#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1svt s ASN 2 N 0.00 7.48 0.97 7.83 4.22 -1.26 -4.77 114.94 129.41 1svt s ASN 2 Ca 0.00 1.88 -0.15 0.00 -2.14 0.00 0.00 52.86 52.45 1svt s ASN 2 Cb 0.00 -2.59 0.18 0.00 1.28 0.00 0.00 41.25 40.12 1svt s ASN 2 CO 0.00 0.04 1.19 0.27 -2.04 0.00 0.00 177.10 176.56 1svt s ILE 3 N -1.41 1.92 -0.33 0.54 -5.25 -1.26 -5.09 121.20 110.32 1svt s ILE 3 Ca 0.46 0.00 0.03 0.00 -0.99 0.00 0.00 60.65 60.14 1svt s ILE 3 Cb -0.22 -2.79 0.16 0.00 2.95 0.00 0.00 42.46 42.55 1svt s ILE 3 CO 0.27 0.00 0.40 -0.60 -1.79 0.00 0.00 174.94 173.23 1svt s ARG 4 N -5.51 0.51 0.49 0.37 6.06 -1.26 -5.01 118.95 114.61 1svt s ARG 4 Ca 0.68 -0.28 -0.22 0.00 -2.50 0.00 0.00 55.73 53.41 1svt s ARG 4 Cb -0.10 -0.46 -0.07 0.00 0.06 0.00 0.00 34.95 34.38 1svt s ARG 4 CO 0.53 -1.10 1.16 -1.25 -2.50 0.00 0.00 175.30 172.14 1svt s PRO 5 N 2.08 3.59 -0.93 5.12 0.04 -1.26 -4.95 135.00 138.68 1svt s PRO 5 Ca 0.13 1.74 -0.09 0.00 0.04 0.00 0.00 61.00 62.82 1svt s PRO 5 Cb -0.13 -2.26 0.24 0.00 0.04 0.00 0.00 34.50 32.39 1svt s PRO 5 CO -0.20 -0.69 0.88 -1.17 0.04 0.00 0.00 177.00 175.86 1svt s LEU 6 N -3.32 6.27 0.00 -3.56 1.98 -1.26 -4.07 118.68 114.72 1svt s LEU 6 Ca 0.67 -3.23 0.00 0.00 -2.89 0.00 0.00 54.13 48.68 1svt s LEU 6 Cb -0.28 -2.13 0.00 0.00 0.66 0.00 0.00 46.19 44.45 1svt s LEU 6 CO 0.33 -0.38 0.00 0.00 -1.89 0.00 0.00 176.35 174.41 1svt n HIS 7 N 3.16 0.00 0.00 5.38 1.44 -1.26 -4.13 115.22 119.81 1svt n HIS 7 Ca 0.18 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.89 1svt n HIS 7 Cb 0.41 -0.43 0.00 0.00 0.12 0.00 0.00 29.99 30.10 1svt n HIS 7 CO 0.00 0.00 0.00 -3.47 -2.81 0.00 0.00 176.34 170.06 1svt n ASP 8 N 0.57 0.00 -4.80 4.39 2.03 -1.20 -4.80 116.55 112.74 1svt n ASP 8 Ca 0.00 0.00 -0.39 0.00 0.52 0.00 0.00 54.79 54.92 1svt n ASP 8 Cb 0.00 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.34 1svt n ASP 8 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1svt s ARG 9 N -0.02 4.20 -0.02 -0.67 1.81 -1.26 -2.10 118.95 120.88 1svt s ARG 9 Ca 0.00 0.69 0.07 0.00 -1.72 0.00 0.00 55.73 54.77 1svt s ARG 9 Cb 0.00 -3.27 -0.02 0.00 -0.45 0.00 0.00 34.95 31.21 1svt s ARG 9 CO 0.00 0.57 -0.24 0.08 -0.68 0.00 0.00 175.30 175.03 1svt s VAL 10 N -0.84 2.24 -0.25 3.52 1.01 0.67 -2.47 120.40 124.28 1svt s VAL 10 Ca 0.29 -1.05 -0.06 0.00 0.00 0.00 0.00 61.98 61.16 1svt s VAL 10 Cb -0.19 -1.80 -0.02 0.00 0.00 0.00 0.00 36.38 34.38 1svt s VAL 10 CO 0.18 0.58 0.04 -0.63 0.00 0.00 0.00 175.10 175.26 1svt s ILE 11 N -0.64 4.01 0.14 2.22 1.01 -0.47 -2.68 121.20 124.79 1svt s ILE 11 Ca 0.10 -0.33 0.08 0.00 0.00 0.00 0.00 60.65 60.51 1svt s ILE 11 Cb -0.10 -2.89 -0.04 0.00 0.01 0.00 0.00 42.46 39.44 1svt s ILE 11 CO -0.01 0.33 -0.19 0.68 0.00 0.00 0.00 174.94 175.75 1svt s VAL 12 N 1.56 1.73 -0.15 2.92 -7.23 -0.82 -0.03 120.40 118.38 1svt s VAL 12 Ca 0.06 -1.76 -0.00 0.00 -1.81 0.00 0.00 61.98 58.46 1svt s VAL 12 Cb -0.15 -1.70 -0.01 0.00 0.56 0.00 0.00 36.38 35.08 1svt s VAL 12 CO 0.02 -0.24 -0.13 -1.59 -0.31 0.00 0.00 175.10 172.85 1svt s LYS 13 N -2.46 3.31 0.91 4.82 -2.85 -0.14 -0.63 119.74 122.70 1svt s LYS 13 Ca 0.12 -0.70 -0.12 0.00 -1.00 0.00 0.00 55.97 