#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4z n SER 2 N 0.00 -4.95 -4.36 1.61 7.64 -1.26 -4.99 113.62 107.31 1x4z n SER 2 Ca 0.00 0.29 -0.22 0.00 1.01 0.00 0.00 58.87 59.95 1x4z n SER 2 Cb 0.00 -0.72 -0.11 0.00 -1.01 0.00 0.00 64.21 62.37 1x4z n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1x4z s SER 3 N -0.92 2.85 0.00 6.43 0.01 -1.26 -5.16 113.70 115.66 1x4z s SER 3 Ca 0.41 -0.93 0.00 0.00 1.31 0.00 0.00 55.95 56.75 1x4z s SER 3 Cb -0.25 -0.18 0.00 0.00 0.21 0.00 0.00 66.02 65.80 1x4z s SER 3 CO 0.72 -0.04 0.00 0.61 0.41 0.00 0.00 173.24 174.93 1x4z n GLY 4 N -0.01 -0.32 3.76 3.44 0.00 -1.26 -5.04 105.19 105.76 1x4z n GLY 4 Ca -0.11 -1.68 -0.38 0.00 0.00 0.00 0.00 46.02 43.85 1x4z n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x4z s SER 5 N -1.00 6.74 0.56 1.61 1.04 -1.26 -5.08 113.70 116.31 1x4z s SER 5 Ca 0.00 0.88 -0.05 0.00 0.48 0.00 0.00 55.95 57.26 1x4z s SER 5 Cb 0.00 -2.28 -0.00 0.00 0.10 0.00 0.00 66.02 63.84 1x4z s SER 5 CO 0.00 0.12 0.86 -0.55 0.98 0.00 0.00 173.24 174.65 1x4z s SER 6 N -0.02 5.74 0.13 7.02 0.15 -1.26 -5.11 113.70 120.35 1x4z s SER 6 Ca 0.25 0.72 0.06 0.00 0.70 0.00 0.00 55.95 57.68 1x4z s SER 6 Cb -0.16 -1.79 -0.04 0.00 -1.71 0.00 0.00 66.02 62.32 1x4z s SER 6 CO 0.12 -0.95 -0.13 -0.83 1.20 0.00 0.00 173.24 172.65 1x4z s GLY 7 N -4.26 1.09 0.63 9.45 0.00 -1.26 -5.13 107.32 107.84 1x4z s GLY 7 Ca 0.52 -1.34 -0.18 0.00 0.00 0.00 0.00 44.72 43.73 1x4z s GLY 7 CO 0.44 -1.40 1.23 -0.45 0.00 0.00 0.00 173.10 172.92 1x4z s SER 8 N -2.59 4.90 0.38 1.64 0.15 -1.26 -4.94 113.70 111.98 1x4z s SER 8 Ca 0.11 2.44 -0.28 0.00 0.70 0.00 0.00 55.95 58.92 1x4z s SER 8 Cb -0.04 -2.60 -0.11 0.00 -1.71 0.00 0.00 66.02 61.56 1x4z s SER 8 CO 0.03 -1.79 1.46 -1.58 1.20 0.00 0.00 173.24 172.55 1x4z s GLN 9 N -3.43 4.10 0.71 5.44 0.74 -1.26 -4.98 119.66 120.99 1x4z s GLN 9 Ca 0.78 2.51 -0.13 0.00 0.05 0.00 0.00 55.36 58.58 1x4z s GLN 9 Cb -0.32 -2.95 0.03 0.00 1.10 0.00 0.00 33.01 30.86 1x4z s GLN 9 CO 0.36 -0.51 1.10 -1.25 -0.55 0.00 0.00 175.29 174.44 1x4z s PRO 10 N -2.09 2.53 -0.09 1.67 0.04 -1.26 -5.06 135.00 130.74 1x4z s PRO 10 Ca 0.53 1.28 0.00 0.00 0.04 0.00 0.00 61.00 62.86 1x4z s PRO 10 Cb -0.45 -1.92 0.02 0.00 0.04 0.00 0.00 34.50 32.18 1x4z s PRO 10 CO 0.61 -1.44 -0.08 -0.51 0.04 0.00 0.00 177.00 175.62 1x4z s ASP 11 N -2.98 1.86 0.17 6.66 1.11 -1.26 -5.14 116.67 117.10 1x4z s ASP 11 Ca 0.64 -0.26 0.08 0.00 0.18 0.00 0.00 52.55 53.20 1x4z s ASP 11 Cb -0.19 -0.75 -0.04 0.00 1.07 0.00 0.00 42.92 43.01 1x4z s ASP 11 CO 0.49 -0.08 -0.07 -1.38 1.18 0.00 0.00 175.17 175.30 1x4z s HIS 12 N 1.37 2.69 0.00 4.23 -3.43 -1.26 -4.89 115.29 113.99 1x4z s HIS 12 Ca -0.02 -0.20 0.00 0.00 -0.80 0.00 0.00 55.06 54.04 1x4z s HIS 12 Cb -0.14 -1.32 0.00 0.00 -1.43 0.00 0.00 32.58 29.70 1x4z s HIS 12 CO -0.04 0.51 0.00 0.41 -2.00 0.00 0.00 174.74 173.62 1x4z n GLY 13 N 0.04 0.79 3.55 -1.38 0.00 -1.26 -5.01 105.19 101.93 1x4z n GLY 13 Ca -0.11 -0.72 -0.38 0.00 0.00 0.00 0.00 46.02 44.81 1x4z n GLY 13 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1x4z s ARG 14 N -2.09 2.98 0.59 1.61 1.70 -1.26 -4.98 118.95 117.50 1x4z s ARG 14 Ca 0.00 -0.14 -0.07 0.00 -0.47 0.00 0.00 55.73 55.05 1x4z s ARG 14 Cb 0.00 -4.61 0.13 0.00 -0.57 0.00 0.00 34.95 29.90 1x4z s ARG 14 CO 0.00 -2.55 0.81 1.28 -1.08 0.00 0.00 175.30 173.76 1x4z n LEU 15 N 11.12 0.00 -3.91 -1.89 4.77 -1.26 -5.12 117.00 120.71 1x4z n LEU 15 Ca 0.20 -1.19 -0.09 0.00 -0.03 0.00 0.00 56.01 54.91 1x4z n LEU 15 Cb 0.50 -0.59 -0.07 0.00 -2.33 0.00 0.00 43.42 40.93 1x4z n LEU 15 CO 0.68 -1.01 -0.10 -0.44 -1.33 0.00 0.00 177.39 175.19 1x4z s SER 16 N -4.09 0.13 1.00 -1.43 0.01 -1.07 -5.11 113.70 103.14 1x4z s SER 16 Ca 0.49 -0.75 -0.12 0.00 1.31 0.00 0.00 55.95 56.87 1x4z s SER 16 Cb -0.02 0.35 0.19 0.00 0.21 0.00 0.00 66.02 66.76 1x4z s SER 16 CO 0.33 -0.76 1.09 -2.16 0.41 0.00 0.00 173.24 172.15 1x4z s PRO 17 N -3.90 0.38 0.56 12.44 0.04 -1.26 -4.08 135.00 139.18 1x4z s PRO 