#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 -0.78 0.32 1.61 0.01 -1.26 -5.14 113.70 108.47 1x4z s SER 2 Ca 0.00 1.44 -0.29 0.00 1.31 0.00 0.00 55.95 58.41 1x4z s SER 2 Cb 0.00 1.44 -0.11 0.00 0.21 0.00 0.00 66.02 67.55 1x4z s SER 2 CO 0.00 -0.25 1.54 -1.54 0.41 0.00 0.00 173.24 173.41 1x4z n SER 3 N 2.99 3.77 -4.32 2.44 3.41 -1.26 -4.89 113.62 115.76 1x4z n SER 3 Ca -0.15 1.18 -0.40 0.00 -0.26 0.00 0.00 58.87 59.24 1x4z n SER 3 Cb 0.56 -1.60 0.01 0.00 -0.26 0.00 0.00 64.21 62.92 1x4z n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1x4z n GLY 4 N 1.48 -2.62 4.00 5.00 0.00 -1.26 -4.97 105.19 106.81 1x4z n GLY 4 Ca 0.06 -0.12 -0.19 0.00 0.00 0.00 0.00 46.02 45.77 1x4z n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x4z s SER 5 N -1.03 5.40 -0.20 1.61 0.01 -1.26 -5.12 113.70 113.11 1x4z s SER 5 Ca 0.60 -0.29 -0.09 0.00 1.31 0.00 0.00 55.95 57.49 1x4z s SER 5 Cb -0.53 -0.64 0.08 0.00 0.21 0.00 0.00 66.02 65.13 1x4z s SER 5 CO 0.62 -1.01 0.46 -0.55 0.41 0.00 0.00 173.24 173.18 1x4z s SER 6 N -4.42 -0.51 0.00 2.44 0.15 -1.26 -5.15 113.70 104.96 1x4z s SER 6 Ca 0.57 1.05 -0.23 0.00 0.70 0.00 0.00 55.95 58.04 1x4z s SER 6 Cb -0.10 1.18 -0.05 0.00 -1.71 0.00 0.00 66.02 65.35 1x4z s SER 6 CO 0.36 -0.22 0.68 -0.83 1.20 0.00 0.00 173.24 174.44 1x4z s GLY 7 N 2.02 2.68 -0.06 9.45 0.00 -1.26 -5.04 107.32 115.11 1x4z s GLY 7 Ca -0.06 0.15 -0.26 0.00 0.00 0.00 0.00 44.72 44.55 1x4z s GLY 7 CO -0.14 0.98 0.81 -0.56 0.00 0.00 0.00 173.10 174.19 1x4z s SER 8 N 0.07 7.10 0.23 1.64 0.01 -1.26 -5.05 113.70 116.44 1x4z s SER 8 Ca 0.35 1.33 -0.15 0.00 1.31 0.00 0.00 55.95 58.80 1x4z s SER 8 Cb -0.19 -2.47 -0.08 0.00 0.21 0.00 0.00 66.02 63.49 1x4z s SER 8 CO 0.20 -0.21 0.64 0.00 0.41 0.00 0.00 173.24 174.28 1x4z s GLN 9 N 1.08 4.01 0.16 12.44 -2.07 -1.26 -5.04 119.66 128.98 1x4z s GLN 9 Ca 0.42 0.58 -0.30 0.00 -1.82 0.00 0.00 55.36 54.24 1x4z s GLN 9 Cb -0.19 -2.73 -0.08 0.00 -1.09 0.00 0.00 33.01 28.93 1x4z s GLN 9 CO 0.20 0.34 1.33 -1.25 -1.32 0.00 0.00 175.29 174.59 1x4z s PRO 10 N -2.42 4.37 0.00 9.60 0.04 -1.26 -5.03 135.00 140.30 1x4z s PRO 10 Ca 0.45 2.04 0.03 0.00 0.04 0.00 0.00 61.00 63.56 1x4z s PRO 10 Cb -0.13 -3.22 -0.03 0.00 0.04 0.00 0.00 34.50 31.15 1x4z s PRO 10 CO 0.20 -0.31 -0.05 -0.51 0.04 0.00 0.00 177.00 176.37 1x4z s ASP 11 N 0.64 4.78 -0.09 6.66 1.01 -1.26 -5.02 116.67 123.39 1x4z s ASP 11 Ca 0.59 -0.11 0.01 0.00 0.71 0.00 0.00 52.55 53.76 1x4z s ASP 11 Cb -0.36 -1.16 -0.07 0.00 1.01 0.00 0.00 42.92 42.35 1x4z s ASP 11 CO 0.35 0.28 -0.07 1.41 0.21 0.00 0.00 175.17 177.34 1x4z n HIS 12 N 1.48 0.00 -3.43 4.23 8.25 -1.26 -4.86 115.22 119.62 1x4z n HIS 12 Ca -0.15 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 56.88 1x4z n HIS 12 Cb 0.53 -0.37 -0.03 0.00 1.12 0.00 0.00 29.99 31.24 1x4z n HIS 12 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1x4z s GLY 13 N -4.81 2.85 -0.55 -1.41 0.00 -1.26 -5.02 107.32 97.11 1x4z s GLY 13 Ca -0.12 -3.53 -0.23 0.00 0.00 0.00 0.00 44.72 40.85 1x4z s GLY 13 CO 0.23 1.24 0.86 1.09 0.00 0.00 0.00 173.10 176.53 1x4z s ARG 14 N -0.46 3.25 0.29 2.90 1.70 -1.26 -5.03 118.95 120.34 1x4z s ARG 14 Ca 0.22 -0.50 0.04 0.00 -0.47 0.00 0.00 55.73 55.02 1x4z s ARG 14 Cb -0.11 -4.09 0.04 0.00 -0.57 0.00 0.00 34.95 30.21 1x4z s ARG 14 CO -0.08 -1.46 0.30 1.28 -1.08 0.00 0.00 175.30 174.25 1x4z n LEU 15 N 7.17 0.00 -3.98 -1.89 4.77 -1.26 -5.16 117.00 116.65 1x4z n LEU 15 Ca -0.01 -1.40 -0.09 0.00 -0.03 0.00 0.00 56.01 54.48 1x4z n LEU 15 Cb 0.47 -0.11 -0.08 0.00 -2.33 0.00 0.00 43.42 41.37 1x4z n LEU 15 CO 0.61 -0.51 -0.17 -0.44 -1.33 0.00 0.00 177.39 175.55 1x4z s SER 16 N -2.75 0.22 1.01 -1.43 0.01 -1.09 -5.12 113.70 104.56 1x4z s SER 16 Ca 0.23 -0.86 -0.12 0.00 1.31 0.00 0.00 55.95 56.50 1x4z s SER 16 Cb -0.02 0.32 0.20 0.00 0.21 0.00 0.00 66.02 66.73 1x4z s SER 16 CO 0.15 -0.73 1.09 -2.16 0.41 0.00 