54.26 1svt s LYS 13 Cb -0.07 -2.68 0.07 0.00 -2.06 0.00 0.00 37.83 33.09 1svt s LYS 13 CO 0.05 0.08 0.75 -2.13 0.10 0.00 0.00 175.35 174.20 1svt n ARG 14 N 3.92 -0.25 0.00 1.78 0.63 -1.26 -1.52 116.66 119.96 1svt n ARG 14 Ca -0.19 -0.02 0.00 0.00 -0.92 0.00 0.00 57.85 56.73 1svt n ARG 14 Cb 0.52 -2.09 0.00 0.00 0.45 0.00 0.00 32.46 31.34 1svt n ARG 14 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 1svt n LYS 15 N -2.65 0.96 -3.40 -0.14 5.02 -0.91 -4.79 118.16 112.24 1svt n LYS 15 Ca 0.09 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 56.01 1svt n LYS 15 Cb 0.52 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.47 1svt n LYS 15 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1svt s GLU 16 N 3.51 4.29 -0.85 1.97 0.41 -1.26 -4.97 118.70 121.79 1svt s GLU 16 Ca 0.00 0.33 -0.26 0.00 -0.41 0.00 0.00 54.97 54.64 1svt s GLU 16 Cb 0.00 -3.42 -0.12 0.00 -1.78 0.00 0.00 34.13 28.81 1svt s GLU 16 CO 0.00 0.22 2.25 0.08 -0.49 0.00 0.00 175.26 177.32 1svt s VAL 17 N 0.46 3.15 -0.74 2.63 1.01 -1.26 -3.70 120.40 121.94 1svt s VAL 17 Ca 0.23 -0.13 -0.04 0.00 0.00 0.00 0.00 61.98 62.03 1svt s VAL 17 Cb -0.15 -3.39 0.01 0.00 0.00 0.00 0.00 36.38 32.85 1svt s VAL 17 CO 0.08 -0.30 0.64 -0.62 0.00 0.00 0.00 175.10 174.90 1svt n GLU 18 N 8.78 -1.55 -1.29 2.72 1.02 -1.26 -4.68 120.64 124.37 1svt n GLU 18 Ca 0.45 1.14 -0.58 0.00 -0.02 0.00 0.00 57.16 58.14 1svt n GLU 18 Cb 0.44 -3.61 -0.11 0.00 -0.02 0.00 0.00 31.44 28.15 1svt n GLU 18 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1svt n THR 19 N -2.01 0.04 -1.54 2.62 -1.04 -1.24 -4.53 114.28 106.58 1svt n THR 19 Ca -0.17 -0.06 -0.14 0.00 -2.04 0.00 0.00 64.05 61.65 1svt n THR 19 Cb 0.62 -0.75 -0.09 0.00 -1.82 0.00 0.00 70.33 68.29 1svt n THR 19 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1svt n LYS 20 N 7.64 0.41 0.00 -2.82 4.01 -1.26 -3.77 118.16 122.36 1svt n LYS 20 Ca 0.52 -0.91 0.00 0.00 -0.51 0.00 0.00 58.31 57.40 1svt n LYS 20 Cb 0.02 -3.44 0.00 0.00 -0.51 0.00 0.00 35.03 31.10 1svt n LYS 20 CO 0.00 0.00 0.00 -1.13 -1.11 0.00 0.00 177.40 175.16 1svt n SER 21 N 17.46 0.00 -4.61 4.39 3.41 -1.26 -4.70 113.62 128.32 1svt n SER 21 Ca 0.47 -0.09 -0.60 0.00 -0.26 0.00 0.00 58.87 58.40 1svt n SER 21 Cb 0.41 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.28 1svt n SER 21 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1svt n ALA 22 N 0.00 -2.10 0.00 7.33 0.00 -1.24 -0.84 120.51 123.65 1svt n ALA 22 Ca 0.00 0.53 0.00 0.00 0.00 0.00 0.00 53.44 53.97 1svt n ALA 22 Cb 0.02 -1.92 0.00 0.00 0.00 0.00 0.00 19.45 17.55 1svt n ALA 22 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1svt n GLY 23 N 2.66 3.03 0.00 0.00 0.00 -1.26 -4.61 105.19 105.01 1svt n GLY 23 Ca 0.23 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.43 1svt n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1svt n GLY 24 N 0.00 -1.08 0.14 -0.02 0.00 -0.02 -4.93 105.19 99.28 1svt n GLY 24 Ca 0.00 0.40 0.04 0.00 0.00 0.00 0.00 46.02 46.45 1svt n GLY 24 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1svt h ILE 25 N 0.00 0.69 -3.12 -0.61 2.04 -1.89 -3.46 117.51 111.15 1svt h ILE 25 Ca 0.00 -2.00 -0.56 0.00 1.00 0.00 0.00 64.86 