#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4z s SER 2 N 0.00 2.62 0.25 1.61 0.01 -1.26 -5.11 113.70 111.83 1x4z s SER 2 Ca 0.00 -1.18 -0.31 0.00 1.31 0.00 0.00 55.95 55.77 1x4z s SER 2 Cb 0.00 -0.14 -0.13 0.00 0.21 0.00 0.00 66.02 65.96 1x4z s SER 2 CO 0.00 -0.35 1.43 -1.54 0.41 0.00 0.00 173.24 173.20 1x4z n SER 3 N -0.54 2.92 -4.50 2.44 3.41 -1.26 -4.93 113.62 111.16 1x4z n SER 3 Ca -0.06 1.14 -0.43 0.00 -0.26 0.00 0.00 58.87 59.27 1x4z n SER 3 Cb 0.63 -1.45 -0.06 0.00 -0.26 0.00 0.00 64.21 63.07 1x4z n SER 3 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1x4z s GLY 4 N 0.31 1.67 -0.25 5.00 0.00 -1.26 -4.87 107.32 107.92 1x4z s GLY 4 Ca 0.67 -1.37 -0.05 0.00 0.00 0.00 0.00 44.72 43.97 1x4z s GLY 4 CO 0.50 1.62 -0.27 -1.14 0.00 0.00 0.00 173.10 173.81 1x4z n SER 5 N 6.48 1.98 -0.31 1.64 3.41 -1.26 -4.63 113.62 120.93 1x4z n SER 5 Ca -0.02 0.08 -0.08 0.00 -0.26 0.00 0.00 58.87 58.59 1x4z n SER 5 Cb 0.47 -0.56 -0.07 0.00 -0.26 0.00 0.00 64.21 63.79 1x4z n SER 5 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1x4z n SER 6 N -3.65 -0.77 -4.68 4.04 2.88 -1.26 -4.12 113.62 106.05 1x4z n SER 6 Ca -0.46 1.49 -0.38 0.00 -1.33 0.00 0.00 58.87 58.19 1x4z n SER 6 Cb 0.91 -0.27 -0.07 0.00 -0.75 0.00 0.00 64.21 64.03 1x4z n SER 6 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1x4z s GLY 7 N -2.21 2.17 0.60 0.46 0.00 -1.26 -5.07 107.32 102.00 1x4z s GLY 7 Ca -0.09 -0.39 -0.07 0.00 0.00 0.00 0.00 44.72 44.17 1x4z s GLY 7 CO 0.45 0.87 0.92 -0.56 0.00 0.00 0.00 173.10 174.79 1x4z s SER 8 N 0.94 5.71 0.49 1.64 0.01 -1.26 -4.95 113.70 116.27 1x4z s SER 8 Ca 0.22 0.86 -0.19 0.00 1.31 0.00 0.00 55.95 58.15 1x4z s SER 8 Cb -0.15 -1.87 -0.08 0.00 0.21 0.00 0.00 66.02 64.13 1x4z s SER 8 CO 0.09 -1.03 1.01 0.00 0.41 0.00 0.00 173.24 173.73 1x4z s GLN 9 N -5.03 3.84 0.10 12.44 -2.07 -1.26 -5.06 119.66 122.63 1x4z s GLN 9 Ca 0.54 1.23 -0.02 0.00 -1.82 0.00 0.00 55.36 55.29 1x4z s GLN 9 Cb -0.11 -2.11 0.03 0.00 -1.09 0.00 0.00 33.01 29.73 1x4z s GLN 9 CO 0.47 -0.38 0.09 -0.35 -1.32 0.00 0.00 175.29 173.80 1x4z n PRO 10 N -1.14 -1.20 0.17 9.60 -0.04 -1.26 -5.00 135.00 136.13 1x4z n PRO 10 Ca 0.08 -0.15 -0.07 0.00 -0.04 0.00 0.00 63.50 63.32 1x4z n PRO 10 Cb 0.53 -0.14 -0.03 0.00 -0.04 0.00 0.00 33.50 33.82 1x4z n PRO 10 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1x4z h ASP 11 N -1.17 -0.39 -1.43 3.54 3.32 -2.01 -3.44 116.42 114.84 1x4z h ASP 11 Ca -0.03 0.01 -0.77 0.00 0.02 0.00 0.00 57.03 56.26 1x4z h ASP 11 Cb 0.11 0.10 0.01 0.00 0.22 0.00 0.00 39.33 39.77 1x4z h ASP 11 CO 0.02 -0.19 0.86 0.00 -1.72 0.00 0.00 179.24 178.22 1x4z n HIS 12 N -3.76 2.00 0.00 4.55 1.44 -1.26 -4.45 115.22 113.74 1x4z n HIS 12 Ca -0.06 0.66 0.00 0.00 -2.01 0.00 0.00 57.72 56.31 1x4z n HIS 12 Cb 0.18 -2.41 0.00 0.00 0.12 0.00 0.00 29.99 27.88 1x4z n HIS 12 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1x4z n GLY 13 N 4.17 0.08 3.56 -1.39 0.00 -1.26 -5.01 105.19 105.34 1x4z n GLY 13 Ca 0.27 -0.45 -0.25 0.00 0.00 0.00 0.00 46.02 45.59 1x4z n GLY 13 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x4z n ARG 14 N 0.00 1.12 -1.57 1.61 5.12 -1.26 -4.90 116.66 116.79 1x4z n ARG 14 Ca 0.00 -2.20 -0.14 0.00 -1.93 0.00 0.00 57.85 53.59 1x4z n ARG 14 Cb 0.00 -3.75 0.08 0.00 -1.16 0.00 0.00 32.46 27.63 1x4z n ARG 14 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 1x4z n LEU 15 N 15.74 0.00 -4.03 0.55 4.77 -1.26 -5.13 117.00 127.63 1x4z n LEU 15 Ca 0.44 -1.10 -0.08 0.00 -0.03 0.00 0.00 56.01 55.24 1x4z n LEU 15 Cb 0.46 -0.40 -0.09 0.00 -2.33 0.00 0.00 43.42 41.06 1x4z n LEU 15 CO 0.68 -0.83 -0.26 -0.94 -1.33 0.00 0.00 177.39 174.71 1x4z s SER 16 N -3.36 0.33 1.02 -1.43 1.04 -1.06 -5.11 113.70 105.12 1x4z s SER 16 Ca 0.38 -0.94 -0.13 0.00 0.48 0.00 0.00 55.95 55.74 1x4z s SER 16 Cb -0.02 0.27 0.20 0.00 0.10 0.00 0.00 66.02 66.57 1x4z s SER 16 CO 0.25 -0.68 1.09 -2.16 0.98 0.00 0.00 173.24 172.73 1x4z s PRO 17 N -3.93 0.29 0.68 4.02 0.04 -1.26 -4.04 135.00 130.80 1x4z s PRO 17 Ca 0.11 0.47 -0.14 0.00 0.04 0.00 0.00 61.00 61.47 1x4z s PRO 17 Cb 0.07 -1.73 0.01 0.00 0.04 0.00 0.00 34.50 32.89 1x4z s PRO 17 CO -0.07 -2.81 1.11 -1.25 0.04 0.00 0.00 177.00 174.01 1x4z s PRO 18 N -4.98 2.68 0.45 0.56 0.04 -1.21 -3.29 135.00 129.25 1x4z s PRO 18 Ca 0.66 1.34 0.08 0.00 0.04 0.00 0.00 61.00 63.12 1x4z s PRO 18 Cb -0.19 -1.94 0.02 0.00 0.04 0.00 0.00 34.50 32.44 1x4z s PRO 18 CO 0.58 -1.34 0.58 -1.83 0.04 0.00 0.00 177.00 175.02 1x4z s GLU 19 N -4.28 2.67 -0.02 4.56 -1.05 -0.99 -3.70 118.70 115.88 1x4z s GLU 19 Ca 0.66 -1.38 -0.30 0.00 -0.15 0.00 0.00 54.97 53.79 1x4z s GLU 19 Cb -0.20 -2.66 -0.06 0.00 -0.44 0.00 0.00 34.13 30.77 1x4z s GLU 19 CO 0.45 -0.38 1.68 0.00 0.95 0.00 0.00 175.26 177.96 1x4z s ALA 20 N -2.44 3.62 0.89 -0.84 0.00 -1.26 -4.49 121.76 117.25 1x4z s ALA 20 Ca 0.55 1.02 -0.11 0.00 0.00 0.00 0.00 51.96 53.41 1x4z s ALA 20 Cb -0.08 -3.74 0.13 0.00 0.00 0.00 0.00 23.12 19.42 1x4z s ALA 20 CO 0.33 -1.35 1.09 -1.25 0.00 0.00 0.00 175.76 174.58 1x4z s PRO 21 N 3.79 1.29 1.06 0.00 0.04 -1.26 -4.74 135.00 135.17 1x4z s PRO 21 Ca 0.75 0.83 -0.17 0.00 0.04 0.00 0.00 61.00 62.45 1x4z s PRO 21 Cb -0.35 -1.81 0.11 0.00 0.04 0.00 0.00 34.50 32.48 1x4z s PRO 21 CO 0.31 -2.22 -0.01 -3.47 0.04 0.00 0.00 177.00 171.65 1x4z n ASP 22 N -3.87 -2.74 -4.68 6.66 2.03 0.58 -4.47 116.55 110.06 1x4z n ASP 22 Ca 0.07 -0.24 -0.43 0.00 0.52 0.00 0.00 54.79 54.71 1x4z n ASP 22 Cb 0.55 -0.82 -0.02 0.00 -0.72 0.00 0.00 41.12 40.11 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 -3.31 4.39 0.44 -0.67 3.52 -1.26 -4.49 118.95 117.56 1x4z s ARG 23 Ca 0.45 1.39 -0.24 0.00 -0.13 0.00 0.00 55.73 57.20 1x4z s ARG 23 Cb -0.07 -3.56 -0.08 0.00 -1.56 0.00 0.00 34.95 29.68 1x4z s ARG 23 CO 0.51 -0.38 1.17 -1.25 -0.81 0.00 0.00 175.30 174.54 1x4z s PRO 24 N 2.26 3.87 0.41 5.12 0.04 -1.26 -4.73 135.00 140.71 1x4z s PRO 24 Ca 0.48 1.82 0.05 0.00 0.04 0.00 0.00 61.00 63.38 1x4z s PRO 24 Cb -0.18 -2.52 0.00 0.00 0.04 0.00 0.00 34.50 31.85 1x4z s PRO 24 CO 0.16 -0.47 0.59 -0.08 0.04 0.00 0.00 177.00 177.23 1x4z s THR 25 N -1.48 3.60 -0.08 1.26 -1.32 0.16 -4.55 115.64 113.22 1x4z s THR 25 Ca 0.61 -0.83 0.03 0.00 -1.21 0.00 0.00 61.69 60.29 1x4z s THR 25 Cb -0.30 -3.27 0.01 0.00 -1.51 0.00 0.00 72.50 67.43 1x4z s THR 25 CO 0.37 -0.14 -0.18 -0.63 -2.21 0.00 0.00 174.62 171.83 1x4z s ILE 26 N -2.39 1.56 0.31 5.08 -1.09 -1.26 -3.06 121.20 120.35 1x4z s ILE 26 Ca 0.50 -0.73 0.03 0.00 -2.23 0.00 0.00 60.65 58.21 1x4z s ILE 26 Cb -0.10 -1.38 -0.04 0.00 -1.58 0.00 0.00 42.46 39.36 1x4z s ILE 26 CO 0.34 0.45 0.12 -0.44 -1.23 0.00 0.00 174.94 174.18 1x4z s SER 27 N 0.47 1.80 -0.52 3.58 0.01 0.20 -4.97 113.70 114.27 1x4z s SER 27 Ca -0.16 -1.49 -0.21 0.00 1.31 0.00 0.00 55.95 55.41 1x4z s SER 27 Cb -0.16 0.25 0.05 0.00 0.21 0.00 0.00 66.02 66.36 1x4z s SER 27 CO 0.06 -0.79 0.74 -0.89 0.41 0.00 0.00 173.24 172.77 1x4z s THR 28 N -3.53 4.70 -0.14 1.44 2.01 -1.26 -2.38 115.64 116.47 1x4z s THR 28 Ca 0.34 -0.22 0.03 0.00 0.31 0.00 0.00 61.69 62.16 1x4z s THR 28 Cb 0.06 -4.39 -0.10 0.00 0.01 0.00 0.00 72.50 68.08 1x4z s THR 28 CO 0.15 -0.92 -0.10 0.00 -0.69 0.00 0.00 174.62 173.06 1x4z n ALA 29 N 6.64 1.69 -3.56 7.40 0.00 -1.25 -4.77 120.51 126.66 1x4z n ALA 29 Ca -0.04 -0.66 0.02 0.00 0.00 0.00 0.00 53.44 52.76 1x4z n ALA 29 Cb 0.46 0.13 0.02 0.00 0.00 0.00 0.00 19.45 20.06 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 -2.84 -1.41 0.11 0.00 7.64 -0.49 -4.94 113.62 111.68 1x4z n SER 30 Ca -0.25 -1.91 0.12 0.00 1.01 0.00 0.00 58.87 57.84 1x4z n SER 30 Cb 0.80 2.34 0.21 0.00 -1.01 0.00 0.00 64.21 66.54 1x4z n SER 30 CO 0.00 0.00 0.00 1.05 -3.01 0.00 0.00 175.04 173.08 1x4z h GLU 31 N 0.00 0.00 0.00 1.43 4.11 -1.84 -3.32 114.58 114.96 1x4z h GLU 31 Ca -0.21 