#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v62 n SER 2 N 0.00 -1.17 -2.22 1.61 2.88 -1.26 -5.03 113.62 108.43 1v62 n SER 2 Ca 0.00 -1.62 -0.29 0.00 -1.33 0.00 0.00 58.87 55.62 1v62 n SER 2 Cb 0.00 1.91 0.10 0.00 -0.75 0.00 0.00 64.21 65.47 1v62 n SER 2 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1v62 n SER 3 N -1.07 6.44 -2.25 -3.46 3.41 -1.26 -4.88 113.62 110.55 1v62 n SER 3 Ca -0.02 -3.61 -0.01 0.00 -0.26 0.00 0.00 58.87 54.97 1v62 n SER 3 Cb 0.39 -0.94 0.00 0.00 -0.26 0.00 0.00 64.21 63.40 1v62 n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1v62 n GLY 4 N -0.79 -0.84 2.12 5.00 0.00 -1.26 -5.09 105.19 104.33 1v62 n GLY 4 Ca 0.57 0.28 -0.16 0.00 0.00 0.00 0.00 46.02 46.70 1v62 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1v62 n SER 5 N -1.07 1.36 -1.39 1.61 7.64 -1.26 -5.11 113.62 115.39 1v62 n SER 5 Ca 0.02 -2.36 0.18 0.00 1.01 0.00 0.00 58.87 57.72 1v62 n SER 5 Cb 0.42 0.59 -0.06 0.00 -1.01 0.00 0.00 64.21 64.14 1v62 n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1v62 n SER 6 N -1.65 -8.35 -1.96 6.43 7.64 -1.26 -5.03 113.62 109.45 1v62 n SER 6 Ca -0.05 0.88 -0.00 0.00 1.01 0.00 0.00 58.87 60.71 1v62 n SER 6 Cb 0.38 -4.43 -0.00 0.00 -1.01 0.00 0.00 64.21 59.16 1v62 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1v62 n GLY 7 N -4.22 -4.93 2.50 0.23 0.00 -1.26 -5.02 105.19 92.50 1v62 n GLY 7 Ca -0.03 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1v62 n GLY 7 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1v62 n ASP 8 N 1.28 0.87 -4.08 1.61 -0.08 -1.26 -5.03 116.55 109.86 1v62 n ASP 8 Ca -0.01 -2.05 -0.35 0.00 -1.51 0.00 0.00 54.79 50.87 1v62 n ASP 8 Cb 0.02 -0.23 -0.11 0.00 2.34 0.00 0.00 41.12 43.14 1v62 n ASP 8 CO 0.00 0.00 0.00 0.42 0.12 0.00 0.00 177.20 177.74 1v62 s THR 9 N -2.36 3.29 -0.12 5.18 -4.23 -1.26 -4.89 115.64 111.25 1v62 s THR 9 Ca 0.24 -2.64 0.15 0.00 -1.18 0.00 0.00 61.69 58.26 1v62 s THR 9 Cb 0.34 -3.22 -0.24 0.00 1.34 0.00 0.00 72.50 70.72 1v62 s THR 9 CO -0.07 -0.78 0.36 1.33 -0.54 0.00 0.00 174.62 174.92 1v62 n VAL 10 N 3.89 1.50 -3.15 2.29 0.24 -1.26 -4.88 118.33 116.96 1v62 n VAL 10 Ca 0.04 -0.82 0.04 0.00 -2.04 0.00 0.00 64.34 61.55 1v62 n VAL 10 Cb 0.39 -0.76 -0.00 0.00 -1.47 0.00 0.00 33.84 31.99 1v62 n VAL 10 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1v62 s ALA 11 N -2.54 -2.55 0.25 2.33 0.00 -1.26 -5.17 121.76 112.82 1v62 s ALA 11 Ca -0.08 1.27 0.12 0.00 0.00 0.00 0.00 51.96 53.27 1v62 s ALA 11 Cb 0.07 -2.49 -0.05 0.00 0.00 0.00 0.00 23.12 20.66 1v62 s ALA 11 CO 0.83 -1.74 -0.20 -0.80 0.00 0.00 0.00 175.76 173.85 1v62 s ASN 12 N 2.85 3.61 -0.33 0.00 0.01 -1.26 -5.12 114.94 114.70 1v62 s ASN 12 Ca 0.14 -0.94 0.01 0.00 -0.71 0.00 0.00 52.86 51.36 1v62 s ASN 12 Cb -0.10 -0.33 0.14 0.00 0.41 0.00 0.00 41.25 41.37 1v62 s ASN 12 CO -0.24 0.07 0.32 0.00 -1.51 0.00 0.00 177.10 175.73 1v62 s ALA 13 N -2.19 -0.25 -0.44 0.60 0.00 -1.26 -4.99 121.76 113.23 1v62 s ALA 13 Ca 0.27 -0.82 0.03 0.00 0.00 0.00 0.00 51.96 51.44 1v62 s ALA 13 Cb -0.06 -1.88 0.60 0.00 0.00 0.00 0.00 23.12 21.78 1v62 s ALA 13 CO 0.13 -1.95 1.87 0.43 0.00 0.00 0.00 175.76 176.25 1v62 n SER 14 N 4.69 4.12 0.00 0.00 7.64 -1.26 -4.76 113.62 124.05 1v62 n SER 14 Ca 0.05 -3.51 0.00 0.00 1.01 0.00 0.00 58.87 56.42 1v62 n SER 14 Cb 0.45 -0.83 0.00 0.00 -1.01 0.00 0.00 64.21 62.81 1v62 n SER 14 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1v62 n GLY 15 N -1.00 1.28 2.80 0.23 0.00 -1.26 -5.01 105.19 102.23 1v62 n GLY 15 Ca 0.56 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.38 1v62 n GLY 15 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1v62 n PRO 16 N 0.00 -2.77 -4.49 1.61 -0.02 -1.26 -4.67 135.00 123.40 1v62 n PRO 16 Ca 0.00 -0.95 -0.28 0.00 -2.02 0.00 0.00 63.50 60.24 1v62 n PRO 16 Cb 0.00 -1.51 -0.17 0.00 -0.02 0.00 0.00 33.50 31.81 1v62 n PRO 16 