#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 6.95 0.16 1.61 0.15 -1.26 -5.01 113.70 116.30 1x4z s SER 2 Ca 0.00 1.84 -0.16 0.00 0.70 0.00 0.00 55.95 58.33 1x4z s SER 2 Cb 0.00 -2.55 -0.07 0.00 -1.71 0.00 0.00 66.02 61.69 1x4z s SER 2 CO 0.00 -0.70 0.59 -0.44 1.20 0.00 0.00 173.24 173.89 1x4z s SER 3 N 1.87 6.90 -0.46 5.45 0.01 -1.26 -5.02 113.70 121.19 1x4z s SER 3 Ca 0.58 1.17 0.07 0.00 1.31 0.00 0.00 55.95 59.07 1x4z s SER 3 Cb -0.25 -2.32 0.29 0.00 0.21 0.00 0.00 66.02 63.95 1x4z s SER 3 CO 0.20 0.10 0.98 0.61 0.41 0.00 0.00 173.24 175.54 1x4z n GLY 4 N 0.87 0.79 2.87 3.44 0.00 -1.26 -5.13 105.19 106.78 1x4z n GLY 4 Ca -0.05 -0.17 -0.14 0.00 0.00 0.00 0.00 46.02 45.66 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 -1.50 0.24 0.01 1.61 0.01 -1.26 -5.07 113.70 107.73 1x4z s SER 5 Ca 0.27 -0.03 -0.20 0.00 1.31 0.00 0.00 55.95 57.31 1x4z s SER 5 Cb 0.27 -0.07 -0.11 0.00 0.21 0.00 0.00 66.02 66.32 1x4z s SER 5 CO -0.12 -0.02 0.97 0.28 0.41 0.00 0.00 173.24 174.77 1x4z h SER 6 N 6.44 -0.62 -0.96 2.44 0.02 -2.08 -3.48 113.55 115.32 1x4z h SER 6 Ca -0.31 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.66 1x4z h SER 6 Cb 1.18 0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.88 1x4z h SER 6 CO 0.50 -0.31 0.00 0.61 -1.14 0.00 0.00 176.83 176.49 1x4z n GLY 7 N -0.43 0.68 3.63 -3.77 0.00 -1.26 -5.08 105.19 98.97 1x4z n GLY 7 Ca -0.09 -0.34 -0.29 0.00 0.00 0.00 0.00 46.02 45.30 1x4z n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x4z s SER 8 N -2.38 1.93 -0.01 1.61 0.01 -1.26 -5.08 113.70 108.51 1x4z s SER 8 Ca 0.00 1.05 -0.20 0.00 1.31 0.00 0.00 55.95 58.11 1x4z s SER 8 Cb 0.00 -1.62 0.04 0.00 0.21 0.00 0.00 66.02 64.65 1x4z s SER 8 CO 0.00 -3.55 0.43 0.00 0.41 0.00 0.00 173.24 170.54 1x4z s GLN 9 N -5.03 0.83 0.08 12.44 -2.07 -1.26 -5.14 119.66 119.50 1x4z s GLN 9 Ca 0.67 -0.10 -0.31 0.00 -1.82 0.00 0.00 55.36 53.80 1x4z s GLN 9 Cb -0.17 0.38 -0.07 0.00 -1.09 0.00 0.00 33.01 32.06 1x4z s GLN 9 CO 0.58 -0.25 1.39 -1.25 -1.32 0.00 0.00 175.29 174.44 1x4z s PRO 10 N -1.52 4.31 -0.03 9.60 0.04 -1.26 -5.02 135.00 141.12 1x4z s PRO 10 Ca -0.11 2.04 -0.12 0.00 0.04 0.00 0.00 61.00 62.85 1x4z s PRO 10 Cb -0.03 -3.35 0.02 0.00 0.04 0.00 0.00 34.50 31.18 1x4z s PRO 10 CO 0.05 -0.47 0.25 -0.51 0.04 0.00 0.00 177.00 176.36 1x4z s ASP 11 N 1.36 -0.15 -1.52 6.66 1.01 -1.26 -4.90 116.67 117.87 1x4z s ASP 11 Ca 0.64 0.09 -0.12 0.00 0.71 0.00 0.00 