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.22 1x4z h GLU 31 Cb 0.82 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.07 1x4z h GLU 31 CO 0.27 0.00 0.00 0.25 0.07 0.00 0.00 179.01 179.60 1x4z n THR 32 N -2.45 0.09 -4.01 -1.06 -2.24 -1.26 -4.09 114.28 99.26 1x4z n THR 32 Ca 0.03 -0.49 -0.09 0.00 -2.27 0.00 0.00 64.05 61.23 1x4z n THR 32 Cb 0.47 1.05 -0.08 0.00 -2.10 0.00 0.00 70.33 69.68 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 -0.09 0.14 -0.02 3.42 1.04 -1.25 -1.80 113.70 115.14 1x4z s SER 33 Ca 0.00 -0.95 -0.06 0.00 0.48 0.00 0.00 55.95 55.42 1x4z s SER 33 Cb 0.00 0.38 0.01 0.00 0.10 0.00 0.00 66.02 66.51 1x4z s SER 33 CO 0.00 -0.82 0.13 0.68 0.98 0.00 0.00 173.24 174.21 1x4z s VAL 34 N -3.98 0.05 -0.23 5.02 -7.23 -1.01 -1.40 120.40 111.62 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 0.05 -0.32 0.00 0.00 0.56 0.00 0.00 36.38 36.67 1x4z s VAL 34 CO -0.01 -0.21 1.13 -0.31 -0.31 0.00 0.00 175.10 175.39 1x4z s TYR 35 N -0.71 3.13 -0.12 2.82 2.02 -1.00 -1.40 117.35 122.08 1x4z s TYR 35 Ca -0.08 1.26 0.00 0.00 -0.37 0.00 0.00 57.07 57.89 1x4z s TYR 35 Cb -0.05 -3.43 -0.02 0.00 -0.40 0.00 0.00 41.96 38.07 1x4z s TYR 35 CO 0.01 -0.95 -0.13 0.08 -1.57 0.00 0.00 175.55 172.99 1x4z s VAL 36 N 3.41 3.10 -0.10 0.71 1.01 0.26 -0.63 120.40 128.17 1x4z s VAL 36 Ca 0.48 -0.66 0.01 0.00 0.00 0.00 0.00 61.98 61.81 1x4z s VAL 36 Cb -0.17 -2.29 0.02 0.00 0.00 0.00 0.00 36.38 33.94 1x4z s VAL 36 CO 0.11 0.54 -0.10 -0.89 0.00 0.00 0.00 175.10 174.75 1x4z s THR 37 N 0.15 1.11 0.37 3.92 2.01 -1.17 -0.87 115.64 121.16 1x4z s THR 37 Ca -0.07 -0.39 0.06 0.00 0.31 0.00 0.00 61.69 61.61 1x4z s THR 37 Cb -0.15 -1.08 -0.07 0.00 0.01 0.00 0.00 72.50 71.21 1x4z s THR 37 CO 0.05 0.37 0.01 -1.66 -0.69 0.00 0.00 174.62 172.70 1x4z s TRP 38 N 1.32 2.29 -0.21 4.92 -2.14 0.07 -0.67 118.94 124.52 1x4z s TRP 38 Ca -0.02 -0.75 -0.03 0.00 2.66 0.00 0.00 56.10 57.96 1x4z s TRP 38 Cb -0.14 -1.54 0.07 0.00 -3.10 0.00 0.00 33.47 28.76 1x4z s TRP 38 CO -0.04 0.31 0.05 0.42 -2.66 0.00 0.00 176.95 175.02 1x4z s ILE 39 N -2.91 0.52 0.32 0.66 -1.09 -1.26 -4.72 121.20 112.72 1x4z s ILE 39 Ca 0.35 -0.65 -0.29 0.00 -2.23 0.00 0.00 60.65 57.83 1x4z s ILE 39 Cb 0.09 -1.09 -0.10 0.00 -1.58 0.00 0.00 42.46 39.78 1x4z s ILE 39 CO 0.17 -0.28 1.22 -2.16 -1.23 0.00 0.00 174.94 172.66 1x4z s PRO 40 N 1.85 4.43 -0.00 2.79 0.04 -1.26 -0.31 135.00 142.54 1x4z s PRO 40 Ca 0.01 2.04 -0.00 0.00 0.04 0.00 0.00 61.00 63.09 1x4z s PRO 40 Cb -0.17 -3.08 -0.00 0.00 0.04 0.00 0.00 34.50 31.29 1x4z s PRO 40 CO -0.11 -0.05 -0.00 0.54 0.04 0.00 0.00 177.00 177.41 1x4z n ARG 41 N 0.88 0.00 -4.32 4.56 5.12 -1.26 -4.87 116.66 116.77 1x4z n ARG 41 Ca -0.00 0.00 -0.34 0.00 -1.93 0.00 0.00 57.85 55.58 1x4z n ARG 41 Cb 0.43 -0.32 -0.09 0.00 -1.16 0.00 0.00 32.46 31.32 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 -3.02 1.87 0.00 -0.13 0.00 -1.26 -5.00 107.32 99.78 1x4z s GLY 42 Ca -0.00 -0.88 0.09 0.00 0.00 0.00 0.00 44.72 43.93 1x4z s GLY 42 CO 0.00 -0.70 1.12 1.16 0.00 0.00 0.00 173.10 174.68 1x4z n ASN 43 N 1.73 2.54 0.00 1.64 0.23 -1.26 -2.36 115.26 117.78 1x4z n ASN 43 Ca -0.16 -1.87 0.00 0.00 -0.53 0.00 0.00 54.58 52.02 1x4z n ASN 43 Cb 0.53 -0.15 0.00 0.00 -2.08 0.00 0.00 39.78 38.08 1x4z n ASN 43 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1x4z n GLY 44 N 0.37 1.20 0.00 4.83 0.00 -1.21 -3.34 105.19 107.04 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 -2.00 1.96 3.78 -0.02 0.00 -1.26 -2.57 105.19 105.09 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 -1.99 2.93 -0.17 1.61 0.08 -1.22 -5.07 117.98 114.15 1x4z s PHE 46 Ca 0.00 -0.21 -0.29 0.00 0.12 0.00 0.00 56.93 56.54 1x4z s PHE 46 Cb 0.00 -1.49 -0.03 0.00 -0.57 0.00 0.00 43.02 40.93 1x4z s PHE 46 CO 0.00 0.43 1.57 -1.25 -0.10 0.00 0.00 175.22 175.87 1x4z s PRO 47 N -3.85 3.97 0.15 0.24 0.04 -1.26 -4.67 135.00 129.62 