63 1wif n LEU 38 Ca 0.14 -0.32 0.00 0.00 -0.02 0.00 0.00 56.01 55.81 1wif n LEU 38 Cb 0.39 -0.12 0.00 0.00 -1.62 0.00 0.00 43.42 42.08 1wif n LEU 38 CO 0.19 0.22 -0.35 0.61 -1.22 0.00 0.00 177.39 176.83 1wif n GLY 39 N 1.42 -3.81 3.49 -0.72 0.00 0.14 -4.58 105.19 101.13 1wif n GLY 39 Ca 0.09 -0.95 -0.42 0.00 0.00 0.00 0.00 46.02 44.74 1wif n GLY 39 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1wif n LEU 40 N -2.10 1.02 -0.62 0.99 -0.00 -1.26 -4.74 117.00 110.29 1wif n LEU 40 Ca 0.00 0.06 0.09 0.00 -0.00 0.00 0.00 56.01 56.16 1wif n LEU 40 Cb 0.30 -1.12 0.29 0.00 -0.00 0.00 0.00 43.42 42.88 1wif n LEU 40 CO 0.00 -0.95 0.72 0.61 -0.00 0.00 0.00 177.39 177.77 1wif n GLY 41 N 6.46 0.49 0.00 1.47 0.00 -1.26 -4.96 105.19 107.39 1wif n GLY 41 Ca 0.55 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1wif n GLY 41 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1wif n LEU 42 N 0.45 0.00 -4.52 0.99 -0.00 -1.26 -4.69 117.00 107.97 1wif n LEU 42 Ca 0.15 0.00 -0.42 0.00 -0.00 0.00 0.00 56.01 55.73 1wif n LEU 42 Cb 0.33 0.00 -0.02 0.00 -0.00 0.00 0.00 43.42 43.73 1wif n LEU 42 CO 0.11 0.00 1.39 -0.69 -0.00 0.00 0.00 177.39 178.20 1wif s VAL 43 N 0.00 4.30 0.74 1.47 1.01 0.31 -4.89 120.40 123.33 1wif s VAL 43 Ca 0.00 -1.34 -0.08 0.00 0.00 0.00 0.00 61.98 60.55 1wif s VAL 43 Cb 0.00 -4.98 0.07 0.00 0.00 0.00 0.00 36.38 31.47 1wif s VAL 43 CO 0.00 -1.79 1.07 -0.69 0.00 0.00 0.00 175.10 173.69 1wif s VAL 44 N 3.86 2.18 0.03 2.92 1.01 -1.26 -1.77 120.40 127.37 1wif s VAL 44 Ca 0.43 -0.19 0.01 0.00 0.00 0.00 0.00 61.98 62.23 1wif s VAL 44 Cb -0.01 -3.00 -0.02 0.00 0.00 0.00 0.00 36.38 33.35 1wif s VAL 44 CO -0.06 0.00 -0.04 0.27 0.00 0.00 0.00 175.10 175.26 1wif s ILE 45 N -3.35 0.24 -1.00 2.22 -4.36 -0.80 -4.75 121.20 109.39 1wif s ILE 45 Ca 0.61 -0.93 -0.23 0.00 -0.26 0.00 0.00 60.65 59.84 1wif s ILE 45 Cb -0.11 -0.36 0.04 0.00 1.25 0.00 0.00 42.46 43.29 1wif s ILE 45 CO 0.46 -0.44 1.48 -1.58 0.24 0.00 0.00 174.94 175.10 1wif s GLN 46 N -1.44 3.49 -0.56 0.37 -0.44 -1.26 -3.26 119.66 116.56 1wif s GLN 46 Ca -0.14 -1.01 0.04 0.00 -2.50 0.00 0.00 55.36 51.75 1wif s GLN 46 Cb -0.10 -5.28 0.14 0.00 -1.64 0.00 0.00 33.01 26.13 1wif s GLN 46 CO -0.01 -2.29 0.31 1.21 0.50 0.00 0.00 175.29 175.01 1wif s ASN 47 N 5.16 4.47 0.00 6.67 2.47 -1.25 -5.04 114.94 127.42 1wif s ASN 47 Ca 0.47 -3.13 0.00 0.00 0.42 0.00 0.00 52.86 50.63 1wif s ASN 47 Cb -0.01 -1.66 0.00 0.00 -1.45 0.00 0.00 41.25 38.13 1wif s ASN 47 CO -0.08 -0.22 0.00 0.61 -3.72 0.00 0.00 177.10 173.69 1wif n GLY 48 N 2.97 -2.01 0.00 1.21 0.00 -1.26 -4.02 105.19 102.08 1wif n GLY 48 Ca 0.07 -1.51 0.08 0.00 0.00 0.00 0.00 46.02 44.65 1wif n GLY 48 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1wif n PRO 49 N 0.00 0.40 -4.62 1.61 -0.04 -1.26 -4.69 135.00 126.40 1wif n PRO 49 Ca 0.00 0.05 -0.28 0.00 -0.04 0.00 0.00 63.50 63.23 1wif n PRO 49 Cb 0.00 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 