0.00 173.24 171.99 1x4z s PRO 17 N -3.93 0.31 0.64 12.44 0.04 -1.26 -4.09 135.00 139.16 1x4z s PRO 17 Ca 0.11 0.48 -0.15 0.00 0.04 0.00 0.00 61.00 61.48 1x4z s PRO 17 Cb 0.06 -1.73 -0.01 0.00 0.04 0.00 0.00 34.50 32.86 1x4z s PRO 17 CO -0.07 -2.80 1.11 -1.25 0.04 0.00 0.00 177.00 174.03 1x4z s PRO 18 N -4.97 2.87 0.51 0.56 0.04 -1.25 -3.47 135.00 129.30 1x4z s PRO 18 Ca 0.66 1.41 0.07 0.00 0.04 0.00 0.00 61.00 63.18 1x4z s PRO 18 Cb -0.19 -1.96 0.05 0.00 0.04 0.00 0.00 34.50 32.44 1x4z s PRO 18 CO 0.58 -1.20 0.70 -1.83 0.04 0.00 0.00 177.00 175.29 1x4z s GLU 19 N -4.00 2.53 -0.02 4.56 -1.05 -1.19 -3.67 118.70 115.86 1x4z s GLU 19 Ca 0.68 -1.34 -0.30 0.00 -0.15 0.00 0.00 54.97 53.85 1x4z s GLU 19 Cb -0.21 -2.67 -0.06 0.00 -0.44 0.00 0.00 34.13 30.75 1x4z s GLU 19 CO 0.40 -0.61 1.67 0.00 0.95 0.00 0.00 175.26 177.67 1x4z s ALA 20 N -2.56 3.62 0.84 -0.84 0.00 -1.26 -4.54 121.76 117.03 1x4z s ALA 20 Ca 0.59 1.02 -0.11 0.00 0.00 0.00 0.00 51.96 53.45 1x4z s ALA 20 Cb -0.08 -3.74 0.10 0.00 0.00 0.00 0.00 23.12 19.40 1x4z s ALA 20 CO 0.36 -1.34 1.09 -1.25 0.00 0.00 0.00 175.76 174.63 1x4z s PRO 21 N 3.74 1.70 1.04 0.00 0.04 -1.26 -4.70 135.00 135.57 1x4z s PRO 21 Ca 0.74 0.97 -0.19 0.00 0.04 0.00 0.00 61.00 62.57 1x4z s PRO 21 Cb -0.35 -1.85 0.05 0.00 0.04 0.00 0.00 34.50 32.39 1x4z s PRO 21 CO 0.31 -1.97 -0.26 -3.47 0.04 0.00 0.00 177.00 171.64 1x4z n ASP 22 N -3.72 -2.66 -4.68 6.66 2.03 0.87 -4.43 116.55 110.62 1x4z n ASP 22 Ca 0.08 -0.17 -0.43 0.00 0.52 0.00 0.00 54.79 54.79 1x4z n ASP 22 Cb 0.54 -0.79 -0.02 0.00 -0.72 0.00 0.00 41.12 40.13 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 -3.08 4.35 0.41 -0.67 3.52 -1.26 -4.49 118.95 117.73 1x4z s ARG 23 Ca 0.44 1.38 -0.25 0.00 -0.13 0.00 0.00 55.73 57.18 1x4z s ARG 23 Cb -0.05 -3.59 -0.08 0.00 -1.56 0.00 0.00 34.95 29.67 1x4z s ARG 23 CO 0.55 -0.46 1.19 -1.25 -0.81 0.00 0.00 175.30 174.52 1x4z s PRO 24 N 2.54 4.00 0.45 5.12 0.04 -1.26 -4.75 135.00 141.14 1x4z s PRO 24 Ca 0.47 1.88 0.03 0.00 0.04 0.00 0.00 61.00 63.41 1x4z s PRO 24 Cb -0.17 -2.65 0.01 0.00 0.04 0.00 0.00 34.50 31.73 1x4z s PRO 24 CO 0.13 -0.38 0.65 -0.08 0.04 0.00 0.00 177.00 177.36 1x4z s THR 25 N -1.41 3.43 -0.13 1.26 -1.32 -0.58 -4.54 115.64 112.36 1x4z s THR 25 Ca 0.58 -0.73 -0.01 0.00 -1.21 0.00 0.00 61.69 60.32 1x4z s THR 25 Cb -0.31 -3.24 0.03 0.00 -1.51 0.00 0.00 72.50 67.47 1x4z s THR 25 CO 0.40 -0.14 -0.06 -0.63 -2.21 0.00 0.00 174.62 171.97 1x4z s ILE 26 N -2.51 1.01 0.51 5.08 -1.09 -1.26 -3.38 121.20 119.56 1x4z s ILE 26 Ca 0.52 -0.36 0.01 0.00 -2.23 0.00 0.00 60.65 58.59 1x4z s ILE 26 Cb -0.10 -1.08 -0.01 0.00 -1.58 0.00 0.00 42.46 39.69 1x4z s ILE 26 CO 0.36 0.29 0.01 -0.55 -1.23 0.00 0.00 174.94 173.82 1x4z s SER 27 N 1.71 4.05 -0.64 3.58 0.15 -0.31 -4.98 113.70 117.25 1x4z s SER 27 Ca 0.04 -1.68 -0.19 0.00 0.70 0.00 0.00 55.95 54.82 1x4z s SER 27 Cb -0.13 0.58 0.11 0.00 -1.71 0.00 0.00 66.02 64.87 1x4z s SER 27 CO -0.08 -0.89 0.76 -0.89 1.20 0.00 0.00 173.24 173.34 1x4z s THR 28 N -2.91 4.84 -0.25 6.45 2.01 -1.26 -3.03 115.64 121.48 1x4z s THR 28 Ca 0.05 -1.11 0.01 0.00 0.31 0.00 0.00 61.69 60.95 1x4z s THR 28 Cb 0.01 -4.52 -0.16 0.00 0.01 0.00 0.00 72.50 67.84 1x4z s THR 28 CO 0.03 -1.17 -0.23 0.00 -0.69 0.00 0.00 174.62 172.56 1x4z n ALA 29 N 6.26 1.45 -3.79 7.40 0.00 -1.26 -4.71 120.51 125.86 1x4z n ALA 29 Ca -0.05 -1.07 -0.01 0.00 0.00 0.00 0.00 53.44 52.31 1x4z n ALA 29 Cb 0.43 -0.06 0.03 0.00 0.00 0.00 0.00 19.45 19.85 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 -3.30 -2.25 0.18 0.00 7.64 -0.99 -4.94 113.62 109.95 1x4z n SER 30 Ca -0.45 -2.59 0.09 0.00 1.01 0.00 0.00 58.87 56.94 1x4z n SER 30 Cb 0.97 3.76 0.10 0.00 -1.01 0.00 0.00 64.21 68.03 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 -0.03 1.43 4.81 -1.96 -3.29 114.58 115.54 1x4z h GLU 31 Ca -0.33 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.90 