52.55 53.88 1x4z s ASP 11 Cb -0.35 0.33 0.08 0.00 1.01 0.00 0.00 42.92 43.99 1x4z s ASP 11 CO 0.29 -0.36 0.87 1.41 0.21 0.00 0.00 175.17 177.60 1x4z n HIS 12 N 1.65 -2.12 -3.01 4.23 8.25 -1.26 -4.91 115.22 118.05 1x4z n HIS 12 Ca -0.20 0.87 0.05 0.00 -0.26 0.00 0.00 57.72 58.17 1x4z n HIS 12 Cb 0.56 -3.86 0.00 0.00 1.12 0.00 0.00 29.99 27.82 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 -3.53 -1.07 -0.70 -1.41 0.00 -1.26 -5.10 107.32 94.24 1x4z s GLY 13 Ca 0.54 2.10 -0.26 0.00 0.00 0.00 0.00 44.72 47.09 1x4z s GLY 13 CO 0.85 4.27 1.62 0.50 0.00 0.00 0.00 173.10 180.35 1x4z s ARG 14 N 2.69 2.88 0.36 2.90 0.52 -1.26 -4.97 118.95 122.07 1x4z s ARG 14 Ca 0.27 0.15 0.01 0.00 -0.52 0.00 0.00 55.73 55.64 1x4z s ARG 14 Cb 0.01 -4.39 0.07 0.00 0.52 0.00 0.00 34.95 31.16 1x4z s ARG 14 CO -0.21 -2.52 0.49 1.28 0.02 0.00 0.00 175.30 174.36 1x4z n LEU 15 N 11.36 0.00 -4.13 2.53 4.77 -1.26 -5.14 117.00 125.13 1x4z n LEU 15 Ca 0.15 -1.13 -0.09 0.00 -0.03 0.00 0.00 56.01 54.91 1x4z n LEU 15 Cb 0.51 -0.31 -0.10 0.00 -2.33 0.00 0.00 43.42 41.19 1x4z n LEU 15 CO 0.70 -0.72 -0.36 -0.44 -1.33 0.00 0.00 177.39 175.25 1x4z s SER 16 N -3.03 0.69 1.01 -1.43 0.01 -1.06 -5.11 113.70 104.78 1x4z s SER 16 Ca 0.33 -1.04 -0.12 0.00 1.31 0.00 0.00 55.95 56.43 1x4z s SER 16 Cb -0.02 0.18 0.20 0.00 0.21 0.00 0.00 66.02 66.58 1x4z s SER 16 CO 0.22 -0.58 1.09 -2.16 0.41 0.00 0.00 173.24 172.23 1x4z s PRO 17 N -3.91 0.30 0.66 12.44 0.04 -1.26 -4.09 135.00 139.18 1x4z s PRO 17 Ca 0.11 0.49 -0.15 0.00 0.04 0.00 0.00 61.00 61.49 1x4z s PRO 17 Cb 0.07 -1.72 -0.00 0.00 0.04 0.00 0.00 34.50 32.88 1x4z s PRO 17 CO -0.06 -2.81 1.11 -1.25 0.04 0.00 0.00 177.00 174.03 1x4z s PRO 18 N -4.96 2.82 0.48 0.56 0.04 -1.23 -3.38 135.00 129.33 1x4z s PRO 18 Ca 0.66 1.40 0.05 0.00 0.04 0.00 0.00 61.00 63.14 1x4z s PRO 18 Cb -0.19 -1.95 0.02 0.00 0.04 0.00 0.00 34.50 32.42 1x4z s PRO 18 CO 0.58 -1.24 0.66 -1.83 0.04 0.00 0.00 177.00 175.21 1x4z s GLU 19 N -4.07 2.70 -0.00 4.56 -1.05 -1.21 -3.66 118.70 115.96 1x4z s GLU 19 Ca 0.67 -1.03 -0.30 0.00 -0.15 0.00 0.00 54.97 54.16 1x4z s GLU 19 Cb -0.21 -2.64 -0.07 0.00 -0.44 0.00 0.00 34.13 30.78 1x4z s GLU 19 CO 0.41 -0.47 1.67 0.00 0.95 0.00 0.00 175.26 177.82 1x4z s ALA 20 N -2.53 3.63 0.83 -0.84 0.00 -1.26 -4.59 121.76 117.00 1x4z s ALA 20 Ca 0.56 1.06 -0.11 0.00 0.00 0.00 0.00 51.96 53.47 1x4z s ALA 20 Cb -0.10 -3.73 0.09 0.00 0.00 0.00 0.00 23.12 19.38 