1x4z s PRO 47 Ca 0.35 1.80 -0.33 0.00 0.04 0.00 0.00 61.00 62.86 1x4z s PRO 47 Cb -0.06 -3.98 -0.17 0.00 0.04 0.00 0.00 34.50 30.33 1x4z s PRO 47 CO 0.24 -1.08 1.00 -0.89 0.04 0.00 0.00 177.00 176.30 1x4z n ILE 48 N 6.00 1.04 -0.08 0.56 5.41 -1.26 -4.75 119.36 126.28 1x4z n ILE 48 Ca 0.18 -0.26 -0.22 0.00 1.00 0.00 0.00 62.75 63.44 1x4z n ILE 48 Cb 0.44 -0.51 -0.12 0.00 -0.71 0.00 0.00 39.64 38.74 1x4z n ILE 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1x4z n GLN 49 N 1.47 0.64 -3.47 0.38 6.02 -0.60 -4.72 117.38 117.10 1x4z n GLN 49 Ca 0.16 0.41 -0.11 0.00 -0.01 0.00 0.00 57.00 57.45 1x4z n GLN 49 Cb 0.22 -1.69 -0.03 0.00 1.02 0.00 0.00 30.24 29.77 1x4z n GLN 49 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1x4z s SER 50 N -6.98 -0.49 0.42 1.08 0.01 -0.78 -4.67 113.70 102.29 1x4z s SER 50 Ca -0.28 0.11 0.08 0.00 1.31 0.00 0.00 55.95 57.16 1x4z s SER 50 Cb 0.07 0.49 -0.03 0.00 0.21 0.00 0.00 66.02 66.77 1x4z s SER 50 CO 0.64 -0.76 0.33 -0.36 0.41 0.00 0.00 173.24 173.50 1x4z s PHE 51 N -3.06 2.67 -0.09 2.43 0.08 -1.04 -0.74 117.98 118.22 1x4z s PHE 51 Ca 0.01 -0.52 -0.04 0.00 0.12 0.00 0.00 56.93 56.50 1x4z s PHE 51 Cb -0.01 -2.12 0.05 0.00 -0.57 0.00 0.00 43.02 40.37 1x4z s PHE 51 CO -0.08 -0.05 0.18 1.03 -0.10 0.00 0.00 175.22 176.20 1x4z s ARG 52 N -4.08 0.06 -0.15 0.44 0.52 0.51 -2.72 118.95 113.53 1x4z s ARG 52 Ca 0.46 0.59 -0.06 0.00 -0.52 0.00 0.00 55.73 56.20 1x4z s ARG 52 Cb -0.01 -0.21 -0.04 0.00 0.52 0.00 0.00 34.95 35.21 1x4z s ARG 52 CO 0.26 -0.29 0.06 0.08 0.02 0.00 0.00 175.30 175.44 1x4z s VAL 53 N 2.24 4.82 0.17 3.52 1.01 -0.89 -0.23 120.40 131.05 1x4z s VAL 53 Ca 0.02 -0.03 0.05 0.00 0.00 0.00 0.00 61.98 62.01 1x4z s VAL 53 Cb -0.12 -3.14 -0.05 0.00 0.00 0.00 0.00 36.38 33.08 1x4z s VAL 53 CO -0.06 0.51 -0.09 -1.61 0.00 0.00 0.00 175.10 173.85 1x4z s GLU 54 N -0.09 1.15 -0.01 2.72 2.02 -1.19 -0.40 118.70 122.90 1x4z s GLU 54 Ca 0.07 -1.51 -0.03 0.00 0.02 0.00 0.00 54.97 53.52 1x4z s GLU 54 Cb -0.12 -0.70 0.00 0.00 0.10 0.00 0.00 34.13 33.41 1x4z s GLU 54 CO 0.01 0.06 0.06 1.52 0.02 0.00 0.00 175.26 176.93 1x4z s TYR 55 N -3.28 0.00 -0.09 1.61 -0.85 0.21 -0.99 117.35 113.95 1x4z s TYR 55 Ca 0.20 0.01 0.03 0.00 -0.52 0.00 0.00 57.07 56.80 1x4z s TYR 55 Cb 0.03 -0.02 -0.01 0.00 0.38 0.00 0.00 41.96 42.33 1x4z s TYR 55 CO 0.03 -0.10 -0.20 0.21 -1.52 0.00 0.00 175.55 173.98 1x4z s LYS 56 N -0.42 2.89 -0.11 -3.49 2.20 -1.19 0.26 119.74 119.86 1x4z s LYS 56 Ca -0.05 -0.80 -0.30 0.00 -0.36 0.00 0.00 55.97 54.46 1x4z s LYS 56 Cb -0.03 -2.36 -0.01 0.00 -1.51 0.00 0.00 37.83 33.92 1x4z s LYS 56 CO 0.00 0.33 1.05 0.15 -0.36 0.00 0.00 175.35 176.52 1x4z s LYS 57 N -0.01 4.38 -0.11 4.03 1.02 -1.26 -2.58 119.74 125.22 1x4z s LYS 57 Ca -0.06 1.44 -0.04 0.00 0.02 0.00 0.00 55.97 57.32 1x4z s LYS 57 Cb -0.15 -3.56 -0.01 0.00 -0.52 0.00 0.00 37.83 33.58 1x4z s LYS 57 CO 0.05 -0.39 -0.09 -0.07 -0.92 0.00 0.00 175.35 173.93 1x4z h LEU 58 N 8.28 0.00 -0.52 3.17 3.38 -1.41 -3.39 115.31 124.81 1x4z h LEU 58 Ca -0.30 0.00 0.08 0.00 0.09 0.00 0.00 57.88 57.76 1x4z h LEU 58 Cb 1.14 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.82 1x4z h LEU 58 CO 0.88 0.58 0.14 0.50 0.09 0.00 0.00 178.44 180.63 1x4z h LYS 59 N -0.91 0.28 -6.58 1.13 1.63 -1.93 -3.42 116.57 106.77 1x4z h LYS 59 Ca 0.00 -0.02 -0.50 0.00 -0.85 0.00 0.00 60.65 59.28 1x4z h LYS 59 Cb 0.25 -0.06 0.00 0.00 -0.60 0.00 0.00 32.23 31.82 1x4z h LYS 59 CO 0.00 0.19 -0.11 0.21 -3.45 0.00 0.00 179.45 176.29 1x4z s LYS 60 N -6.13 3.57 -0.33 1.90 2.20 -1.26 -5.06 119.74 114.63 1x4z s LYS 60 Ca -0.13 -0.06 -0.18 0.00 -0.36 0.00 0.00 55.97 55.24 1x4z s LYS 60 Cb 0.16 -2.60 -0.01 0.00 -1.51 0.00 0.00 37.83 33.87 1x4z s LYS 60 CO 0.73 0.12 0.51 0.54 -0.36 0.00 0.00 175.35 176.89 1x4z s VAL 61 N -2.28 5.03 0.00 4.02 0.11 -1.26 -4.66 120.40 121.36 1x4z s VAL 61 Ca 0.43 0.46 0.00 0.00 -2.93 0.00 0.00 