1x4z h GLU 31 Cb 1.22 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.60 1x4z h GLU 31 CO 0.42 0.12 0.00 0.25 -0.73 0.00 0.00 179.01 179.07 1x4z n THR 32 N -3.06 0.36 -4.14 0.32 -2.24 -1.26 -4.62 114.28 99.64 1x4z n THR 32 Ca 0.02 -0.68 -0.14 0.00 -2.27 0.00 0.00 64.05 60.99 1x4z n THR 32 Cb 0.59 0.85 -0.07 0.00 -2.10 0.00 0.00 70.33 69.60 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 -0.47 0.66 -0.15 3.42 1.04 -1.24 -1.66 113.70 115.30 1x4z s SER 33 Ca 0.03 -1.41 -0.17 0.00 0.48 0.00 0.00 55.95 54.88 1x4z s SER 33 Cb 0.02 0.55 0.04 0.00 0.10 0.00 0.00 66.02 66.73 1x4z s SER 33 CO 0.03 -1.09 0.47 0.68 0.98 0.00 0.00 173.24 174.30 1x4z s VAL 34 N -3.62 0.01 -0.20 5.02 -7.23 -0.85 -2.35 120.40 111.18 1x4z s VAL 34 Ca 0.33 -0.07 -0.29 0.00 -1.81 0.00 0.00 61.98 60.15 1x4z s VAL 34 Cb 0.02 -0.68 -0.00 0.00 0.56 0.00 0.00 36.38 36.28 1x4z s VAL 34 CO 0.17 -0.04 1.14 -0.31 -0.31 0.00 0.00 175.10 175.76 1x4z s TYR 35 N -0.08 3.12 -0.12 2.82 2.02 -1.17 -0.94 117.35 122.99 1x4z s TYR 35 Ca -0.03 1.26 0.01 0.00 -0.37 0.00 0.00 57.07 57.94 1x4z s TYR 35 Cb -0.03 -3.38 -0.01 0.00 -0.40 0.00 0.00 41.96 38.14 1x4z s TYR 35 CO 0.02 -1.05 -0.15 0.08 -1.57 0.00 0.00 175.55 172.89 1x4z s VAL 36 N 3.30 2.92 -0.12 0.71 1.01 0.66 -1.17 120.40 127.72 1x4z s VAL 36 Ca 0.49 -0.71 -0.00 0.00 0.00 0.00 0.00 61.98 61.75 1x4z s VAL 36 Cb -0.18 -2.21 0.02 0.00 0.00 0.00 0.00 36.38 34.01 1x4z s VAL 36 CO 0.10 0.53 -0.09 -0.89 0.00 0.00 0.00 175.10 174.76 1x4z s THR 37 N 0.28 1.10 0.41 3.92 2.01 -1.22 -0.63 115.64 121.51 1x4z s THR 37 Ca -0.11 -0.34 0.06 0.00 0.31 0.00 0.00 61.69 61.61 1x4z s THR 37 Cb -0.16 -1.10 -0.07 0.00 0.01 0.00 0.00 72.50 71.18 1x4z s THR 37 CO 0.06 0.38 0.02 -1.66 -0.69 0.00 0.00 174.62 172.73 1x4z s TRP 38 N 1.65 2.38 -0.18 4.92 -2.14 0.06 -1.53 118.94 124.09 1x4z s TRP 38 Ca 0.04 -0.74 -0.03 0.00 2.66 0.00 0.00 56.10 58.03 1x4z s TRP 38 Cb -0.13 -1.69 0.06 0.00 -3.10 0.00 0.00 33.47 28.61 1x4z s TRP 38 CO -0.08 0.36 0.04 0.42 -2.66 0.00 0.00 176.95 175.02 1x4z s ILE 39 N -2.82 0.47 0.13 0.66 -1.09 -1.26 -4.70 121.20 112.60 1x4z s ILE 39 Ca 0.33 -0.48 -0.31 0.00 -2.23 0.00 0.00 60.65 57.96 1x4z s ILE 39 Cb 0.09 -0.96 -0.08 0.00 -1.58 0.00 0.00 42.46 39.93 1x4z s ILE 39 CO 0.16 -0.18 1.35 -2.16 -1.23 0.00 0.00 174.94 172.88 1x4z s PRO 40 N 1.88 4.35 0.00 2.79 0.04 -1.26 -0.09 135.00 142.72 1x4z s PRO 40 Ca -0.00 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.07 1x4z s PRO 40 Cb -0.17 -3.24 0.00 0.00 0.04 0.00 0.00 34.50 31.13 1x4z s PRO 40 CO -0.08 -0.37 0.00 0.54 0.04 0.00 0.00 177.00 177.14 1x4z n ARG 41 N 3.59 0.00 -4.05 4.56 5.12 -1.26 -4.89 116.66 119.73 1x4z n ARG 41 Ca 0.10 0.11 -0.31 0.00 -1.93 0.00 0.00 57.85 55.82 1x4z n ARG 41 Cb 0.43 -0.60 -0.06 0.00 -1.16 0.00 0.00 32.46 31.06 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 -2.75 2.03 0.00 -0.13 0.00 -1.26 -5.01 107.32 100.20 1x4z s GLY 42 Ca 0.00 -1.00 0.02 0.00 0.00 0.00 0.00 44.72 43.74 1x4z s GLY 42 CO 0.00 -0.97 0.99 1.16 0.00 0.00 0.00 173.10 174.28 1x4z n ASN 43 N 0.50 2.03 0.00 1.64 6.94 -1.26 -3.19 115.26 121.91 1x4z n ASN 43 Ca -0.09 -1.90 0.00 0.00 -0.02 0.00 0.00 54.58 52.57 1x4z n ASN 43 Cb 0.52 -0.03 0.00 0.00 -2.36 0.00 0.00 39.78 37.91 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 -0.31 0.69 0.00 4.83 0.00 -1.23 -2.96 105.19 106.21 1x4z n GLY 44 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -2.08 2.77 3.74 -0.02 0.00 -1.26 -2.66 105.19 105.68 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 -2.54 2.84 -0.22 1.61 0.08 -1.16 -5.07 117.98 113.52 1x4z s PHE 46 Ca 0.00 -0.24 -0.29 0.00 0.12 0.00 0.00 56.93 56.52 1x4z s PHE 46 Cb 0.00 -1.43 -0.03 0.00 -0.57 0.00 0.00 43.02 40.99 1x4z s PHE 46 CO 0.00 0.47 1.61 -1.25 -0.10 0.00 0.00 175.22 175.95 1x4z s PRO 47 N -3.80 3.80 -0.02 0.24 0.04 -1.26 -4.67 135.00 129.32 1x4z