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1v62 s LEU 17 N 0.00 1.71 -0.42 2.45 2.96 0.21 -4.81 118.68 120.79 1v62 s LEU 17 Ca 0.44 -0.41 -0.19 0.00 -0.22 0.00 0.00 54.13 53.75 1v62 s LEU 17 Cb -0.08 -1.06 0.02 0.00 0.50 0.00 0.00 46.19 45.57 1v62 s LEU 17 CO 0.37 0.02 0.53 -0.04 -1.32 0.00 0.00 176.35 175.90 1v62 s MET 18 N 0.93 3.23 -0.55 1.98 -1.94 -1.26 0.11 119.30 121.81 1v62 s MET 18 Ca -0.08 -0.54 -0.06 0.00 -1.71 0.00 0.00 55.69 53.30 1v62 s MET 18 Cb -0.15 -3.94 0.14 0.00 2.01 0.00 0.00 34.83 32.89 1v62 s MET 18 CO -0.01 -0.89 0.39 0.08 -0.01 0.00 0.00 175.02 174.58 1v62 s VAL 19 N 2.43 3.97 0.32 -6.03 1.01 0.62 -4.50 120.40 118.22 1v62 s VAL 19 Ca 0.17 -2.32 -0.17 0.00 0.00 0.00 0.00 61.98 59.66 1v62 s VAL 19 Cb -0.16 -3.61 -0.09 0.00 0.00 0.00 0.00 36.38 32.52 1v62 s VAL 19 CO 0.16 -0.82 0.77 -1.61 0.00 0.00 0.00 175.10 173.60 1v62 s GLU 20 N 0.71 4.11 -0.11 2.72 2.02 -1.23 -2.76 118.70 124.17 1v62 s GLU 20 Ca 0.11 0.81 -0.02 0.00 0.02 0.00 0.00 54.97 55.89 1v62 s GLU 20 Cb -0.22 -2.51 0.04 0.00 0.10 0.00 0.00 34.13 31.55 1v62 s GLU 20 CO -0.03 0.19 0.04 0.42 0.02 0.00 0.00 175.26 175.89 1v62 s ILE 21 N -1.90 0.22 -0.48 -1.63 1.01 -1.11 -4.77 121.20 112.54 1v62 s ILE 21 Ca 0.53 0.01 -0.28 0.00 0.00 0.00 0.00 60.65 60.91 1v62 s ILE 21 Cb -0.12 -0.55 -0.00 0.00 0.01 0.00 0.00 42.46 41.79 1v62 s ILE 21 CO 0.18 0.06 1.63 0.54 0.00 0.00 0.00 174.94 177.35 1v62 s VAL 22 N 2.02 3.61 0.49 2.92 0.11 -1.26 -2.71 120.40 125.59 1v62 s VAL 22 Ca 0.03 0.55 0.05 0.00 -2.93 0.00 0.00 61.98 59.68 1v62 s VAL 22 Cb -0.14 -4.05 -0.00 0.00 -1.53 0.00 0.00 36.38 30.66 1v62 s VAL 22 CO -0.06 -0.82 0.27 -1.59 -3.33 0.00 0.00 175.10 169.57 1v62 s LYS 23 N 5.82 2.25 0.37 1.54 -2.85 -1.10 -5.01 119.74 120.77 1v62 s LYS 23 Ca 0.65 -2.01 -0.25 0.00 -1.00 0.00 0.00 55.97 53.36 1v62 s LYS 23 Cb -0.15 -1.98 -0.09 0.00 -2.06 0.00 0.00 37.83 33.55 1v62 s LYS 23 CO 0.28 -0.40 1.05 0.99 0.10 0.00 0.00 175.35 177.36 1v62 s THR 24 N -2.72 3.72 -0.40 3.79 2.01 -1.26 -4.78 115.64 115.99 1v62 s THR 24 Ca 0.32 1.40 -0.32 0.00 0.31 0.00 0.00 61.69 63.39 1v62 s THR 24 Cb 0.00 -3.76 -0.10 0.00 0.01 0.00 0.00 72.50 68.65 1v62 s THR 24 CO 0.19 0.09 2.27 -2.65 -0.69 0.00 0.00 174.62 173.82 1v62 n PRO 25 N 0.22 1.13 -2.37 4.92 -0.02 -1.26 -0.64 135.00 136.97 1v62 n PRO 25 Ca 0.04 0.26 -0.08 0.00 -2.02 0.00 0.00 63.50 61.70 1v62 n PRO 25 Cb 0.49 -2.66 0.01 0.00 -0.02 0.00 0.00 33.50 31.31 1v62 n PRO 25 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1v62 n GLY 26 N 6.34 0.15 3.52 -1.23 0.00 -1.20 -5.04 105.19 107.73 1v62 n GLY 26 Ca 0.41 -0.49 -0.32 0.00 0.00 0.00 0.00 46.02 45.61 1v62 n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1v62 s SER 27 N -2.78 4.23 -0.30 1.61 0.01 0.19 -5.10 113.70 111.55 1v62 s SER 27 Ca 0.06 -0.22 -0.14 0.00 1.31 0.00 0.00 55.95 56.97 1v62 s SER 27 Cb -0.03 -0.89 -0.03 0.00 0.21 0.00 0.00 66.02 65.28 1v62 s SER 27 CO 0.08 0.30 0.31 0.00 0.41 0.00 0.00 173.24 174.34 1v62 s ALA 28 N -0.88 3.53 0.04 1.44 0.00 -1.26 -4.69 121.76 119.94 1v62 s ALA 28 Ca 0.14 -1.04 -0.28 0.00 0.00 0.00 0.00 51.96 50.78 1v62 s ALA 28 Cb -0.11 -2.67 -0.16 0.00 0.00 0.00 0.00 23.12 20.19 1v62 s ALA 28 CO 0.04 -0.76 1.31 -0.07 0.00 0.00 0.00 175.76 176.28 1v62 h LEU 29 N 8.57 -0.86 0.00 0.00 3.38 -1.97 -3.48 115.31 120.94 1v62 h LEU 29 Ca -0.32 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1v62 h LEU 29 Cb 1.16 0.22 0.00 0.00 0.09 0.00 0.00 40.66 42.14 1v62 h LEU 29 CO 0.63 -0.57 0.00 0.61 0.09 0.00 0.00 178.44 179.20 1v62 n GLY 30 N -1.19 0.70 3.84 0.83 0.00 -1.26 -4.77 105.19 103.34 1v62 n GLY 30 Ca -0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.52 1v62 n GLY 30 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1v62 s ILE 31 N -1.06 5.18 -0.24 -0.61 1.01 -1.26 -1.69 121.20 122.53 1v62 s ILE 31 Ca 0.00 0.65 0.02 0.00 