17 Ca 0.09 0.51 -0.19 0.00 0.04 0.00 0.00 61.00 61.45 1x4z s PRO 17 Cb 0.05 -1.73 -0.05 0.00 0.04 0.00 0.00 34.50 32.81 1x4z s PRO 17 CO -0.08 -2.76 1.13 -1.25 0.04 0.00 0.00 177.00 174.07 1x4z s PRO 18 N -4.96 3.28 0.65 0.56 0.04 -1.24 -3.35 135.00 129.97 1x4z s PRO 18 Ca 0.65 1.58 0.00 0.00 0.04 0.00 0.00 61.00 63.27 1x4z s PRO 18 Cb -0.19 -2.00 0.09 0.00 0.04 0.00 0.00 34.50 32.44 1x4z s PRO 18 CO 0.58 -0.90 0.90 -1.83 0.04 0.00 0.00 177.00 175.78 1x4z s GLU 19 N -3.41 2.05 -0.02 4.56 -1.05 -1.07 -3.66 118.70 116.10 1x4z s GLU 19 Ca 0.72 -1.00 -0.30 0.00 -0.15 0.00 0.00 54.97 54.24 1x4z s GLU 19 Cb -0.23 -2.40 -0.06 0.00 -0.44 0.00 0.00 34.13 31.00 1x4z s GLU 19 CO 0.29 -1.14 1.57 0.00 0.95 0.00 0.00 175.26 176.93 1x4z s ALA 20 N -2.98 3.63 0.82 -0.84 0.00 -1.26 -4.50 121.76 116.62 1x4z s ALA 20 Ca 0.63 0.96 -0.11 0.00 0.00 0.00 0.00 51.96 53.44 1x4z s ALA 20 Cb -0.07 -3.69 0.08 0.00 0.00 0.00 0.00 23.12 19.44 1x4z s ALA 20 CO 0.42 -1.20 1.09 -1.25 0.00 0.00 0.00 175.76 174.82 1x4z s PRO 21 N 3.29 1.90 1.10 0.00 0.04 -1.26 -4.75 135.00 135.32 1x4z s PRO 21 Ca 0.70 1.04 -0.17 0.00 0.04 0.00 0.00 61.00 62.62 1x4z s PRO 21 Cb -0.34 -1.87 0.17 0.00 0.04 0.00 0.00 34.50 32.51 1x4z s PRO 21 CO 0.29 -1.86 0.26 -3.47 0.04 0.00 0.00 177.00 172.26 1x4z n ASP 22 N -3.65 -2.90 -4.67 6.66 2.03 0.38 -4.42 116.55 109.96 1x4z n ASP 22 Ca 0.08 -0.35 -0.43 0.00 0.52 0.00 0.00 54.79 54.62 1x4z n ASP 22 Cb 0.54 -0.86 -0.02 0.00 -0.72 0.00 0.00 41.12 40.05 1x4z n ASP 22 CO 0.00 0.00 0.00 -0.60 -1.92 0.00 0.00 177.20 174.68 1x4z s ARG 23 N -3.64 4.34 0.38 -0.67 3.52 -1.26 -4.49 118.95 117.13 1x4z s ARG 23 Ca 0.47 1.35 -0.26 0.00 -0.13 0.00 0.00 55.73 57.16 1x4z s ARG 23 Cb -0.09 -3.59 -0.09 0.00 -1.56 0.00 0.00 34.95 29.63 1x4z s ARG 23 CO 0.48 -0.46 1.20 -1.25 -0.81 0.00 0.00 175.30 174.46 1x4z s PRO 24 N 2.56 4.15 0.35 5.12 0.04 -1.26 -4.70 135.00 141.26 1x4z s PRO 24 Ca 0.46 1.93 -0.01 0.00 0.04 0.00 0.00 61.00 63.42 1x4z s PRO 24 Cb -0.17 -2.80 -0.04 0.00 0.04 0.00 0.00 34.50 31.54 1x4z s PRO 24 CO 0.12 -0.27 0.57 -0.08 0.04 0.00 0.00 177.00 177.39 1x4z s THR 25 N -1.33 5.07 -0.17 1.26 -1.32 0.73 -4.66 115.64 115.23 1x4z s THR 25 Ca 0.54 -0.31 0.01 0.00 -1.21 0.00 0.00 61.69 60.72 1x4z s THR 25 Cb -0.33 -3.84 0.02 0.00 -1.51 0.00 0.00 72.50 66.84 1x4z s THR 25 CO 0.42 -0.55 -0.17 -0.63 -2.21 0.00 0.00 174.62 171.49 1x4z s ILE 26 N -2.32 1.84 0.26 5.08 -1.09 -1.26 -2.74 121.20 120.96 1x4z s ILE 26 Ca 0.41 -0.85 0.00 0.00 -2.23 0.00 0.00 60.65 57.98 1x4z s ILE 26 Cb -0.10 -1.71 0.00 0.00 -1.58 0.00 0.00 42.46 39.07 1x4z s ILE 26 CO 0.36 0.46 0.01 -1.20 -1.23 0.00 0.00 174.94 173.34 1x4z n SER 27 N 4.68 2.67 -4.27 3.58 7.64 -0.50 -4.98 113.62 122.44 1x4z n SER 27 Ca -0.19 -2.14 -0.43 0.00 1.01 0.00 0.00 58.87 57.12 1x4z n SER 27 Cb 0.49 0.17 -0.07 0.00 -1.01 0.00 0.00 64.21 63.79 1x4z n SER 27 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1x4z s THR 28 N -1.91 4.75 -0.21 0.44 2.01 -1.26 -3.33 115.64 116.13 1x4z s THR 28 Ca 0.01 -1.57 0.04 0.00 0.31 0.00 0.00 61.69 60.48 1x4z s THR 28 Cb -0.00 -4.05 -0.15 0.00 0.01 0.00 0.00 72.50 68.31 1x4z s THR 28 CO 0.01 -0.78 -0.15 0.00 -0.69 0.00 0.00 174.62 173.00 1x4z n ALA 29 N 5.09 1.55 -3.78 7.40 0.00 -1.25 -4.79 120.51 124.72 1x4z n ALA 29 Ca -0.11 -0.95 0.00 0.00 0.00 0.00 0.00 53.44 52.38 1x4z n ALA 29 Cb 0.41 -0.01 0.03 0.00 0.00 0.00 0.00 19.45 19.87 1x4z n ALA 29 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1x4z n SER 30 N -3.04 -2.17 0.18 0.00 7.64 -0.20 -4.94 113.62 111.08 1x4z n SER 30 Ca -0.36 -2.47 0.09 0.00 1.01 0.00 0.00 58.87 57.14 1x4z n SER 30 Cb 0.93 3.61 0.10 0.00 -1.01 0.00 0.00 64.21 67.85 1x4z n SER 30 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1x4z h GLU 31 N 0.00 0.00 -0.00 1.43 4.81 -1.93 -3.30 114.58 115.58 1x4z h GLU 31 Ca -0.32 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.91 1x4z h GLU 31 Cb 1.20 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.58 1x4z h