63.30 1svt h ILE 25 Cb 0.00 2.30 -0.03 0.00 -0.74 0.00 0.00 36.82 38.35 1svt h ILE 25 CO 0.00 0.39 0.69 -0.69 0.00 0.00 0.00 178.15 178.54 1svt s VAL 26 N -3.00 4.44 -0.85 1.67 1.01 -1.26 -4.97 120.40 117.44 1svt s VAL 26 Ca 0.03 1.74 -0.23 0.00 0.00 0.00 0.00 61.98 63.53 1svt s VAL 26 Cb 0.07 -4.12 0.06 0.00 0.00 0.00 0.00 36.38 32.40 1svt s VAL 26 CO 0.75 -0.02 1.24 -0.22 0.00 0.00 0.00 175.10 176.84 1svt s LEU 27 N 2.34 3.91 -0.25 3.92 0.20 -1.26 -3.67 118.68 123.86 1svt s LEU 27 Ca 0.53 -1.20 -0.28 0.00 0.69 0.00 0.00 54.13 53.86 1svt s LEU 27 Cb -0.22 -2.50 -0.04 0.00 -0.43 0.00 0.00 46.19 43.00 1svt s LEU 27 CO 0.19 -1.50 2.04 0.28 -0.29 0.00 0.00 176.35 177.07 1svt s THR 28 N 4.53 3.20 0.57 3.68 -1.32 -1.26 -4.90 115.64 120.15 1svt s THR 28 Ca 0.35 0.21 -0.20 0.00 -1.21 0.00 0.00 61.69 60.84 1svt s THR 28 Cb -0.07 -3.26 -0.04 0.00 -1.51 0.00 0.00 72.50 67.62 1svt s THR 28 CO 0.01 -0.16 1.27 -0.83 -2.21 0.00 0.00 174.62 172.70 1svt s GLY 29 N 7.19 2.82 -0.58 6.08 0.00 -1.26 -4.76 107.32 116.81 1svt s GLY 29 Ca 0.92 1.15 -0.31 0.00 0.00 0.00 0.00 44.72 46.48 1svt s GLY 29 CO 0.35 1.60 2.42 -1.26 0.00 0.00 0.00 173.10 176.21 1svt n SER 30 N -1.33 1.69 -2.24 1.64 2.88 -1.26 -4.82 113.62 110.18 1svt n SER 30 Ca 0.12 0.01 -0.25 0.00 -1.33 0.00 0.00 58.87 57.42 1svt n SER 30 Cb 0.48 -1.29 0.17 0.00 -0.75 0.00 0.00 64.21 62.82 1svt n SER 30 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1svt n ALA 31 N 12.27 5.69 -2.91 -1.46 0.00 -1.26 -4.92 120.51 127.91 1svt n ALA 31 Ca 0.47 -2.96 -0.10 0.00 0.00 0.00 0.00 53.44 50.84 1svt n ALA 31 Cb 0.29 -1.49 0.01 0.00 0.00 0.00 0.00 19.45 18.27 1svt n ALA 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1svt n ALA 32 N -1.12 -2.98 -3.55 0.00 0.00 -1.26 -5.09 120.51 106.51 1svt n ALA 32 Ca 0.60 1.02 -0.08 0.00 0.00 0.00 0.00 53.44 54.99 1svt n ALA 32 Cb 1.56 -3.35 -0.02 0.00 0.00 0.00 0.00 19.45 17.64 1svt n ALA 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1svt s ALA 33 N -2.38 -1.78 0.38 0.00 0.00 -1.26 -5.20 121.76 111.52 1svt s ALA 33 Ca 0.24 0.82 0.01 0.00 0.00 0.00 0.00 51.96 53.03 1svt s ALA 33 Cb -0.06 0.48 -0.00 0.00 0.00 0.00 0.00 23.12 23.54 1svt s ALA 33 CO 0.77 -0.76 0.03 1.17 0.00 0.00 0.00 175.76 176.97 1svt n LYS 34 N -0.29 0.94 -3.99 0.00 3.00 -1.26 -4.72 118.16 111.84 1svt n LYS 34 Ca -0.09 -2.87 -0.36 0.00 -0.00 0.00 0.00 58.31 54.99 1svt n LYS 34 Cb 0.62 0.96 -0.07 0.00 0.00 0.00 0.00 35.03 36.53 1svt n LYS 34 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1svt s SER 35 N -3.14 6.03 -0.00 3.14 0.15 -1.26 -4.58 113.70 114.03 1svt s SER 35 Ca 0.04 0.33 0.21 0.00 0.70 0.00 0.00 55.95 57.24 1svt s SER 35 Cb 0.00 -1.93 -0.19 0.00 -1.71 0.00 0.00 66.02 62.20 1svt s SER 35 CO 0.03 0.35 0.87 0.35 1.20 0.00 0.00 173.24 176.05 1svt n THR 36 N 2.34 0.01 -3.05 6.45 -2.24 -1.26 -4.88 114.28 111.66 1svt n THR 36 Ca -0.19 -0.09 -0.30 0.00 -2.27 0.00 0.00 64.05 61.20 1svt n THR 36 Cb 0.54 0.76 -0.04 0.00 -2.10 0.00 0.00 70.33 69.49 1svt n THR 36 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1svt s ARG 37 N -3.09 3.77 0.05 -0.78 3.00 -1.26 -2.31 118.95 118.34 1svt s ARG 37 Ca 0.05 0.37 -0.27 0.00 0.00 0.00 