31.82 1wif n PRO 49 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1wif s TYR 50 N -2.18 2.12 -0.50 0.54 2.02 -1.26 -4.16 117.35 113.94 1wif s TYR 50 Ca 0.20 -0.40 -0.27 0.00 -0.37 0.00 0.00 57.07 56.24 1wif s TYR 50 Cb 0.10 -1.22 0.03 0.00 -0.40 0.00 0.00 41.96 40.47 1wif s TYR 50 CO 0.19 0.19 1.04 -0.51 -1.57 0.00 0.00 175.55 174.89 1wif s LEU 51 N -1.53 3.81 -0.26 -1.29 2.01 -1.26 -3.95 118.68 116.21 1wif s LEU 51 Ca 0.11 0.16 -0.10 0.00 0.01 0.00 0.00 54.13 54.31 1wif s LEU 51 Cb -0.10 -3.25 -0.04 0.00 0.01 0.00 0.00 46.19 42.81 1wif s LEU 51 CO 0.03 -1.21 0.15 -1.10 1.01 0.00 0.00 176.35 175.23 1wif s GLN 52 N 4.20 3.90 0.78 1.70 -0.21 -1.20 -3.10 119.66 125.73 1wif s GLN 52 Ca 0.41 -0.35 -0.14 0.00 0.02 0.00 0.00 55.36 55.29 1wif s GLN 52 Cb -0.09 -3.52 0.06 0.00 1.00 0.00 0.00 33.01 30.46 1wif s GLN 52 CO 0.27 -0.11 1.18 -0.89 -2.12 0.00 0.00 175.29 173.62 1wif n ILE 53 N 4.79 2.44 0.00 1.08 5.41 -0.56 -1.90 119.36 130.62 1wif n ILE 53 Ca -0.15 -0.26 0.00 0.00 1.00 0.00 0.00 62.75 63.34 1wif n ILE 53 Cb 0.52 -1.22 0.00 0.00 -0.71 0.00 0.00 39.64 38.23 1wif n ILE 53 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 1wif n SER 54 N -2.94 2.99 -3.64 4.38 2.88 -0.13 -3.17 113.62 113.98 1wif n SER 54 Ca 0.14 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.59 1wif n SER 54 Cb 0.50 0.34 -0.07 0.00 -0.75 0.00 0.00 64.21 64.23 1wif n SER 54 CO 0.00 0.00 0.00 -2.28 -1.23 0.00 0.00 175.04 171.53 1wif s HIS 55 N -1.55 -0.47 -0.17 0.66 5.65 -0.73 -4.80 115.29 113.88 1wif s HIS 55 Ca 0.00 1.14 -0.15 0.00 0.25 0.00 0.00 55.06 56.29 1wif s HIS 55 Cb 0.00 0.37 -0.04 0.00 -1.18 0.00 0.00 32.58 31.72 1wif s HIS 55 CO 0.00 -0.23 0.36 -0.51 -0.65 0.00 0.00 174.74 173.71 1wif s LEU 56 N 0.31 4.21 -0.43 8.88 1.43 -1.26 0.11 118.68 131.92 1wif s LEU 56 Ca 0.02 0.55 -0.27 0.00 -1.03 0.00 0.00 54.13 53.40 1wif s LEU 56 Cb -0.05 -2.47 -0.03 0.00 0.03 0.00 0.00 46.19 43.67 1wif s LEU 56 CO -0.07 0.01 1.98 -0.63 0.23 0.00 0.00 176.35 177.87 1wif s ILE 57 N 0.85 3.30 0.31 -0.59 1.09 -1.26 -4.75 121.20 120.15 1wif s ILE 57 Ca 0.19 0.25 0.02 0.00 -1.10 0.00 0.00 60.65 60.01 1wif s ILE 57 Cb -0.14 -3.55 0.42 0.00 -1.06 0.00 0.00 42.46 38.13 1wif s ILE 57 CO 0.07 -0.45 1.55 -3.20 -0.10 0.00 0.00 174.94 172.81 1wif n ASN 58 N 12.25 -0.11 -1.60 3.58 5.15 -1.26 0.18 115.26 133.45 1wif n ASN 58 Ca 0.25 1.69 -0.08 0.00 -0.60 0.00 0.00 54.58 55.84 1wif n ASN 58 Cb 0.50 -0.62 0.03 0.00 -0.53 0.00 0.00 39.78 39.16 1wif n ASN 58 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 1wif n LYS 59 N -5.49 1.41 -1.15 1.20 4.76 -1.26 -4.65 118.16 112.98 1wif n LYS 59 Ca 0.23 -0.84 0.00 0.00 -2.87 0.00 0.00 58.31 54.83 1wif n LYS 59 Cb 0.77 -1.33 0.00 0.00 -1.84 0.00 0.00 35.03 32.63 1wif n LYS 59 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1wif n GLY 60 N 0.64 5.30 0.11 0.72 0.00 0.49 -4.84 105.19 107.61 1wif n GLY 60 Ca 0.16 -1.92 -0.20 