GLU 31 CO 0.41 0.14 -0.04 0.25 -0.73 0.00 0.00 179.01 179.04 1x4z n THR 32 N -3.08 0.00 -4.06 0.32 -2.24 -1.26 -4.57 114.28 99.39 1x4z n THR 32 Ca 0.03 -0.48 -0.09 0.00 -2.27 0.00 0.00 64.05 61.23 1x4z n THR 32 Cb 0.60 1.06 -0.09 0.00 -2.10 0.00 0.00 70.33 69.80 1x4z n THR 32 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1x4z s SER 33 N -0.56 0.25 -0.02 3.42 1.04 -1.24 -1.60 113.70 114.99 1x4z s SER 33 Ca 0.04 -1.04 -0.05 0.00 0.48 0.00 0.00 55.95 55.38 1x4z s SER 33 Cb 0.03 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.48 1x4z s SER 33 CO 0.07 -0.75 0.11 0.68 0.98 0.00 0.00 173.24 174.33 1x4z s VAL 34 N -3.99 0.05 -0.32 5.02 -7.23 -1.07 -1.04 120.40 111.82 1x4z s VAL 34 Ca 0.18 -0.39 -0.29 0.00 -1.81 0.00 0.00 61.98 59.67 1x4z s VAL 34 Cb 0.06 -0.29 0.00 0.00 0.56 0.00 0.00 36.38 36.72 1x4z s VAL 34 CO -0.02 -0.22 1.33 -0.31 -0.31 0.00 0.00 175.10 175.58 1x4z s TYR 35 N -0.70 2.60 -0.21 2.82 2.02 -1.21 -1.45 117.35 121.22 1x4z s TYR 35 Ca -0.08 0.81 -0.06 0.00 -0.37 0.00 0.00 57.07 57.37 1x4z s TYR 35 Cb -0.05 -4.00 -0.03 0.00 -0.40 0.00 0.00 41.96 37.48 1x4z s TYR 35 CO 0.01 -1.81 0.03 0.08 -1.57 0.00 0.00 175.55 172.28 1x4z s VAL 36 N 4.63 4.19 -0.14 0.71 1.01 0.78 -1.40 120.40 130.18 1x4z s VAL 36 Ca 0.58 -0.23 0.01 0.00 0.00 0.00 0.00 61.98 62.33 1x4z s VAL 36 Cb -0.16 -2.91 0.02 0.00 0.00 0.00 0.00 36.38 33.33 1x4z s VAL 36 CO 0.25 0.41 -0.14 -0.89 0.00 0.00 0.00 175.10 174.73 1x4z s THR 37 N 1.02 1.55 0.41 3.92 2.01 -1.11 -0.69 115.64 122.75 1x4z s THR 37 Ca 0.03 -0.63 0.07 0.00 0.31 0.00 0.00 61.69 61.47 1x4z s THR 37 Cb -0.14 -1.45 -0.07 0.00 0.01 0.00 0.00 72.50 70.85 1x4z s THR 37 CO 0.02 0.45 0.05 -1.66 -0.69 0.00 0.00 174.62 172.80 1x4z s TRP 38 N 1.37 2.54 -0.24 4.92 -2.14 0.42 -0.19 118.94 125.62 1x4z s TRP 38 Ca 0.02 -0.63 -0.02 0.00 2.66 0.00 0.00 56.10 58.13 1x4z s TRP 38 Cb -0.13 -1.80 0.08 0.00 -3.10 0.00 0.00 33.47 28.51 1x4z s TRP 38 CO -0.08 0.38 0.06 0.42 -2.66 0.00 0.00 176.95 175.07 1x4z s ILE 39 N -2.67 0.57 0.36 0.66 -1.09 -1.26 -4.72 121.20 113.05 1x4z s ILE 39 Ca 0.37 -0.82 -0.27 0.00 -2.23 0.00 0.00 60.65 57.70 1x4z s ILE 39 Cb 0.08 -1.21 -0.09 0.00 -1.58 0.00 0.00 42.46 39.66 1x4z s ILE 39 CO 0.19 -0.39 1.20 -2.16 -1.23 0.00 0.00 174.94 172.55 1x4z s PRO 40 N 1.81 4.21 -0.00 2.79 0.04 -1.26 -0.47 135.00 142.12 1x4z s PRO 40 Ca 0.03 1.96 -0.00 0.00 0.04 0.00 0.00 61.00 63.02 1x4z s PRO 40 Cb -0.17 -2.86 -0.00 0.00 0.04 0.00 0.00 34.50 31.51 1x4z s PRO 40 CO -0.16 -0.22 -0.01 0.54 0.04 0.00 0.00 177.00 177.20 1x4z n ARG 41 N 0.43 0.01 -4.26 4.56 5.12 -1.26 -4.87 116.66 116.39 1x4z n ARG 41 Ca 0.02 0.00 -0.34 0.00 -1.93 0.00 0.00 57.85 55.61 1x4z n ARG 41 Cb 0.45 -0.24 -0.09 0.00 -1.16 0.00 0.00 32.46 31.42 1x4z n ARG 41 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 1x4z s GLY 42 N -3.07 1.92 0.00 -0.13 0.00 -1.26 -4.99 107.32 99.79 1x4z s GLY 42 Ca -0.01 -0.84 0.09 0.00 0.00 0.00 0.00 44.72 43.96 1x4z s GLY 42 CO 0.01 -0.65 1.19 1.16 0.00 0.00 0.00 173.10 174.81 1x4z n ASN 43 N 1.76 2.70 0.00 1.64 6.94 -1.26 -2.61 115.26 124.44 1x4z n ASN 43 Ca -0.17 -1.97 0.00 0.00 -0.02 0.00 0.00 54.58 52.42 1x4z n ASN 43 Cb 0.53 -0.18 0.00 0.00 -2.36 0.00 0.00 39.78 37.78 1x4z n ASN 43 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1x4z n GLY 44 N 0.33 0.92 0.00 4.83 0.00 -1.21 -3.20 105.19 106.85 1x4z n GLY 44 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1x4z n GLY 44 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x4z n GLY 45 N -2.05 2.19 3.78 -0.02 0.00 -1.26 -2.60 105.19 105.23 1x4z n GLY 45 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1x4z n GLY 45 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1x4z s PHE 46 N -2.16 2.92 -0.25 1.61 0.08 -1.19 -5.07 117.98 113.92 1x4z s PHE 46 Ca 0.00 -0.22 -0.29 0.00 0.12 0.00 0.00 56.93 56.54 1x4z s PHE 46 Cb 0.00 -1.50 -0.02 0.00 -0.57 0.00 0.00 43.02 40.93 1x4z s PHE 46 CO 0.00 0.42 1.63 -1.25 -0.10 0.00 0.00 175.22 175.92 1x4z s PRO 