1x4z s ALA 20 CO 0.35 -1.29 1.09 -1.25 0.00 0.00 0.00 175.76 174.66 1x4z s PRO 21 N 3.54 1.80 1.01 0.00 0.04 -1.26 -4.75 135.00 135.38 1x4z s PRO 21 Ca 0.74 1.02 -0.17 0.00 0.04 0.00 0.00 61.00 62.63 1x4z s PRO 21 Cb -0.36 -1.86 0.07 0.00 0.04 0.00 0.00 34.50 32.39 1x4z s PRO 21 CO 0.31 -1.92 -0.16 -3.47 0.04 0.00 0.00 177.00 171.81 1x4z n ASP 22 N -3.69 -2.72 -4.68 6.66 2.03 0.76 -4.47 116.55 110.44 1x4z n ASP 22 Ca 0.08 -0.20 -0.43 0.00 0.52 0.00 0.00 54.79 54.76 1x4z n ASP 22 Cb 0.54 -0.76 -0.02 0.00 -0.72 0.00 0.00 41.12 40.16 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 4.38 0.38 -0.67 3.52 -1.26 -4.46 118.95 117.76 1x4z s ARG 23 Ca 0.40 1.37 -0.26 0.00 -0.13 0.00 0.00 55.73 57.11 1x4z s ARG 23 Cb -0.04 -3.57 -0.09 0.00 -1.56 0.00 0.00 34.95 29.69 1x4z s ARG 23 CO 0.48 -0.39 1.19 -1.25 -0.81 0.00 0.00 175.30 174.52 1x4z s PRO 24 N 2.29 4.12 0.49 5.12 0.04 -1.26 -4.72 135.00 141.07 1x4z s PRO 24 Ca 0.47 1.91 -0.00 0.00 0.04 0.00 0.00 61.00 63.42 1x4z s PRO 24 Cb -0.17 -2.76 0.01 0.00 0.04 0.00 0.00 34.50 31.61 1x4z s PRO 24 CO 0.15 -0.29 0.72 -0.08 0.04 0.00 0.00 177.00 177.54 1x4z s THR 25 N -1.35 3.65 -0.12 1.26 -1.32 0.35 -4.56 115.64 113.55 1x4z s THR 25 Ca 0.55 -0.49 -0.00 0.00 -1.21 0.00 0.00 61.69 60.54 1x4z s THR 25 Cb -0.33 -3.36 0.03 0.00 -1.51 0.00 0.00 72.50 67.33 1x4z s THR 25 CO 0.41 -0.26 -0.08 -0.63 -2.21 0.00 0.00 174.62 171.85 1x4z s ILE 26 N -2.64 1.10 0.42 5.08 -1.09 -1.26 -3.15 121.20 119.67 1x4z s ILE 26 Ca 0.51 -0.37 0.04 0.00 -2.23 0.00 0.00 60.65 58.60 1x4z s ILE 26 Cb -0.10 -1.12 -0.05 0.00 -1.58 0.00 0.00 42.46 39.61 1x4z s ILE 26 CO 0.39 0.36 0.04 -0.55 -1.23 0.00 0.00 174.94 173.94 1x4z s SER 27 N 1.67 3.43 -0.58 3.58 0.15 -0.43 -4.98 113.70 116.54 1x4z s SER 27 Ca 0.05 -1.51 -0.22 0.00 0.70 0.00 0.00 55.95 54.96 1x4z s SER 27 Cb -0.13 0.11 0.06 0.00 -1.71 0.00 0.00 66.02 64.35 1x4z s SER 27 CO -0.08 -0.69 0.86 -0.89 1.20 0.00 0.00 173.24 173.63 1x4z s THR 28 N -2.98 4.51 -0.18 6.45 2.01 -1.26 -2.71 115.64 121.48 1x4z s THR 28 Ca 0.24 -0.23 0.01 0.00 0.31 0.00 0.00 61.69 62.03 1x4z s THR 28 Cb 0.06 -4.53 -0.11 0.00 0.01 0.00 0.00 72.50 67.92 1x4z s THR 28 CO 0.12 -1.17 -0.16 0.00 -0.69 0.00 0.00 174.62 172.73 1x4z n ALA 29 N 7.17 1.63 -3.77 7.40 0.00 -1.25 -4.79 120.51 126.89 1x4z n ALA 29 Ca -0.03 -0.75 -0.08 0.00 0.00 0.00 0.00 53.44 52.59 1x4z n ALA 29 Cb 0.46 0.10 -0.02 0.00 0.00 0.00 0.00 19.45 19.99 1x4z n ALA 