0.00 0.00 0.00 0.00 46.02 44.06 1wif n GLY 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wif h ALA 61 N 1.00 0.20 -0.41 4.61 0.00 -1.82 -3.33 119.26 119.52 1wif h ALA 61 Ca 0.00 -1.06 0.06 0.00 0.00 0.00 0.00 54.91 53.91 1wif h ALA 61 Cb 0.00 0.54 -0.05 0.00 0.00 0.00 0.00 17.79 18.27 1wif h ALA 61 CO 0.00 0.65 0.10 0.00 0.00 0.00 0.00 179.25 180.00 1wif h ALA 62 N -0.25 0.45 -0.03 0.00 0.00 -1.91 0.63 119.26 118.16 1wif h ALA 62 Ca -0.28 0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.71 1wif h ALA 62 Cb 1.43 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.30 1wif h ALA 62 CO -0.08 -0.30 0.08 0.00 0.00 0.00 0.00 179.25 178.95 1wif h ALA 63 N 1.30 1.26 -0.01 0.00 0.00 -1.74 0.32 119.26 120.38 1wif h ALA 63 Ca 0.20 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1wif h ALA 63 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1wif h ALA 63 CO -0.24 -0.10 -0.26 0.45 0.00 0.00 0.00 179.25 179.10 1wif n SER 64 N -3.28 1.53 -4.36 0.00 2.88 0.16 -4.83 113.62 105.73 1wif n SER 64 Ca -0.02 -1.24 -0.35 0.00 -1.33 0.00 0.00 58.87 55.93 1wif n SER 64 Cb 0.16 0.20 -0.14 0.00 -0.75 0.00 0.00 64.21 63.68 1wif n SER 64 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1wif s ASP 65 N -2.38 4.38 -0.53 -3.46 2.15 0.11 -5.00 116.67 111.94 1wif s ASP 65 Ca 0.25 -0.33 -0.02 0.00 0.43 0.00 0.00 52.55 52.88 1wif s ASP 65 Cb 0.19 -1.74 0.32 0.00 -0.30 0.00 0.00 42.92 41.39 1wif s ASP 65 CO 0.49 0.04 2.10 0.61 -0.17 0.00 0.00 175.17 178.23 1wif n GLY 66 N 4.42 5.03 0.00 2.66 0.00 -1.26 -4.03 105.19 112.01 1wif n GLY 66 Ca -0.18 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.02 1wif n GLY 66 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1wif n ILE 67 N -0.24 0.00 -3.23 -0.61 -0.00 -1.26 -5.07 119.36 108.96 1wif n ILE 67 Ca 0.48 0.00 -0.07 0.00 -0.00 0.00 0.00 62.75 63.16 1wif n ILE 67 Cb 0.58 0.15 0.01 0.00 -0.00 0.00 0.00 39.64 40.39 1wif n ILE 67 CO 0.00 0.00 0.00 0.18 -0.00 0.00 0.00 176.55 176.73 1wif n LEU 68 N -1.52 0.00 -3.70 1.39 7.99 -1.26 -4.86 117.00 115.04 1wif n LEU 68 Ca 0.00 -0.85 -0.14 0.00 -0.01 0.00 0.00 56.01 55.02 1wif n LEU 68 Cb 0.11 -0.09 -0.07 0.00 -0.11 0.00 0.00 43.42 43.25 1wif n LEU 68 CO 0.00 -0.50 0.11 0.00 -1.51 0.00 0.00 177.39 175.50 1wif s GLN 69 N -2.80 0.81 0.00 3.23 -2.07 -1.26 -5.02 119.66 112.55 1wif s GLN 69 Ca 0.16 -0.22 0.00 0.00 -1.82 0.00 0.00 55.36 53.48 1wif s GLN 69 Cb -0.01 0.36 0.00 0.00 -1.09 0.00 0.00 33.01 32.27 1wif s GLN 69 CO 0.10 -0.25 0.27 -0.35 -1.32 0.00 0.00 175.29 173.74 1wif n PRO 70 N 0.92 0.49 -1.06 9.60 -0.04 -1.26 -2.40 135.00 141.25 1wif n PRO 70 Ca -0.20 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.25 1wif n PRO 70 Cb 0.58 -1.22 -0.02 0.00 -0.04 0.00 0.00 33.50 32.79 1wif n PRO 70 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1wif n GLY 71 N 0.23 0.74 3.95 0.55 0.00 -1.19 -0.96 105.19 108.51 1wif n GLY 71 Ca 0.00 -0.30 -0.24 0.00 0.00 