#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 -8.60 -4.72 1.61 7.64 -1.26 -4.77 113.62 103.52 1v62 n SER 2 Ca 0.00 1.11 -0.39 0.00 1.01 0.00 0.00 58.87 60.59 1v62 n SER 2 Cb 0.00 -4.74 -0.05 0.00 -1.01 0.00 0.00 64.21 58.41 1v62 n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1v62 s SER 3 N -7.26 6.96 -0.07 6.43 0.01 -1.26 -4.95 113.70 113.56 1v62 s SER 3 Ca 0.00 1.15 0.20 0.00 1.31 0.00 0.00 55.95 58.61 1v62 s SER 3 Cb 0.00 -2.39 0.40 0.00 0.21 0.00 0.00 66.02 64.23 1v62 s SER 3 CO 0.00 -0.07 1.17 0.61 0.41 0.00 0.00 173.24 175.36 1v62 n GLY 4 N 3.02 2.30 1.49 3.44 0.00 -1.26 -4.85 105.19 109.32 1v62 n GLY 4 Ca -0.03 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 45.05 1v62 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1v62 n SER 5 N -0.06 0.00 -3.83 1.61 2.88 -1.26 -5.08 113.62 107.88 1v62 n SER 5 Ca 0.10 0.00 -0.26 0.00 -1.33 0.00 0.00 58.87 57.37 1v62 n SER 5 Cb 0.98 0.07 -0.17 0.00 -0.75 0.00 0.00 64.21 64.33 1v62 n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1v62 s SER 6 N -3.99 2.42 0.00 -3.46 0.15 -1.26 -5.04 113.70 102.52 1v62 s SER 6 Ca 0.00 -0.49 0.00 0.00 0.70 0.00 0.00 55.95 56.16 1v62 s SER 6 Cb 0.00 -0.71 0.00 0.00 -1.71 0.00 0.00 66.02 63.60 1v62 s SER 6 CO 0.00 -0.20 0.00 0.61 1.20 0.00 0.00 173.24 174.85 1v62 n GLY 7 N 4.99 -0.63 3.48 9.45 0.00 -1.26 -4.93 105.19 116.29 1v62 n GLY 7 Ca -0.10 -1.05 -0.12 0.00 0.00 0.00 0.00 46.02 44.74 1v62 n GLY 7 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1v62 s ASP 8 N -0.05 -0.52 -0.34 1.61 1.47 -1.26 -4.68 116.67 112.90 1v62 s ASP 8 Ca 0.00 0.19 0.06 0.00 1.18 0.00 0.00 52.55 53.98 1v62 s ASP 8 Cb 0.00 0.51 0.46 0.00 -0.34 0.00 0.00 42.92 43.55 1v62 s ASP 8 CO 0.00 -0.75 1.36 0.35 0.68 0.00 0.00 175.17 176.82 1v62 n THR 9 N 0.03 2.67 0.17 2.11 -2.24 -1.26 -4.83 114.28 110.93 1v62 n THR 9 Ca -0.15 -3.70 -0.07 0.00 -2.27 0.00 0.00 64.05 57.87 1v62 n THR 9 Cb 0.62 -0.92 -0.03 0.00 -2.10 0.00 0.00 70.33 67.90 1v62 n THR 9 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1v62 h VAL 10 N 1.69 0.00 -3.42 2.28 2.07 -2.02 -3.39 116.25 113.46 1v62 h VAL 10 Ca 0.34 0.00 -0.71 0.00 0.82 0.00 0.00 66.70 67.15 1v62 h VAL 10 Cb 1.39 0.00 -0.30 0.00 -1.52 0.00 0.00 31.29 30.86 1v62 h VAL 10 CO 0.75 0.00 -0.46 0.00 0.02 0.00 0.00 177.57 177.87 1v62 s ALA 11 N -4.00 3.28 0.12 1.67 0.00 -1.26 -5.06 121.76 116.51 1v62 s ALA 11 Ca -0.07 -2.34 0.01 0.00 0.00 0.00 0.00 51.96 49.56 1v62 s ALA 11 Cb 0.01 -2.64 -0.04 0.00 0.00 0.00 0.00 23.12 20.44 1v62 s ALA 11 CO 0.20 -1.75 -0.02 1.21 0.00 0.00 0.00 175.76 175.40 1v62 s ASN 12 N 2.23 0.93 -0.51 0.00 3.04 -1.26 -5.12 114.94 114.25 1v62 s ASN 12 Ca 0.05 -1.10 0.03 0.00 0.04 0.00 0.00 52.86 51.88 1v62 s ASN 12 Cb -0.24 0.15 0.15 0.00 -1.54 0.00 0.00 41.25 39.78 1v62 s ASN 12 CO -0.00 -0.57 0.33 0.00 -3.04 0.00 0.00 177.10 173.83 1v62 s ALA 13 N -3.75 2.47 -0.64 1.71 0.00 -1.26 -4.95 121.76 115.33 1v62 s ALA 13 Ca 0.17 -2.93 -0.01 0.00 0.00 0.00 0.00 51.96 49.19 1v62 s ALA 13 Cb 0.06 -1.90 0.47 0.00 0.00 0.00 0.00 23.12 21.74 1v62 s ALA 13 CO -0.01 -2.05 2.03 0.45 0.00 0.00 0.00 175.76 176.17 1v62 n SER 14 N 2.93 7.33 0.00 0.00 2.88 -1.26 -4.73 113.62 120.77 1v62 n SER 14 Ca 0.17 -3.76 0.00 0.00 -1.33 0.00 0.00 58.87 53.95 1v62 n SER 14 Cb 0.38 -0.97 0.00 0.00 -0.75 0.00 0.00 64.21 62.87 1v62 n SER 14 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1v62 n GLY 15 N -0.92 -1.54 3.78 0.46 0.00 -1.26 -5.15 105.19 100.56 1v62 n GLY 15 Ca 0.62 0.52 -0.30 0.00 0.00 0.00 0.00 46.02 46.86 1v62 n GLY 15 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1v62 s PRO 16 N 0.00 1.99 0.75 1.61 0.04 -1.26 -4.71 135.00 133.43 1v62 s PRO 16 Ca 0.00 0.76 -0.03 0.00 0.04 0.00 0.00 61.00 61.78 1v62 s PRO 16 Cb 0.00 -1.90 0.14 0.00 0.04 0.00 0.00 34.50 32.78 1v62 s PRO 16 CO 0.00 -1.71 