0.00 0.00 0.00 60.65 61.32 1v62 s ILE 31 Cb 0.00 -3.62 0.06 0.00 0.01 0.00 0.00 42.46 38.90 1v62 s ILE 31 CO 0.00 0.57 -0.09 -0.44 0.00 0.00 0.00 174.94 174.99 1v62 s SER 32 N -0.94 4.03 0.16 3.58 0.01 -0.60 -5.01 113.70 114.93 1v62 s SER 32 Ca 0.21 -1.22 -0.16 0.00 1.31 0.00 0.00 55.95 56.09 1v62 s SER 32 Cb -0.15 -1.35 -0.07 0.00 0.21 0.00 0.00 66.02 64.65 1v62 s SER 32 CO 0.10 -0.20 0.60 -0.76 0.41 0.00 0.00 173.24 173.39 1v62 s LEU 33 N 1.27 4.35 -0.08 2.44 1.43 -1.26 0.10 118.68 126.93 1v62 s LEU 33 Ca -0.06 1.19 0.05 0.00 -1.03 0.00 0.00 54.13 54.27 1v62 s LEU 33 Cb -0.19 -3.34 -0.01 0.00 0.03 0.00 0.00 46.19 42.69 1v62 s LEU 33 CO -0.06 0.09 -0.23 0.28 0.23 0.00 0.00 176.35 176.66 1v62 s THR 34 N -1.46 2.17 -0.12 5.49 -1.32 0.28 -4.63 115.64 116.05 1v62 s THR 34 Ca 0.39 -1.01 -0.13 0.00 -1.21 0.00 0.00 61.69 59.72 1v62 s THR 34 Cb -0.16 -1.81 -0.05 0.00 -1.51 0.00 0.00 72.50 68.98 1v62 s THR 34 CO 0.20 0.56 0.30 0.42 -2.21 0.00 0.00 174.62 173.90 1v62 s THR 35 N -0.00 5.27 0.26 5.08 -4.23 -1.26 0.54 115.64 121.30 1v62 s THR 35 Ca -0.08 0.58 0.06 0.00 -1.18 0.00 0.00 61.69 61.07 1v62 s THR 35 Cb -0.15 -3.63 -0.02 0.00 1.34 0.00 0.00 72.50 70.04 1v62 s THR 35 CO 0.05 0.45 0.20 0.35 -0.54 0.00 0.00 174.62 175.13 1v62 n THR 36 N 3.06 0.00 -4.39 3.99 -2.24 -1.05 -4.98 114.28 108.66 1v62 n THR 36 Ca -0.13 -1.85 -0.19 0.00 -2.27 0.00 0.00 64.05 59.61 1v62 n THR 36 Cb 0.52 0.89 -0.10 0.00 -2.10 0.00 0.00 70.33 69.54 1v62 n THR 36 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1v62 s SER 37 N -2.79 2.14 0.00 3.42 0.15 -1.26 -1.65 113.70 113.71 1v62 s SER 37 Ca 0.28 -1.29 0.00 0.00 0.70 0.00 0.00 55.95 55.65 1v62 s SER 37 Cb 0.01 -0.04 0.00 0.00 -1.71 0.00 0.00 66.02 64.28 1v62 s SER 37 CO 0.20 -0.54 0.00 0.18 1.20 0.00 0.00 173.24 174.28 1v62 n LEU 38 N -0.55 0.00 -3.14 3.45 4.77 -1.26 -4.97 117.00 115.29 1v62 n LEU 38 Ca -0.04 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 55.70 1v62 n LEU 38 Cb 0.65 0.12 -0.05 0.00 -2.33 0.00 0.00 43.42 41.81 1v62 n LEU 38 CO 0.39 -0.25 -0.01 0.54 -1.33 0.00 0.00 177.39 176.73 1v62 n ARG 39 N -1.75 2.22 -3.41 3.23 1.74 -1.26 -4.88 116.66 112.55 1v62 n ARG 39 Ca 0.00 -4.26 -0.20 0.00 -0.77 0.00 0.00 57.85 52.62 1v62 n ARG 39 Cb 0.00 -1.99 0.07 0.00 -1.02 0.00 0.00 32.46 29.52 1v62 n ARG 39 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1v62 n ASN 40 N 0.34 -5.66 -3.23 0.55 3.02 -1.26 -4.98 115.26 104.04 1v62 n ASN 40 Ca 0.28 -0.45 -0.02 0.00 -0.03 0.00 0.00 54.58 54.36 1v62 n ASN 40 Cb 0.48 -4.27 -0.02 0.00 -0.61 0.00 0.00 39.78 35.35 1v62 n ASN 40 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1v62 s LYS 41 N -6.10 0.76 0.13 3.52 1.02 -1.26 -5.13 119.74 112.68 1v62 s LYS 41 Ca 0.49 -0.26 -0.31 0.00 0.02 0.00 0.00 55.97 55.90 1v62 s LYS 41 Cb -0.22 -0.03 -0.09 0.00 -0.52 0.00 0.00 37.83 36.97 1v62 s LYS 41 CO 0.61 -1.17 1.60 -1.54 -0.92 0.00 0.00 175.35 173.92 1v62 s SER 42 N 1.90 6.59 -0.05 2.83 1.04 -1.26 -4.23 113.70 120.53 1v62 s SER 42 Ca 0.15 2.57 0.04 0.00 0.48 0.00 0.00 55.95 59.19 1v62 s SER 42 Cb -0.07 -2.58 0.00 0.00 0.10 0.00 0.00 66.02 63.47 1v62 s SER 42 CO -0.09 -0.84 -0.15 -0.69 0.98 0.00 0.00 173.24 172.44 1v62 s VAL 43 N 1.65 1.32 -0.04 5.02 1.01 -0.66 -2.36 120.40 126.35 1v62 s VAL 43 Ca 0.71 -0.64 -0.30 0.00 0.00 0.00 0.00 61.98 61.76 1v62 s VAL 43 Cb -0.42 -1.15 -0.02 0.00 0.00 0.00 0.00 36.38 34.79 1v62 s VAL 43 CO 0.32 0.39 0.98 -0.63 0.00 0.00 0.00 175.10 176.15 1v62 s ILE 44 N 0.19 4.84 0.33 2.22 1.09 -1.26 -2.53 121.20 126.08 1v62 s ILE 44 Ca -0.06 2.04 0.01 0.00 -1.10 0.00 0.00 60.65 61.54 1v62 s ILE 44 Cb -0.12 -4.31 -0.00 0.00 -1.06 0.00 0.00 42.46 36.96 1v62 s ILE 44 CO 0.02 0.11 0.03 0.35 -0.10 0.00 0.00 174.94 175.36 1v62 n THR 45 N 4.12 0.00 -3.30 2.92 -2.24 0.19 -1.62 114.28 114.34 1v62 n THR 45 Ca 0.07 -1.67 -0.41 0.00 -2.27 0.00 0.00 