0.00 0.00 46.02 45.48 1wif n GLY 71 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1wif s ASP 72 N -1.22 6.33 -0.36 1.61 1.11 -1.01 -4.67 116.67 118.47 1wif s ASP 72 Ca 0.12 0.25 -0.09 0.00 0.18 0.00 0.00 52.55 53.01 1wif s ASP 72 Cb 0.14 -1.94 0.03 0.00 1.07 0.00 0.00 42.92 42.22 1wif s ASP 72 CO -0.06 -0.09 0.16 -0.69 1.18 0.00 0.00 175.17 175.67 1wif s VAL 73 N -1.98 4.18 0.79 -1.27 1.01 -1.24 -1.50 120.40 120.39 1wif s VAL 73 Ca 0.36 -1.01 -0.11 0.00 0.00 0.00 0.00 61.98 61.22 1wif s VAL 73 Cb -0.10 -3.36 0.07 0.00 0.00 0.00 0.00 36.38 32.99 1wif s VAL 73 CO 0.30 -0.22 1.11 -0.76 0.00 0.00 0.00 175.10 175.54 1wif s LEU 74 N 1.48 3.05 -0.00 3.92 2.01 -1.18 -1.25 118.68 126.70 1wif s LEU 74 Ca 0.00 1.97 0.00 0.00 0.01 0.00 0.00 54.13 56.11 1wif s LEU 74 Cb -0.19 -4.54 0.00 0.00 0.01 0.00 0.00 46.19 41.47 1wif s LEU 74 CO 0.05 -2.25 0.61 -0.38 1.01 0.00 0.00 176.35 175.39 1wif n ILE 75 N -3.50 0.10 0.00 -0.59 5.41 0.35 -4.28 119.36 116.85 1wif n ILE 75 Ca 0.10 -0.10 0.00 0.00 1.00 0.00 0.00 62.75 63.75 1wif n ILE 75 Cb 0.52 0.88 0.00 0.00 -0.71 0.00 0.00 39.64 40.33 1wif n ILE 75 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 1wif n SER 76 N -0.06 0.00 -4.52 4.38 3.41 -1.25 -4.02 113.62 111.57 1wif n SER 76 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.19 1wif n SER 76 Cb 0.51 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.43 1wif n SER 76 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1wif s VAL 77 N 0.00 4.03 0.00 -3.33 1.01 -1.09 -3.84 120.40 117.18 1wif s VAL 77 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 61.98 61.74 1wif s VAL 77 Cb 0.00 -4.87 0.00 0.00 0.00 0.00 0.00 36.38 31.51 1wif s VAL 77 CO 0.00 -1.73 0.00 0.61 0.00 0.00 0.00 175.10 173.98 1wif n GLY 78 N 5.68 0.58 2.83 4.51 0.00 -1.25 -3.91 105.19 113.63 1wif n GLY 78 Ca 0.09 -0.33 -0.04 0.00 0.00 0.00 0.00 46.02 45.74 1wif n GLY 78 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1wif n HIS 79 N -0.84 0.00 -3.79 1.61 -0.00 -1.25 -4.91 115.22 106.04 1wif n HIS 79 Ca 0.00 0.00 -0.35 0.00 0.46 0.00 0.00 57.72 57.83 1wif n HIS 79 Cb 0.32 -2.14 -0.11 0.00 -0.12 0.00 0.00 29.99 27.93 1wif n HIS 79 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1wif s ALA 80 N -1.46 3.40 -0.86 1.57 0.00 -1.25 -5.02 121.76 118.14 1wif s ALA 80 Ca 0.00 -3.06 -0.14 0.00 0.00 0.00 0.00 51.96 48.76 1wif s ALA 80 Cb 0.00 -2.48 -0.25 0.00 0.00 0.00 0.00 23.12 20.39 1wif s ALA 80 CO 0.00 -2.00 2.14 -1.71 0.00 0.00 0.00 175.76 174.20 1wif n ASN 81 N 3.72 -0.37 -0.17 0.00 5.15 -1.26 -2.67 115.26 119.65 1wif n ASN 81 Ca 0.05 -1.00 0.01 0.00 -0.60 0.00 0.00 54.58 53.04 1wif n ASN 81 Cb 0.38 -0.94 0.04 0.00 -0.53 0.00 0.00 39.78 38.72 1wif n ASN 81 CO 0.00 0.00 0.00 1.33 1.40 0.00 0.00 177.26 179.99 1wif n VAL 82 N 6.61 0.12 -0.22 3.44 0.24 -1.26 -4.12 118.33 123.16 1wif n VAL 82 Ca 0.55 -0.11 0.02 0.00 -2.04 0.00 0.00 64.34 62.76 1wif n VAL 82 Cb 0.27 