61.98 59.95 1x4z s VAL 61 Cb -0.10 -3.93 0.00 0.00 -1.53 0.00 0.00 36.38 30.82 1x4z s VAL 61 CO 0.34 -0.14 0.00 0.61 -3.33 0.00 0.00 175.10 172.58 1x4z n GLY 62 N 4.71 1.09 3.10 6.54 0.00 -1.26 -5.08 105.19 114.29 1x4z n GLY 62 Ca -0.05 0.30 -0.23 0.00 0.00 0.00 0.00 46.02 46.04 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 -3.06 -4.73 1.61 8.00 -1.26 -4.11 116.55 113.00 1x4z n ASP 63 Ca 0.00 -0.42 -0.36 0.00 0.71 0.00 0.00 54.79 54.72 1x4z n ASP 63 Cb 0.00 -0.85 0.08 0.00 -0.02 0.00 0.00 41.12 40.33 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 -2.11 2.07 0.19 1.24 0.52 -1.26 -4.57 118.94 115.01 1x4z s TRP 64 Ca 0.45 1.53 0.10 0.00 0.02 0.00 0.00 56.10 58.20 1x4z s TRP 64 Cb -0.08 -3.61 -0.04 0.00 -1.15 0.00 0.00 33.47 28.58 1x4z s TRP 64 CO 0.44 -2.79 -0.19 0.42 0.02 0.00 0.00 176.95 174.84 1x4z s ILE 65 N -1.61 2.02 -0.24 2.03 -1.09 0.14 -4.93 121.20 117.51 1x4z s ILE 65 Ca 0.79 -2.04 -0.20 0.00 -2.23 0.00 0.00 60.65 56.97 1x4z s ILE 65 Cb -0.34 -1.99 -0.02 0.00 -1.58 0.00 0.00 42.46 38.53 1x4z s ILE 65 CO 0.41 -0.31 0.63 -0.22 -1.23 0.00 0.00 174.94 174.22 1x4z s LEU 66 N -2.85 4.08 -0.14 2.97 2.96 -1.26 -0.62 118.68 123.82 1x4z s LEU 66 Ca 0.19 0.74 -0.10 0.00 -0.22 0.00 0.00 54.13 54.75 1x4z s LEU 66 Cb -0.06 -2.87 -0.04 0.00 0.50 0.00 0.00 46.19 43.73 1x4z s LEU 66 CO 0.08 -0.34 -0.15 0.00 -1.32 0.00 0.00 176.35 174.62 1x4z h ALA 67 N 7.78 0.02 -2.84 5.97 0.00 -1.06 -3.48 119.26 125.64 1x4z h ALA 67 Ca -0.28 -0.54 -0.21 0.00 0.00 0.00 0.00 54.91 53.88 1x4z h ALA 67 Cb 1.13 0.51 -0.10 0.00 0.00 0.00 0.00 17.79 19.33 1x4z h ALA 67 CO 0.77 0.51 -0.25 -0.08 0.00 0.00 0.00 179.25 180.21 1x4z s THR 68 N -2.23 0.00 0.17 0.00 -1.32 -1.10 -4.94 115.64 106.22 1x4z s THR 68 Ca -0.15 -1.62 -0.23 0.00 -1.21 0.00 0.00 61.69 58.48 1x4z s THR 68 Cb 0.02 -2.48 0.08 0.00 -1.51 0.00 0.00 72.50 68.61 1x4z s THR 68 CO 0.24 0.00 1.03 -0.55 -2.21 0.00 0.00 174.62 173.13 1x4z s SER 69 N -3.16 -0.03 -1.06 8.08 0.15 -1.26 -2.10 113.70 114.32 1x4z s SER 69 Ca 0.30 -0.61 0.00 0.00 0.70 0.00 0.00 55.95 56.34 1x4z s SER 69 Cb 0.01 0.49 0.00 0.00 -1.71 0.00 0.00 66.02 64.81 1x4z s SER 69 CO 0.16 -0.96 0.00 0.00 1.20 0.00 0.00 173.24 173.64 1x4z n ALA 70 N -0.66 -0.26 -1.86 5.45 0.00 -1.10 -4.96 120.51 117.11 1x4z n ALA 70 Ca -0.04 0.13 -0.40 0.00 0.00 0.00 0.00 53.44 53.13 1x4z n ALA 70 Cb 0.60 -1.38 -0.05 0.00 0.00 0.00 0.00 19.45 18.62 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 -2.50 3.97 0.71 0.00 1.01 -1.25 -4.85 121.20 118.30 1x4z s ILE 71 Ca 0.00 1.90 -0.13 0.00 0.00 0.00 0.00 60.65 62.41 1x4z s ILE 71 Cb 0.00 -4.21 0.02 0.00 0.01 0.00 0.00 42.46 38.29 1x4z s ILE 71 CO 0.00 0.41 1.10 -2.16 0.00 0.00 0.00 174.94 174.30 1x4z s PRO 72 N -0.97 2.57 0.49 2.79 0.04 -1.26 -2.51 135.00 136.15 1x4z s PRO 72 Ca 0.44 1.30 0.28 0.00 0.04 0.00 0.00 61.00 63.05 1x4z s PRO 72 Cb -0.27 -1.93 1.17 0.00 0.04 0.00 0.00 34.50 33.51 1x4z s PRO 72 CO 0.34 -1.41 1.93 -1.00 0.04 0.00 0.00 177.00 176.89 1x4z h PRO 73 N -0.45 0.00 -0.00 0.56 0.13 -1.84 -2.46 132.00 127.94 1x4z h PRO 73 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 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 0.14 -0.12 0.43 -0.23 0.00 0.00 178.00 178.75 1x4z n SER 74 N -3.34 0.15 -4.22 1.44 7.64 -1.26 -4.60 113.62 109.42 1x4z n SER 74 Ca -0.00 0.18 -0.40 0.00 1.01 0.00 0.00 58.87 59.66 1x4z n SER 74 Cb 0.35 -0.28 -0.09 0.00 -1.01 0.00 0.00 64.21 63.18 1x4z n SER 74 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 1x4z s ARG 75 N -2.91 2.48 -0.06 1.43 3.52 -0.93 -4.90 118.95 117.58 1x4z s ARG 75 Ca 0.16 -1.64 0.21 0.00 -0.13 0.00 0.00 55.73 54.33 1x4z s ARG 75 Cb 0.19 -3.82 0.70 0.00 -1.56 0.00 0.00 34.95 30.46 1x4z s ARG 75 CO 0.55 -1.08 1.60 1.28 -0.81 0.00 0.00 175.30 176.85 1x4z n LEU 76 N 4.88 4.43 -3.69 -0.88 4.77 -1.26 -4.70 117.00 120.55 1x4z n LEU 76 Ca -0.08 -2.23 -0.10 