64.05 59.78 1v62 n THR 45 Cb 0.50 0.42 -0.08 0.00 -2.10 0.00 0.00 70.33 69.07 1v62 n THR 45 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1v62 s ILE 46 N -2.38 5.08 -0.07 2.28 1.01 -1.14 0.10 121.20 126.09 1v62 s ILE 46 Ca 0.05 0.40 -0.09 0.00 0.00 0.00 0.00 60.65 61.00 1v62 s ILE 46 Cb 0.00 -3.86 -0.05 0.00 0.01 0.00 0.00 42.46 38.55 1v62 s ILE 46 CO 0.03 -0.08 0.38 -0.78 0.00 0.00 0.00 174.94 174.49 1v62 h ASP 47 N 8.34 -0.25 -4.82 3.58 1.82 0.41 -2.21 116.42 123.31 1v62 h ASP 47 Ca -0.29 -0.02 0.11 0.00 -0.39 0.00 0.00 57.03 56.44 1v62 h ASP 47 Cb 1.14 0.06 -0.13 0.00 0.68 0.00 0.00 39.33 41.08 1v62 h ASP 47 CO 0.72 0.23 0.46 -0.60 -1.61 0.00 0.00 179.24 178.44 1v62 s ARG 48 N -2.56 0.95 0.26 0.28 3.52 -0.86 -4.73 118.95 115.80 1v62 s ARG 48 Ca -0.05 -0.40 0.09 0.00 -0.13 0.00 0.00 55.73 55.24 1v62 s ARG 48 Cb 0.00 0.41 -0.04 0.00 -1.56 0.00 0.00 34.95 33.76 1v62 s ARG 48 CO 0.16 -0.42 0.04 0.42 -0.81 0.00 0.00 175.30 174.69 1v62 s ILE 49 N -3.23 3.69 0.22 4.11 1.09 -1.26 -1.56 121.20 124.27 1v62 s ILE 49 Ca 0.06 -1.77 -0.22 0.00 -1.10 0.00 0.00 60.65 57.62 1v62 s ILE 49 Cb -0.01 -2.97 -0.08 0.00 -1.06 0.00 0.00 42.46 38.33 1v62 s ILE 49 CO -0.07 -0.35 0.77 -0.54 -0.10 0.00 0.00 174.94 174.65 1v62 s LYS 50 N -3.66 4.40 0.41 2.79 1.02 -0.68 -5.00 119.74 119.01 1v62 s LYS 50 Ca 0.31 1.03 -0.24 0.00 0.02 0.00 0.00 55.97 57.09 1v62 s LYS 50 Cb -0.07 -2.98 -0.08 0.00 -0.52 0.00 0.00 37.83 34.17 1v62 s LYS 50 CO 0.21 0.43 1.10 -1.25 -0.92 0.00 0.00 175.35 174.92 1v62 s PRO 51 N -1.74 4.06 -1.57 -1.68 0.04 -1.26 -3.41 135.00 129.44 1v62 s PRO 51 Ca 0.42 1.65 -0.04 0.00 0.04 0.00 0.00 61.00 63.07 1v62 s PRO 51 Cb -0.19 -2.56 0.00 0.00 0.04 0.00 0.00 34.50 31.80 1v62 s PRO 51 CO 0.23 -0.27 0.53 0.00 0.04 0.00 0.00 177.00 177.53 1v62 n ALA 52 N -0.10 -0.92 -2.17 8.56 0.00 -1.26 -4.99 120.51 119.63 1v62 n ALA 52 Ca 0.05 0.27 -0.21 0.00 0.00 0.00 0.00 53.44 53.56 1v62 n ALA 52 Cb 0.48 -3.66 0.00 0.00 0.00 0.00 0.00 19.45 16.27 1v62 n ALA 52 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1v62 s SER 53 N -2.63 5.11 0.34 0.00 0.15 -1.22 -4.95 113.70 110.50 1v62 s SER 53 Ca 0.26 -0.80 0.10 0.00 0.70 0.00 0.00 55.95 56.22 1v62 s SER 53 Cb -0.12 -0.21 0.61 0.00 -1.71 0.00 0.00 66.02 64.60 1v62 s SER 53 CO 0.32 -0.91 1.78 0.58 1.20 0.00 0.00 173.24 176.21 1v62 h VAL 54 N 0.71 1.29 0.11 4.45 2.07 -1.90 -1.48 116.25 121.49 1v62 h VAL 54 Ca -0.38 -1.37 -0.31 0.00 0.82 0.00 0.00 66.70 65.46 1v62 h VAL 54 Cb 1.28 1.68 -0.01 0.00 -1.52 0.00 0.00 31.29 32.72 1v62 h VAL 54 CO 0.51 0.40 -1.60 0.58 0.02 0.00 0.00 177.57 177.48 1v62 h VAL 55 N 0.09 1.06 -0.10 2.57 2.07 -1.93 -3.02 116.25 116.99 1v62 h VAL 55 Ca 0.01 -2.73 -0.02 0.00 0.82 0.00 0.00 66.70 64.78 1v62 h VAL 55 Cb 0.72 2.70 -0.00 0.00 -1.52 0.00 0.00 31.29 33.19 1v62 h VAL 55 CO 0.05 0.80 -0.01 -0.78 0.02 0.00 0.00 177.57 177.66 1v62 h ASP 56 N 0.06 0.18 0.08 0.57 1.82 -1.75 0.54 116.42 117.92 1v62 h ASP 56 Ca -0.27 -0.33 -0.08 0.00 -0.39 0.00 0.00 57.03 55.96 1v62 h ASP 56 Cb 2.02 -0.05 -0.01 0.00 0.68 0.00 0.00 39.33 41.97 1v62 h ASP 56 CO 0.15 0.46 -0.26 0.03 -1.61 0.00 0.00 179.24 178.01 1v62 h ARG 57 N -0.11 0.30 0.00 0.28 3.08 -1.43 -3.19 114.38 113.32 1v62 h ARG 57 Ca 0.03 -0.11 -0.00 0.00 0.07 0.00 0.00 59.98 59.97 1v62 h ARG 57 Cb 0.38 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.40 1v62 h ARG 57 CO 0.01 0.55 -0.00 1.03 -1.07 0.00 0.00 179.97 180.48 1v62 h SER 58 N 0.27 -0.00 -1.26 7.04 0.87 -1.41 -3.49 113.55 115.57 1v62 h SER 58 Ca 0.04 -0.86 0.00 0.00 -1.23 0.00 0.00 61.79 59.75 1v62 h SER 58 Cb 0.61 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.57 1v62 h SER 58 CO 0.04 0.86 0.00 0.61 -0.53 0.00 0.00 176.83 177.81 1v62 n GLY 59 N 1.26 0.56 0.13 5.77 0.00 0.19 -5.02 105.19 108.07 1v62 n GLY 59 Ca -0.09 -0.37 -0.21 0.00 0.00 0.00 0.00 46.02 45.35 