1.04 -1.17 0.04 0.00 0.00 177.00 175.19 1v62 s LEU 17 N -5.87 2.94 -0.27 -3.56 2.96 0.23 -4.92 118.68 110.18 1v62 s LEU 17 Ca 0.61 -0.28 -0.02 0.00 -0.22 0.00 0.00 54.13 54.21 1v62 s LEU 17 Cb -0.15 -2.02 0.09 0.00 0.50 0.00 0.00 46.19 44.61 1v62 s LEU 17 CO 0.55 -1.97 0.09 -0.04 -1.32 0.00 0.00 176.35 173.66 1v62 s MET 18 N -5.24 0.51 -0.86 1.98 -1.94 -1.26 -2.85 119.30 109.64 1v62 s MET 18 Ca 0.67 -0.73 -0.13 0.00 -1.71 0.00 0.00 55.69 53.79 1v62 s MET 18 Cb -0.05 -1.75 0.23 0.00 2.01 0.00 0.00 34.83 35.27 1v62 s MET 18 CO 0.45 -0.91 0.81 0.08 -0.01 0.00 0.00 175.02 175.44 1v62 s VAL 19 N 1.84 5.60 0.19 -6.03 1.01 0.03 -4.54 120.40 118.49 1v62 s VAL 19 Ca 0.07 -2.64 -0.30 0.00 0.00 0.00 0.00 61.98 59.11 1v62 s VAL 19 Cb -0.17 -4.45 -0.08 0.00 0.00 0.00 0.00 36.38 31.69 1v62 s VAL 19 CO -0.25 -1.05 0.98 -1.61 0.00 0.00 0.00 175.10 173.18 1v62 s GLU 20 N -0.06 4.75 -0.18 2.72 2.02 -1.26 -3.92 118.70 122.76 1v62 s GLU 20 Ca 0.20 1.53 -0.03 0.00 0.02 0.00 0.00 54.97 56.69 1v62 s GLU 20 Cb -0.10 -3.31 0.06 0.00 0.10 0.00 0.00 34.13 30.88 1v62 s GLU 20 CO -0.09 0.33 0.04 0.42 0.02 0.00 0.00 175.26 175.97 1v62 s ILE 21 N -0.63 0.48 -0.30 -1.63 1.01 -1.23 -4.94 121.20 113.96 1v62 s ILE 21 Ca 0.45 -0.48 -0.28 0.00 0.00 0.00 0.00 60.65 60.33 1v62 s ILE 21 Cb -0.26 -0.97 -0.03 0.00 0.01 0.00 0.00 42.46 41.22 1v62 s ILE 21 CO 0.32 -0.17 1.89 0.54 0.00 0.00 0.00 174.94 177.52 1v62 s VAL 22 N 1.88 3.37 0.42 2.92 0.11 -1.26 -2.68 120.40 125.17 1v62 s VAL 22 Ca -0.00 0.38 0.07 0.00 -2.93 0.00 0.00 61.98 59.50 1v62 s VAL 22 Cb -0.17 -3.50 -0.03 0.00 -1.53 0.00 0.00 36.38 31.16 1v62 s VAL 22 CO -0.08 -0.32 0.32 -1.59 -3.33 0.00 0.00 175.10 170.11 1v62 s LYS 23 N 5.80 2.43 0.61 1.54 -2.85 -0.44 -4.97 119.74 121.85 1v62 s LYS 23 Ca 0.85 -1.65 -0.18 0.00 -1.00 0.00 0.00 55.97 53.98 1v62 s LYS 23 Cb -0.25 -2.25 -0.03 0.00 -2.06 0.00 0.00 37.83 33.24 1v62 s LYS 23 CO 0.34 -0.19 1.20 0.95 0.10 0.00 0.00 175.35 177.75 1v62 s THR 24 N -2.52 2.63 0.01 3.79 -4.23 -1.26 -4.78 115.64 109.27 1v62 s THR 24 Ca 0.46 0.38 -0.30 0.00 -1.18 0.00 0.00 61.69 61.04 1v62 s THR 24 Cb -0.01 -3.11 -0.06 0.00 1.34 0.00 0.00 72.50 70.66 1v62 s THR 24 CO 0.26 -0.10 1.46 -2.16 -0.54 0.00 0.00 174.62 173.55 1v62 s PRO 25 N -3.42 4.26 -1.69 3.99 0.04 -1.26 -2.85 135.00 134.06 1v62 s PRO 25 Ca 0.77 2.04 -0.02 0.00 0.04 0.00 0.00 61.00 63.83 1v62 s PRO 25 Cb -0.30 -3.61 0.00 0.00 0.04 0.00 0.00 34.50 30.63 1v62 s PRO 25 CO 0.34 -0.63 0.22 0.41 0.04 0.00 0.00 177.00 177.39 1v62 n GLY 26 N 3.74 -0.49 2.66 0.56 0.00 -1.26 -4.98 105.19 105.42 1v62 n GLY 26 Ca 0.14 0.04 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 1v62 n GLY 26 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1v62 n SER 27 N -2.15 2.18 -4.28 1.61 7.64 -1.13 -5.17 113.62 112.31 1v62 n SER 27 Ca -0.20 -2.67 -0.18 0.00 1.01 0.00 0.00 58.87 56.83 1v62 n SER 27 Cb 0.66 0.51 -0.11 0.00 -1.01 0.00 0.00 64.21 64.27 1v62 n SER 27 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1v62 s ALA 28 N -2.75 1.71 -0.15 -0.43 0.00 -1.26 -4.86 121.76 114.01 1v62 s ALA 28 Ca 0.07 -1.44 -0.14 0.00 0.00 0.00 0.00 51.96 50.45 1v62 s ALA 28 Cb 0.00 -0.08 -0.05 0.00 0.00 0.00 0.00 23.12 22.99 1v62 s ALA 28 CO 0.05 0.10 -0.27 1.28 0.00 0.00 0.00 175.76 176.92 1v62 n LEU 29 N 0.19 1.76 0.00 0.00 4.77 -1.26 -4.93 117.00 117.52 1v62 n LEU 29 Ca -0.13 0.41 0.00 0.00 -0.03 0.00 0.00 56.01 56.27 1v62 n LEU 29 Cb 0.58 -0.77 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 1v62 n LEU 29 CO 0.30 -0.35 0.00 0.61 -1.33 0.00 0.00 177.39 176.61 1v62 n GLY 30 N 1.52 1.11 3.70 -0.72 0.00 -1.26 -4.81 105.19 104.74 1v62 n GLY 30 Ca -0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.50 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 -1.89 4.93 -0.27 -0.61 1.01 -1.26 -2.89 121.20 120.22 1v62 s ILE 31 Ca 