0.00 -0.03 0.00 0.00 56.01 53.57 1x4z n LEU 76 Cb 0.42 -0.55 -0.10 0.00 -2.33 0.00 0.00 43.42 40.86 1x4z n LEU 76 CO 0.40 0.90 0.12 -0.55 -1.33 0.00 0.00 177.39 176.94 1x4z s SER 77 N -0.94 -0.59 0.12 -1.43 0.15 -1.26 -0.75 113.70 108.99 1x4z s SER 77 Ca 0.51 1.02 -0.07 0.00 0.70 0.00 0.00 55.95 58.10 1x4z s SER 77 Cb 0.30 0.92 -0.01 0.00 -1.71 0.00 0.00 66.02 65.51 1x4z s SER 77 CO 0.29 -0.20 0.19 0.68 1.20 0.00 0.00 173.24 175.40 1x4z s VAL 78 N 1.25 0.12 -0.40 4.45 -7.23 -0.05 -4.97 120.40 113.58 1x4z s VAL 78 Ca -0.08 -1.38 -0.16 0.00 -1.81 0.00 0.00 61.98 58.56 1x4z s VAL 78 Cb -0.07 -1.60 0.01 0.00 0.56 0.00 0.00 36.38 35.29 1x4z s VAL 78 CO -0.12 -0.54 0.36 -0.70 -0.31 0.00 0.00 175.10 173.79 1x4z s GLU 79 N -3.92 3.18 -0.67 4.82 2.12 -1.26 -0.58 118.70 122.38 1x4z s GLU 79 Ca 0.11 -0.78 -0.27 0.00 0.36 0.00 0.00 54.97 54.40 1x4z s GLU 79 Cb 0.05 -3.93 0.04 0.00 0.26 0.00 0.00 34.13 30.55 1x4z s GLU 79 CO -0.06 -0.72 1.20 0.42 -0.54 0.00 0.00 175.26 175.56 1x4z s ILE 80 N 1.92 3.91 0.44 -3.70 -1.09 -0.50 -4.85 121.20 117.34 1x4z s ILE 80 Ca 0.09 0.45 0.05 0.00 -2.23 0.00 0.00 60.65 59.02 1x4z s ILE 80 Cb -0.18 -4.82 0.01 0.00 -1.58 0.00 0.00 42.46 35.90 1x4z s ILE 80 CO 0.12 -1.62 0.62 0.42 -1.23 0.00 0.00 174.94 173.24 1x4z s THR 81 N 5.22 3.16 0.00 2.92 -4.23 -1.26 -2.42 115.64 119.03 1x4z s THR 81 Ca 0.35 -0.87 0.00 0.00 -1.18 0.00 0.00 61.69 59.99 1x4z s THR 81 Cb -0.09 -3.10 0.00 0.00 1.34 0.00 0.00 72.50 70.65 1x4z s THR 81 CO 0.18 -0.05 0.00 0.61 -0.54 0.00 0.00 174.62 174.82 1x4z n GLY 82 N -1.97 0.96 3.99 3.99 0.00 -1.08 -4.96 105.19 106.12 1x4z n GLY 82 Ca 0.06 -0.57 -0.18 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 -0.84 3.55 -0.17 0.99 1.43 -0.75 -5.08 118.68 117.82 1x4z s LEU 83 Ca 0.00 -0.53 -0.02 0.00 -1.03 0.00 0.00 54.13 52.55 1x4z s LEU 83 Cb 0.00 -2.45 -0.01 0.00 0.03 0.00 0.00 46.19 43.76 1x4z s LEU 83 CO 0.00 -0.80 -0.08 -1.61 0.23 0.00 0.00 176.35 174.09 1x4z s GLU 84 N -4.34 3.44 0.60 1.70 2.02 -1.26 -4.91 118.70 115.94 1x4z s GLU 84 Ca 0.54 -0.63 -0.17 0.00 0.02 0.00 0.00 54.97 54.72 1x4z s GLU 84 Cb -0.08 -2.81 -0.03 0.00 0.10 0.00 0.00 34.13 31.30 1x4z s GLU 84 CO 0.32 0.08 1.14 0.15 0.02 0.00 0.00 175.26 176.97 1x4z s LYS 85 N 0.74 3.04 -0.30 1.61 1.02 -1.26 -2.93 119.74 121.66 1x4z s LYS 85 Ca -0.04 1.57 0.00 0.00 0.02 0.00 0.00 55.97 57.52 1x4z s LYS 85 Cb -0.15 -1.97 0.00 0.00 -0.52 0.00 0.00 37.83 35.19 1x4z s LYS 85 CO 0.02 -1.09 0.00 0.41 -0.92 0.00 0.00 175.35 173.77 1x4z n GLY 86 N -0.03 0.46 2.96 -3.33 0.00 -0.02 -4.96 105.19 100.27 1x4z n GLY 86 Ca 0.11 -0.10 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.64 1.95 0.20 -0.61 -1.09 -1.15 -5.02 121.20 113.84 1x4z s ILE 87 Ca 0.00 -2.06 -0.30 0.00 -2.23 0.00 0.00 60.65 56.06 1x4z s ILE 87 Cb 0.00 -2.41 -0.09 0.00 -1.58 0.00 0.00 42.46 38.37 1x4z s ILE 87 CO 0.00 -0.56 1.40 -0.44 -1.23 0.00 0.00 174.94 174.11 1x4z s SER 88 N 1.08 6.76 0.19 3.58 0.01 -1.26 -4.48 113.70 119.58 1x4z s SER 88 Ca 0.09 2.51 -0.19 0.00 1.31 0.00 0.00 55.95 59.67 1x4z s SER 88 Cb -0.19 -2.61 0.03 0.00 0.21 0.00 0.00 66.02 63.47 1x4z s SER 88 CO -0.11 -0.65 0.54 -0.72 0.41 0.00 0.00 173.24 172.72 1x4z s TYR 89 N 0.36 -0.19 0.54 2.43 -0.85 -1.21 -0.96 117.35 117.46 1x4z s TYR 89 Ca 0.60 -0.14 0.05 0.00 -0.52 0.00 0.00 57.07 57.07 1x4z s TYR 89 Cb -0.39 0.44 0.03 0.00 0.38 0.00 0.00 41.96 42.41 1x4z s TYR 89 CO 0.38 -0.92 0.35 0.15 -1.52 0.00 0.00 175.55 173.99 1x4z s LYS 90 N -3.85 2.25 0.07 -3.49 1.02 -1.06 -1.94 119.74 112.73 1x4z s LYS 90 Ca 0.08 -2.07 0.02 0.00 0.02 0.00 0.00 55.97 54.02 1x4z s LYS 90 Cb -0.01 -2.02 -0.03 0.00 -0.52 0.00 0.00 37.83 35.24 1x4z s LYS 90 CO -0.04 -0.58 -0.08 -0.06 -0.92 0.00 0.00 175.35 173.67 1x4z s PHE 91 N -2.78 0.83 0.34 3.18 0.40 -1.26 -3.20 117.98 115.49 1x4z s PHE 91 Ca 0.30 -0.70 0.02 0.00 -0.60 0.00 0.00 56.93 55.95 1x4z s PHE 91 Cb -0.02 -0.48 -0.01 0.00 0.51 0.00 0.00 43.02 43.02 1x4z s PHE 91 CO 0.19 -0.10 0.40 -0.98 0.70 0.00 0.00 175.22 175.42 1x4z s ARG 92 N -2.73 1.87 -0.06 0.44 1.70 -0.16 -2.46 118.95 117.55 1x4z s ARG 92 Ca 0.02 -1.89 -0.07 0.00 -0.47 0.00 0.00 55.73 53.32 1x4z s ARG 92 Cb -0.02 0.39 0.02 0.00 -0.57 0.00 0.00 34.95 34.77 1x4z s ARG 92 CO -0.02 -0.74 0.19 0.08 -1.08 0.00 0.00 175.30 173.73 1x4z s VAL 93 N -3.18 0.02 -0.02 4.99 1.01 -1.26 -3.15 120.40 118.82 1x4z s VAL 93 Ca 0.35 -0.13 0.02 0.00 0.00 0.00 0.00 61.98 62.23 1x4z s VAL 93 Cb 0.01 -0.31 0.00 0.00 0.00 0.00 0.00 36.38 36.08 1x4z s VAL 93 CO 0.24 -0.07 -0.08 -0.13 0.00 0.00 0.00 175.10 175.06 1x4z s ARG 94 N -0.18 0.79 -0.18 2.72 0.52 0.69 -2.91 118.95 120.40 1x4z s ARG 94 Ca -0.03 -0.27 -0.12 0.00 -0.52 0.00 0.00 55.73 54.79 1x4z s ARG 94 Cb -0.02 -0.76 -0.05 0.00 0.52 0.00 0.00 34.95 34.64 1x4z s ARG 94 CO 0.01 0.12 0.20 0.00 0.02 0.00 0.00 175.30 175.65 1x4z s ALA 95 N 0.09 3.65 -0.16 2.13 0.00 -1.26 -0.37 121.76 125.84 1x4z s ALA 95 Ca -0.01 -0.58 0.01 0.00 0.00 0.00 0.00 51.96 51.37 1x4z s ALA 95 Cb -0.07 -2.26 0.02 0.00 0.00 0.00 0.00 23.12 20.81 1x4z s ALA 95 CO 0.00 0.14 -0.16 -0.51 0.00 0.00 0.00 175.76 175.24 1x4z s LEU 96 N 0.36 1.86 0.00 0.00 1.02 0.08 0.15 118.68 122.14 1x4z s LEU 96 Ca 0.12 -0.57 0.01 0.00 0.02 0.00 0.00 54.13 53.71 1x4z s LEU 96 Cb -0.12 -1.27 -0.00 0.00 0.02 0.00 0.00 46.19 44.81 1x4z s LEU 96 CO 0.01 -0.05 0.02 -0.46 0.02 0.00 0.00 176.35 175.90 1x4z n ASN 97 N 4.72 2.12 0.00 2.29 6.94 0.58 -1.55 115.26 130.37 1x4z n ASN 97 Ca -0.18 -2.03 0.06 0.00 -0.02 0.00 0.00 54.58 52.41 1x4z n ASN 97 Cb 0.50 0.27 0.32 0.00 -2.36 0.00 0.00 39.78 38.51 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 -0.54 0.27 -0.04 -3.83 0.00 -1.26 -1.71 117.12 110.02 1x4z n MET 98 Ca -0.07 0.08 0.00 0.00 0.00 0.00 0.00 57.70 57.71 1x4z n MET 98 Cb 0.29 -1.50 -0.13 0.00 0.00 0.00 0.00 33.22 31.89 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 -1.13 0.00 0.00 3.17 4.77 -1.26 -5.11 117.00 117.44 1x4z n LEU 99 Ca 0.07 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 1x4z n LEU 99 Cb 0.06 0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 1x4z n LEU 99 CO 0.07 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 176.93 1x4z n GLY 100 N 1.80 0.25 3.95 -0.72 0.00 -0.69 -4.71 105.19 105.07 1x4z n GLY 100 Ca -0.14 -1.68 -0.24 0.00 0.00 0.00 0.00 46.02 43.96 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 3.47 0.63 1.61 -1.05 -1.26 -0.30 118.70 119.80 1x4z s GLU 101 Ca 0.00 -0.52 0.02 0.00 -0.15 0.00 0.00 54.97 54.31 1x4z s GLU 101 Cb 0.00 -2.81 0.09 0.00 -0.44 0.00 0.00 34.13 30.97 1x4z s GLU 101 CO 0.00 0.34 0.88 -1.54 0.95 0.00 0.00 175.26 175.89 1x4z s SER 102 N -3.77 4.81 0.71 0.83 1.04 0.38 -4.55 113.70 113.14 1x4z s SER 102 Ca 0.37 -0.34 -0.11 0.00 0.48 0.00 0.00 55.95 56.34 1x4z s SER 102 Cb -0.10 -0.25 0.02 0.00 0.10 0.00 0.00 66.02 65.79 1x4z s SER 102 CO 0.31 -1.51 1.07 -1.61 0.98 0.00 0.00 173.24 172.48 1x4z s GLU 103 N -4.91 2.77 -0.37 4.02 2.02 -1.26 -4.64 118.70 116.33 1x4z s GLU 103 Ca 0.62 1.04 -0.28 0.00 0.02 0.00 0.00 54.97 56.37 1x4z s GLU 103 Cb -0.07 -1.97 -0.01 0.00 0.10 0.00 0.00 34.13 32.18 1x4z s GLU 103 CO 0.41 -1.24 1.71 -1.25 0.02 0.00 0.00 175.26 174.91 1x4z s PRO 104 N -4.92 3.35 0.88 0.39 0.04 -1.26 -3.99 135.00 129.49 1x4z s PRO 104 Ca 0.59 1.26 -0.14 0.00 0.04 0.00 0.00 61.00 62.76 1x4z s PRO 104 Cb -0.15 -4.17 0.02 0.00 0.04 0.00 0.00 34.50 30.24 1x4z s PRO 104 CO 0.54 -1.84 0.49 -1.13 0.04 0.00 0.00 177.00 175.10 1x4z n SER 105 N 10.08 -1.65 -4.65 6.66 3.41 -1.15 -4.85 113.62 121.47 1x4z n SER 105 Ca 0.21 0.41 -0.43 0.00 -0.26 0.00 0.00 58.87 58.81 1x4z n SER 105 Cb 0.47 -1.23 -0.01 0.00 -0.26 0.00 0.00 64.21 63.19 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 -3.27 0.66 -2.04 7.33 0.00 -1.26 -4.70 120.51 117.23 1x4z n ALA 106 Ca 