1v62 n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v62 n ALA 60 N -0.91 1.32 -2.75 4.61 0.00 -1.23 -4.94 120.51 116.62 1v62 n ALA 60 Ca 0.00 -1.05 -0.36 0.00 0.00 0.00 0.00 53.44 52.03 1v62 n ALA 60 Cb 0.35 -0.10 -0.07 0.00 0.00 0.00 0.00 19.45 19.63 1v62 n ALA 60 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1v62 s LEU 61 N -6.82 4.28 -0.06 0.00 1.43 -1.26 -4.91 118.68 111.33 1v62 s LEU 61 Ca -0.35 0.41 0.03 0.00 -1.03 0.00 0.00 54.13 53.19 1v62 s LEU 61 Cb 0.10 -2.20 0.01 0.00 0.03 0.00 0.00 46.19 44.13 1v62 s LEU 61 CO 0.59 0.22 -0.14 -1.00 0.23 0.00 0.00 176.35 176.24 1v62 s HIS 62 N -0.01 1.58 0.03 0.29 3.76 -1.26 -4.96 115.29 114.72 1v62 s HIS 62 Ca 0.13 -0.54 -0.34 0.00 -0.15 0.00 0.00 55.06 54.16 1v62 s HIS 62 Cb -0.12 -1.12 -0.13 0.00 1.11 0.00 0.00 32.58 32.32 1v62 s HIS 62 CO 0.02 -0.24 1.72 -2.30 -0.85 0.00 0.00 174.74 173.09 1v62 n PRO 63 N 3.55 2.12 0.00 8.40 -0.02 -1.26 -2.47 135.00 145.32 1v62 n PRO 63 Ca -0.21 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 1v62 n PRO 63 Cb 0.52 -2.57 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 1v62 n PRO 63 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1v62 n GLY 64 N 3.88 0.79 3.70 -1.23 0.00 -0.83 -4.99 105.19 106.51 1v62 n GLY 64 Ca 0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.86 1v62 n GLY 64 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1v62 n ASP 65 N 0.00 1.56 -4.52 1.61 8.00 -1.03 -4.77 116.55 117.40 1v62 n ASP 65 Ca 0.00 0.73 -0.38 0.00 0.71 0.00 0.00 54.79 55.85 1v62 n ASP 65 Cb 0.00 -1.53 -0.12 0.00 -0.02 0.00 0.00 41.12 39.46 1v62 n ASP 65 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 1v62 s HIS 66 N -1.68 3.17 -0.20 1.24 3.76 -1.26 -2.86 115.29 117.45 1v62 s HIS 66 Ca 0.79 -0.18 -0.25 0.00 -0.15 0.00 0.00 55.06 55.26 1v62 s HIS 66 Cb -0.35 -2.33 -0.01 0.00 1.11 0.00 0.00 32.58 31.00 1v62 s HIS 66 CO 0.45 -0.28 0.83 0.42 -0.85 0.00 0.00 174.74 175.31 1v62 s ILE 67 N 1.69 4.86 -0.11 0.60 1.01 -0.64 0.19 121.20 128.79 1v62 s ILE 67 Ca 0.06 1.62 0.13 0.00 0.00 0.00 0.00 60.65 62.46 1v62 s ILE 67 Cb -0.16 -4.13 -0.24 0.00 0.01 0.00 0.00 42.46 37.94 1v62 s ILE 67 CO 0.08 -0.01 0.39 0.18 0.00 0.00 0.00 174.94 175.57 1v62 n LEU 68 N 5.53 0.79 -3.62 2.97 4.77 0.29 -4.47 117.00 123.26 1v62 n LEU 68 Ca 0.05 0.23 -0.09 0.00 -0.03 0.00 0.00 56.01 56.17 1v62 n LEU 68 Cb 0.48 0.15 -0.02 0.00 -2.33 0.00 0.00 43.42 41.70 1v62 n LEU 68 CO 0.48 0.49 0.52 -0.94 -1.33 0.00 0.00 177.39 176.60 1v62 s SER 69 N -5.96 -0.38 -0.21 -1.43 1.04 -0.67 -1.75 113.70 104.33 1v62 s SER 69 Ca -0.09 -0.25 -0.04 0.00 0.48 0.00 0.00 55.95 56.05 1v62 s SER 69 Cb 0.07 0.59 0.11 0.00 0.10 0.00 0.00 66.02 66.89 1v62 s SER 69 CO 0.81 -1.02 0.33 -0.63 0.98 0.00 0.00 173.24 173.72 1v62 s ILE 70 N -3.63 -0.52 -1.78 -1.02 1.01 -0.43 0.56 121.20 115.40 1v62 s ILE 70 Ca 0.06 0.01 -0.00 0.00 0.00 0.00 0.00 60.65 60.72 1v62 s ILE 70 Cb -0.03 -0.70 0.00 0.00 0.01 0.00 0.00 42.46 41.74 1v62 s ILE 70 CO -0.04 -0.07 0.04 -0.67 0.00 0.00 0.00 174.94 174.20 1v62 n ASP 71 N 5.36 -5.96 0.00 3.58 2.03 0.24 -1.13 116.55 120.66 1v62 n ASP 71 Ca -0.05 -0.04 0.00 0.00 0.52 0.00 0.00 54.79 55.22 1v62 n ASP 71 Cb 0.50 -4.95 0.00 0.00 -0.72 0.00 0.00 41.12 35.94 1v62 n ASP 71 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1v62 n GLY 72 N -1.06 0.75 3.83 0.27 0.00 -1.26 -5.06 105.19 102.67 1v62 n GLY 72 Ca -0.24 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.40 1v62 n GLY 72 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1v62 s THR 73 N -2.38 5.17 0.16 2.61 2.01 -0.29 -5.07 115.64 117.86 1v62 s THR 73 Ca 0.00 0.68 -0.30 0.00 0.31 0.00 0.00 61.69 62.38 1v62 s THR 73 Cb 0.00 -3.64 -0.07 0.00 0.01 0.00 0.00 72.50 68.80 1v62 s THR 73 CO 0.00 0.55 1.02 -0.55 -0.69 0.00 0.00 174.62 174.95 1v62 s SER 74 N -0.80 7.42 -0.54 3.53 0.15 -1.26 -1.31 113.70 120.88 