0.00 55.73 55.88 1svt s ARG 37 Cb 0.16 -2.47 0.09 0.00 0.00 0.00 0.00 34.95 32.72 1svt s ARG 37 CO 0.86 0.07 0.91 0.20 0.00 0.00 0.00 175.30 177.34 1svt s GLY 38 N -2.99 -0.39 -0.06 -3.53 0.00 -0.47 -2.14 107.32 97.74 1svt s GLY 38 Ca 0.50 0.69 0.02 0.00 0.00 0.00 0.00 44.72 45.93 1svt s GLY 38 CO 0.28 0.21 -0.13 1.85 0.00 0.00 0.00 173.10 175.32 1svt s GLU 39 N -3.19 2.68 0.42 2.90 2.12 -0.57 -0.02 118.70 123.03 1svt s GLU 39 Ca 0.07 -0.66 -0.24 0.00 0.36 0.00 0.00 54.97 54.50 1svt s GLU 39 Cb -0.01 -2.46 -0.08 0.00 0.26 0.00 0.00 34.13 31.84 1svt s GLU 39 CO -0.05 0.58 1.09 0.08 -0.54 0.00 0.00 175.26 176.41 1svt s VAL 40 N -0.60 3.52 0.00 3.70 1.01 -0.82 -0.97 120.40 126.24 1svt s VAL 40 Ca 0.09 1.16 0.00 0.00 0.00 0.00 0.00 61.98 63.23 1svt s VAL 40 Cb -0.11 -3.60 0.00 0.00 0.00 0.00 0.00 36.38 32.67 1svt s VAL 40 CO 0.01 0.00 0.00 0.18 0.00 0.00 0.00 175.10 175.30 1svt n LEU 41 N -0.18 1.83 -3.82 3.92 4.77 0.95 -3.32 117.00 121.15 1svt n LEU 41 Ca 0.06 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.92 1svt n LEU 41 Cb 0.49 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.49 1svt n LEU 41 CO 0.46 0.28 -0.07 0.00 -1.33 0.00 0.00 177.39 176.73 1svt s ALA 42 N -1.87 -0.47 -0.02 -1.18 0.00 -1.22 -4.80 121.76 112.21 1svt s ALA 42 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 51.96 51.86 1svt s ALA 42 Cb 0.00 0.21 0.02 0.00 0.00 0.00 0.00 23.12 23.35 1svt s ALA 42 CO 0.00 -0.32 0.01 0.08 0.00 0.00 0.00 175.76 175.53 1svt s VAL 43 N -2.10 0.06 1.04 0.00 1.01 -1.26 -1.36 120.40 117.79 1svt s VAL 43 Ca -0.09 0.10 -0.17 0.00 0.00 0.00 0.00 61.98 61.82 1svt s VAL 43 Cb -0.03 -0.15 0.23 0.00 0.00 0.00 0.00 36.38 36.43 1svt s VAL 43 CO -0.01 0.09 1.28 -0.83 0.00 0.00 0.00 175.10 175.63 1svt s GLY 44 N 0.77 1.75 0.00 4.51 0.00 -1.03 -4.79 107.32 108.53 1svt s GLY 44 Ca -0.07 -1.20 0.00 0.00 0.00 0.00 0.00 44.72 43.45 1svt s GLY 44 CO -0.02 -0.37 0.94 0.70 0.00 0.00 0.00 173.10 174.35 1svt n ASN 45 N -4.07 0.00 0.00 1.64 3.02 -1.26 -4.58 115.26 110.01 1svt n ASN 45 Ca 0.16 0.94 0.00 0.00 -0.03 0.00 0.00 54.58 55.65 1svt n ASN 45 Cb 0.59 -0.44 0.00 0.00 -0.61 0.00 0.00 39.78 39.32 1svt n ASN 45 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1svt n GLY 46 N -0.96 -1.38 3.75 7.41 0.00 -1.26 -3.54 105.19 109.20 1svt n GLY 46 Ca 0.00 -1.02 -0.41 0.00 0.00 0.00 0.00 46.02 44.59 1svt n GLY 46 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1svt s ARG 47 N -1.58 4.57 0.01 1.61 3.52 -1.17 -3.22 118.95 122.69 1svt s ARG 47 Ca 0.00 1.81 -0.07 0.00 -0.13 0.00 0.00 55.73 57.34 1svt s ARG 47 Cb 0.00 -3.23 -0.30 0.00 -1.56 0.00 0.00 34.95 29.86 1svt s ARG 47 CO 0.00 0.06 0.87 0.82 -0.81 0.00 0.00 175.30 176.24 1svt h ILE 48 N 3.52 1.17 -1.13 4.11 2.04 -1.93 -3.25 117.51 122.05 1svt h ILE 48 Ca -0.45 -2.75 -0.45 0.00 1.00 0.00 0.00 64.86 62.20 1svt h ILE 48 Cb 1.21 2.83 0.11 0.00 -0.74 0.00 0.00 36.82 40.23 1svt h ILE 48 CO 0.71 0.83 -0.63 0.18 0.00 0.00 0.00 178.15 179.24 1svt n LEU 49 N -3.53 -1.88 0.00 1.44 4.77 -1.26 -3.13 117.00 113.41 1svt n LEU 49 Ca -0.17 0.61 0.00 0.00 -0.03 0.00 0.00 56.01 56.42 1svt n LEU 49 Cb 1.06 -0.64 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 