0.08 0.35 -0.39 0.00 0.00 0.00 0.00 53.44 53.48 1x4z n ALA 106 Cb 0.52 -2.16 -0.03 0.00 0.00 0.00 0.00 19.45 17.79 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 -1.82 2.68 1.07 0.00 0.04 -1.26 -4.57 135.00 131.14 1x4z s PRO 107 Ca 0.58 0.66 -0.22 0.00 0.04 0.00 0.00 61.00 62.06 1x4z s PRO 107 Cb -0.60 -4.37 -0.01 0.00 0.04 0.00 0.00 34.50 29.55 1x4z s PRO 107 CO 0.61 -2.67 -0.60 -1.13 0.04 0.00 0.00 177.00 173.24 1x4z n SER 108 N 12.56 -2.63 -4.71 6.66 3.41 -1.03 -4.86 113.62 123.02 1x4z n SER 108 Ca 0.20 -0.09 -0.37 0.00 -0.26 0.00 0.00 58.87 58.36 1x4z n SER 108 Cb 0.52 -0.77 0.07 0.00 -0.26 0.00 0.00 64.21 63.77 1x4z n SER 108 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1x4z n ARG 109 N -0.28 1.01 -2.17 4.33 5.12 -1.26 -4.54 116.66 118.87 1x4z n ARG 109 Ca -0.00 0.40 -0.42 0.00 -1.93 0.00 0.00 57.85 55.89 1x4z n ARG 109 Cb 0.67 -2.48 -0.03 0.00 -1.16 0.00 0.00 32.46 29.46 1x4z n ARG 109 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1x4z s PRO 110 N -3.37 4.23 -0.26 5.56 0.04 -1.26 -4.68 135.00 135.26 1x4z s PRO 110 Ca 0.81 2.01 -0.05 0.00 0.04 0.00 0.00 61.00 63.82 1x4z s PRO 110 Cb -0.38 -3.75 0.01 0.00 0.04 0.00 0.00 34.50 30.42 1x4z s PRO 110 CO 0.42 -0.70 0.01 -0.47 0.04 0.00 0.00 177.00 176.29 1x4z s TYR 111 N 3.18 3.07 -0.55 0.56 5.04 -0.82 -4.93 117.35 122.90 1x4z s TYR 111 Ca 0.66 -1.11 -0.20 0.00 -2.44 0.00 0.00 57.07 53.97 1x4z s TYR 111 Cb -0.31 -2.16 0.07 0.00 0.35 0.00 0.00 41.96 39.91 1x4z s TYR 111 CO 0.26 -0.60 0.74 0.08 -1.34 0.00 0.00 175.55 174.68 1x4z s VAL 112 N 1.45 4.71 -0.44 3.14 1.01 -1.26 -3.30 120.40 125.71 1x4z s VAL 112 Ca 0.03 -0.47 -0.28 0.00 0.00 0.00 0.00 61.98 61.25 1x4z s VAL 112 Cb -0.16 -4.43 -0.01 0.00 0.00 0.00 0.00 36.38 31.77 1x4z s VAL 112 CO -0.01 -1.02 1.69 -0.69 0.00 0.00 0.00 175.10 175.07 1x4z s VAL 113 N 3.04 3.57 -0.57 2.92 1.01 -1.26 -4.87 120.40 124.24 1x4z s VAL 113 Ca 0.18 0.53 0.02 0.00 0.00 0.00 0.00 61.98 62.71 1x4z s VAL 113 Cb -0.19 -3.91 0.41 0.00 0.00 0.00 0.00 36.38 32.69 1x4z s VAL 113 CO 0.11 -0.68 1.53 -0.24 0.00 0.00 0.00 175.10 175.82 1x4z n SER 114 N 10.48 6.01 -0.02 3.32 2.88 -1.26 -0.84 113.62 134.20 1x4z n SER 114 Ca 0.20 -3.77 0.00 0.00 -1.33 0.00 0.00 58.87 53.97 1x4z n SER 114 Cb 0.48 -0.69 0.00 0.00 -0.75 0.00 0.00 64.21 63.25 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 -0.60 -0.70 0.34 0.46 0.00 -1.26 -3.74 105.19 99.70 1x4z n GLY 115 Ca 0.48 -1.15 0.13 0.00 0.00 0.00 0.00 46.02 45.48 1x4z n GLY 115 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1x4z h SER 116 N 0.00 -0.55 0.00 1.61 4.64 -1.85 -3.39 113.55 114.01 1x4z h SER 116 Ca 0.00 0.28 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 1x4z h SER 116 Cb 0.00 0.51 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 1x4z h SER 116 CO 0.00 -0.35 0.00 0.61 -0.87 0.00 0.00 176.83 176.22 1x4z n GLY 117 N -1.52 -1.76 0.00 -0.77 0.00 -1.25 -4.26 105.19 95.64 1x4z n GLY 117 Ca 0.22 -1.89 0.06 0.00 0.00 0.00 0.00 46.02 44.41 1x4z n GLY 117 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x4z n PRO 118 N 0.00 0.49 -1.62 1.61 -0.04 -1.26 -4.86 135.00 129.31 1x4z n PRO 118 Ca 0.00 0.00 -0.63 0.00 -0.04 0.00 0.00 63.50 62.83 1x4z n PRO 118 Cb 0.00 -1.40 -0.09 0.00 -0.04 0.00 0.00 33.50 31.97 1x4z n PRO 118 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1x4z n SER 119 N -0.90 1.12 -4.30 3.54 3.41 -1.26 -4.92 113.62 110.32 1x4z n SER 119 Ca 0.09 1.10 -0.21 0.00 -0.26 0.00 0.00 58.87 59.60 1x4z n SER 119 Cb 0.04 -0.82 -0.10 0.00 -0.26 0.00 0.00 64.21 63.08 1x4z n SER 119 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1x4z s SER 120 N 2.79 2.10 0.00 4.04 1.04 -1.26 -5.14 113.70 117.27 1x4z s SER 120 Ca 0.98 -1.47 0.00 0.00 0.48 0.00 0.00 55.95 55.94 1x4z s SER 120 Cb -1.39 0.16 0.00 0.00 0.10 0.00 0.00 66.02 64.89 1x4z s SER 120 CO 0.76 -0.74 0.00 0.61 0.98 0.00 0.00 173.24 174.85