1v62 s SER 74 Ca 0.21 1.96 0.01 0.00 0.70 0.00 0.00 55.95 58.83 1v62 s SER 74 Cb -0.15 -2.60 0.47 0.00 -1.71 0.00 0.00 66.02 62.03 1v62 s SER 74 CO 0.10 -0.10 1.80 0.23 1.20 0.00 0.00 173.24 176.48 1v62 n MET 75 N 2.36 2.81 -3.27 5.44 2.81 -0.72 -4.79 117.12 121.76 1v62 n MET 75 Ca 0.02 -3.46 -0.44 0.00 -1.81 0.00 0.00 57.70 52.00 1v62 n MET 75 Cb 0.47 -2.25 -0.06 0.00 -0.71 0.00 0.00 33.22 30.67 1v62 n MET 75 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 1v62 s GLU 76 N -3.70 3.03 -1.64 0.03 2.12 -1.26 -4.35 118.70 112.94 1v62 s GLU 76 Ca 0.60 -1.24 -0.03 0.00 0.36 0.00 0.00 54.97 54.66 1v62 s GLU 76 Cb 0.48 -4.16 0.00 0.00 0.26 0.00 0.00 34.13 30.71 1v62 s GLU 76 CO 0.01 -1.19 0.43 1.58 -0.54 0.00 0.00 175.26 175.55 1v62 n HIS 77 N 5.66 -1.68 -1.67 5.30 -0.00 -0.99 -4.99 115.22 116.84 1v62 n HIS 77 Ca -0.10 0.37 -0.21 0.00 0.46 0.00 0.00 57.72 58.24 1v62 n HIS 77 Cb 0.44 -4.36 0.14 0.00 -0.12 0.00 0.00 29.99 26.09 1v62 n HIS 77 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1v62 s SER 79 N -4.41 5.44 0.16 0.00 0.01 -1.26 -4.93 113.70 108.72 1v62 s SER 79 Ca 0.53 -0.36 -0.06 0.00 1.31 0.00 0.00 55.95 57.37 1v62 s SER 79 Cb -0.01 -1.21 0.02 0.00 0.21 0.00 0.00 66.02 65.03 1v62 s SER 79 CO 0.37 -0.20 1.45 0.25 0.41 0.00 0.00 173.24 175.52 1v62 h LEU 80 N 1.35 0.75 -0.04 2.44 6.46 -1.98 -2.27 115.31 122.02 1v62 h LEU 80 Ca -0.47 -0.42 -0.01 0.00 -0.12 0.00 0.00 57.88 56.87 1v62 h LEU 80 Cb 1.25 -0.22 -0.00 0.00 -0.73 0.00 0.00 40.66 40.96 1v62 h LEU 80 CO 0.59 1.17 0.00 -0.07 -0.62 0.00 0.00 178.44 179.51 1v62 h LEU 81 N 0.50 0.07 -0.37 2.25 3.38 -1.96 -1.10 115.31 118.09 1v62 h LEU 81 Ca 0.00 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1v62 h LEU 81 Cb 1.16 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.88 1v62 h LEU 81 CO 0.12 0.34 0.24 -0.08 0.09 0.00 0.00 178.44 179.15 1v62 h GLU 82 N -0.21 0.49 -0.46 1.13 4.81 -1.98 0.50 114.58 118.87 1v62 h GLU 82 Ca 0.01 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1v62 h GLU 82 Cb 0.30 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.55 1v62 h GLU 82 CO 0.00 0.33 0.29 0.00 -0.73 0.00 0.00 179.01 178.90 1v62 h ALA 83 N 1.13 0.58 -0.10 2.92 0.00 -1.38 -1.58 119.26 120.83 1v62 h ALA 83 Ca 0.14 -0.05 -0.14 0.00 0.00 0.00 0.00 54.91 54.85 1v62 h ALA 83 Cb -0.05 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1v62 h ALA 83 CO -0.03 0.05 -0.56 1.15 0.00 0.00 0.00 179.25 179.86 1v62 h THR 84 N 0.61 1.36 -0.11 0.00 2.02 -0.93 -2.99 112.91 112.88 1v62 h THR 84 Ca 0.17 -1.88 -0.06 0.00 0.77 0.00 0.00 66.41 65.41 1v62 h THR 84 Cb -0.04 1.91 -0.01 0.00 -1.74 0.00 0.00 68.15 68.27 1v62 h THR 84 CO -0.03 0.56 -0.20 0.11 0.37 0.00 0.00 175.52 176.33 1v62 h LYS 85 N 0.23 0.18 -0.38 6.66 1.57 0.41 -2.84 116.57 122.40 1v62 h LYS 85 Ca 0.00 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.72 1v62 h LYS 85 Cb 1.06 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.33 1v62 h LYS 85 CO 0.09 0.38 0.18 -0.07 -0.57 0.00 0.00 179.45 179.45 1v62 h LEU 86 N 0.17 0.50 -1.83 2.94 3.38 -1.14 0.38 115.31 119.70 1v62 h LEU 86 Ca 0.03 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 1v62 h LEU 86 Cb 0.45 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1v62 h LEU 86 CO 0.03 0.49 0.09 -0.07 0.09 0.00 0.00 178.44 179.07 1v62 h LEU 87 N 0.47 0.17 0.03 1.67 3.38 -1.55 -1.83 115.31 117.65 1v62 h LEU 87 Ca 0.13 -0.01 -0.23 0.00 0.09 0.00 0.00 57.88 57.86 1v62 h LEU 87 Cb 0.13 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 1v62 h LEU 87 CO -0.02 0.13 -1.14 0.00 0.09 0.00 0.00 178.44 177.50 1v62 h ALA 88 N 1.90 0.35 -0.34 1.53 0.00 -1.34 -3.35 119.26 118.00 1v62 h ALA 88 Ca 0.05 -0.97 -0.61 0.00 0.00 0.00 0.00 54.91 53.38 1v62 h ALA 88 Cb -0.00 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 17.67 1v62 h ALA 88 CO -0.01 1.23 2.18 0.45 0.00 0.00 