1svt n LEU 49 CO 0.53 -2.87 0.00 1.21 -1.33 0.00 0.00 177.39 174.93 1svt n GLU 50 N 0.92 0.00 0.00 3.23 4.07 -1.26 -4.68 120.64 122.92 1svt n GLU 50 Ca 0.09 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.19 1svt n GLU 50 Cb 0.27 -2.28 0.00 0.00 -0.06 0.00 0.00 31.44 29.37 1svt n GLU 50 CO 0.00 0.00 0.00 -1.71 -0.06 0.00 0.00 177.13 175.36 1svt n ASN 51 N 0.00 0.00 0.00 4.31 5.15 -1.18 -4.90 115.26 118.64 1svt n ASN 51 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 1svt n ASN 51 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 1svt n ASN 51 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1svt n GLY 52 N 0.00 0.00 2.11 8.20 0.00 -1.26 -4.60 105.19 109.64 1svt n GLY 52 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1svt n GLY 52 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1svt n GLU 53 N 0.00 0.00 -3.47 1.61 4.71 -1.26 -4.59 120.64 117.64 1svt n GLU 53 Ca 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 57.16 57.10 1svt n GLU 53 Cb 0.00 0.00 -0.07 0.00 -1.01 0.00 0.00 31.44 30.36 1svt n GLU 53 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 1svt s VAL 54 N 0.00 -0.76 -0.09 2.62 1.01 -1.26 -4.73 120.40 117.18 1svt s VAL 54 Ca 0.00 0.04 -0.26 0.00 0.00 0.00 0.00 61.98 61.76 1svt s VAL 54 Cb 0.00 -0.83 -0.03 0.00 0.00 0.00 0.00 36.38 35.53 1svt s VAL 54 CO 0.00 -0.01 0.82 -1.59 0.00 0.00 0.00 175.10 174.31 1svt s LYS 55 N 2.69 4.41 0.93 2.72 0.00 -1.23 -4.85 119.74 124.41 1svt s LYS 55 Ca 0.06 1.06 -0.11 0.00 0.00 0.00 0.00 55.97 56.98 1svt s LYS 55 Cb -0.14 -3.50 0.15 0.00 0.00 0.00 0.00 37.83 34.34 1svt s LYS 55 CO -0.16 -0.12 1.10 -1.25 0.00 0.00 0.00 175.35 174.92 1svt s PRO 56 N 1.39 0.96 0.46 1.78 0.04 -1.26 -3.03 135.00 135.35 1svt s PRO 56 Ca 0.41 1.14 -0.03 0.00 0.04 0.00 0.00 61.00 62.56 1svt s PRO 56 Cb -0.18 -1.75 -0.02 0.00 0.04 0.00 0.00 34.50 32.59 1svt s PRO 56 CO 0.18 -2.54 0.72 -0.51 0.04 0.00 0.00 177.00 174.90 1svt s LEU 57 N -6.48 3.64 0.00 -3.56 1.43 -1.23 -4.90 118.68 107.58 1svt s LEU 57 Ca 0.65 0.60 0.18 0.00 -1.03 0.00 0.00 54.13 54.54 1svt s LEU 57 Cb -0.21 -3.49 0.56 0.00 0.03 0.00 0.00 46.19 43.08 1svt s LEU 57 CO 0.58 -0.64 1.44 0.47 0.23 0.00 0.00 176.35 178.43 1svt n ASP 58 N -2.17 2.13 -4.38 2.29 9.92 -1.26 -4.80 116.55 118.29 1svt n ASP 58 Ca 0.00 -1.86 -0.36 0.00 -0.53 0.00 0.00 54.79 52.05 1svt n ASP 58 Cb 0.56 -0.19 -0.13 0.00 -0.64 0.00 0.00 41.12 40.72 1svt n ASP 58 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 1svt s VAL 59 N -1.62 3.80 0.17 2.53 -7.23 -1.26 -5.10 120.40 111.69 1svt s VAL 59 Ca 0.32 -0.35 -0.20 0.00 -1.81 0.00 0.00 61.98 59.94 1svt s VAL 59 Cb 0.17 -2.75 -0.08 0.00 0.56 0.00 0.00 36.38 34.28 1svt s VAL 59 CO 0.24 0.39 0.68 -1.59 -0.31 0.00 0.00 175.10 174.51 1svt s LYS 60 N 1.48 4.27 -0.70 4.82 -2.85 -1.26 -4.95 119.74 120.54 1svt s LYS 60 Ca 0.05 0.85 -0.29 0.00 -1.00 0.00 0.00 55.97 55.58 1svt s LYS 60 Cb -0.15 -3.04 -0.14 0.00 -2.06 0.00 0.00 37.83 32.45 1svt s LYS 60 CO 0.00 0.49 2.52 0.28 0.10 0.00 0.00 175.35 178.75 1svt n VAL 61 N 1.12 -0.03 0.00 1.79 0.31 -1.26 -2.55 118.33 117.71 1svt n VAL 61 Ca -0.05 -0.43 0.00 0.00 -0.01 0.00 0.00 64.34 