29 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1x4z s SER 30 N -5.73 -0.31 0.39 0.00 0.01 -0.31 -4.92 113.70 102.83 1x4z s SER 30 Ca -0.24 -0.48 0.28 0.00 1.31 0.00 0.00 55.95 56.83 1x4z s SER 30 Cb 0.06 0.68 1.04 0.00 0.21 0.00 0.00 66.02 68.02 1x4z s SER 30 CO 0.40 -1.24 1.82 1.05 0.41 0.00 0.00 173.24 175.68 1x4z h GLU 31 N 2.00 0.00 -0.00 12.44 4.11 -1.88 -3.07 114.58 128.18 1x4z h GLU 31 Ca -0.22 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.21 1x4z h GLU 31 Cb 1.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.51 1x4z h GLU 31 CO 0.26 0.00 -0.01 0.25 0.07 0.00 0.00 179.01 179.58 1x4z n THR 32 N -2.69 0.00 -4.18 -1.06 -2.24 -1.26 -4.72 114.28 98.13 1x4z n THR 32 Ca 0.02 -0.49 -0.12 0.00 -2.27 0.00 0.00 64.05 61.18 1x4z n THR 32 Cb 0.32 1.01 -0.09 0.00 -2.10 0.00 0.00 70.33 69.47 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 -0.50 0.29 -0.02 3.42 1.04 -1.16 -2.29 113.70 114.48 1x4z s SER 33 Ca 0.00 -1.37 -0.14 0.00 0.48 0.00 0.00 55.95 54.92 1x4z s SER 33 Cb 0.00 0.43 0.02 0.00 0.10 0.00 0.00 66.02 66.58 1x4z s SER 33 CO 0.01 -0.91 0.30 0.68 0.98 0.00 0.00 173.24 174.30 1x4z s VAL 34 N -4.04 0.06 -0.30 5.02 -7.23 -1.05 -1.16 120.40 111.69 1x4z s VAL 34 Ca 0.37 -0.46 -0.27 0.00 -1.81 0.00 0.00 61.98 59.82 1x4z s VAL 34 Cb 0.05 -0.59 0.01 0.00 0.56 0.00 0.00 36.38 36.41 1x4z s VAL 34 CO 0.13 -0.25 0.94 -0.31 -0.31 0.00 0.00 175.10 175.31 1x4z s TYR 35 N -1.22 3.21 -0.14 2.82 2.02 -1.10 -1.00 117.35 121.95 1x4z s TYR 35 Ca -0.13 1.09 -0.01 0.00 -0.37 0.00 0.00 57.07 57.65 1x4z s TYR 35 Cb -0.05 -3.41 -0.02 0.00 -0.40 0.00 0.00 41.96 38.08 1x4z s TYR 35 CO 0.04 -0.62 -0.09 0.08 -1.57 0.00 0.00 175.55 173.38 1x4z s VAL 36 N 3.27 3.39 -0.09 0.71 1.01 0.74 -1.31 120.40 128.12 1x4z s VAL 36 Ca 0.40 -0.54 0.01 0.00 0.00 0.00 0.00 61.98 61.84 1x4z s VAL 36 Cb -0.14 -2.45 0.02 0.00 0.00 0.00 0.00 36.38 33.82 1x4z s VAL 36 CO 0.12 0.52 -0.10 -0.89 0.00 0.00 0.00 175.10 174.75 1x4z s THR 37 N 0.28 1.07 0.38 3.92 2.01 -1.19 -0.46 115.64 121.66 1x4z s THR 37 Ca -0.07 -0.38 0.06 0.00 0.31 0.00 0.00 61.69 61.61 1x4z s THR 37 Cb -0.15 -1.03 -0.08 0.00 0.01 0.00 0.00 72.50 71.25 1x4z s THR 37 CO 0.04 0.36 0.02 -1.66 -0.69 0.00 0.00 174.62 172.70 1x4z s TRP 38 N 1.18 2.36 -0.22 4.92 -2.14 0.15 -0.49 118.94 124.70 1x4z s TRP 38 Ca -0.05 -0.75 -0.02 0.00 2.66 0.00 0.00 56.10 57.94 1x4z s TRP 38 Cb -0.14 -1.63 0.07 0.00 -3.10 0.00 0.00 33.47 