0.00 1.76 -0.05 0.00 0.00 0.00 0.00 60.65 62.36 1v62 s ILE 31 Cb 0.00 -4.19 0.01 0.00 0.01 0.00 0.00 42.46 38.29 1v62 s ILE 31 CO 0.00 0.16 0.03 -0.44 0.00 0.00 0.00 174.94 174.69 1v62 s SER 32 N 0.96 4.82 0.66 3.58 0.01 -0.71 -5.04 113.70 117.99 1v62 s SER 32 Ca 0.44 -0.66 -0.01 0.00 1.31 0.00 0.00 55.95 57.03 1v62 s SER 32 Cb -0.19 -1.81 0.10 0.00 0.21 0.00 0.00 66.02 64.33 1v62 s SER 32 CO 0.21 -0.14 0.66 0.18 0.41 0.00 0.00 173.24 174.56 1v62 n LEU 33 N 4.82 0.00 -3.15 2.44 4.77 -1.26 -0.01 117.00 124.61 1v62 n LEU 33 Ca -0.16 -1.29 0.05 0.00 -0.03 0.00 0.00 56.01 54.58 1v62 n LEU 33 Cb 0.48 -0.44 -0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1v62 n LEU 33 CO 0.30 -0.85 0.33 0.28 -1.33 0.00 0.00 177.39 176.12 1v62 s THR 34 N -1.99 -0.65 0.12 -5.08 -1.32 0.30 -4.18 115.64 102.84 1v62 s THR 34 Ca 0.43 0.00 -0.27 0.00 -1.21 0.00 0.00 61.69 60.63 1v62 s THR 34 Cb -0.02 -0.78 -0.07 0.00 -1.51 0.00 0.00 72.50 70.12 1v62 s THR 34 CO 0.29 0.00 0.86 0.28 -2.21 0.00 0.00 174.62 173.83 1v62 s THR 35 N 2.90 4.47 0.35 5.08 -1.32 -1.26 -2.05 115.64 123.81 1v62 s THR 35 Ca 0.15 1.86 0.02 0.00 -1.21 0.00 0.00 61.69 62.51 1v62 s THR 35 Cb -0.08 -4.22 -0.01 0.00 -1.51 0.00 0.00 72.50 66.68 1v62 s THR 35 CO -0.21 0.41 0.06 0.41 -2.21 0.00 0.00 174.62 173.08 1v62 n THR 36 N 2.30 0.00 -4.42 5.08 -1.04 -1.04 -4.97 114.28 110.19 1v62 n THR 36 Ca -0.02 -1.86 -0.24 0.00 -2.04 0.00 0.00 64.05 59.89 1v62 n THR 36 Cb 0.49 0.54 -0.09 0.00 -1.82 0.00 0.00 70.33 69.44 1v62 n THR 36 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 1v62 s SER 37 N -3.06 3.84 0.00 8.00 0.01 -1.26 -3.16 113.70 118.07 1v62 s SER 37 Ca 0.09 -0.92 0.00 0.00 1.31 0.00 0.00 55.95 56.42 1v62 s SER 37 Cb 0.00 -0.44 0.00 0.00 0.21 0.00 0.00 66.02 65.79 1v62 s SER 37 CO 0.06 0.03 0.00 0.18 0.41 0.00 0.00 173.24 173.93 1v62 n LEU 38 N -0.67 0.00 0.08 2.44 4.77 -1.24 -4.99 117.00 117.39 1v62 n LEU 38 Ca -0.06 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 1v62 n LEU 38 Cb 0.60 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.69 1v62 n LEU 38 CO 0.38 -0.28 -0.05 0.54 -1.33 0.00 0.00 177.39 176.65 1v62 n ARG 39 N -1.83 0.00 -1.01 3.23 1.74 -1.26 -4.98 116.66 112.55 1v62 n ARG 39 Ca 0.00 0.00 -0.02 0.00 -0.77 0.00 0.00 57.85 57.06 1v62 n ARG 39 Cb 0.00 -0.14 -0.02 0.00 -1.02 0.00 0.00 32.46 31.28 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 -3.17 -0.11 -3.68 0.55 3.02 -1.26 -5.11 115.26 105.49 1v62 n ASN 40 Ca 0.00 -1.84 -0.14 0.00 -0.03 0.00 0.00 54.58 52.57 1v62 n ASN 40 Cb 0.05 0.01 -0.09 0.00 -0.61 0.00 0.00 39.78 39.15 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 0.00 0.67 -0.32 3.52 1.02 -1.26 -5.05 119.74 118.32 1v62 s LYS 41 Ca 0.10 0.50 -0.10 0.00 0.02 0.00 0.00 55.97 56.49 1v62 s LYS 41 Cb 0.12 0.32 -0.00 0.00 -0.52 0.00 0.00 37.83 37.74 1v62 s LYS 41 CO -0.05 -0.13 0.16 -1.54 -0.92 0.00 0.00 175.35 172.87 1v62 s SER 42 N -0.19 5.58 -0.24 2.83 1.04 -1.26 -3.63 113.70 117.83 1v62 s SER 42 Ca -0.04 -0.56 -0.12 0.00 0.48 0.00 0.00 55.95 55.71 1v62 s SER 42 Cb -0.03 -2.01 -0.05 0.00 0.10 0.00 0.00 66.02 64.03 1v62 s SER 42 CO 0.03 -0.21 0.24 -0.69 0.98 0.00 0.00 173.24 173.58 1v62 s VAL 43 N 1.61 5.30 -0.55 5.02 1.01 -1.19 -3.91 120.40 127.70 1v62 s VAL 43 Ca 0.04 0.33 -0.26 0.00 0.00 0.00 0.00 61.98 62.10 1v62 s VAL 43 Cb -0.17 -3.57 0.04 0.00 0.00 0.00 0.00 36.38 32.67 1v62 s VAL 43 CO 0.06 0.29 1.02 -0.63 0.00 0.00 0.00 175.10 175.85 1v62 s ILE 44 N 1.30 4.29 0.10 2.22 1.09 -1.26 -2.49 121.20 126.44 1v62 s ILE 44 Ca 0.11 0.55 0.06 0.00 -1.10 0.00 0.00 60.65 60.26 1v62 s ILE 44 Cb -0.14 -4.58 -0.04 0.00 -1.06 0.00 0.00 42.46 36.64 1v62 s ILE 44 CO 0.07 -1.14 -0.03 0.42 -0.10 0.00 0.00 174.94 174.16 1v62 s THR 45 N 4.23 3.84 0.20 2.92 -4.23 -0.87 -1.88 115.64 119.85 1v62 s THR 45 Ca 0.35 -1.08 -0.31 0.00 -1.18 