63.85 1svt n VAL 61 Cb 0.51 -1.75 0.00 0.00 -0.91 0.00 0.00 33.84 31.69 1svt n VAL 61 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1svt n GLY 62 N 6.26 1.05 3.82 2.92 0.00 -1.21 -4.96 105.19 113.06 1svt n GLY 62 Ca 0.50 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.19 1svt n GLY 62 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1svt s ASP 63 N -1.56 6.34 -0.44 1.61 1.01 -1.06 -4.73 116.67 117.85 1svt s ASP 63 Ca 0.00 1.71 -0.20 0.00 0.71 0.00 0.00 52.55 54.76 1svt s ASP 63 Cb 0.00 -2.53 0.02 0.00 1.01 0.00 0.00 42.92 41.43 1svt s ASP 63 CO 0.00 -0.78 0.61 -0.63 0.21 0.00 0.00 175.17 174.58 1svt s ILE 64 N -2.45 4.86 0.06 0.77 1.01 -1.26 -1.95 121.20 122.25 1svt s ILE 64 Ca 0.62 0.03 0.10 0.00 0.00 0.00 0.00 60.65 61.40 1svt s ILE 64 Cb -0.13 -4.19 -0.03 0.00 0.01 0.00 0.00 42.46 38.13 1svt s ILE 64 CO 0.30 -0.58 -0.26 0.68 0.00 0.00 0.00 174.94 175.08 1svt s VAL 65 N 2.72 2.17 -0.14 2.92 -7.23 0.97 -0.32 120.40 121.49 1svt s VAL 65 Ca 0.21 -1.47 -0.15 0.00 -1.81 0.00 0.00 61.98 58.77 1svt s VAL 65 Cb -0.15 -1.87 -0.05 0.00 0.56 0.00 0.00 36.38 34.88 1svt s VAL 65 CO 0.18 0.31 0.33 -0.63 -0.31 0.00 0.00 175.10 174.98 1svt s ILE 66 N -0.86 5.27 0.24 -0.62 1.01 -0.94 -1.36 121.20 123.93 1svt s ILE 66 Ca 0.12 0.64 0.04 0.00 0.00 0.00 0.00 60.65 61.45 1svt s ILE 66 Cb -0.10 -3.67 -0.05 0.00 0.01 0.00 0.00 42.46 38.65 1svt s ILE 66 CO 0.03 0.39 -0.01 0.72 0.00 0.00 0.00 174.94 176.06 1svt s PHE 67 N 0.41 1.61 -0.35 3.97 -0.12 -0.98 -1.24 117.98 121.28 1svt s PHE 67 Ca 0.19 -0.88 -0.16 0.00 -0.05 0.00 0.00 56.93 56.02 1svt s PHE 67 Cb -0.14 -0.93 -0.01 0.00 -0.63 0.00 0.00 43.02 41.32 1svt s PHE 67 CO 0.06 0.01 0.41 1.21 -0.05 0.00 0.00 175.22 176.86 1svt s ASN 68 N -3.32 6.22 -0.69 1.98 3.84 -0.62 -4.82 114.94 117.53 1svt s ASN 68 Ca 0.28 -0.21 -0.12 0.00 0.21 0.00 0.00 52.86 53.02 1svt s ASN 68 Cb 0.05 -2.22 -0.10 0.00 -0.55 0.00 0.00 41.25 38.43 1svt s ASN 68 CO 0.09 -0.40 1.87 -0.67 -2.79 0.00 0.00 177.10 175.20 1svt n ASP 69 N 5.51 3.23 -2.75 -4.21 -0.08 -1.26 -4.87 116.55 112.12 1svt n ASP 69 Ca -0.08 -2.41 0.00 0.00 -1.51 0.00 0.00 54.79 50.79 1svt n ASP 69 Cb 0.49 -0.99 0.00 0.00 2.34 0.00 0.00 41.12 42.96 1svt n ASP 69 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1svt n GLY 70 N 4.13 -0.64 0.18 0.27 0.00 -1.26 -4.97 105.19 102.90 1svt n GLY 70 Ca 0.41 -1.66 -0.19 0.00 0.00 0.00 0.00 46.02 44.58 1svt n GLY 70 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1svt h TYR 71 N -0.10 0.88 0.00 1.61 3.20 -2.04 -3.26 116.97 117.26 1svt h TYR 71 Ca 0.00 -0.46 0.00 0.00 3.14 0.00 0.00 58.73 61.41 1svt h TYR 71 Cb 0.00 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.16 1svt h TYR 71 CO 0.00 1.29 0.00 0.41 -1.64 0.00 0.00 178.16 178.22 1svt n GLY 72 N 1.01 -0.43 3.63 1.82 0.00 -1.26 -4.63 105.19 105.33 1svt n GLY 72 Ca -0.10 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 1svt n GLY 72 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1svt s VAL 73 N -2.59 4.78 0.22 1.61 1.01 -1.23 -4.57 120.40 119.63 1svt s VAL 73 Ca 0.04 1.37 0.08 0.00 0.00 0.00 0.00 61.98 63.47 1svt s VAL 73 Cb 0.03 -4.16 -0.04 0.00 0.00 0.00 0.00 36.38 32.21 1svt s