s PRO 47 Ca 0.35 1.66 -0.39 0.00 0.04 0.00 0.00 61.00 62.66 1x4z s PRO 47 Cb -0.06 -4.03 -0.18 0.00 0.04 0.00 0.00 34.50 30.27 1x4z s PRO 47 CO 0.23 -1.29 1.33 -0.89 0.04 0.00 0.00 177.00 176.41 1x4z n ILE 48 N 6.40 0.04 -0.03 0.56 5.41 -1.26 -4.73 119.36 125.75 1x4z n ILE 48 Ca 0.19 -0.01 -0.18 0.00 1.00 0.00 0.00 62.75 63.75 1x4z n ILE 48 Cb 0.45 -0.61 -0.13 0.00 -0.71 0.00 0.00 39.64 38.64 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 4.45 0.13 -2.67 0.38 4.20 -1.63 -3.41 115.11 116.54 1x4z h GLN 49 Ca -0.48 -0.22 0.05 0.00 0.06 0.00 0.00 58.65 58.06 1x4z h GLN 49 Cb 1.36 0.08 -0.13 0.00 0.30 0.00 0.00 27.48 29.09 1x4z h GLN 49 CO 0.77 1.10 0.34 -1.12 -0.67 0.00 0.00 178.83 179.26 1x4z s SER 50 N -6.66 -0.46 0.54 1.46 0.01 -0.63 -4.48 113.70 103.49 1x4z s SER 50 Ca -0.19 -0.04 0.06 0.00 1.31 0.00 0.00 55.95 57.09 1x4z s SER 50 Cb 0.01 0.51 0.04 0.00 0.21 0.00 0.00 66.02 66.79 1x4z s SER 50 CO 0.73 -0.84 0.47 -0.36 0.41 0.00 0.00 173.24 173.65 1x4z s PHE 51 N -3.47 1.64 -0.16 2.43 0.08 -0.92 -0.51 117.98 117.06 1x4z s PHE 51 Ca 0.03 -0.81 -0.06 0.00 0.12 0.00 0.00 56.93 56.22 1x4z s PHE 51 Cb -0.01 -1.97 0.07 0.00 -0.57 0.00 0.00 43.02 40.54 1x4z s PHE 51 CO -0.10 -0.57 0.35 1.03 -0.10 0.00 0.00 175.22 175.82 1x4z s ARG 52 N -4.34 0.25 -0.21 0.44 0.52 0.83 -3.71 118.95 112.73 1x4z s ARG 52 Ca 0.39 0.87 -0.07 0.00 -0.52 0.00 0.00 55.73 56.40 1x4z s ARG 52 Cb -0.03 0.12 -0.03 0.00 0.52 0.00 0.00 34.95 35.53 1x4z s ARG 52 CO 0.24 -0.25 0.05 0.08 0.02 0.00 0.00 175.30 175.45 1x4z s VAL 53 N 2.32 4.48 0.04 3.52 1.01 -1.23 0.21 120.40 130.74 1x4z s VAL 53 Ca -0.02 -0.13 0.04 0.00 0.00 0.00 0.00 61.98 61.87 1x4z s VAL 53 Cb -0.12 -3.04 -0.02 0.00 0.00 0.00 0.00 36.38 33.20 1x4z s VAL 53 CO -0.11 0.41 -0.12 -1.61 0.00 0.00 0.00 175.10 173.67 1x4z s GLU 54 N 0.92 0.80 0.48 2.72 2.02 -1.12 -1.66 118.70 122.86 1x4z s GLU 54 Ca 0.03 -0.71 0.03 0.00 0.02 0.00 0.00 54.97 54.34 1x4z s GLU 54 Cb -0.14 -0.76 -0.03 0.00 0.10 0.00 0.00 34.13 33.30 1x4z s GLU 54 CO 0.03 0.18 0.01 1.52 0.02 0.00 0.00 175.26 177.01 1x4z s TYR 55 N -0.91 2.06 -0.13 1.61 -0.85 -0.67 -0.23 117.35 118.23 1x4z s TYR 55 Ca -0.01 -0.88 -0.09 0.00 -0.52 0.00 0.00 57.07 55.58 1x4z s TYR 55 Cb -0.08 -1.66 0.04 0.00 0.38 0.00 0.00 41.96 40.65 1x4z s TYR 55 CO 0.01 0.29 0.32 0.21 -1.52 0.00 0.00 175.55 174.85 1x4z s LYS 56 N -3.83 0.33 -0.12 -3.49 2.20 -1.16 -0.17 119.74 113.51 1x4z s LYS 56 Ca 0.14 0.53 -0.27 0.00 -0.36 0.00 0.00 55.97 56.02 1x4z s LYS 56 Cb 0.04 0.06 -0.02 0.00 -1.51 0.00 0.00 37.83 36.40 1x4z s LYS 56 CO 0.07 -0.10 0.89 0.15 -0.36 0.00 0.00 175.35 176.01 1x4z s LYS 57 N 0.72 4.39 -0.17 4.03 1.02 -1.26 -1.81 119.74 126.66 1x4z s LYS 57 Ca -0.04 1.17 -0.23 0.00 0.02 0.00 0.00 55.97 56.89 1x4z s LYS 57 Cb -0.06 -3.53 -0.23 0.00 -0.52 0.00 0.00 37.83 33.49 1x4z s LYS 57 CO -0.05 -0.25 0.46 -0.07 -0.92 0.00 0.00 175.35 174.53 1x4z h LEU 58 N 7.86 0.06 -4.47 3.17 3.38 -1.43 -3.37 115.31 120.51 1x4z h LEU 58 Ca -0.33 -0.73 -0.53 0.00 0.09 0.00 0.00 57.88 56.38 1x4z h LEU 58 Cb 1.15 -0.02 -0.19 0.00 0.09 0.00 0.00 40.66 41.69 1x4z h LEU 58 CO 0.82 1.34 0.52 1.17 0.09 0.00 0.00 178.44 182.39 1x4z n LYS 59 N -4.41 2.40 -3.37 1.13 3.00 -1.25 -4.89 118.16 110.76 1x4z n LYS 59 Ca -0.23 -2.48 -0.08 0.00 -0.00 0.00 0.00 58.31 55.52 1x4z n LYS 59 Cb 0.65 -2.11 0.02 0.00 0.00 0.00 0.00 35.03 33.59 1x4z n LYS 59 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1x4z n LYS 60 N 0.53 0.95 -0.06 1.64 4.81 -1.26 -4.93 118.16 119.84 1x4z n LYS 60 Ca 0.48 -1.92 -0.01 0.00 -0.87 0.00 0.00 58.31 55.99 1x4z n LYS 60 Cb 0.51 2.37 -0.15 0.00 0.02 0.00 0.00 35.03 37.77 1x4z n LYS 60 CO 0.00 0.00 0.00 1.55 1.17 0.00 0.00 177.40 180.12 1x4z n VAL 61 N -0.46 0.77 -1.67 3.15 3.14 -1.26 -4.97 118.33 117.03 1x4z n VAL 61 Ca -0.07 -0.67 -0.44 0.00 -2.96 0.00 0.00 64.34 60.20 1x4z n VAL 61 Cb 0.51 -0.28 -0.02 0.00 -1.06 0.00 0.00 33.84 32.98 1x4z n VAL 61 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1x4z n GLY 62 N 1.63 0.65 2.35 7.55 0.00 -1.26 -4.99 105.19 111.12 1x4z n GLY 62 Ca -0.20 0.43 -0.16 0.00 0.00 0.00 0.00 46.02 46.09 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 1.67 0.35 -4.59 1.61 9.92 -1.26 -4.10 116.55 120.14 1x4z n ASP 63 Ca 0.09 -1.44 -0.48 0.00 -0.53 0.00 0.00 54.79 52.43 1x4z n ASP 63 Cb 0.33 -0.53 -0.04 0.00 -0.64 0.00 0.00 41.12 40.24 1x4z n ASP 63 CO 0.00 0.00 0.00 0.79 0.13 0.00 0.00 177.20 178.12 1x4z n TRP 64 N -2.80 1.40 -4.60 1.24 7.02 -1.26 -4.57 117.44 113.86 1x4z n TRP 64 Ca 0.10 0.65 -0.27 0.00 -1.02 0.00 0.00 57.50 56.96 1x4z n TRP 64 Cb 0.35 -2.30 -0.11 0.00 -2.42 0.00 0.00 31.31 26.84 1x4z n TRP 64 CO 0.00 0.00 0.00 0.42 -2.02 0.00 0.00 177.69 176.09 1x4z s ILE 65 N -0.24 1.95 -0.25 -0.99 -1.09 0.76 -4.96 121.20 116.37 1x4z s ILE 65 Ca 0.71 -2.01 -0.08 0.00 -2.23 0.00 0.00 60.65 57.04 1x4z s ILE 65 Cb -0.82 -2.96 -0.03 0.00 -1.58 0.00 0.00 42.46 37.07 1x4z s ILE 65 CO 0.52 -0.01 0.10 -0.22 -1.23 0.00 0.00 174.94 174.10 1x4z s LEU 66 N -3.69 3.61 -0.03 2.97 2.96 -1.26 -1.67 118.68 121.57 1x4z s LEU 66 Ca 0.35 -0.13 -0.01 0.00 -0.22 0.00 0.00 54.13 54.12 1x4z s LEU 66 Cb 0.10 -1.97 -0.00 0.00 0.50 0.00 0.00 46.19 44.81 1x4z s LEU 66 CO 0.18 -0.01 -0.03 0.00 -1.32 0.00 0.00 176.35 175.17 1x4z h ALA 67 N 8.09 0.00 -4.51 5.97 0.00 -1.68 -3.48 119.26 123.64 1x4z h ALA 67 Ca -0.37 -0.21 -0.39 0.00 0.00 0.00 0.00 54.91 53.94 1x4z h ALA 67 Cb 1.18 0.08 -0.09 0.00 0.00 0.00 0.00 17.79 18.96 1x4z h ALA 67 CO 0.58 0.08 -0.32 -2.37 0.00 0.00 0.00 179.25 177.22 1x4z n THR 68 N -2.75 0.00 -3.93 0.00 5.66 -1.21 -4.93 114.28 107.13 1x4z n THR 68 Ca -0.01 -1.65 0.01 0.00 -3.05 0.00 0.00 64.05 59.35 1x4z n THR 68 Cb 0.04 0.57 0.01 0.00 -1.55 0.00 0.00 70.33 69.41 1x4z n THR 68 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 1x4z n SER 69 N -1.65 -1.11 -2.17 1.09 3.41 -1.26 -3.54 113.62 108.39 1x4z n SER 69 Ca -0.05 -1.37 -0.20 0.00 -0.26 0.00 0.00 58.87 56.99 1x4z n SER 69 Cb 0.43 1.75 -0.03 0.00 -0.26 0.00 0.00 64.21 66.10 1x4z n SER 69 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1x4z n ALA 70 N -1.29 -0.54 -1.94 7.33 0.00 -1.24 -4.94 120.51 117.89 1x4z n ALA 70 Ca -0.10 0.21 -0.41 0.00 0.00 0.00 0.00 53.44 53.14 1x4z n ALA 70 Cb 0.47 -2.07 -0.05 0.00 0.00 0.00 0.00 19.45 17.80 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 -2.90 3.93 0.71 0.00 1.01 -1.26 -4.90 121.20 117.79 1x4z s ILE 71 Ca 0.00 1.79 -0.13 0.00 0.00 0.00 0.00 60.65 62.31 1x4z s ILE 71 Cb 0.00 -4.14 0.03 0.00 0.01 0.00 0.00 42.46 38.36 1x4z s ILE 71 CO 0.00 0.36 1.10 -2.16 0.00 0.00 0.00 174.94 174.25 1x4z s PRO 72 N -0.79 2.56 0.46 2.79 0.04 -1.26 -2.18 135.00 136.63 1x4z s PRO 72 Ca 0.46 1.29 0.25 0.00 0.04 0.00 0.00 61.00 63.03 1x4z s PRO 72 Cb -0.28 -1.93 1.07 0.00 0.04 0.00 0.00 34.50 33.40 1x4z s PRO 72 CO 0.35 -1.42 1.89 -1.00 0.04 0.00 0.00 177.00 176.85 1x4z h PRO 73 N -0.49 0.00 0.00 0.56 0.13 -1.81 -2.63 132.00 127.76 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 0.20 0.00 0.66 -0.23 0.00 0.00 178.00 179.16 1x4z h SER 74 N 0.00 0.00 -3.12 1.44 4.64 -1.95 -3.41 113.55 111.15 1x4z h SER 74 Ca -0.00 0.00 -0.72 0.00 -0.47 0.00 0.00 61.79 60.60 1x4z h SER 74 Cb 0.64 0.00 -0.21 0.00 -0.31 0.00 0.00 62.40 62.52 1x4z h SER 74 CO 0.03 0.00 -0.06 -0.60 -0.87 0.00 0.00 176.83 175.33 1x4z s ARG 75 N -3.18 3.04 -0.10 4.77 3.52 -0.99 -4.88 118.95 121.13 1x4z s ARG 75 Ca 0.08 -1.27 0.19 0.00 -0.13 0.00 0.00 55.73 54.60 1x4z s ARG 75 Cb 0.08 -4.20 0.73 0.00 -1.56 0.00 0.00 34.95 30.00 1x4z s ARG 75 CO 0.64 -1.30 1.63 1.28 -0.81 0.00 0.00 175.30 176.74 1x4z n LEU 76 N 5.85 4.74 -3.67 -0.88 4.77 -1.26 -4.71 117.00 121.84 1x4z n LEU 76 Ca -0.10 -2.40 -0.10 0.00 -0.03 0.00 0.00 56.01 53.38 1x4z n LEU 76 Cb 0.43 -0.58 -0.09 