0.00 0.00 61.69 59.48 1v62 s THR 45 Cb -0.11 -2.83 -0.10 0.00 1.34 0.00 0.00 72.50 70.81 1v62 s THR 45 CO 0.22 0.11 1.44 -0.63 -0.54 0.00 0.00 174.62 175.22 1v62 s ILE 46 N -1.30 2.84 -0.14 2.99 1.01 -0.95 0.11 121.20 125.76 1v62 s ILE 46 Ca 0.25 0.66 -0.10 0.00 0.00 0.00 0.00 60.65 61.46 1v62 s ILE 46 Cb -0.11 -3.42 -0.03 0.00 0.01 0.00 0.00 42.46 38.90 1v62 s ILE 46 CO 0.17 0.08 -0.19 -0.67 0.00 0.00 0.00 174.94 174.34 1v62 n ASP 47 N 2.98 1.74 -3.54 3.58 2.03 0.99 -1.23 116.55 123.09 1v62 n ASP 47 Ca 0.09 0.59 -0.11 0.00 0.52 0.00 0.00 54.79 55.88 1v62 n ASP 47 Cb 0.41 -0.84 -0.03 0.00 -0.72 0.00 0.00 41.12 39.93 1v62 n ASP 47 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1v62 s ARG 48 N -2.26 1.24 0.25 -0.67 0.52 -0.77 -4.57 118.95 112.69 1v62 s ARG 48 Ca -0.16 -0.61 0.07 0.00 -0.52 0.00 0.00 55.73 54.51 1v62 s ARG 48 Cb 0.02 0.54 -0.04 0.00 0.52 0.00 0.00 34.95 36.00 1v62 s ARG 48 CO 0.23 -0.53 0.16 0.42 0.02 0.00 0.00 175.30 175.61 1v62 s ILE 49 N -3.79 4.30 0.04 1.52 1.01 -1.26 -1.73 121.20 121.29 1v62 s ILE 49 Ca 0.03 -1.46 -0.17 0.00 0.00 0.00 0.00 60.65 59.05 1v62 s ILE 49 Cb -0.00 -3.31 -0.06 0.00 0.01 0.00 0.00 42.46 39.09 1v62 s ILE 49 CO -0.11 -0.34 0.49 -0.54 0.00 0.00 0.00 174.94 174.44 1v62 s LYS 50 N -3.78 4.05 0.58 2.79 1.02 -1.14 -4.96 119.74 118.30 1v62 s LYS 50 Ca 0.32 0.57 -0.17 0.00 0.02 0.00 0.00 55.97 56.71 1v62 s LYS 50 Cb -0.08 -3.21 -0.04 0.00 -0.52 0.00 0.00 37.83 33.98 1v62 s LYS 50 CO 0.24 0.66 1.07 -1.25 -0.92 0.00 0.00 175.35 175.15 1v62 s PRO 51 N -1.14 3.32 -1.75 -1.68 0.04 -1.26 -3.53 135.00 129.00 1v62 s PRO 51 Ca 0.27 1.31 -0.01 0.00 0.04 0.00 0.00 61.00 62.61 1v62 s PRO 51 Cb -0.18 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.34 1v62 s PRO 51 CO 0.16 -0.82 0.13 0.00 0.04 0.00 0.00 177.00 176.52 1v62 n ALA 52 N -1.83 -0.70 -3.78 8.56 0.00 -1.26 -4.98 120.51 116.52 1v62 n ALA 52 Ca 0.09 0.20 -0.16 0.00 0.00 0.00 0.00 53.44 53.57 1v62 n ALA 52 Cb 0.52 -2.59 -0.00 0.00 0.00 0.00 0.00 19.45 17.38 1v62 n ALA 52 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1v62 n SER 53 N -2.13 2.04 0.06 0.00 2.88 -1.23 -5.02 113.62 110.21 1v62 n SER 53 Ca -0.22 -2.06 -0.10 0.00 -1.33 0.00 0.00 58.87 55.16 1v62 n SER 53 Cb 0.68 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 64.01 1v62 n SER 53 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 1v62 h VAL 54 N 0.65 1.46 0.12 2.46 2.07 -1.88 -2.95 116.25 118.18 1v62 h VAL 54 Ca -0.19 -3.16 -0.28 0.00 0.82 0.00 0.00 66.70 63.88 1v62 h VAL 54 Cb 0.70 2.79 0.02 0.00 -1.52 0.00 0.00 31.29 33.27 1v62 h VAL 54 CO 0.31 0.87 -1.21 0.58 0.02 0.00 0.00 177.57 178.13 1v62 h VAL 55 N 0.02 1.36 -0.43 2.57 2.07 -1.94 -2.02 116.25 117.87 1v62 h VAL 55 Ca -0.11 -2.63 -0.12 0.00 0.82 0.00 0.00 66.70 64.66 1v62 h VAL 55 Cb 1.88 2.74 -0.01 0.00 -1.52 0.00 0.00 31.29 34.38 1v62 h VAL 55 CO 0.14 0.79 -0.20 -0.78 0.02 0.00 0.00 177.57 177.54 1v62 h ASP 56 N 0.20 0.93 -0.22 0.57 1.82 -1.75 0.79 116.42 118.76 1v62 h ASP 56 Ca -0.16 -0.40 -0.21 0.00 -0.39 0.00 0.00 57.03 55.87 1v62 h ASP 56 Cb 1.89 -0.26 0.01 0.00 0.68 0.00 0.00 39.33 41.65 1v62 h ASP 56 CO 0.22 1.12 -0.66 0.03 -1.61 0.00 0.00 179.24 178.34 1v62 h ARG 57 N 0.73 0.85 0.03 0.28 3.08 -1.61 -3.28 114.38 114.46 1v62 h ARG 57 Ca 0.10 -0.61 -0.21 0.00 0.07 0.00 0.00 59.98 59.33 1v62 h ARG 57 Cb 0.77 0.10 0.02 0.00 0.08 0.00 0.00 29.97 30.94 1v62 h ARG 57 CO 0.06 1.23 -0.84 1.03 -1.07 0.00 0.00 179.97 180.38 1v62 h SER 58 N 0.62 0.69 -0.43 7.04 0.87 -1.33 -3.48 113.55 117.52 1v62 h SER 58 Ca -0.02 -0.78 -0.07 0.00 -1.23 0.00 0.00 61.79 59.69 1v62 h SER 58 Cb 1.28 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 63.02 1v62 h SER 58 CO 0.14 1.39 -0.08 0.61 -0.53 0.00 0.00 176.83 178.36 1v62 n GLY 59 N 1.18 0.29 0.17 5.77 0.00 0.27 -4.95 105.19 107.92 1v62 n GLY 59 Ca -0.11 -0.77 -0.20 0.00 0.00 0.00 0.00 46.02 44.93 1v62 n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v62 h ALA 60 N 0.14 0.09 -3.22 4.61 0.00 -1.89 -3.44 119.26 115.55 1v62 h ALA 60 Ca -0.08 -0.76 -0.63 0.00 0.00 0.00 0.00 54.91 53.44 1v62 h ALA 60 Cb 0.94 0.07 -0.20 0.00 0.00 0.00 0.00 17.79 18.59 1v62 h ALA 60 CO 0.09 0.74 -0.63 -0.51 0.00 0.00 0.00 179.25 178.94 1v62 s LEU 61 N -7.82 3.43 0.10 0.00 1.43 -1.26 -4.94 118.68 109.63 1v62 s LEU 61 Ca -0.08 -0.09 0.08 0.00 -1.03 0.00 0.00 54.13 53.01 1v62 s LEU 61 Cb 0.07 -1.86 -0.04 0.00 0.03 0.00 0.00 46.19 44.39 1v62 s LEU 61 CO 0.92 0.13 -0.17 -1.00 0.23 0.00 0.00 176.35 176.45 1v62 s HIS 62 N 0.63 2.56 -0.67 0.29 3.76 -1.26 -4.90 115.29 115.70 1v62 s HIS 62 Ca 0.00 -0.25 -0.26 0.00 -0.15 0.00 0.00 55.06 54.40 1v62 s HIS 62 Cb -0.14 -1.38 -0.03 0.00 1.11 0.00 0.00 32.58 32.15 1v62 s HIS 62 CO 0.02 0.37 1.88 -1.25 -0.85 0.00 0.00 174.74 174.91 1v62 s PRO 63 N -2.01 2.60 0.00 8.40 0.04 -1.26 -2.85 135.00 139.92 1v62 s PRO 63 Ca 0.18 0.43 0.00 0.00 0.04 0.00 0.00 61.00 61.64 1v62 s PRO 63 Cb -0.11 -4.53 0.00 0.00 0.04 0.00 0.00 34.50 29.90 1v62 s PRO 63 CO 0.10 -2.88 0.00 0.41 0.04 0.00 0.00 177.00 174.67 1v62 n GLY 64 N 5.94 0.85 3.66 0.56 0.00 -0.36 -4.92 105.19 110.92 1v62 n GLY 64 Ca 0.25 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.92 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 0.88 -4.36 1.61 9.92 -1.13 -4.68 116.55 118.79 1v62 n ASP 65 Ca 0.00 0.64 -0.40 0.00 -0.53 0.00 0.00 54.79 54.50 1v62 n ASP 65 Cb 0.00 -1.47 -0.11 0.00 -0.64 0.00 0.00 41.12 38.90 1v62 n ASP 65 CO 0.00 0.00 0.00 -1.00 0.13 0.00 0.00 177.20 176.33 1v62 s HIS 66 N -1.92 3.24 -0.05 1.24 3.76 -1.26 -2.24 115.29 118.06 1v62 s HIS 66 Ca 0.74 -1.03 -0.30 0.00 -0.15 0.00 0.00 55.06 54.33 1v62 s HIS 66 Cb -0.32 -2.41 -0.03 0.00 1.11 0.00 0.00 32.58 30.94 1v62 s HIS 66 CO 0.50 -0.65 1.13 0.42 -0.85 0.00 0.00 174.74 175.28 1v62 s ILE 67 N 1.53 4.44 -0.16 0.60 1.01 -0.79 -0.97 121.20 126.86 1v62 s ILE 67 Ca 0.01 1.74 0.19 0.00 0.00 0.00 0.00 60.65 62.60 1v62 s ILE 67 Cb -0.19 -4.12 -0.27 0.00 0.01 0.00 0.00 42.46 37.89 1v62 s ILE 67 CO 0.06 0.02 0.17 0.18 0.00 0.00 0.00 174.94 175.37 1v62 n LEU 68 N 4.92 0.00 -3.46 2.97 4.77 0.01 -4.43 117.00 121.79 1v62 n LEU 68 Ca 0.10 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.97 1v62 n LEU 68 Cb 0.47 0.38 -0.02 0.00 -2.33 0.00 0.00 43.42 41.92 1v62 n LEU 68 CO 0.54 0.38 0.52 -0.44 -1.33 0.00 0.00 177.39 177.06 1v62 s SER 69 N -5.24 -0.48 -0.16 -1.43 0.01 -0.95 -0.89 113.70 104.56 1v62 s SER 69 Ca -0.09 0.00 -0.06 0.00 1.31 0.00 0.00 55.95 57.10 1v62 s SER 69 Cb 0.08 0.51 0.07 0.00 0.21 0.00 0.00 66.02 66.89 1v62 s SER 69 CO 0.85 -0.82 0.34 -0.63 0.41 0.00 0.00 173.24 173.38 1v62 s ILE 70 N -3.48 -0.42 -1.89 1.44 1.01 -0.02 -0.07 121.20 117.76 1v62 s ILE 70 Ca 0.03 0.20 0.00 0.00 0.00 0.00 0.00 60.65 60.88 1v62 s ILE 70 Cb -0.01 -0.54 0.00 0.00 0.01 0.00 0.00 42.46 41.92 1v62 s ILE 70 CO -0.11 0.08 0.00 -0.67 0.00 0.00 0.00 174.94 174.24 1v62 n ASP 71 N 5.12 -5.87 0.00 3.58 2.03 0.22 -0.94 116.55 120.71 1v62 n ASP 71 Ca -0.11 0.10 0.00 0.00 0.52 0.00 0.00 54.79 55.30 1v62 n ASP 71 Cb 0.51 -4.94 0.00 0.00 -0.72 0.00 0.00 41.12 35.96 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 -0.88 0.73 3.82 0.27 0.00 -1.26 -5.05 105.19 102.81 1v62 n GLY 72 Ca -0.24 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.42 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 -2.33 5.45 0.36 2.61 2.01 -0.11 -5.08 115.64 118.54 1v62 s THR 73 Ca 0.00 0.19 -0.26 0.00 0.31 0.00 0.00 61.69 61.93 1v62 s THR 73 Cb 0.00 -3.42 -0.09 0.00 0.01 0.00 0.00 72.50 69.00 1v62 s THR 73 CO 0.00 0.55 1.09 -0.44 -0.69 0.00 0.00 174.62 175.13 1v62 s SER 74 N -0.47 6.88 -0.47 3.53 0.01 -1.26 -0.84 113.70 121.07 1v62 s SER 74 Ca 0.12 2.18 0.03 