VAL 73 CO 0.06 -0.21 0.07 -0.54 0.00 0.00 0.00 175.10 174.49 1svt s LYS 74 N 2.98 2.59 -0.12 2.72 -0.14 -0.65 -4.94 119.74 122.19 1svt s LYS 74 Ca 0.34 -1.16 -0.00 0.00 -1.36 0.00 0.00 55.97 53.79 1svt s LYS 74 Cb -0.14 -2.39 -0.02 0.00 -1.68 0.00 0.00 37.83 33.59 1svt s LYS 74 CO 0.11 0.41 -0.11 0.45 -0.76 0.00 0.00 175.35 175.46 1svt s SER 75 N -3.46 4.25 0.17 2.83 0.15 -1.26 -1.45 113.70 114.92 1svt s SER 75 Ca 0.31 -0.23 0.00 0.00 0.70 0.00 0.00 55.95 56.72 1svt s SER 75 Cb -0.08 -1.50 -0.04 0.00 -1.71 0.00 0.00 66.02 62.69 1svt s SER 75 CO 0.21 0.21 0.05 -1.61 1.20 0.00 0.00 173.24 173.31 1svt s GLU 76 N 0.08 1.07 -0.22 5.44 0.41 0.48 -5.00 118.70 120.96 1svt s GLU 76 Ca -0.04 -1.52 0.01 0.00 -0.41 0.00 0.00 54.97 53.00 1svt s GLU 76 Cb -0.14 0.02 0.05 0.00 -1.78 0.00 0.00 34.13 32.28 1svt s GLU 76 CO 0.04 -0.23 -0.08 0.21 -0.49 0.00 0.00 175.26 174.71 1svt s LYS 77 N -4.01 1.84 -0.15 1.61 2.47 -1.26 -2.03 119.74 118.21 1svt s LYS 77 Ca 0.27 -0.96 -0.00 0.00 -1.56 0.00 0.00 55.97 53.71 1svt s LYS 77 Cb 0.07 -2.55 0.03 0.00 -1.46 0.00 0.00 37.83 33.93 1svt s LYS 77 CO 0.05 -0.53 -0.09 0.42 0.16 0.00 0.00 175.35 175.36 1svt s ILE 78 N 1.37 1.28 -0.30 5.43 1.09 -1.07 -4.70 121.20 124.30 1svt s ILE 78 Ca -0.04 -0.58 0.00 0.00 -1.10 0.00 0.00 60.65 58.93 1svt s ILE 78 Cb -0.18 -1.32 0.00 0.00 -1.06 0.00 0.00 42.46 39.90 1svt s ILE 78 CO -0.07 0.30 0.00 0.47 -0.10 0.00 0.00 174.94 175.54 1svt n ASP 79 N 4.84 -5.11 -0.35 3.58 8.00 -1.26 -0.22 116.55 126.03 1svt n ASP 79 Ca -0.14 0.07 0.00 0.00 0.71 0.00 0.00 54.79 55.43 1svt n ASP 79 Cb 0.49 -3.28 0.00 0.00 -0.02 0.00 0.00 41.12 38.31 1svt n ASP 79 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1svt n ASN 80 N -0.55 -1.48 -4.24 -2.24 2.85 -1.26 -5.12 115.26 103.22 1svt n ASN 80 Ca -0.03 0.00 -0.30 0.00 -0.11 0.00 0.00 54.58 54.15 1svt n ASN 80 Cb 0.46 -0.39 -0.16 0.00 1.24 0.00 0.00 39.78 40.92 1svt n ASN 80 CO 0.00 0.00 0.00 -1.61 -2.11 0.00 0.00 177.26 173.54 1svt s GLU 81 N -3.87 2.17 -0.52 1.20 8.01 0.69 -5.10 118.70 121.29 1svt s GLU 81 Ca 0.00 -0.82 -0.28 0.00 0.01 0.00 0.00 54.97 53.87 1svt s GLU 81 Cb 0.00 -1.93 0.02 0.00 -4.31 0.00 0.00 34.13 27.91 1svt s GLU 81 CO 0.00 0.40 1.34 -1.21 0.01 0.00 0.00 175.26 175.80 1svt s GLU 82 N -0.27 3.46 0.17 1.61 0.41 -1.26 -2.59 118.70 120.24 1svt s GLU 82 Ca 0.01 0.56 0.07 0.00 -0.41 0.00 0.00 54.97 55.20 1svt s GLU 82 Cb -0.12 -4.05 -0.04 0.00 -1.78 0.00 0.00 34.13 28.14 1svt s GLU 82 CO 0.02 -1.73 -0.15 0.14 -0.49 0.00 0.00 175.26 173.04 1svt s VAL 83 N 5.53 1.63 0.09 2.63 -7.23 -0.86 -4.34 120.40 117.85 1svt s VAL 83 Ca 0.53 -2.03 0.07 0.00 -1.81 0.00 0.00 61.98 58.73 1svt s VAL 83 Cb -0.10 -1.88 -0.03 0.00 0.56 0.00 0.00 36.38 34.93 1svt s VAL 83 CO 0.28 -0.51 -0.18 -0.76 -0.31 0.00 0.00 175.10 173.62 1svt s LEU 84 N -2.98 2.30 -0.09 1.32 1.02 0.20 -0.39 118.68 120.06 1svt s LEU 84 Ca 0.18 -0.67 -0.01 0.00 0.02 0.00 0.00 54.13 53.65 1svt s LEU 84 Cb -0.02 -0.73 0.03 0.00 0.02 0.00 0.00 46.19 45.49 1svt s LEU 84 CO 0.05 -0.00 -0.01 -0.63 0.02 0.00 0.00 176.35 175.78 1svt s ILE 85 N -1.26 0.53 0.21 -0.59 1.01 -0.53 -1.94 121.20 118.64 1svt s ILE 85 Ca 0.03 -0.04 -0.06 