47 N -3.85 3.71 -0.08 0.24 0.04 -1.26 -4.66 135.00 129.14 1x4z s PRO 47 Ca 0.35 1.58 -0.40 0.00 0.04 0.00 0.00 61.00 62.57 1x4z s PRO 47 Cb -0.06 -4.06 -0.18 0.00 0.04 0.00 0.00 34.50 30.23 1x4z s PRO 47 CO 0.24 -1.40 1.32 -0.89 0.04 0.00 0.00 177.00 176.31 1x4z n ILE 48 N 6.61 0.04 -0.04 0.56 5.41 -1.26 -4.76 119.36 125.92 1x4z n ILE 48 Ca 0.19 -0.01 -0.17 0.00 1.00 0.00 0.00 62.75 63.77 1x4z n ILE 48 Cb 0.46 -0.48 -0.13 0.00 -0.71 0.00 0.00 39.64 38.77 1x4z n ILE 48 CO 0.00 0.00 0.00 1.56 0.00 0.00 0.00 176.55 178.11 1x4z h GLN 49 N 4.30 0.08 -2.79 0.38 4.20 -1.71 -3.42 115.11 116.16 1x4z h GLN 49 Ca -0.48 -0.14 0.04 0.00 0.06 0.00 0.00 58.65 58.12 1x4z h GLN 49 Cb 1.38 0.05 -0.12 0.00 0.30 0.00 0.00 27.48 29.10 1x4z h GLN 49 CO 0.78 1.07 0.30 -1.12 -0.67 0.00 0.00 178.83 179.18 1x4z s SER 50 N -6.53 -0.45 0.51 1.46 0.01 -0.69 -4.57 113.70 103.44 1x4z s SER 50 Ca -0.19 -0.11 0.06 0.00 1.31 0.00 0.00 55.95 57.02 1x4z s SER 50 Cb -0.00 0.56 0.02 0.00 0.21 0.00 0.00 66.02 66.81 1x4z s SER 50 CO 0.71 -0.94 0.40 -0.36 0.41 0.00 0.00 173.24 173.47 1x4z s PHE 51 N -3.59 1.89 -0.16 2.43 0.08 -1.00 -0.86 117.98 116.76 1x4z s PHE 51 Ca 0.04 -0.75 -0.07 0.00 0.12 0.00 0.00 56.93 56.27 1x4z s PHE 51 Cb -0.02 -1.98 0.07 0.00 -0.57 0.00 0.00 43.02 40.52 1x4z s PHE 51 CO -0.08 -0.40 0.35 1.03 -0.10 0.00 0.00 175.22 176.02 1x4z s ARG 52 N -4.25 0.28 -0.15 0.44 0.52 -0.12 -3.61 118.95 112.07 1x4z s ARG 52 Ca 0.39 0.84 -0.05 0.00 -0.52 0.00 0.00 55.73 56.39 1x4z s ARG 52 Cb -0.02 0.10 -0.04 0.00 0.52 0.00 0.00 34.95 35.51 1x4z s ARG 52 CO 0.24 -0.23 0.03 0.08 0.02 0.00 0.00 175.30 175.44 1x4z s VAL 53 N 2.13 4.53 0.18 3.52 1.01 -1.23 -0.37 120.40 130.18 1x4z s VAL 53 Ca -0.04 -0.14 0.04 0.00 0.00 0.00 0.00 61.98 61.84 1x4z s VAL 53 Cb -0.11 -2.99 -0.05 0.00 0.00 0.00 0.00 36.38 33.23 1x4z s VAL 53 CO -0.11 0.52 -0.04 -1.61 0.00 0.00 0.00 175.10 173.85 1x4z s GLU 54 N -0.05 1.17 -0.05 2.72 2.02 -1.12 -1.97 118.70 121.42 1x4z s GLU 54 Ca 0.05 -1.55 -0.12 0.00 0.02 0.00 0.00 54.97 53.37 1x4z s GLU 54 Cb -0.12 -0.54 0.02 0.00 0.10 0.00 0.00 34.13 33.58 1x4z s GLU 54 CO 0.01 -0.03 0.28 1.52 0.02 0.00 0.00 175.26 177.06 1x4z s TYR 55 N -3.43 -0.20 -0.08 1.61 -0.85 -0.37 -1.04 117.35 112.98 1x4z s TYR 55 Ca 0.22 0.41 0.04 0.00 -0.52 0.00 0.00 57.07 57.22 1x4z s TYR 55 Cb 0.04 0.08 -0.00 0.00 0.38 0.00 0.00 41.96 42.46 1x4z s TYR 55 CO 0.04 -0.29 -0.22 0.21 -1.52 0.00 0.00 175.55 173.78 1x4z s LYS 56 N -0.77 2.61 0.01 -3.49 2.20 -1.21 0.77 119.74 119.85 1x4z s LYS 56 Ca -0.09 -0.79 -0.30 0.00 -0.36 0.00 0.00 55.97 54.43 1x4z s LYS 56 Cb -0.04 -2.06 -0.04 0.00 -1.51 0.00 0.00 37.83 34.18 1x4z s LYS 56 CO 0.02 0.21 1.13 0.15 -0.36 0.00 0.00 175.35 176.50 1x4z s LYS 57 N 0.24 4.45 0.51 4.03 1.02 -1.26 -2.77 119.74 125.96 1x4z s LYS 57 Ca -0.13 1.63 -0.06 0.00 0.02 0.00 0.00 55.97 57.43 1x4z s LYS 57 Cb -0.16 -3.43 -0.03 0.00 -0.52 0.00 0.00 37.83 33.68 1x4z s LYS 57 CO 0.06 -0.24 0.83 -0.51 -0.92 0.00 0.00 175.35 174.57 1x4z s LEU 58 N 1.34 3.54 -1.80 3.17 1.43 -0.12 -4.01 118.68 122.23 1x4z s LEU 58 Ca 0.56 0.99 0.00 0.00 -1.03 0.00 0.00 54.13 54.64 1x4z s LEU 58 Cb -0.25 -3.95 0.00 0.00 0.03 0.00 0.00 46.19 42.02 1x4z s LEU 58 CO 0.27 -0.66 0.00 0.29 0.23 0.00 0.00 176.35 176.48 1x4z n LYS 59 N -2.36 -1.67 -3.89 1.70 5.02 -1.26 -4.77 118.16 110.93 1x4z n LYS 59 Ca 0.02 1.01 -0.09 0.00 -2.02 0.00 0.00 58.31 57.22 1x4z n LYS 59 Cb 0.55 -5.59 -0.06 0.00 -0.02 0.00 0.00 35.03 29.91 1x4z n LYS 59 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1x4z s LYS 60 N -4.67 1.25 -0.12 1.97 1.02 -1.26 -5.16 119.74 112.77 1x4z s LYS 60 Ca 0.00 -1.07 -0.06 0.00 0.02 0.00 0.00 55.97 54.86 1x4z s LYS 60 Cb 0.00 0.43 -0.04 0.00 -0.52 0.00 0.00 37.83 37.70 1x4z s LYS 60 CO 0.00 -0.49 0.11 0.54 -0.92 0.00 0.00 175.35 174.60 1x4z s VAL 61 N -3.94 5.29 0.00 3.17 0.11 -1.26 -4.95 120.40 118.82 1x4z s VAL 61 Ca 0.14 0.13 0.00 0.00 -2.93 0.00 0.00 61.98 59.32 1x4z s VAL 61 Cb 0.02 -3.30 0.00 