0.00 179.25 183.10 1v62 n SER 89 N -3.36 7.67 -4.47 0.00 2.88 0.08 -4.90 113.62 111.51 1v62 n SER 89 Ca -0.04 -2.89 -0.25 0.00 -1.33 0.00 0.00 58.87 54.37 1v62 n SER 89 Cb 0.97 -1.41 -0.10 0.00 -0.75 0.00 0.00 64.21 62.92 1v62 n SER 89 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1v62 s ILE 90 N -0.00 2.50 -0.01 2.46 -1.09 -1.25 -4.94 121.20 118.86 1v62 s ILE 90 Ca 0.62 -2.30 -0.01 0.00 -2.23 0.00 0.00 60.65 56.72 1v62 s ILE 90 Cb 0.23 -2.29 -0.00 0.00 -1.58 0.00 0.00 42.46 38.82 1v62 s ILE 90 CO -0.09 -0.34 -0.02 -1.20 -1.23 0.00 0.00 174.94 172.06 1v62 n SER 91 N -0.45 0.13 0.04 3.58 7.64 -1.26 -4.51 113.62 118.80 1v62 n SER 91 Ca -0.07 0.20 0.00 0.00 1.01 0.00 0.00 58.87 60.01 1v62 n SER 91 Cb 0.59 -0.52 0.00 0.00 -1.01 0.00 0.00 64.21 63.27 1v62 n SER 91 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1v62 n GLU 92 N -2.49 0.00 -4.24 1.43 4.07 -1.26 -3.27 120.64 114.88 1v62 n GLU 92 Ca -0.01 0.00 -0.35 0.00 -0.06 0.00 0.00 57.16 56.75 1v62 n GLU 92 Cb 0.02 -0.36 -0.08 0.00 -0.06 0.00 0.00 31.44 30.96 1v62 n GLU 92 CO 0.00 0.00 0.00 -1.59 -0.06 0.00 0.00 177.13 175.48 1v62 s LYS 93 N -2.00 3.04 -0.37 5.31 -2.85 -1.26 -2.71 119.74 118.91 1v62 s LYS 93 Ca 0.00 -0.40 -0.13 0.00 -1.00 0.00 0.00 55.97 54.44 1v62 s LYS 93 Cb 0.00 -2.85 0.00 0.00 -2.06 0.00 0.00 37.83 32.92 1v62 s LYS 93 CO 0.00 0.70 0.25 0.08 0.10 0.00 0.00 175.35 176.47 1v62 s VAL 94 N -0.99 5.09 -0.73 1.79 1.01 -1.10 -4.93 120.40 120.55 1v62 s VAL 94 Ca 0.16 -0.49 -0.23 0.00 0.00 0.00 0.00 61.98 61.41 1v62 s VAL 94 Cb -0.12 -3.73 0.07 0.00 0.00 0.00 0.00 36.38 32.60 1v62 s VAL 94 CO 0.06 -0.14 1.09 -0.13 0.00 0.00 0.00 175.10 175.98 1v62 s ARG 95 N 1.67 3.21 -0.38 2.72 0.52 -1.26 -2.76 118.95 122.67 1v62 s ARG 95 Ca 0.05 -0.80 -0.10 0.00 -0.52 0.00 0.00 55.73 54.37 1v62 s ARG 95 Cb -0.18 -4.36 0.04 0.00 0.52 0.00 0.00 34.95 30.97 1v62 s ARG 95 CO 0.09 -1.92 0.20 -0.51 0.02 0.00 0.00 175.30 173.18 1v62 s LEU 96 N 4.41 4.74 -0.59 2.53 1.43 -1.11 0.82 118.68 130.90 1v62 s LEU 96 Ca 0.28 -1.16 -0.24 0.00 -1.03 0.00 0.00 54.13 51.98 1v62 s LEU 96 Cb -0.12 -1.98 0.05 0.00 0.03 0.00 0.00 46.19 44.16 1v62 s LEU 96 CO 0.08 -0.41 0.97 -1.61 0.23 0.00 0.00 176.35 175.61 1v62 s GLU 97 N 1.49 3.27 0.23 1.70 8.01 0.19 -0.28 118.70 133.31 1v62 s GLU 97 Ca 0.01 -0.41 0.08 0.00 0.01 0.00 0.00 54.97 54.67 1v62 s GLU 97 Cb -0.20 -4.11 -0.04 0.00 -4.31 0.00 0.00 34.13 25.47 1v62 s GLU 97 CO 0.05 -1.62 0.08 0.42 0.01 0.00 0.00 175.26 174.20 1v62 s ILE 98 N 4.12 3.97 0.04 -1.63 1.01 0.29 -0.55 121.20 128.45 1v62 s ILE 98 Ca 0.29 -1.55 -0.30 0.00 0.00 0.00 0.00 60.65 59.09 1v62 s ILE 98 Cb -0.13 -3.10 -0.05 0.00 0.01 0.00 0.00 42.46 39.19 1v62 s ILE 98 CO 0.17 -0.29 1.09 -0.22 0.00 0.00 0.00 174.94 175.69 1v62 s LEU 99 N -3.53 4.38 -0.78 2.97 0.20 0.13 0.68 118.68 122.72 1v62 s LEU 99 Ca 0.31 1.85 -0.24 0.00 0.69 0.00 0.00 54.13 56.74 1v62 s LEU 99 Cb -0.08 -3.58 -0.17 0.00 -0.43 0.00 0.00 46.19 41.93 1v62 s LEU 99 CO 0.22 -0.35 2.44 -2.65 -0.29 0.00 0.00 176.35 175.72 1v62 n PRO 100 N 3.81 0.48 -4.33 0.98 -0.02 -1.26 -4.69 135.00 129.96 1v62 n PRO 100 Ca 0.07 -0.20 -0.26 0.00 -2.02 0.00 0.00 63.50 61.09 1v62 n PRO 100 Cb 0.49 -2.59 -0.10 0.00 -0.02 0.00 0.00 33.50 31.28 1v62 n PRO 100 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1v62 s VAL 101 N 9.94 2.99 0.15 -1.45 -7.23 -1.26 -5.01 120.40 118.53 1v62 s VAL 101 Ca 1.12 -1.84 0.31 0.00 -1.81 0.00 0.00 61.98 59.76 1v62 s VAL 101 Cb -0.55 -2.50 0.34 0.00 0.56 0.00 0.00 36.38 34.23 1v62 s VAL 101 CO 0.33 -0.18 1.96 1.55 -0.31 0.00 0.00 175.10 178.45 1v62 h PRO 102 N 2.76 0.00 -0.96 4.82 0.13 -1.99 -2.22 132.00 134.53 1v62 h PRO 102 Ca -0.46 0.00 0.07 0.00 -0.87 0.00 0.00 66.00 64.74 1v62 h PRO 102 Cb 1.22 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.28 1v62 h PRO 102 CO 0.54 0.07 0.62 1.96 -0.23 0.00 0.00 