0.03 0.13 0.00 -1.47 0.00 0.00 33.84 32.81 1wif n VAL 82 CO 0.00 0.00 0.00 0.25 -2.14 0.00 0.00 176.83 174.94 1wif h LEU 83 N 0.48 0.13 -3.81 1.34 6.46 -1.75 -1.86 115.31 116.31 1wif h LEU 83 Ca 0.00 0.10 -0.55 0.00 -0.12 0.00 0.00 57.88 57.32 1wif h LEU 83 Cb 0.13 0.11 -0.31 0.00 -0.73 0.00 0.00 40.66 39.86 1wif h LEU 83 CO 0.00 0.07 0.14 0.61 -0.62 0.00 0.00 178.44 178.64 1wif n GLY 84 N -1.31 5.80 4.02 3.75 0.00 -1.26 -4.05 105.19 112.13 1wif n GLY 84 Ca 0.10 -2.17 -0.18 0.00 0.00 0.00 0.00 46.02 43.78 1wif n GLY 84 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1wif s TYR 85 N -3.62 2.42 0.12 1.61 1.51 -0.70 -5.05 117.35 113.64 1wif s TYR 85 Ca 0.56 -0.49 0.10 0.00 -1.01 0.00 0.00 57.07 56.23 1wif s TYR 85 Cb 0.46 -2.33 -0.04 0.00 -0.11 0.00 0.00 41.96 39.94 1wif s TYR 85 CO 0.02 -0.63 -0.25 0.95 -1.11 0.00 0.00 175.55 174.53 1wif s THR 86 N -2.44 2.06 0.52 -0.71 -4.23 -1.26 -4.54 115.64 105.04 1wif s THR 86 Ca 0.57 -1.70 0.44 0.00 -1.18 0.00 0.00 61.69 59.82 1wif s THR 86 Cb -0.09 -1.85 0.66 0.00 1.34 0.00 0.00 72.50 72.56 1wif s THR 86 CO 0.35 0.02 1.60 0.25 -0.54 0.00 0.00 174.62 176.30 1wif h LEU 87 N 3.91 0.07 0.00 4.79 5.85 -1.96 1.21 115.31 129.17 1wif h LEU 87 Ca -0.49 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.27 1wif h LEU 87 Cb 1.18 0.04 -0.00 0.00 0.37 0.00 0.00 40.66 42.25 1wif h LEU 87 CO 0.40 -0.07 -0.08 0.03 -0.34 0.00 0.00 178.44 178.38 1wif h ARG 88 N 0.01 0.00 0.00 1.25 3.08 -1.99 -2.67 114.38 114.06 1wif h ARG 88 Ca 0.89 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.94 1wif h ARG 88 Cb 3.35 0.00 0.00 0.00 0.08 0.00 0.00 29.97 33.40 1wif h ARG 88 CO -0.14 0.27 0.00 0.39 -1.07 0.00 0.00 179.97 179.42 1wif n GLU 89 N -4.72 0.04 -0.10 0.04 -0.58 0.30 -2.42 120.64 113.21 1wif n GLU 89 Ca -0.04 0.41 -0.18 0.00 -0.42 0.00 0.00 57.16 56.92 1wif n GLU 89 Cb 0.16 -1.60 -0.10 0.00 -0.57 0.00 0.00 31.44 29.33 1wif n GLU 89 CO 0.00 0.00 0.00 0.35 -0.48 0.00 0.00 177.13 177.00 1wif h PHE 90 N 0.00 0.00 -0.34 -0.32 3.57 0.12 -3.10 116.94 116.87 1wif h PHE 90 Ca 0.00 0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.55 1wif h PHE 90 Cb 0.14 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 38.87 1wif h PHE 90 CO 0.00 1.22 0.23 -0.07 -2.23 0.00 0.00 178.31 177.46 1wif h LEU 91 N -1.00 0.22 -0.15 0.59 -0.00 -1.26 -0.80 115.31 112.92 1wif h LEU 91 Ca -0.27 -0.00 -0.20 0.00 -0.00 0.00 0.00 57.88 57.41 1wif h LEU 91 Cb 1.15 -0.05 -0.03 0.00 -0.00 0.00 0.00 40.66 41.73 1wif h LEU 91 CO -0.16 0.15 -0.93 0.07 -0.00 0.00 0.00 178.44 177.56 1wif h LYS 92 N 0.25 0.02 0.00 1.13 5.09 -1.64 -3.02 116.57 118.41 1wif h LYS 92 Ca 0.15 -0.03 0.00 0.00 0.09 0.00 0.00 60.65 60.86 1wif h LYS 92 Cb 0.28 0.01 0.00 0.00 0.10 0.00 0.00 32.23 32.62 1wif h LYS 92 CO -0.03 0.94 0.00 -0.11 -2.09 0.00 0.00 179.45 178.16 1wif n LEU 93 N -3.46 0.01 -0.05 7.07 7.94 -0.32 -2.87 117.00 125.31 1wif n LEU 93 Ca -0.01 0.93 0.23 0.00 -1.11 0.00 0.00 56.01 56.05 1wif n LEU 93 Cb 0.88 -0.44 0.71 0.00 0.53 0.00 0.00 43.42 45.09 1wif n LEU 93 CO 0.46 -0.44 1.21 -0.07 -1.11 0.00 0.00 177.39 177.44 1wif h LEU 94 N 0.00 0.00 -0.73 -1.96 -0.00 -1.68 0.25 115.31 111.20 1wif h LEU 94 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 1wif h LEU 94 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.66 1wif h LEU 94 CO 0.00 0.00 0.05 0.00 -0.00 0.00 0.00 178.44 178.49 1wif n GLN 95 N -4.31 0.07 -0.41 1.13 1.13 -1.14 0.16 117.38 114.02 1wif n GLN 95 Ca 0.12 0.55 0.10 0.00 -1.94 0.00 0.00 57.00 55.84 1wif n GLN 95 Cb 0.72 -1.78 0.30 0.00 0.11 0.00 0.00 30.24 29.59 1wif n GLN 95 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1wif n ASN 96 N -1.88 3.81 -4.90 1.08 3.02 0.88 -4.94 115.26 112.34 1wif n ASN 96 Ca -0.01 -2.12 -0.29 0.00 -0.03 0.00 0.00 54.58 52.13 1wif n ASN 96 Cb 0.06 -0.48 -0.04 0.00 -0.61 0.00 0.00 39.78 38.72 1wif n ASN 96 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1wif s ILE 97 N -1.32 4.98 0.20 2.41 -1.09 0.12 -5.10 121.20 121.40 1wif s ILE 97 Ca 0.45 0.20 0.05 0.00 -2.23 0.00 0.00 60.65 59.12 1wif s ILE 97 Cb 0.25 -3.71 -0.03 0.00 -1.58 0.00 0.00 42.46 37.38 1wif s ILE 97 CO 0.28 -0.31 0.26 -0.89 -1.23 0.00 0.00 174.94 173.05 1wif s THR 98 N -2.08 4.96 0.58 2.92 2.01 -1.26 -5.05 115.64 117.71 1wif s THR 98 Ca 0.45 -1.01 -0.20 0.00 0.31 0.00 0.00 61.69 61.25 1wif s THR 98 Cb -0.11 -3.62 -0.04 0.00 0.01 0.00 0.00 72.50 68.75 1wif s THR 98 CO 0.29 -0.22 1.28 -0.63 -0.69 0.00 0.00 174.62 174.64 1wif s ILE 99 N -1.90 2.32 -1.17 1.82 1.01 -1.26 -3.52 121.20 118.50 1wif s ILE 99 Ca 0.33 0.22 -0.02 0.00 0.00 0.00 0.00 60.65 61.18 1wif s ILE 99 Cb -0.10 -3.10 -0.02 0.00 0.01 0.00 0.00 42.46 39.26 1wif s ILE 99 CO 0.27 -0.03 0.95 0.61 0.00 0.00 0.00 174.94 176.74 1wif n GLY 100 N 0.69 -0.56 3.21 6.18 0.00 -0.94 -4.97 105.19 108.80 1wif n GLY 100 Ca 0.13 0.23 -0.32 0.00 0.00 0.00 0.00 46.02 46.06 1wif n GLY 100 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wif s THR 101 N -3.40 2.03 -0.51 2.61 2.01 -1.23 -4.92 115.64 112.23 1wif s THR 101 Ca 0.12 -1.00 -0.24 0.00 0.31 0.00 0.00 61.69 60.88 1wif s THR 101 Cb -0.02 -1.76 0.04 0.00 0.01 0.00 0.00 72.50 70.77 1wif s THR 101 CO 0.74 0.55 0.91 -0.69 -0.69 0.00 0.00 174.62 175.45 1wif s VAL 102 N 0.40 4.45 0.16 3.82 1.01 -1.26 -3.63 120.40 125.36 1wif s VAL 102 Ca -0.17 0.41 0.10 0.00 0.00 0.00 0.00 61.98 62.31 1wif s VAL 102 Cb -0.18 -4.48 -0.04 0.00 0.00 0.00 0.00 36.38 31.68 1wif s VAL 102 CO 0.08 -0.99 -0.18 -0.76 0.00 0.00 0.00 175.10 173.24 1wif s LEU 103 N 3.80 2.65 -0.49 3.92 2.01 -1.25 -5.02 118.68 124.30 1wif s LEU 103 Ca 0.32 -0.68 -0.15 0.00 0.01 0.00 0.00 54.13 53.63 1wif s LEU 103 Cb -0.12 -1.43 0.09 0.00 0.01 0.00 0.00 46.19 44.75 1wif s LEU 103 CO 0.21 0.14 0.42 -1.58 1.01 0.00 0.00 176.35 176.55 1wif s GLN 104 N -2.49 2.93 -0.60 1.70 0.74 -1.26 -3.44 119.66 117.24 1wif s GLN 104 Ca 0.20 -1.50 -0.20 0.00 0.05 0.00 0.00 55.36 53.91 1wif s GLN 104 Cb -0.09 -4.15 0.08 0.00 1.10 0.00 0.00 33.01 29.95 1wif s GLN 104 CO 0.11 -1.13 0.79 0.42 -0.55 0.00 0.00 175.29 174.93 1wif s ILE 105 N 1.60 4.64 -0.32 -2.34 -1.09 -0.99 -3.85 121.20 118.86 1wif s ILE 105 Ca 0.04 -0.64 -0.14 0.00 -2.23 0.00 0.00 60.65 57.68 1wif s ILE 105 Cb -0.26 -4.53 -0.03 0.00 -1.58 0.00 0.00 42.46 36.07 1wif s ILE 105 CO 0.05 -1.18 0.30 -0.75 -1.23 0.00 0.00 174.94 172.12 1wif s LYS 106 N 3.19 3.71 0.14 2.79 2.20 -1.26 -3.02 119.74 127.49 1wif s LYS 106 Ca 0.16 -0.37 0.05 0.00 -0.36 0.00 0.00 55.97 55.45 1wif s LYS 106 Cb -0.20 -3.75 -0.04 0.00 -1.51 0.00 0.00 37.83 32.32 1wif s LYS 106 CO 0.09 -0.39 -0.11 0.00 -0.36 0.00 0.00 175.35 174.58 1wif s ALA 107 N 1.90 1.45 0.13 3.13 0.00 0.97 0.13 121.76 129.47 1wif s ALA 107 Ca 0.10 -1.44 -0.03 0.00 0.00 0.00 0.00 51.96 50.59 1wif s ALA 107 Cb -0.16 0.02 -0.05 0.00 0.00 0.00 0.00 23.12 22.92 1wif s ALA 107 CO 0.11 -0.05 0.34 0.71 0.00 0.00 0.00 175.76 176.87 1wif s TYR 108 N -3.04 3.48 -0.60 0.00 2.02 -0.38 -0.64 117.35 118.19 1wif s TYR 108 Ca 0.15 0.47 0.01 0.00 -0.37 0.00 0.00 57.07 57.33 1wif s TYR 108 Cb 0.01 -1.94 0.41 0.00 -0.40 0.00 0.00 41.96 40.04 1wif s TYR 108 CO 0.01 0.46 1.67 0.54 -1.57 0.00 0.00 175.55 176.66 1wif n ARG 109 N 0.05 3.05 0.00 -0.62 5.12 -1.26 -3.60 116.66 119.39 1wif n ARG 109 Ca -0.03 -3.79 0.00 0.00 -1.93 0.00 0.00 57.85 52.09 1wif n ARG 109 Cb 0.52 -2.27 0.00 0.00 -1.16 0.00 0.00 32.46 29.54 1wif n ARG 109 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1wif n GLY 110 N -0.67 0.23 0.26 -0.13 0.00 -1.26 -5.01 105.19 98.61 1wif n GLY 110 Ca 0.51 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.59 1wif n GLY 110 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1wif n PHE 111 N 0.00 0.31 -3.78 1.61 7.35 -1.26 -3.57 117.46 118.11 1wif n PHE 111 Ca 0.00 0.87 -0.29 0.00 -0.76 0.00 0.00 57.45 57.28 1wif n PHE 111 Cb 0.00 -0.95 -0.16 0.00 0.35 0.00 0.00 39.48 38.72 1wif n PHE 111 CO 0.00 0.00 0.00 -1.17 -0.76 0.00 0.00 176.76 174.83 1wif s LEU 112 N -10.25 1.72 0.81 -2.13 2.96 -1.26 -5.13 118.68 105.40 1wif s LEU 112 Ca -0.10 -1.08 -0.13 0.00 -0.22 0.00 0.00 54.13 52.60 1wif s LEU 112 Cb 0.20 -0.78 0.08 0.00 0.50 0.00 0.00 46.19 46.19 1wif s LEU 112 CO 0.56 -0.31 1.19 -1.61 -1.32 0.00 0.00 176.35 174.86 1wif s GLU 113 N 1.70 1.65 0.04 1.98 2.02 -1.23 -4.85 118.70 120.00 1wif s GLU 113 Ca 0.00 1.70 -0.28 0.00 0.02 0.00 0.00 54.97 56.42 1wif s GLU 113 Cb -0.18 -1.78 -0.05 0.00 0.10 0.00 0.00 34.13 32.23 1wif s GLU 113 CO -0.11 -2.20 0.89 0.42 0.02 0.00 0.00 175.26 174.29 1wif s ILE 114 N -2.22 4.74 -0.38 -1.63 1.01 -1.26 -4.99 121.20 116.46 1wif s ILE 114 Ca 0.72 1.90 -0.28 0.00 0.00 0.00 0.00 60.65 62.99 1wif s ILE 114 Cb -0.27 -4.24 -0.01 0.00 0.01 0.00 0.00 42.46 37.94 1wif s ILE 114 CO 0.51 0.27 1.72 -2.16 0.00 0.00 0.00 174.94 175.28 1wif s PRO 115 N 0.42 3.30 0.24 2.79 