0.00 -1.53 0.00 0.00 36.38 31.57 1x4z s VAL 61 CO -0.01 0.60 0.00 0.61 -3.33 0.00 0.00 175.10 172.98 1x4z n GLY 62 N 2.12 4.15 3.11 6.54 0.00 -1.26 -5.07 105.19 114.79 1x4z n GLY 62 Ca -0.19 -0.82 -0.23 0.00 0.00 0.00 0.00 46.02 44.77 1x4z n GLY 62 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1x4z n ASP 63 N 0.00 -3.10 -3.68 1.61 8.00 -1.26 -4.72 116.55 113.40 1x4z n ASP 63 Ca 0.00 -0.44 -0.30 0.00 0.71 0.00 0.00 54.79 54.76 1x4z n ASP 63 Cb 0.00 -0.86 0.28 0.00 -0.02 0.00 0.00 41.12 40.52 1x4z n ASP 63 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 1x4z s TRP 64 N -2.12 -0.19 0.19 1.24 0.52 -1.26 -4.76 118.94 112.56 1x4z s TRP 64 Ca 0.47 0.70 0.03 0.00 0.02 0.00 0.00 56.10 57.31 1x4z s TRP 64 Cb -0.09 -2.95 -0.05 0.00 -1.15 0.00 0.00 33.47 29.24 1x4z s TRP 64 CO 0.44 -4.76 -0.02 0.42 0.02 0.00 0.00 176.95 173.06 1x4z s ILE 65 N -2.32 0.87 -0.24 2.03 -1.09 0.23 -4.93 121.20 115.75 1x4z s ILE 65 Ca 0.69 -2.01 -0.09 0.00 -2.23 0.00 0.00 60.65 57.01 1x4z s ILE 65 Cb -0.16 -2.14 -0.04 0.00 -1.58 0.00 0.00 42.46 38.54 1x4z s ILE 65 CO 0.59 -0.47 0.12 -0.22 -1.23 0.00 0.00 174.94 173.73 1x4z s LEU 66 N -3.21 3.82 -0.05 2.97 2.96 -1.26 -1.24 118.68 122.67 1x4z s LEU 66 Ca 0.24 -0.02 -0.04 0.00 -0.22 0.00 0.00 54.13 54.09 1x4z s LEU 66 Cb 0.05 -2.02 -0.01 0.00 0.50 0.00 0.00 46.19 44.71 1x4z s LEU 66 CO 0.05 0.03 -0.07 0.00 -1.32 0.00 0.00 176.35 175.03 1x4z n ALA 67 N 4.50 0.19 -2.56 5.97 0.00 -0.83 -4.98 120.51 122.80 1x4z n ALA 67 Ca -0.15 -0.29 -0.27 0.00 0.00 0.00 0.00 53.44 52.72 1x4z n ALA 67 Cb 0.52 0.01 -0.08 0.00 0.00 0.00 0.00 19.45 19.89 1x4z n ALA 67 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1x4z s THR 68 N -1.46 0.73 0.03 0.00 -1.32 -1.24 -4.96 115.64 107.41 1x4z s THR 68 Ca -0.06 -2.00 -0.29 0.00 -1.21 0.00 0.00 61.69 58.13 1x4z s THR 68 Cb 0.01 -2.33 0.10 0.00 -1.51 0.00 0.00 72.50 68.77 1x4z s THR 68 CO 0.09 0.00 1.11 -0.94 -2.21 0.00 0.00 174.62 172.68 1x4z s SER 69 N -3.65 -0.14 -0.65 8.08 1.04 -1.26 -3.51 113.70 113.60 1x4z s SER 69 Ca 0.21 -0.20 -0.02 0.00 0.48 0.00 0.00 55.95 56.41 1x4z s SER 69 Cb 0.03 0.30 0.00 0.00 0.10 0.00 0.00 66.02 66.45 1x4z s SER 69 CO 0.13 -0.55 0.31 0.00 0.98 0.00 0.00 173.24 174.11 1x4z n ALA 70 N -0.41 -0.44 -2.27 5.32 0.00 -1.24 -5.01 120.51 116.46 1x4z n ALA 70 Ca -0.07 0.13 -0.39 0.00 0.00 0.00 0.00 53.44 53.12 1x4z n ALA 70 Cb 0.61 -2.10 -0.06 0.00 0.00 0.00 0.00 19.45 17.91 1x4z n ALA 70 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1x4z s ILE 71 N -2.87 4.69 0.70 0.00 1.01 -1.26 -4.91 121.20 118.55 1x4z s ILE 71 Ca 0.15 1.38 -0.13 0.00 0.00 0.00 0.00 60.65 62.05 1x4z s ILE 71 Cb -0.07 -3.99 0.02 0.00 0.01 0.00 0.00 42.46 38.44 1x4z s ILE 71 CO 0.19 0.50 1.10 -2.16 0.00 0.00 0.00 174.94 174.57 1x4z s PRO 72 N -0.80 2.62 0.54 2.79 0.04 -1.26 -2.38 135.00 136.55 1x4z s PRO 72 Ca 0.32 1.31 0.33 0.00 0.04 0.00 0.00 61.00 63.00 1x4z s PRO 72 Cb -0.20 -1.93 1.35 0.00 0.04 0.00 0.00 34.50 33.75 1x4z s PRO 72 CO 0.21 -1.38 1.98 -1.00 0.04 0.00 0.00 177.00 176.85 1x4z h PRO 73 N -0.36 0.00 0.00 0.56 0.13 -1.81 -2.43 132.00 128.08 1x4z h PRO 73 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1x4z h PRO 73 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1x4z h PRO 73 CO 0.53 0.03 -0.23 0.45 -0.23 0.00 0.00 178.00 178.56 1x4z n SER 74 N -3.15 0.29 -4.30 1.44 2.88 -1.26 -4.64 113.62 104.88 1x4z n SER 74 Ca 0.00 0.20 -0.43 0.00 -1.33 0.00 0.00 58.87 57.31 1x4z n SER 74 Cb 0.31 -0.19 -0.08 0.00 -0.75 0.00 0.00 64.21 63.50 1x4z n SER 74 CO 0.00 0.00 0.00 -0.60 -1.23 0.00 0.00 175.04 173.21 1x4z s ARG 75 N -3.02 2.77 -0.01 -1.46 3.52 -0.92 -4.89 118.95 114.94 1x4z s ARG 75 Ca 0.12 -1.54 0.22 0.00 -0.13 0.00 0.00 55.73 54.40 1x4z s ARG 75 Cb 0.18 -4.02 0.65 0.00 -1.56 0.00 0.00 34.95 30.19 1x4z s ARG 75 CO 0.61 -1.10 1.54 1.28 -0.81 0.00 0.00 175.30 176.82 1x4z n LEU 76 N 5.07 4.01 -3.69 -0.88 4.77 -1.26 -4.73 117.00 120.29 1x4z n LEU 76 Ca -0.11 -2.04 -0.10 0.00 -0.03 0.00 