0.00 1.31 0.00 0.00 55.95 59.59 1v62 s SER 74 Cb -0.12 -2.61 0.64 0.00 0.21 0.00 0.00 66.02 64.14 1v62 s SER 74 CO 0.02 -0.41 1.92 0.23 0.41 0.00 0.00 173.24 175.40 1v62 n MET 75 N 0.38 2.30 -3.14 12.44 2.81 -0.07 -4.82 117.12 127.03 1v62 n MET 75 Ca 0.03 -3.06 -0.41 0.00 -1.81 0.00 0.00 57.70 52.45 1v62 n MET 75 Cb 0.47 -2.18 -0.07 0.00 -0.71 0.00 0.00 33.22 30.73 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 -3.37 3.72 -1.68 0.03 2.56 -1.26 -4.04 118.70 114.66 1v62 s GLU 76 Ca 0.58 0.08 -0.01 0.00 0.00 0.00 0.00 54.97 55.62 1v62 s GLU 76 Cb 0.48 -3.79 0.00 0.00 2.00 0.00 0.00 34.13 32.82 1v62 s GLU 76 CO 0.09 -0.68 0.09 1.58 -0.56 0.00 0.00 175.26 175.79 1v62 n HIS 77 N 5.95 -1.10 -3.00 5.30 -0.00 -1.25 -4.98 115.22 116.14 1v62 n HIS 77 Ca -0.02 0.08 -0.25 0.00 0.46 0.00 0.00 57.72 57.99 1v62 n HIS 77 Cb 0.49 -3.93 0.00 0.00 -0.12 0.00 0.00 29.99 26.42 1v62 n HIS 77 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1v62 n SER 79 N -2.05 1.18 0.06 0.00 7.64 -1.26 -4.84 113.62 114.35 1v62 n SER 79 Ca -0.01 -1.65 -0.20 0.00 1.01 0.00 0.00 58.87 58.02 1v62 n SER 79 Cb 0.56 -0.10 -0.14 0.00 -1.01 0.00 0.00 64.21 63.53 1v62 n SER 79 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1v62 h LEU 80 N 0.00 0.58 -0.03 -3.43 5.85 -1.98 -2.82 115.31 113.47 1v62 h LEU 80 Ca -0.12 -0.89 0.01 0.00 0.84 0.00 0.00 57.88 57.72 1v62 h LEU 80 Cb 0.48 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 1v62 h LEU 80 CO 0.18 1.42 -0.01 -0.07 -0.34 0.00 0.00 178.44 179.62 1v62 h LEU 81 N -0.17 -0.02 -0.92 2.25 3.38 -1.97 0.51 115.31 118.36 1v62 h LEU 81 Ca -0.15 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 1v62 h LEU 81 Cb 1.67 0.02 -0.04 0.00 0.09 0.00 0.00 40.66 42.39 1v62 h LEU 81 CO 0.17 -0.01 0.49 -0.08 0.09 0.00 0.00 178.44 179.10 1v62 h GLU 82 N 0.00 1.25 -0.11 1.13 4.81 -1.98 0.55 114.58 120.23 1v62 h GLU 82 Ca 0.01 -0.15 -0.16 0.00 -0.13 0.00 0.00 59.36 58.94 1v62 h GLU 82 Cb 0.02 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.15 1v62 h GLU 82 CO -0.03 0.91 -0.62 0.00 -0.73 0.00 0.00 179.01 178.55 1v62 h ALA 83 N 1.28 0.73 0.06 2.92 0.00 -1.21 -3.02 119.26 120.02 1v62 h ALA 83 Ca 0.31 -0.55 -0.23 0.00 0.00 0.00 0.00 54.91 54.44 1v62 h ALA 83 Cb 0.03 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1v62 h ALA 83 CO -0.05 0.72 -1.06 1.15 0.00 0.00 0.00 179.25 180.01 1v62 h THR 84 N 0.29 1.53 -0.79 0.00 2.02 0.48 -3.26 112.91 113.18 1v62 h THR 84 Ca -0.01 -2.94 -0.01 0.00 0.77 0.00 0.00 66.41 64.22 1v62 h THR 84 Cb 1.15 2.73 -0.04 0.00 -1.74 0.00 0.00 68.15 70.26 1v62 h THR 84 CO 0.11 0.86 0.44 0.11 0.37 0.00 0.00 175.52 177.40 1v62 h LYS 85 N 0.08 1.10 -0.61 6.66 1.57 0.12 -2.49 116.57 123.01 1v62 h LYS 85 Ca -0.08 -0.12 -0.05 0.00 -1.87 0.00 0.00 60.65 58.54 1v62 h LYS 85 Cb 1.76 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 33.82 1v62 h LYS 85 CO 0.17 0.80 0.20 -0.07 -0.57 0.00 0.00 179.45 179.98 1v62 h LEU 86 N 1.11 0.88 -1.75 2.94 3.38 -1.58 -2.40 115.31 117.88 1v62 h LEU 86 Ca 0.28 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1v62 h LEU 86 Cb 0.01 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1v62 h LEU 86 CO -0.05 0.84 0.09 -0.07 0.09 0.00 0.00 178.44 179.35 1v62 h LEU 87 N 0.86 0.22 -0.65 1.67 3.38 -1.50 -1.51 115.31 117.80 1v62 h LEU 87 Ca 0.20 -0.01 -0.14 0.00 0.09 0.00 0.00 57.88 58.01 1v62 h LEU 87 Cb 0.27 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 1v62 h LEU 87 CO -0.01 0.19 -0.66 0.00 0.09 0.00 0.00 178.44 178.05 1v62 h ALA 88 N 1.84 0.87 -1.73 1.53 0.00 -1.12 -3.37 119.26 117.28 1v62 h ALA 88 Ca 0.07 -0.60 -0.73 0.00 0.00 0.00 0.00 54.91 53.65 1v62 h ALA 88 Cb 0.03 -0.10 -0.18 0.00 0.00 0.00 0.00 17.79 17.54 1v62 h ALA 88 CO -0.01 0.81 1.25 -1.12 0.00 0.00 0.00 179.25 180.18 1v62 s SER 89 N -6.85 6.98 -0.03 0.00 0.01 -0.57 -4.94 113.70 