0.00 -2.33 0.00 0.00 43.42 40.86 1x4z n LEU 76 CO 0.54 0.84 0.22 -0.55 -1.33 0.00 0.00 177.39 177.11 1x4z s SER 77 N -0.91 -0.71 0.12 -1.43 0.15 -1.26 -0.76 113.70 108.90 1x4z s SER 77 Ca 0.52 1.21 -0.08 0.00 0.70 0.00 0.00 55.95 58.29 1x4z s SER 77 Cb 0.33 1.12 -0.01 0.00 -1.71 0.00 0.00 66.02 65.75 1x4z s SER 77 CO 0.26 -0.21 0.23 0.68 1.20 0.00 0.00 173.24 175.39 1x4z s VAL 78 N 1.21 0.11 -0.41 4.45 -7.23 0.20 -4.97 120.40 113.76 1x4z s VAL 78 Ca -0.07 -1.30 -0.16 0.00 -1.81 0.00 0.00 61.98 58.64 1x4z s VAL 78 Cb -0.06 -1.60 0.02 0.00 0.56 0.00 0.00 36.38 35.30 1x4z s VAL 78 CO -0.12 -0.48 0.35 -0.70 -0.31 0.00 0.00 175.10 173.84 1x4z s GLU 79 N -3.92 3.09 -0.53 4.82 2.12 -1.26 -0.24 118.70 122.78 1x4z s GLU 79 Ca 0.11 -0.85 -0.28 0.00 0.36 0.00 0.00 54.97 54.31 1x4z s GLU 79 Cb 0.04 -3.95 0.02 0.00 0.26 0.00 0.00 34.13 30.50 1x4z s GLU 79 CO -0.05 -0.76 1.37 0.42 -0.54 0.00 0.00 175.26 175.70 1x4z s ILE 80 N 1.89 3.86 0.38 -3.70 -1.09 -0.12 -4.82 121.20 117.60 1x4z s ILE 80 Ca 0.08 0.77 0.07 0.00 -2.23 0.00 0.00 60.65 59.35 1x4z s ILE 80 Cb -0.18 -4.44 0.00 0.00 -1.58 0.00 0.00 42.46 36.26 1x4z s ILE 80 CO 0.12 -1.10 0.53 0.42 -1.23 0.00 0.00 174.94 173.67 1x4z s THR 81 N 5.74 3.53 0.00 2.92 -4.23 -1.26 -2.01 115.64 120.32 1x4z s THR 81 Ca 0.53 -0.97 0.00 0.00 -1.18 0.00 0.00 61.69 60.06 1x4z s THR 81 Cb -0.11 -3.21 0.00 0.00 1.34 0.00 0.00 72.50 70.52 1x4z s THR 81 CO 0.27 -0.08 0.00 0.61 -0.54 0.00 0.00 174.62 174.87 1x4z n GLY 82 N -1.77 0.74 2.27 3.99 0.00 -1.10 -4.95 105.19 104.37 1x4z n GLY 82 Ca 0.04 -0.57 -0.12 0.00 0.00 0.00 0.00 46.02 45.38 1x4z n GLY 82 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1x4z n LEU 83 N -0.68 0.00 -3.83 0.99 4.77 -0.66 -5.07 117.00 112.51 1x4z n LEU 83 Ca 0.00 -1.42 -0.25 0.00 -0.03 0.00 0.00 56.01 54.31 1x4z n LEU 83 Cb 0.48 -0.27 -0.17 0.00 -2.33 0.00 0.00 43.42 41.13 1x4z n LEU 83 CO 0.00 -0.65 -0.41 -1.61 -1.33 0.00 0.00 177.39 173.40 1x4z s GLU 84 N -3.59 1.01 0.79 3.23 2.02 -1.26 -4.97 118.70 115.93 1x4z s GLU 84 Ca 0.36 -0.07 -0.13 0.00 0.02 0.00 0.00 54.97 55.15 1x4z s GLU 84 Cb -0.03 -1.27 0.08 0.00 0.10 0.00 0.00 34.13 33.01 1x4z s GLU 84 CO 0.23 -0.30 1.17 0.15 0.02 0.00 0.00 175.26 176.54 1x4z s LYS 85 N 1.85 1.79 -0.69 1.61 1.02 -1.26 -2.60 119.74 121.46 1x4z s LYS 85 Ca 0.05 1.62 0.00 0.00 0.02 0.00 0.00 55.97 57.66 1x4z s LYS 85 Cb -0.12 -1.81 0.00 0.00 -0.52 0.00 0.00 37.83 35.38 1x4z s LYS 85 CO -0.07 -2.07 0.00 0.41 -0.92 0.00 0.00 175.35 172.71 1x4z n GLY 86 N 0.14 0.68 2.88 -3.33 0.00 -0.39 -4.93 105.19 100.24 1x4z n GLY 86 Ca 0.12 -0.05 -0.30 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 -1.68 1.52 0.37 -0.61 -1.09 -1.07 -5.03 121.20 113.61 1x4z s ILE 87 Ca 0.00 -1.73 -0.27 0.00 -2.23 0.00 0.00 60.65 56.42 1x4z s ILE 87 Cb 0.00 -2.08 -0.09 0.00 -1.58 0.00 0.00 42.46 38.71 1x4z s ILE 87 CO 0.00 -0.55 1.28 -0.44 -1.23 0.00 0.00 174.94 173.99 1x4z s SER 88 N 1.31 6.55 0.10 3.58 0.01 -1.26 -4.47 113.70 119.51 1x4z s SER 88 Ca 0.08 2.60 -0.26 0.00 1.31 0.00 0.00 55.95 59.69 1x4z s SER 88 Cb -0.18 -2.64 0.08 0.00 0.21 0.00 0.00 66.02 63.49 1x4z s SER 88 CO -0.15 -0.68 0.79 -0.72 0.41 0.00 0.00 173.24 172.88 1x4z s TYR 89 N -1.24 -0.36 0.27 2.43 -0.85 -1.20 -1.03 117.35 115.38 1x4z s TYR 89 Ca 0.54 0.15 0.03 0.00 -0.52 0.00 0.00 57.07 57.26 1x4z s TYR 89 Cb -0.37 0.58 0.03 0.00 0.38 0.00 0.00 41.96 42.57 1x4z s TYR 89 CO 0.48 -0.75 0.22 1.63 -1.52 0.00 0.00 175.55 175.61 1x4z n LYS 90 N -0.34 1.07 -3.88 -3.49 5.02 -0.75 -1.95 118.16 113.84 1x4z n LYS 90 Ca -0.11 -1.67 -0.11 0.00 -2.02 0.00 0.00 58.31 54.40 1x4z n LYS 90 Cb 0.62 0.16 -0.10 0.00 -0.02 0.00 0.00 35.03 35.70 1x4z n LYS 90 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1x4z s PHE 91 N -1.29 0.07 0.28 2.13 0.40 -1.26 -2.96 117.98 115.34 1x4z s PHE 91 Ca 0.16 -0.20 0.02 0.00 -0.60 0.00 0.00 56.93 56.31 1x4z s