0.00 0.00 0.00 0.00 60.65 60.58 1svt s ILE 85 Cb -0.10 -0.70 -0.02 0.00 0.01 0.00 0.00 42.46 41.65 1svt s ILE 85 CO 0.03 0.23 0.28 0.00 0.00 0.00 0.00 174.94 175.48 1svt s MET 86 N 1.90 1.33 0.56 2.79 0.23 -1.09 -1.63 119.30 123.39 1svt s MET 86 Ca 0.04 -1.45 -0.04 0.00 -1.03 0.00 0.00 55.69 53.21 1svt s MET 86 Cb -0.13 0.36 0.01 0.00 -1.53 0.00 0.00 34.83 33.53 1svt s MET 86 CO -0.06 -0.49 0.85 -1.54 -2.03 0.00 0.00 175.02 171.75 1svt s SER 87 N -3.09 5.62 0.38 -1.18 1.04 -1.26 -0.23 113.70 114.98 1svt s SER 87 Ca 0.31 0.60 0.12 0.00 0.48 0.00 0.00 55.95 57.46 1svt s SER 87 Cb 0.04 -1.64 0.93 0.00 0.10 0.00 0.00 66.02 65.45 1svt s SER 87 CO 0.10 -1.00 1.86 -0.08 0.98 0.00 0.00 173.24 175.10 1svt h GLU 88 N -0.06 0.55 -0.89 4.02 4.81 -1.78 -1.04 114.58 120.19 1svt h GLU 88 Ca -0.45 -0.03 0.21 0.00 -0.13 0.00 0.00 59.36 58.95 1svt h GLU 88 Cb 1.26 -0.12 -0.06 0.00 0.63 0.00 0.00 28.75 30.45 1svt h GLU 88 CO 0.60 0.37 0.60 0.77 -0.73 0.00 0.00 179.01 180.61 1svt h SER 89 N 0.57 0.34 1.17 1.04 0.02 -1.93 0.30 113.55 115.07 1svt h SER 89 Ca 0.47 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.45 1svt h SER 89 Cb 0.93 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.44 1svt h SER 89 CO -0.21 0.13 -0.12 0.47 -1.14 0.00 0.00 176.83 175.97 1svt n ASP 90 N -4.48 0.52 -4.76 3.07 8.00 -0.40 -4.80 116.55 113.70 1svt n ASP 90 Ca 0.19 0.43 -0.39 0.00 0.71 0.00 0.00 54.79 55.74 1svt n ASP 90 Cb 0.73 -0.50 -0.06 0.00 -0.02 0.00 0.00 41.12 41.27 1svt n ASP 90 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1svt s ILE 91 N -3.07 4.95 -0.14 0.53 1.01 0.11 -1.59 121.20 123.00 1svt s ILE 91 Ca 0.11 1.19 0.05 0.00 0.00 0.00 0.00 60.65 62.01 1svt s ILE 91 Cb 0.15 -3.91 -0.12 0.00 0.01 0.00 0.00 42.46 38.59 1svt s ILE 91 CO 0.60 0.41 -0.06 0.18 0.00 0.00 0.00 174.94 176.07 1svt n LEU 92 N 2.79 1.76 -3.83 2.97 4.77 -0.37 -4.98 117.00 120.11 1svt n LEU 92 Ca -0.07 -0.05 -0.06 0.00 -0.03 0.00 0.00 56.01 55.80 1svt n LEU 92 Cb 0.51 -0.19 0.02 0.00 -2.33 0.00 0.00 43.42 41.43 1svt n LEU 92 CO 0.43 0.56 0.63 0.00 -1.33 0.00 0.00 177.39 177.69 1svt s ALA 93 N -2.29 -1.13 0.11 -1.18 0.00 -1.11 -5.02 121.76 111.14 1svt s ALA 93 Ca -0.14 -0.51 0.09 0.00 0.00 0.00 0.00 51.96 51.40 1svt s ALA 93 Cb 0.04 0.71 -0.04 0.00 0.00 0.00 0.00 23.12 23.84 1svt s ALA 93 CO 0.40 -1.02 -0.24 0.42 0.00 0.00 0.00 175.76 175.32 1svt s ILE 94 N -2.48 1.96 -0.77 0.00 1.01 -1.26 -2.21 121.20 117.45 1svt s ILE 94 Ca 0.17 -1.61 -0.13 0.00 0.00 0.00 0.00 60.65 59.08 1svt s ILE 94 Cb -0.04 -1.75 0.20 0.00 0.01 0.00 0.00 42.46 40.88 1svt s ILE 94 CO 0.08 0.04 0.70 -0.69 0.00 0.00 0.00 174.94 175.07 1svt s VAL 95 N -1.08 5.41 0.44 2.92 1.01 0.56 -4.93 120.40 124.72 1svt s VAL 95 Ca 0.10 -2.37 0.04 0.00 0.00 0.00 0.00 61.98 59.75 1svt s VAL 95 Cb -0.10 -4.37 0.01 0.00 0.00 0.00 0.00 36.38 31.92 1svt s VAL 95 CO 0.05 -0.99 0.62 -1.61 0.00 0.00 0.00 175.10 173.16 1svt s GLU 96 N 0.35 2.88 0.00 2.72 2.02 -1.26 -4.59 118.70 120.82 1svt s GLU 96 Ca 0.16 -0.91 0.00 0.00 0.02 0.00 0.00 54.97 54.23 1svt s GLU 96 Cb -0.14 -2.67 0.00 0.00 0.10 0.00 0.00 34.13 31.43 1svt s GLU 96 CO -0.07 -0.29 0.00 0.00 0.02 0.00 0.00 175.26 174.92