108.30 1v62 s SER 89 Ca -0.02 -2.80 -0.01 0.00 1.31 0.00 0.00 55.95 54.44 1v62 s SER 89 Cb 0.12 -2.40 0.03 0.00 0.21 0.00 0.00 66.02 63.98 1v62 s SER 89 CO 0.78 -0.81 0.05 -0.63 0.41 0.00 0.00 173.24 173.03 1v62 s ILE 90 N 1.82 -0.07 0.00 1.44 -1.09 -1.26 -4.94 121.20 117.10 1v62 s ILE 90 Ca 0.41 0.25 -0.24 0.00 -2.23 0.00 0.00 60.65 58.84 1v62 s ILE 90 Cb -0.03 -0.11 -0.18 0.00 -1.58 0.00 0.00 42.46 40.56 1v62 s ILE 90 CO -0.02 0.10 1.32 -1.28 -1.23 0.00 0.00 174.94 173.83 1v62 h SER 91 N 7.46 0.14 0.00 3.58 0.87 -1.95 -3.41 113.55 120.24 1v62 h SER 91 Ca -0.41 -0.46 0.00 0.00 -1.23 0.00 0.00 61.79 59.69 1v62 h SER 91 Cb 1.12 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 63.04 1v62 h SER 91 CO 0.43 0.57 0.00 1.21 -0.53 0.00 0.00 176.83 178.51 1v62 n GLU 92 N -4.76 0.00 -3.46 2.24 2.13 -1.26 -4.37 120.64 111.16 1v62 n GLU 92 Ca -0.07 0.00 -0.38 0.00 0.66 0.00 0.00 57.16 57.37 1v62 n GLU 92 Cb 0.28 0.00 -0.08 0.00 0.27 0.00 0.00 31.44 31.91 1v62 n GLU 92 CO 0.00 0.00 0.00 -1.59 -0.41 0.00 0.00 177.13 175.13 1v62 s LYS 93 N -1.63 4.16 -0.02 5.31 -2.85 -1.26 -1.33 119.74 122.12 1v62 s LYS 93 Ca 0.00 0.09 -0.30 0.00 -1.00 0.00 0.00 55.97 54.76 1v62 s LYS 93 Cb 0.00 -3.53 -0.03 0.00 -2.06 0.00 0.00 37.83 32.21 1v62 s LYS 93 CO 0.00 0.00 1.09 0.54 0.10 0.00 0.00 175.35 177.08 1v62 s VAL 94 N 1.19 4.50 -1.20 1.79 0.11 -1.09 -4.88 120.40 120.83 1v62 s VAL 94 Ca 0.16 1.80 -0.13 0.00 -2.93 0.00 0.00 61.98 60.88 1v62 s VAL 94 Cb -0.14 -4.15 0.19 0.00 -1.53 0.00 0.00 36.38 30.74 1v62 s VAL 94 CO 0.07 0.08 1.39 -0.13 -3.33 0.00 0.00 175.10 173.18 1v62 s ARG 95 N 1.52 4.12 -0.27 1.54 1.81 -1.26 -3.52 118.95 122.89 1v62 s ARG 95 Ca 0.54 -2.70 -0.13 0.00 -1.72 0.00 0.00 55.73 51.73 1v62 s ARG 95 Cb -0.23 -4.99 -0.04 0.00 -0.45 0.00 0.00 34.95 29.23 1v62 s ARG 95 CO 0.25 -1.69 0.26 -0.51 -0.68 0.00 0.00 175.30 172.93 1v62 s LEU 96 N 1.12 4.04 -0.46 2.53 1.43 -1.25 0.73 118.68 126.82 1v62 s LEU 96 Ca 0.41 0.12 -0.13 0.00 -1.03 0.00 0.00 54.13 53.51 1v62 s LEU 96 Cb -0.04 -2.24 0.08 0.00 0.03 0.00 0.00 46.19 44.02 1v62 s LEU 96 CO -0.01 -0.09 0.35 -1.61 0.23 0.00 0.00 176.35 175.22 1v62 s GLU 97 N 1.81 2.81 0.22 1.70 8.01 0.90 -0.79 118.70 133.36 1v62 s GLU 97 Ca 0.10 -1.45 0.05 0.00 0.01 0.00 0.00 54.97 53.68 1v62 s GLU 97 Cb -0.16 -4.01 -0.03 0.00 -4.31 0.00 0.00 34.13 25.62 1v62 s GLU 97 CO 0.10 -1.04 0.28 0.42 0.01 0.00 0.00 175.26 175.03 1v62 s ILE 98 N 1.54 4.97 0.26 -1.63 1.01 -1.13 -0.81 121.20 125.42 1v62 s ILE 98 Ca 0.04 -1.06 -0.29 0.00 0.00 0.00 0.00 60.65 59.34 1v62 s ILE 98 Cb -0.24 -3.66 -0.09 0.00 0.01 0.00 0.00 42.46 38.48 1v62 s ILE 98 CO 0.04 -0.27 0.96 -0.22 0.00 0.00 0.00 174.94 175.45 1v62 s LEU 99 N -3.72 4.56 -0.87 2.97 2.96 -0.14 0.75 118.68 125.20 1v62 s LEU 99 Ca 0.33 1.95 -0.19 0.00 -0.22 0.00 0.00 54.13 56.00 1v62 s LEU 99 Cb -0.09 -3.71 -0.22 0.00 0.50 0.00 0.00 46.19 42.67 1v62 s LEU 99 CO 0.27 0.07 2.32 -2.65 -1.32 0.00 0.00 176.35 175.05 1v62 n PRO 100 N 1.23 0.34 -4.20 0.98 -0.02 -1.26 -4.77 135.00 127.30 1v62 n PRO 100 Ca -0.01 -0.44 -0.26 0.00 -2.02 0.00 0.00 63.50 60.77 1v62 n PRO 100 Cb 0.48 -2.52 -0.07 0.00 -0.02 0.00 0.00 33.50 31.36 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 8.57 3.81 0.37 -1.45 -7.23 -1.24 -5.02 120.40 118.20 1v62 s VAL 101 Ca 1.11 -1.43 0.18 0.00 -1.81 0.00 0.00 61.98 60.03 1v62 s VAL 101 Cb -0.46 -2.93 0.18 0.00 0.56 0.00 0.00 36.38 33.72 1v62 s VAL 101 CO 0.30 -0.14 1.92 1.55 -0.31 0.00 0.00 175.10 178.42 1v62 h PRO 102 N 2.56 0.00 -0.45 4.82 0.13 -2.02 -2.96 132.00 134.08 1v62 h PRO 102 Ca -0.47 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.60 1v62 h PRO 102 Cb 1.21 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.32 1v62 h PRO 102 CO 0.59 0.26 0.04 1.96 -0.23 0.00 0.00 178.00 180.62 1v62 h GLN 103 N 0.00 0.76 -3.88 0.86 4.20 -1.97 -3.42 115.11 111.66 1v62 h GLN 103 Ca -0.00 -0.22 -0.46 0.00 0.06 0.00 0.00 58.65 58.02 1v62 h GLN 103 Cb 0.54 -0.08 -0.38 0.00 0.30 0.00 0.00 27.48 27.86 1v62 h GLN 103 CO 0.03 0.81 -0.78 0.45 -0.67 0.00 0.00 178.83 178.67 1v62 s SER 104 N -6.21 1.75 -0.04 1.46 0.15 -1.12 -4.99 113.70 104.71 1v62 s SER 104 Ca -0.13 -0.16 0.14 0.00 0.70 0.00 0.00 55.95 56.51 1v62 s SER 104 Cb 0.11 -0.57 0.26 0.00 -1.71 0.00 0.00 66.02 64.11 1v62 s SER 104 CO 0.80 -0.16 1.12 0.00 1.20 0.00 0.00 173.24 176.19 1v62 n GLN 105 N 5.04 0.20 -3.37 5.44 6.02 -1.25 -3.63 117.38 125.84 1v62 n GLN 105 Ca -0.09 -1.65 -0.17 0.00 -0.01 0.00 0.00 57.00 55.07 1v62 n GLN 105 Cb 0.50 0.12 -0.08 0.00 1.02 0.00 0.00 30.24 31.80 1v62 n GLN 105 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1v62 s ARG 106 N -0.26 0.59 0.24 -1.09 0.52 -1.26 -5.02 118.95 112.66 1v62 s ARG 106 Ca 0.18 -0.76 -0.06 0.00 -0.52 0.00 0.00 55.73 54.57 1v62 s ARG 106 Cb 0.23 -0.73 0.42 0.00 0.52 0.00 0.00 34.95 35.39 1v62 s ARG 106 CO -0.09 -1.17 1.70 -1.35 0.02 0.00 0.00 175.30 174.41 1v62 h PRO 107 N 7.25 0.28 0.00 3.54 0.11 -1.96 -3.45 132.00 137.78 1v62 h PRO 107 Ca 0.02 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1v62 h PRO 107 Cb 1.06 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.10 1v62 h PRO 107 CO 0.22 0.19 0.00 1.28 -0.21 0.00 0.00 178.00 179.48 1v62 n LEU 108 N -5.13 0.00 -3.21 2.35 4.77 -1.26 -4.64 117.00 109.89 1v62 n LEU 108 Ca 0.13 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 56.01 1v62 n LEU 108 Cb 0.42 0.09 0.04 0.00 -2.33 0.00 0.00 43.42 41.63 1v62 n LEU 108 CO 0.14 -0.09 0.15 -1.14 -1.33 0.00 0.00 177.39 175.13 1v62 n ARG 109 N -1.93 -1.78 0.27 3.23 3.00 -1.26 -4.95 116.66 113.23 1v62 n ARG 109 Ca 0.00 1.11 -0.14 0.00 -0.00 0.00 0.00 57.85 58.82 1v62 n ARG 109 Cb 0.00 -5.62 -0.07 0.00 0.00 0.00 0.00 32.46 26.76 1v62 n ARG 109 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.63 176.28 1v62 h PRO 110 N -0.45 -0.78 0.00 -0.14 0.11 -2.02 -3.49 132.00 125.23 1v62 h PRO 110 Ca -0.35 0.05 0.19 0.00 0.11 0.00 0.00 66.00 66.00 1v62 h PRO 110 Cb 1.18 0.18 -0.04 0.00 0.11 0.00 0.00 31.00 32.43 1v62 h PRO 110 CO 0.38 -0.52 0.49 -1.13 -0.21 0.00 0.00 178.00 177.01 1v62 n SER 111 N -4.64 -0.58 -4.50 -2.05 3.41 -1.26 -5.09 113.62 98.90 1v62 n SER 111 Ca -0.10 -1.08 -0.42 0.00 -0.26 0.00 0.00 58.87 57.01 1v62 n SER 111 Cb 0.35 0.89 -0.03 0.00 -0.26 0.00 0.00 64.21 65.16 1v62 n SER 111 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1v62 s SER 112 N -2.50 6.34 0.10 4.04 0.01 -1.26 -4.96 113.70 115.47 1v62 s SER 112 Ca 0.16 -1.18 -0.15 0.00 1.31 0.00 0.00 55.95 56.09 1v62 s SER 112 Cb -0.00 -2.49 0.03 0.00 0.21 0.00 0.00 66.02 63.77 1v62 s SER 112 CO -0.01 -1.48 0.35 -0.83 0.41 0.00 0.00 173.24 171.68 1v62 s GLY 113 N 4.01 -0.18 0.89 3.44 0.00 -1.26 -5.17 107.32 109.05 1v62 s GLY 113 Ca 0.34 -0.12 -0.12 0.00 0.00 0.00 0.00 44.72 44.82 1v62 s GLY 113 CO 0.02 -0.36 1.09 2.56 0.00 0.00 0.00 173.10 176.42 1v62 s PRO 114 N -3.53 1.33 -1.63 2.90 0.04 -1.26 -3.82 135.00 129.03 1v62 s PRO 114 Ca 0.02 0.79 -0.03 0.00 0.04 0.00 0.00 61.00 61.81 1v62 s PRO 114 Cb 0.02 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 32.74 1v62 s PRO 114 CO -0.10 -2.18 0.40 0.45 0.04 0.00 0.00 177.00 175.61 1v62 n SER 115 N -3.84 -6.05 -3.83 6.66 2.88 -1.26 -4.98 113.62 103.20 1v62 n SER 115 Ca 0.07 -0.19 -0.12 0.00 -1.33 0.00 0.00 58.87 57.30 1v62 n SER 115 Cb 0.55 -4.93 -0.11 0.00 -0.75 0.00 0.00 64.21 58.98 1v62 n SER 115 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1v62 s SER 116 N -2.49 -0.09 0.00 -3.46 0.15 -1.25 -5.24 113.70 101.32 1v62 s SER 116 Ca 0.20 0.07 0.00 0.00 0.70 0.00 0.00 55.95 56.91 1v62 s SER 116 Cb -0.09 0.30 0.00 0.00 -1.71 0.00 0.00 66.02 64.52 1v62 s SER 116 CO 0.24 -0.26 0.00 0.61 1.20 0.00 0.00 173.24 175.03