178.00 180.97 1v62 h GLN 103 N 0.00 1.07 0.00 0.86 4.20 -1.97 -3.42 115.11 115.85 1v62 h GLN 103 Ca -0.00 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.64 1v62 h GLN 103 Cb 0.55 -0.24 0.00 0.00 0.30 0.00 0.00 27.48 28.09 1v62 h GLN 103 CO 0.01 0.71 0.00 0.43 -0.67 0.00 0.00 178.83 179.31 1v62 n SER 104 N -4.50 0.00 -2.91 1.46 7.64 -1.17 -5.02 113.62 109.12 1v62 n SER 104 Ca 0.15 0.00 -0.22 0.00 1.01 0.00 0.00 58.87 59.81 1v62 n SER 104 Cb 0.19 0.00 0.03 0.00 -1.01 0.00 0.00 64.21 63.42 1v62 n SER 104 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 1v62 n GLN 105 N -1.48 -4.23 -3.62 1.43 7.27 -0.85 -4.98 117.38 110.93 1v62 n GLN 105 Ca 0.00 0.91 -0.27 0.00 0.07 0.00 0.00 57.00 57.71 1v62 n GLN 105 Cb 0.00 -5.73 -0.17 0.00 2.41 0.00 0.00 30.24 26.75 1v62 n GLN 105 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 1v62 s ARG 106 N -5.59 0.19 0.04 3.69 1.81 -1.26 -5.03 118.95 112.80 1v62 s ARG 106 Ca 0.25 -0.23 -0.21 0.00 -1.72 0.00 0.00 55.73 53.82 1v62 s ARG 106 Cb -0.11 -1.78 -0.14 0.00 -0.45 0.00 0.00 34.95 32.47 1v62 s ARG 106 CO 0.31 -0.73 1.39 -1.00 -0.68 0.00 0.00 175.30 174.59 1v62 h PRO 107 N 8.38 0.29 -5.48 3.54 0.13 -1.94 -3.47 132.00 133.46 1v62 h PRO 107 Ca -0.16 -0.13 -0.64 0.00 -0.87 0.00 0.00 66.00 64.20 1v62 h PRO 107 Cb 1.12 -0.01 -0.11 0.00 0.13 0.00 0.00 31.00 32.13 1v62 h PRO 107 CO 0.33 0.62 -0.50 -0.51 -0.23 0.00 0.00 178.00 177.70 1v62 s LEU 108 N -9.28 2.58 -0.03 1.56 1.43 -1.26 -3.54 118.68 110.13 1v62 s LEU 108 Ca -0.14 -1.47 0.02 0.00 -1.03 0.00 0.00 54.13 51.51 1v62 s LEU 108 Cb 0.05 -0.91 0.01 0.00 0.03 0.00 0.00 46.19 45.37 1v62 s LEU 108 CO 0.73 -0.76 -0.07 -0.13 0.23 0.00 0.00 176.35 176.35 1v62 s ARG 109 N -3.90 0.86 -0.22 1.70 1.81 -1.26 -5.08 118.95 112.87 1v62 s ARG 109 Ca 0.20 -0.22 -0.29 0.00 -1.72 0.00 0.00 55.73 53.70 1v62 s ARG 109 Cb 0.03 -0.82 -0.01 0.00 -0.45 0.00 0.00 34.95 33.70 1v62 s ARG 109 CO 0.11 0.04 1.30 -1.25 -0.68 0.00 0.00 175.30 174.82 1v62 s PRO 110 N 0.41 4.09 -0.06 3.54 0.04 -1.26 -5.02 135.00 136.74 1v62 s PRO 110 Ca -0.06 1.52 -0.01 0.00 0.04 0.00 0.00 61.00 62.49 1v62 s PRO 110 Cb -0.10 -3.82 -0.03 0.00 0.04 0.00 0.00 34.50 30.58 1v62 s PRO 110 CO 0.00 -0.89 -0.00 -1.12 0.04 0.00 0.00 177.00 175.03 1v62 s SER 111 N 2.42 5.19 -0.28 6.66 0.01 -1.26 -4.83 113.70 121.61 1v62 s SER 111 Ca 0.56 0.10 -0.02 0.00 1.31 0.00 0.00 55.95 57.90 1v62 s SER 111 Cb -0.20 -1.43 0.01 0.00 0.21 0.00 0.00 66.02 64.61 1v62 s SER 111 CO 0.19 0.35 0.04 -1.20 0.41 0.00 0.00 173.24 173.03 1v62 n SER 112 N 1.95 -6.63 -4.75 2.44 7.64 -1.26 -5.00 113.62 108.01 1v62 n SER 112 Ca -0.18 1.40 -0.29 0.00 1.01 0.00 0.00 58.87 60.82 1v62 n SER 112 Cb 0.53 -5.26 0.15 0.00 -1.01 0.00 0.00 64.21 58.62 1v62 n SER 112 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1v62 s GLY 113 N -1.44 1.57 0.37 0.23 0.00 -1.26 -4.96 107.32 101.83 1v62 s GLY 113 Ca -0.05 -0.51 0.16 0.00 0.00 0.00 0.00 44.72 44.32 1v62 s GLY 113 CO 0.78 0.06 1.78 -0.56 0.00 0.00 0.00 173.10 175.16 1v62 h PRO 114 N -1.59 0.00 -0.43 2.90 0.13 -2.02 -3.20 132.00 127.79 1v62 h PRO 114 Ca -0.51 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.30 1v62 h PRO 114 Cb 1.33 0.00 -0.32 0.00 0.13 0.00 0.00 31.00 32.14 1v62 h PRO 114 CO 0.61 0.39 -0.83 -1.13 -0.23 0.00 0.00 178.00 176.81 1v62 n SER 115 N -3.76 3.08 -4.43 1.44 3.41 -1.26 -5.05 113.62 107.05 1v62 n SER 115 Ca -0.01 -3.26 -0.31 0.00 -0.26 0.00 0.00 58.87 55.02 1v62 n SER 115 Cb 0.47 -0.41 -0.13 0.00 -0.26 0.00 0.00 64.21 63.87 1v62 n SER 115 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1v62 s SER 116 N -3.39 3.71 0.00 4.04 0.01 -1.21 -5.25 113.70 111.61 1v62 s SER 116 Ca 0.41 -0.37 0.00 0.00 1.31 0.00 0.00 55.95 57.30 1v62 s SER 116 Cb 0.38 -0.62 0.00 0.00 0.21 0.00 0.00 66.02 65.99 1v62 s SER 116 CO -0.02 0.29 0.00 0.61 0.41 0.00 0.00 173.24 174.53