PHE 91 Cb -0.01 -0.06 -0.03 0.00 0.51 0.00 0.00 43.02 43.43 1x4z s PHE 91 CO 0.10 -0.30 0.26 -0.98 0.70 0.00 0.00 175.22 175.00 1x4z s ARG 92 N -1.61 1.55 -0.04 0.44 1.70 0.68 -2.04 118.95 119.64 1x4z s ARG 92 Ca -0.13 -1.79 -0.02 0.00 -0.47 0.00 0.00 55.73 53.32 1x4z s ARG 92 Cb -0.07 0.33 0.02 0.00 -0.57 0.00 0.00 34.95 34.66 1x4z s ARG 92 CO 0.00 -0.57 0.08 0.08 -1.08 0.00 0.00 175.30 173.82 1x4z s VAL 93 N -3.70 -0.02 0.01 4.99 1.01 -1.26 -2.79 120.40 118.65 1x4z s VAL 93 Ca 0.38 0.08 0.07 0.00 0.00 0.00 0.00 61.98 62.51 1x4z s VAL 93 Cb 0.04 -0.14 -0.02 0.00 0.00 0.00 0.00 36.38 36.26 1x4z s VAL 93 CO 0.20 0.03 -0.20 -0.13 0.00 0.00 0.00 175.10 175.00 1x4z s ARG 94 N 0.51 1.47 -0.18 2.72 0.52 0.13 -2.54 118.95 121.59 1x4z s ARG 94 Ca -0.04 -0.82 -0.07 0.00 -0.52 0.00 0.00 55.73 54.28 1x4z s ARG 94 Cb -0.06 -1.50 -0.04 0.00 0.52 0.00 0.00 34.95 33.87 1x4z s ARG 94 CO -0.02 0.40 0.07 0.00 0.02 0.00 0.00 175.30 175.76 1x4z s ALA 95 N -0.63 3.44 -0.16 2.13 0.00 -1.26 -0.12 121.76 125.16 1x4z s ALA 95 Ca 0.07 -0.74 0.00 0.00 0.00 0.00 0.00 51.96 51.30 1x4z s ALA 95 Cb -0.08 -1.92 0.03 0.00 0.00 0.00 0.00 23.12 21.14 1x4z s ALA 95 CO 0.00 0.21 -0.14 -0.51 0.00 0.00 0.00 175.76 175.33 1x4z s LEU 96 N 0.26 1.80 0.00 0.00 1.02 0.34 0.87 118.68 122.96 1x4z s LEU 96 Ca 0.04 -0.56 0.01 0.00 0.02 0.00 0.00 54.13 53.64 1x4z s LEU 96 Cb -0.12 -1.20 -0.00 0.00 0.02 0.00 0.00 46.19 44.89 1x4z s LEU 96 CO 0.00 -0.07 0.02 -0.46 0.02 0.00 0.00 176.35 175.86 1x4z n ASN 97 N 4.75 2.01 0.00 2.29 6.94 0.74 -1.56 115.26 130.43 1x4z n ASN 97 Ca -0.17 -1.83 0.07 0.00 -0.02 0.00 0.00 54.58 52.63 1x4z n ASN 97 Cb 0.49 0.22 0.39 0.00 -2.36 0.00 0.00 39.78 38.53 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 -0.43 0.40 -0.04 -3.83 0.00 -1.26 -1.87 117.12 110.08 1x4z n MET 98 Ca -0.06 0.02 -0.01 0.00 0.00 0.00 0.00 57.70 57.65 1x4z n MET 98 Cb 0.24 -1.50 -0.11 0.00 0.00 0.00 0.00 33.22 31.85 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 -1.03 0.00 0.00 3.17 4.77 -1.26 -5.12 117.00 117.53 1x4z n LEU 99 Ca 0.10 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 1x4z n LEU 99 Cb 0.05 0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 1x4z n LEU 99 CO 0.08 0.21 0.00 0.61 -1.33 0.00 0.00 177.39 176.96 1x4z n GLY 100 N 1.95 0.22 3.84 -0.72 0.00 -0.78 -4.70 105.19 105.00 1x4z n GLY 100 Ca -0.15 -1.60 -0.24 0.00 0.00 0.00 0.00 46.02 44.04 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 3.03 0.58 1.61 1.03 -1.26 -0.18 118.70 121.51 1x4z s GLU 101 Ca 0.00 -0.89 0.05 0.00 0.03 0.00 0.00 54.97 54.15 1x4z s GLU 101 Cb 0.00 -2.68 0.07 0.00 -0.80 0.00 0.00 34.13 30.72 1x4z s GLU 101 CO 0.00 0.45 0.80 -1.54 -1.33 0.00 0.00 175.26 173.64 1x4z s SER 102 N -3.47 5.03 0.74 0.83 1.04 0.25 -4.60 113.70 113.53 1x4z s SER 102 Ca 0.32 -0.46 -0.11 0.00 0.48 0.00 0.00 55.95 56.18 1x4z s SER 102 Cb -0.09 -0.21 0.04 0.00 0.10 0.00 0.00 66.02 65.85 1x4z s SER 102 CO 0.25 -1.33 1.08 -1.61 0.98 0.00 0.00 173.24 172.61 1x4z s GLU 103 N -4.76 2.48 -0.43 4.02 2.02 -1.26 -4.60 118.70 116.18 1x4z s GLU 103 Ca 0.61 1.14 -0.28 0.00 0.02 0.00 0.00 54.97 56.46 1x4z s GLU 103 Cb -0.07 -1.93 -0.01 0.00 0.10 0.00 0.00 34.13 32.22 1x4z s GLU 103 CO 0.39 -1.47 1.76 -1.25 0.02 0.00 0.00 175.26 174.71 1x4z s PRO 104 N -4.85 3.16 0.74 0.39 0.04 -1.26 -4.17 135.00 129.04 1x4z s PRO 104 Ca 0.61 1.10 -0.17 0.00 0.04 0.00 0.00 61.00 62.59 1x4z s PRO 104 Cb -0.17 -4.23 -0.09 0.00 0.04 0.00 0.00 34.50 30.06 1x4z s PRO 104 CO 0.54 -2.08 0.06 -1.13 0.04 0.00 0.00 177.00 174.43 1x4z n SER 105 N 10.80 -2.96 -4.57 6.66 3.41 -1.05 -4.79 113.62 121.11 1x4z n SER 105 Ca 0.21 0.50 -0.45 0.00 -0.26 0.00 0.00 58.87 58.87 1x4z n SER 105 Cb 0.49 -1.02 -0.02 0.00 -0.26 0.00 0.00 64.21 63.40 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 -2.24 -0.58 -2.04 7.33 0.00 -1.26 -4.59 120.51 117.12 1x4z n ALA 106 Ca 