0.00 56.01 53.72 1x4z n LEU 76 Cb 0.42 -0.49 -0.11 0.00 -2.33 0.00 0.00 43.42 40.91 1x4z n LEU 76 CO 0.45 0.97 0.06 -0.55 -1.33 0.00 0.00 177.39 176.99 1x4z s SER 77 N -0.99 -0.51 0.15 -1.43 0.15 -1.26 -0.44 113.70 109.37 1x4z s SER 77 Ca 0.49 0.93 -0.06 0.00 0.70 0.00 0.00 55.95 58.00 1x4z s SER 77 Cb 0.26 0.84 -0.02 0.00 -1.71 0.00 0.00 66.02 65.39 1x4z s SER 77 CO 0.32 -0.20 0.19 0.68 1.20 0.00 0.00 173.24 175.44 1x4z s VAL 78 N 1.51 0.08 -0.36 4.45 -7.23 0.14 -4.97 120.40 114.01 1x4z s VAL 78 Ca -0.09 -1.58 -0.15 0.00 -1.81 0.00 0.00 61.98 58.36 1x4z s VAL 78 Cb -0.09 -1.89 -0.00 0.00 0.56 0.00 0.00 36.38 34.96 1x4z s VAL 78 CO -0.13 -0.38 0.32 -0.70 -0.31 0.00 0.00 175.10 173.90 1x4z s GLU 79 N -3.99 3.38 -0.74 4.82 2.12 -1.26 -0.15 118.70 122.87 1x4z s GLU 79 Ca 0.19 -0.64 -0.24 0.00 0.36 0.00 0.00 54.97 54.64 1x4z s GLU 79 Cb 0.05 -3.86 0.05 0.00 0.26 0.00 0.00 34.13 30.63 1x4z s GLU 79 CO 0.00 -0.58 1.17 0.42 -0.54 0.00 0.00 175.26 175.73 1x4z s ILE 80 N 1.88 4.02 0.42 -3.70 -1.09 -0.53 -4.87 121.20 117.33 1x4z s ILE 80 Ca 0.09 -0.10 0.03 0.00 -2.23 0.00 0.00 60.65 58.44 1x4z s ILE 80 Cb -0.17 -4.83 -0.00 0.00 -1.58 0.00 0.00 42.46 35.87 1x4z s ILE 80 CO 0.11 -1.69 0.61 0.42 -1.23 0.00 0.00 174.94 173.15 1x4z s THR 81 N 4.86 3.90 0.00 2.92 -4.23 -1.26 -2.58 115.64 119.24 1x4z s THR 81 Ca 0.31 -0.70 0.00 0.00 -1.18 0.00 0.00 61.69 60.12 1x4z s THR 81 Cb -0.11 -3.41 0.00 0.00 1.34 0.00 0.00 72.50 70.33 1x4z s THR 81 CO 0.10 -0.24 0.00 0.61 -0.54 0.00 0.00 174.62 174.55 1x4z n GLY 82 N -1.94 0.99 4.00 3.99 0.00 -1.18 -4.95 105.19 106.10 1x4z n GLY 82 Ca 0.01 -0.48 -0.22 0.00 0.00 0.00 0.00 46.02 45.34 1x4z n GLY 82 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1x4z s LEU 83 N -0.33 3.08 -0.17 0.99 1.43 -0.63 -5.08 118.68 117.98 1x4z s LEU 83 Ca 0.00 -0.44 0.01 0.00 -1.03 0.00 0.00 54.13 52.67 1x4z s LEU 83 Cb 0.00 -2.05 0.02 0.00 0.03 0.00 0.00 46.19 44.19 1x4z s LEU 83 CO 0.00 -1.58 -0.18 -1.61 0.23 0.00 0.00 176.35 173.21 1x4z s GLU 84 N -4.93 2.73 0.79 1.70 8.01 -1.26 -4.94 118.70 120.80 1x4z s GLU 84 Ca 0.63 -0.73 -0.13 0.00 0.01 0.00 0.00 54.97 54.76 1x4z s GLU 84 Cb -0.06 -2.39 0.08 0.00 -4.31 0.00 0.00 34.13 27.44 1x4z s GLU 84 CO 0.42 -0.21 1.17 0.15 0.01 0.00 0.00 175.26 176.80 1x4z s LYS 85 N 1.34 1.80 -0.77 1.61 1.02 -1.26 -2.61 119.74 120.87 1x4z s LYS 85 Ca 0.04 1.61 0.00 0.00 0.02 0.00 0.00 55.97 57.65 1x4z s LYS 85 Cb -0.13 -1.81 0.00 0.00 -0.52 0.00 0.00 37.83 35.37 1x4z s LYS 85 CO -0.12 -2.06 0.00 0.41 -0.92 0.00 0.00 175.35 172.66 1x4z n GLY 86 N 0.12 0.74 2.93 -3.33 0.00 0.06 -4.93 105.19 100.78 1x4z n GLY 86 Ca 0.12 -0.05 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 1x4z n GLY 86 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1x4z s ILE 87 N -1.73 1.66 0.19 -0.61 -1.09 -1.07 -5.02 121.20 113.52 1x4z s ILE 87 Ca 0.00 -1.62 -0.30 0.00 -2.23 0.00 0.00 60.65 56.50 1x4z s ILE 87 Cb 0.00 -2.06 -0.08 0.00 -1.58 0.00 0.00 42.46 38.73 1x4z s ILE 87 CO 0.00 -0.37 1.28 -0.44 -1.23 0.00 0.00 174.94 174.18 1x4z s SER 88 N 1.28 6.95 0.18 3.58 0.01 -1.26 -4.40 113.70 120.03 1x4z s SER 88 Ca 0.02 2.34 -0.19 0.00 1.31 0.00 0.00 55.95 59.43 1x4z s SER 88 Cb -0.19 -2.61 0.04 0.00 0.21 0.00 0.00 66.02 63.48 1x4z s SER 88 CO -0.11 -0.49 0.55 -0.72 0.41 0.00 0.00 173.24 172.88 1x4z s TYR 89 N 0.16 -0.26 0.51 2.43 -0.85 -1.18 -0.94 117.35 117.22 1x4z s TYR 89 Ca 0.56 -0.05 0.05 0.00 -0.52 0.00 0.00 57.07 57.11 1x4z s TYR 89 Cb -0.35 0.45 0.02 0.00 0.38 0.00 0.00 41.96 42.45 1x4z s TYR 89 CO 0.37 -0.90 0.34 0.15 -1.52 0.00 0.00 175.55 173.99 1x4z s LYS 90 N -3.83 2.27 0.13 -3.49 1.02 -1.12 -1.76 119.74 112.96 1x4z s LYS 90 Ca 0.06 -1.99 0.04 0.00 0.02 0.00 0.00 55.97 54.11 1x4z s LYS 90 Cb -0.01 -2.06 -0.04 0.00 -0.52 0.00 0.00 37.83 35.20 1x4z s LYS 90 CO -0.06 -0.49 -0.10 -0.06 -0.92 0.00 0.00 175.35 173.71 1x4z s PHE 91 N -2.73 1.20 0.26 3.18 0.40 -1.26 -3.33 117.98 115.70 1x4z s PHE 91 Ca 0.34 -0.71 -0.09 0.00 -0.60 