0.04 -1.26 -4.89 135.00 135.65 1wif s PRO 115 Ca 0.46 1.22 -0.08 0.00 0.04 0.00 0.00 61.00 62.64 1wif s PRO 115 Cb -0.21 -4.18 0.41 0.00 0.04 0.00 0.00 34.50 30.56 1wif s PRO 115 CO 0.26 -1.90 1.62 1.96 0.04 0.00 0.00 177.00 178.99 1wif h GLN 116 N 12.64 0.06 -0.80 4.56 1.08 -1.94 0.01 115.11 130.72 1wif h GLN 116 Ca -0.31 -0.00 0.19 0.00 -1.45 0.00 0.00 58.65 57.07 1wif h GLN 116 Cb 1.15 -0.01 -0.15 0.00 -0.05 0.00 0.00 27.48 28.42 1wif h GLN 116 CO 1.07 0.04 -0.10 0.39 -0.95 0.00 0.00 178.83 179.27 1wif n GLU 117 N -5.41 -0.07 0.00 1.46 1.02 -1.26 -1.61 120.64 114.77 1wif n GLU 117 Ca 0.13 1.22 0.00 0.00 -0.02 0.00 0.00 57.16 58.49 1wif n GLU 117 Cb 0.46 -1.88 0.00 0.00 -0.02 0.00 0.00 31.44 30.00 1wif n GLU 117 CO 0.00 0.00 0.00 0.91 1.18 0.00 0.00 177.13 179.22 1wif n TRP 118 N -5.22 0.00 -1.65 -0.32 7.02 -0.01 -4.59 117.44 112.67 1wif n TRP 118 Ca 0.16 0.00 -0.59 0.00 -1.02 0.00 0.00 57.50 56.05 1wif n TRP 118 Cb 0.50 -0.25 -0.08 0.00 -2.42 0.00 0.00 31.31 29.06 1wif n TRP 118 CO 0.00 0.00 0.00 1.04 -2.02 0.00 0.00 177.69 176.71 1wif n GLN 119 N -1.34 0.86 -0.30 -0.99 1.13 -0.63 -4.81 117.38 111.30 1wif n GLN 119 Ca 0.00 0.30 0.10 0.00 -1.94 0.00 0.00 57.00 55.46 1wif n GLN 119 Cb 0.00 -1.99 0.26 0.00 0.11 0.00 0.00 30.24 28.61 1wif n GLN 119 CO 0.00 0.00 0.00 0.22 -1.44 0.00 0.00 177.06 175.84 1wif h ASP 120 N 7.58 0.43 0.00 1.08 3.58 -1.81 -2.90 116.42 124.38 1wif h ASP 120 Ca -0.41 0.12 0.00 0.00 0.42 0.00 0.00 57.03 57.16 1wif h ASP 120 Cb 1.34 0.07 0.00 0.00 1.72 0.00 0.00 39.33 42.45 1wif h ASP 120 CO 0.98 0.12 0.00 -0.24 -2.88 0.00 0.00 179.24 177.22 1wif n SER 121 N -4.95 0.00 0.00 2.28 2.88 -1.26 -4.67 113.62 107.90 1wif n SER 121 Ca 0.19 0.70 0.00 0.00 -1.33 0.00 0.00 58.87 58.43 1wif n SER 121 Cb 0.53 -0.34 0.00 0.00 -0.75 0.00 0.00 64.21 63.64 1wif n SER 121 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wif n GLY 122 N -0.99 1.32 0.00 0.46 0.00 -1.10 -0.31 105.19 104.57 1wif n GLY 122 Ca 0.00 -0.42 0.05 0.00 0.00 0.00 0.00 46.02 45.66 1wif n GLY 122 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1wif n PRO 123 N 8.44 0.49 -0.96 1.61 -0.04 -1.26 -4.97 135.00 138.30 1wif n PRO 123 Ca 0.00 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.58 1wif n PRO 123 Cb 0.00 -1.35 -0.06 0.00 -0.04 0.00 0.00 33.50 32.05 1wif n PRO 123 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1wif n SER 124 N -0.85 -5.37 -4.82 3.54 7.64 0.58 -5.00 113.62 109.34 1wif n SER 124 Ca 0.08 0.92 -0.24 0.00 1.01 0.00 0.00 58.87 60.64 1wif n SER 124 Cb 0.04 -3.28 -0.04 0.00 -1.01 0.00 0.00 64.21 59.91 1wif n SER 124 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1wif s SER 125 N -6.26 4.70 0.00 6.43 0.15 -1.26 -5.14 113.70 112.32 1wif s SER 125 Ca 0.00 -0.99 0.00 0.00 0.70 0.00 0.00 55.95 55.66 1wif s SER 125 Cb 0.00 -0.33 0.00 0.00 -1.71 0.00 0.00 66.02 63.98 1wif s SER 125 CO 0.00 -0.70 0.00 0.61 1.20 0.00 0.00 173.24 174.35