0.07 0.40 -0.32 0.00 0.00 0.00 0.00 53.44 53.59 1x4z n ALA 106 Cb 0.51 -1.97 -0.04 0.00 0.00 0.00 0.00 19.45 17.94 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 -1.37 2.59 0.93 0.00 0.04 -1.26 -4.55 135.00 131.38 1x4z s PRO 107 Ca 0.61 0.14 -0.16 0.00 0.04 0.00 0.00 61.00 61.62 1x4z s PRO 107 Cb -0.74 -4.74 -0.12 0.00 0.04 0.00 0.00 34.50 28.93 1x4z s PRO 107 CO 0.59 -3.07 -0.52 -1.13 0.04 0.00 0.00 177.00 172.90 1x4z n SER 108 N 13.40 -5.09 -4.49 6.66 3.41 -0.86 -4.82 113.62 121.82 1x4z n SER 108 Ca 0.31 0.26 -0.37 0.00 -0.26 0.00 0.00 58.87 58.81 1x4z n SER 108 Cb 0.49 -0.85 0.06 0.00 -0.26 0.00 0.00 64.21 63.66 1x4z n SER 108 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1x4z n ARG 109 N 1.70 0.43 -2.20 4.33 1.85 -1.26 -4.35 116.66 117.16 1x4z n ARG 109 Ca 0.01 0.18 -0.42 0.00 -1.00 0.00 0.00 57.85 56.62 1x4z n ARG 109 Cb 0.55 -1.86 -0.03 0.00 -1.05 0.00 0.00 32.46 30.06 1x4z n ARG 109 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 1x4z s PRO 110 N -2.63 4.32 -0.20 2.89 0.04 -1.26 -4.69 135.00 133.47 1x4z s PRO 110 Ca 0.68 2.04 0.01 0.00 0.04 0.00 0.00 61.00 63.77 1x4z s PRO 110 Cb -0.38 -3.30 0.03 0.00 0.04 0.00 0.00 34.50 30.88 1x4z s PRO 110 CO 0.55 -0.44 -0.17 -0.47 0.04 0.00 0.00 177.00 176.51 1x4z s TYR 111 N 1.28 2.88 -0.56 0.56 5.04 -0.82 -4.94 117.35 120.79 1x4z s TYR 111 Ca 0.64 -1.73 -0.20 0.00 -2.44 0.00 0.00 57.07 53.35 1x4z s TYR 111 Cb -0.36 -1.94 0.08 0.00 0.35 0.00 0.00 41.96 40.10 1x4z s TYR 111 CO 0.30 -0.81 0.72 0.08 -1.34 0.00 0.00 175.55 174.50 1x4z s VAL 112 N 1.27 4.76 -0.42 3.14 1.01 -1.26 -3.21 120.40 125.69 1x4z s VAL 112 Ca 0.02 -0.65 -0.28 0.00 0.00 0.00 0.00 61.98 61.07 1x4z s VAL 112 Cb -0.14 -4.44 -0.02 0.00 0.00 0.00 0.00 36.38 31.78 1x4z s VAL 112 CO -0.11 -1.04 1.81 -0.69 0.00 0.00 0.00 175.10 175.08 1x4z s VAL 113 N 2.89 3.45 -0.24 2.92 1.01 -1.26 -4.80 120.40 124.38 1x4z s VAL 113 Ca 0.15 0.42 0.04 0.00 0.00 0.00 0.00 61.98 62.59 1x4z s VAL 113 Cb -0.21 -3.74 -0.17 0.00 0.00 0.00 0.00 36.38 32.26 1x4z s VAL 113 CO 0.10 -0.56 -0.17 -0.24 0.00 0.00 0.00 175.10 174.23 1x4z n SER 114 N 11.06 1.78 0.00 3.32 2.88 -1.26 -1.26 113.62 130.14 1x4z n SER 114 Ca 0.22 -0.11 0.00 0.00 -1.33 0.00 0.00 58.87 57.65 1x4z n SER 114 Cb 0.49 -0.17 0.00 0.00 -0.75 0.00 0.00 64.21 63.78 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 2.24 1.56 3.23 0.46 0.00 -1.26 -4.85 105.19 106.57 1x4z n GLY 115 Ca -0.42 -0.40 -0.34 0.00 0.00 0.00 0.00 46.02 44.86 1x4z n GLY 115 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1x4z n SER 116 N 0.00 -3.33 0.00 1.61 3.41 -1.26 -4.50 113.62 109.55 1x4z n SER 116 Ca 0.00 0.17 0.00 0.00 -0.26 0.00 0.00 58.87 58.78 1x4z n SER 116 Cb 0.00 -0.97 0.00 0.00 -0.26 0.00 0.00 64.21 62.98 1x4z n SER 116 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1x4z n GLY 117 N 2.35 1.90 0.00 5.00 0.00 -1.26 -5.03 105.19 108.14 1x4z n GLY 117 Ca 0.02 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 44.97 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 -0.90 0.08 -4.02 1.61 -0.04 -1.26 -5.09 135.00 125.38 1x4z n PRO 118 Ca 0.00 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.34 1x4z n PRO 118 Cb 0.00 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.34 1x4z n PRO 118 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1x4z s SER 119 N -1.51 0.45 0.16 3.54 1.04 -1.26 -4.97 113.70 111.15 1x4z s SER 119 Ca 0.00 -0.34 -0.18 0.00 0.48 0.00 0.00 55.95 55.90 1x4z s SER 119 Cb 0.00 0.03 0.06 0.00 0.10 0.00 0.00 66.02 66.21 1x4z s SER 119 CO 0.00 -0.15 1.67 -1.28 0.98 0.00 0.00 173.24 174.46 1x4z h SER 120 N 5.14 -0.41 0.00 7.02 0.87 -1.95 -3.53 113.55 120.70 1x4z h SER 120 Ca -0.31 0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.36 1x4z h SER 120 Cb 1.20 0.24 0.00 0.00 -0.44 0.00 0.00 62.40 63.41 1x4z h SER 120 CO 0.44 -0.15 0.00 0.61 -0.53 0.00 0.00 176.83 177.21