0.00 0.00 56.93 55.86 1x4z s PHE 91 Cb -0.01 -0.63 -0.01 0.00 0.51 0.00 0.00 43.02 42.88 1x4z s PHE 91 CO 0.20 0.05 0.44 -0.98 0.70 0.00 0.00 175.22 175.63 1x4z s ARG 92 N -3.36 1.59 0.01 0.44 1.70 -0.21 -2.50 118.95 116.61 1x4z s ARG 92 Ca 0.12 -1.41 0.00 0.00 -0.47 0.00 0.00 55.73 53.98 1x4z s ARG 92 Cb 0.00 0.44 -0.01 0.00 -0.57 0.00 0.00 34.95 34.82 1x4z s ARG 92 CO 0.00 -0.65 -0.01 0.08 -1.08 0.00 0.00 175.30 173.64 1x4z s VAL 93 N -3.80 0.06 0.00 4.99 1.01 -1.26 -2.81 120.40 118.60 1x4z s VAL 93 Ca 0.26 -0.27 0.03 0.00 0.00 0.00 0.00 61.98 62.01 1x4z s VAL 93 Cb 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 36.38 36.27 1x4z s VAL 93 CO 0.12 -0.13 -0.10 -0.13 0.00 0.00 0.00 175.10 174.86 1x4z s ARG 94 N -0.41 0.79 -0.23 2.72 0.52 0.50 -2.57 118.95 120.27 1x4z s ARG 94 Ca -0.04 -0.44 -0.09 0.00 -0.52 0.00 0.00 55.73 54.64 1x4z s ARG 94 Cb -0.03 -0.75 -0.04 0.00 0.52 0.00 0.00 34.95 34.64 1x4z s ARG 94 CO -0.00 0.20 0.12 0.00 0.02 0.00 0.00 175.30 175.64 1x4z s ALA 95 N -0.40 3.48 -0.20 2.13 0.00 -1.26 -0.94 121.76 124.56 1x4z s ALA 95 Ca 0.02 -0.90 0.01 0.00 0.00 0.00 0.00 51.96 51.09 1x4z s ALA 95 Cb -0.05 -2.19 0.03 0.00 0.00 0.00 0.00 23.12 20.91 1x4z s ALA 95 CO -0.00 -0.17 -0.18 -0.51 0.00 0.00 0.00 175.76 174.91 1x4z s LEU 96 N 1.01 2.41 0.00 0.00 1.02 -0.04 0.10 118.68 123.19 1x4z s LEU 96 Ca 0.06 -0.79 0.01 0.00 0.02 0.00 0.00 54.13 53.43 1x4z s LEU 96 Cb -0.14 -1.50 -0.00 0.00 0.02 0.00 0.00 46.19 44.57 1x4z s LEU 96 CO 0.04 -0.04 0.02 -0.46 0.02 0.00 0.00 176.35 175.93 1x4z n ASN 97 N 4.59 2.10 0.00 2.29 6.94 0.69 -1.70 115.26 130.17 1x4z n ASN 97 Ca -0.20 -1.99 0.06 0.00 -0.02 0.00 0.00 54.58 52.44 1x4z n ASN 97 Cb 0.48 0.26 0.33 0.00 -2.36 0.00 0.00 39.78 38.50 1x4z n ASN 97 CO 0.00 0.00 0.00 1.15 -1.03 0.00 0.00 177.26 177.38 1x4z n MET 98 N -0.51 0.30 -0.04 -3.83 0.00 -1.26 -1.78 117.12 109.99 1x4z n MET 98 Ca -0.07 0.07 -0.01 0.00 0.00 0.00 0.00 57.70 57.69 1x4z n MET 98 Cb 0.28 -1.50 -0.12 0.00 0.00 0.00 0.00 33.22 31.88 1x4z n MET 98 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1x4z n LEU 99 N -1.11 0.00 0.00 3.17 4.77 -1.26 -5.11 117.00 117.46 1x4z n LEU 99 Ca 0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 1x4z n LEU 99 Cb 0.06 0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 1x4z n LEU 99 CO 0.08 0.21 0.00 0.61 -1.33 0.00 0.00 177.39 176.95 1x4z n GLY 100 N 1.87 0.19 3.92 -0.72 0.00 -0.73 -4.70 105.19 105.02 1x4z n GLY 100 Ca -0.15 -1.64 -0.24 0.00 0.00 0.00 0.00 46.02 44.00 1x4z n GLY 100 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1x4z s GLU 101 N -2.00 3.31 0.61 1.61 1.03 -1.26 -0.22 118.70 121.78 1x4z s GLU 101 Ca 0.00 -0.75 0.02 0.00 0.03 0.00 0.00 54.97 54.27 1x4z s GLU 101 Cb 0.00 -2.85 0.08 0.00 -0.80 0.00 0.00 34.13 30.56 1x4z s GLU 101 CO 0.00 0.47 0.85 -1.54 -1.33 0.00 0.00 175.26 173.70 1x4z s SER 102 N -3.59 4.91 0.78 0.83 1.04 0.28 -4.60 113.70 113.35 1x4z s SER 102 Ca 0.34 -0.30 -0.11 0.00 0.48 0.00 0.00 55.95 56.36 1x4z s SER 102 Cb -0.10 -0.35 0.06 0.00 0.10 0.00 0.00 66.02 65.73 1x4z s SER 102 CO 0.28 -1.43 1.09 -1.61 0.98 0.00 0.00 173.24 172.55 1x4z s GLU 103 N -4.87 2.24 -0.47 4.02 2.02 -1.26 -4.61 118.70 115.77 1x4z s GLU 103 Ca 0.61 1.12 -0.28 0.00 0.02 0.00 0.00 54.97 56.45 1x4z s GLU 103 Cb -0.08 -1.90 -0.02 0.00 0.10 0.00 0.00 34.13 32.24 1x4z s GLU 103 CO 0.40 -1.64 1.77 -1.25 0.02 0.00 0.00 175.26 174.56 1x4z s PRO 104 N -4.92 3.05 0.83 0.39 0.04 -1.26 -4.30 135.00 128.83 1x4z s PRO 104 Ca 0.61 0.99 -0.16 0.00 0.04 0.00 0.00 61.00 62.48 1x4z s PRO 104 Cb -0.17 -4.26 -0.09 0.00 0.04 0.00 0.00 34.50 30.03 1x4z s PRO 104 CO 0.56 -2.21 -0.11 -1.13 0.04 0.00 0.00 177.00 174.15 1x4z n SER 105 N 11.18 -3.64 -4.62 6.66 3.41 -1.06 -4.79 113.62 120.76 1x4z n SER 105 Ca 0.21 0.40 -0.44 0.00 -0.26 0.00 0.00 58.87 58.78 1x4z n SER 105 Cb 0.49 -0.98 -0.01 0.00 -0.26 0.00 0.00 64.21 63.45 1x4z n SER 105 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1x4z n ALA 106 N -2.50 0.18 -2.05 7.33 0.00 -1.26 -4.67 120.51 117.54 1x4z n ALA 106 Ca 0.05 0.38 -0.27 0.00 0.00 0.00 0.00 53.44 53.60 1x4z n ALA 106 Cb 0.52 -2.08 -0.05 0.00 0.00 0.00 0.00 19.45 17.84 1x4z n ALA 106 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1x4z s PRO 107 N -1.63 2.54 0.62 0.00 0.04 -1.26 -4.63 135.00 130.68 1x4z s PRO 107 Ca 0.58 -0.35 -0.18 0.00 0.04 0.00 0.00 61.00 61.09 1x4z s PRO 107 Cb -0.67 -5.07 -0.14 0.00 0.04 0.00 0.00 34.50 28.65 1x4z s PRO 107 CO 0.60 -3.43 -0.22 0.45 0.04 0.00 0.00 177.00 174.44 1x4z n SER 108 N 14.04 -4.00 -4.29 6.66 2.88 -1.04 -4.79 113.62 123.08 1x4z n SER 108 Ca 0.41 0.56 -0.37 0.00 -1.33 0.00 0.00 58.87 58.13 1x4z n SER 108 Cb 0.47 -0.85 0.04 0.00 -0.75 0.00 0.00 64.21 63.12 1x4z n SER 108 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1x4z n ARG 109 N 1.58 0.13 -2.22 -1.46 1.74 -1.26 -4.33 116.66 110.84 1x4z n ARG 109 Ca 0.06 0.06 -0.42 0.00 -0.77 0.00 0.00 57.85 56.79 1x4z n ARG 109 Cb 0.49 -1.35 -0.03 0.00 -1.02 0.00 0.00 32.46 30.55 1x4z n ARG 109 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1x4z s PRO 110 N -1.94 4.37 -0.20 5.56 0.04 -1.26 -4.66 135.00 136.91 1x4z s PRO 110 Ca 0.57 2.04 0.01 0.00 0.04 0.00 0.00 61.00 63.66 1x4z s PRO 110 Cb -0.37 -3.22 0.03 0.00 0.04 0.00 0.00 34.50 30.98 1x4z s PRO 110 CO 0.66 -0.30 -0.16 -0.47 0.04 0.00 0.00 177.00 176.78 1x4z s TYR 111 N 0.43 2.78 -0.48 0.56 6.14 -0.72 -4.95 117.35 121.11 1x4z s TYR 111 Ca 0.59 -1.77 -0.19 0.00 0.64 0.00 0.00 57.07 56.34 1x4z s TYR 111 Cb -0.36 -1.84 0.04 0.00 0.42 0.00 0.00 41.96 40.22 1x4z s TYR 111 CO 0.35 -0.80 0.61 0.08 0.64 0.00 0.00 175.55 176.43 1x4z s VAL 112 N 1.28 4.88 -0.39 3.14 1.01 -1.26 -3.08 120.40 125.98 1x4z s VAL 112 Ca 0.00 -0.30 -0.29 0.00 0.00 0.00 0.00 61.98 61.40 1x4z s VAL 112 Cb -0.15 -4.24 0.01 0.00 0.00 0.00 0.00 36.38 32.00 1x4z s VAL 112 CO -0.10 -0.70 1.32 -0.69 0.00 0.00 0.00 175.10 174.93 1x4z s VAL 113 N 2.64 4.04 -0.07 2.92 1.01 -1.26 -4.81 120.40 124.86 1x4z s VAL 113 Ca 0.17 1.11 0.05 0.00 0.00 0.00 0.00 61.98 63.31 1x4z s VAL 113 Cb -0.17 -4.27 -0.08 0.00 0.00 0.00 0.00 36.38 31.86 1x4z s VAL 113 CO 0.14 -0.71 0.01 -0.24 0.00 0.00 0.00 175.10 174.30 1x4z n SER 114 N 8.24 3.30 -2.47 3.32 2.88 -1.26 -0.76 113.62 126.87 1x4z n SER 114 Ca 0.15 -0.01 0.02 0.00 -1.33 0.00 0.00 58.87 57.71 1x4z n SER 114 Cb 0.48 0.54 0.00 0.00 -0.75 0.00 0.00 64.21 64.49 1x4z n SER 114 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x4z n GLY 115 N 2.65 0.25 3.98 0.46 0.00 -1.26 -4.89 105.19 106.38 1x4z n GLY 115 Ca -0.12 -0.90 -0.22 0.00 0.00 0.00 0.00 46.02 44.78 1x4z n GLY 115 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x4z s SER 116 N -2.45 4.95 0.00 1.61 1.04 -1.26 -4.46 113.70 113.14 1x4z s SER 116 Ca 0.16 -0.97 0.00 0.00 0.48 0.00 0.00 55.95 55.62 1x4z s SER 116 Cb -0.00 0.26 0.00 0.00 0.10 0.00 0.00 66.02 66.38 1x4z s SER 116 CO -0.01 -1.20 0.00 0.61 0.98 0.00 0.00 173.24 173.62 1x4z n GLY 117 N -2.02 6.06 3.63 7.32 0.00 -1.26 -4.96 105.19 113.95 1x4z n GLY 117 Ca 0.09 -1.61 -0.43 0.00 0.00 0.00 0.00 46.02 44.07 1x4z n GLY 117 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x4z s PRO 118 N 1.20 3.79 0.47 1.61 0.04 -1.26 -4.99 135.00 135.86 1x4z s PRO 118 Ca 0.00 1.65 -0.21 0.00 0.04 0.00 0.00 61.00 62.48 1x4z s PRO 118 Cb 0.00 -4.03 -0.08 0.00 0.04 0.00 0.00 34.50 30.42 1x4z s PRO 118 CO 0.00 -1.30 1.06 0.45 0.04 0.00 0.00 177.00 177.25 1x4z s SER 119 N 4.23 6.37 -0.25 6.66 0.15 -1.26 -5.04 113.70 124.56 1x4z s SER 119 Ca 0.71 2.01 -0.05 0.00 0.70 0.00 0.00 55.95 59.32 1x4z s SER 119 Cb -0.25 -2.57 -0.00 0.00 -1.71 0.00 0.00 66.02 61.49 1x4z s SER 119 CO 0.29 -0.77 0.01 -0.55 1.20 0.00 0.00 173.24 173.43 1x4z s SER 120 N -1.81 4.70 0.00 5.45 0.15 -1.26 -5.29 113.70 115.64 1x4z s SER 120 Ca 0.65 -0.53 0.00 0.00 0.70 0.00 0.00 55.95 56.78 1x4z s SER 120 Cb -0.19 -1.80 0.00 0.00 -1.71 0.00 0.00 66.02 62.31 1x4z s SER 120 CO 0.24 -0.09 0.00 0.61 1.20 0.00 0.00 173.24 175.20