28.67 1x4z s TRP 38 CO -0.02 0.32 0.04 0.42 -2.66 0.00 0.00 176.95 175.05 1x4z s ILE 39 N -2.88 0.66 0.38 0.66 -1.09 -1.26 -4.73 121.20 112.94 1x4z s ILE 39 Ca 0.35 -0.78 -0.26 0.00 -2.23 0.00 0.00 60.65 57.74 1x4z s ILE 39 Cb 0.10 -1.22 -0.09 0.00 -1.58 0.00 0.00 42.46 39.67 1x4z s ILE 39 CO 0.17 -0.30 1.20 -2.16 -1.23 0.00 0.00 174.94 172.62 1x4z s PRO 40 N 1.78 4.12 0.00 2.79 0.04 -1.26 -0.17 135.00 142.30 1x4z s PRO 40 Ca 0.01 1.92 0.00 0.00 0.04 0.00 0.00 61.00 62.97 1x4z s PRO 40 Cb -0.17 -2.77 0.00 0.00 0.04 0.00 0.00 34.50 31.60 1x4z s PRO 40 CO -0.12 -0.29 0.00 0.54 0.04 0.00 0.00 177.00 177.18 1x4z n ARG 41 N 0.25 0.00 -4.01 4.56 5.12 -1.26 -4.87 116.66 116.45 1x4z n ARG 41 Ca 0.03 0.00 -0.28 0.00 -1.93 0.00 0.00 57.85 55.68 1x4z n ARG 41 Cb 0.45 -0.22 -0.05 0.00 -1.16 0.00 0.00 32.46 31.49 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 -2.93 1.83 0.00 -0.13 0.00 -1.26 -5.01 107.32 99.83 1x4z s GLY 42 Ca 0.00 -1.07 0.00 0.00 0.00 0.00 0.00 44.72 43.65 1x4z s GLY 42 CO 0.00 -1.07 0.77 1.16 0.00 0.00 0.00 173.10 173.96 1x4z n ASN 43 N -0.17 1.50 0.00 1.64 6.94 -1.26 -3.29 115.26 120.62 1x4z n ASN 43 Ca -0.08 -1.55 0.00 0.00 -0.02 0.00 0.00 54.58 52.93 1x4z n ASN 43 Cb 0.53 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.95 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 -0.28 0.91 0.00 4.83 0.00 -1.22 -3.33 105.19 106.11 1x4z n GLY 44 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.13 2.43 3.75 -0.02 0.00 -1.26 -2.55 105.19 105.41 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 -2.31 2.84 -0.13 1.61 0.08 -1.21 -5.08 117.98 113.77 1x4z s PHE 46 Ca 0.00 -0.25 -0.29 0.00 0.12 0.00 0.00 56.93 56.50 1x4z s PHE 46 Cb 0.00 -1.48 -0.04 0.00 -0.57 0.00 0.00 43.02 40.94 1x4z s PHE 46 CO 0.00 0.44 1.55 -1.25 -0.10 0.00 0.00 175.22 175.87 1x4z s PRO 47 N -3.82 4.07 0.24 0.24 0.04 -1.26 -4.68 135.00 129.84 1x4z s PRO 47 Ca 0.35 1.91 -0.29 0.00 0.04 0.00 0.00 61.00 63.00 1x4z s PRO 47 Cb -0.05 -3.95 -0.15 0.00 0.04 0.00 0.00 34.50 30.39 1x4z s PRO 47 CO 0.23 -0.95 1.00 -0.89 0.04 0.00 0.00 177.00 176.43 1x4z n ILE 48 N 5.74 1.66 -0.11 0.56 5.41 -1.26 -4.67 119.36 126.69 1x4z n ILE 48 Ca 0.17 -0.42 -0.22 0.00 1.00 0.00 0.00 62.75 63.28 1x4z n ILE 48 Cb 0.44 -0.83 -0.10 0.00 -0.71 0.00 0.00 39.64 38.44 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 1.06 0.56 -3.68 0.38 6.02 -0.59 -4.75 117.38 116.38 1x4z n GLN 49 Ca 0.12 0.48 -0.09 0.00 -0.01 0.00 0.00 57.00 57.50 1x4z n GLN 49 Cb 0.29 -1.67 -0.03 0.00 1.02 0.00 0.00 30.24 29.86 1x4z n GLN 49 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 1x4z s SER 50 N -6.89 -0.36 0.41 1.08 1.04 -0.88 -4.52 113.70 103.59 1x4z s SER 50 Ca -0.30 -0.38 0.07 0.00 0.48 0.00 0.00 55.95 55.82 1x4z s SER 50 Cb 0.08 0.64 -0.05 0.00 0.10 0.00 0.00 66.02 66.78 1x4z s SER 50 CO 0.53 -1.13 0.17 -0.36 0.98 0.00 0.00 173.24 173.43 1x4z s PHE 51 N -3.85 2.60 -0.08 5.02 0.08 -0.76 -1.58 117.98 119.41 1x4z s PHE 51 Ca 0.07 -0.60 -0.07 0.00 0.12 0.00 0.00 56.93 56.46 1x4z s PHE 51 Cb -0.03 -1.95 0.02 0.00 -0.57 0.00 0.00 43.02 40.50 1x4z s PHE 51 CO -0.03 0.20 0.20 1.03 -0.10 0.00 0.00 175.22 176.53 1x4z s ARG 52 N -3.89 0.22 -0.08 0.44 0.52 -0.34 -3.20 118.95 112.62 1x4z s ARG 52 Ca 0.41 0.31 0.04 0.00 -0.52 0.00 0.00 55.73 55.96 1x4z s ARG 52 Cb 0.04 0.07 -0.01 0.00 0.52 0.00 0.00 34.95 35.57 1x4z s ARG 52 CO 0.22 -0.05 -0.20 0.08 0.02 0.00 0.00 175.30 175.38 1x4z s VAL 53 N 0.29 2.52 0.21 3.52 1.01 -1.16 -0.17 120.40 126.63 1x4z s VAL 53 Ca -0.02 -0.88 0.07 0.00 0.00 0.00 0.00 61.98 61.15 1x4z s VAL 53 Cb -0.03 -1.98 -0.05 0.00 0.00 0.00 0.00 36.38 34.32 1x4z s VAL 53 CO -0.01 0.56 -0.12 -1.61 0.00 0.00 0.00 175.10 173.92 1x4z s GLU 54 N -0.06 1.33 -0.03 2.72 2.02 -1.11 -0.86 118.70 122.72 1x4z s GLU 54 Ca -0.05 -1.61 -0.06 0.00 0.02 0.00 0.00 54.97 53.27 1x4z s GLU 54 Cb -0.14 -1.05 0.01 0.00 0.10 0.00 0.00 34.13 33.04 1x4z s GLU 54 CO 0.04 0.14 0.15 1.52 0.02 0.00 0.00 175.26 177.13 1x4z s TYR 55 N -3.03 -0.07 -0.05 1.61 -0.85 0.37 -1.61 117.35 113.72 1x4z s TYR 55 Ca 0.23 0.15 0.03 0.00 -0.52 0.00 0.00 57.07 56.96 1x4z s TYR 55 Cb 0.00 0.01 0.00 0.00 0.38 0.00 0.00 41.96 42.35 1x4z s TYR 55 CO 0.07 -0.18 -0.14 0.21 -1.52 0.00 0.00 175.55 173.98 1x4z s LYS 56 N -0.64 1.63 0.30 -3.49 2.20 -1.22 0.36 119.74 118.89 1x4z s LYS 56 Ca -0.07 -0.50 -0.29 0.00 -0.36 0.00 0.00 55.97 54.75 1x4z s LYS 56 Cb -0.04 -1.40 -0.10 0.00 -1.51 0.00 0.00 37.83 34.78 1x4z s LYS 56 CO 0.01 0.15 1.14 0.15 -0.36 0.00 0.00 175.35 176.45 1x4z s LYS 57 N 0.26 4.52 -0.16 4.03 3.01 -1.24 -2.40 119.74 127.75 1x4z s LYS 57 Ca -0.07 1.88 -0.06 0.00 -1.01 0.00 0.00 55.97 56.71 1x4z s LYS 57 Cb -0.12 -3.10 -0.08 0.00 -1.01 0.00 0.00 37.83 33.52 1x4z s LYS 57 CO 0.02 0.08 -0.19 1.28 0.51 0.00 0.00 175.35 177.05 1x4z n LEU 58 N 0.97 1.56 -0.47 3.17 4.77 0.95 -4.56 117.00 123.39 1x4z n LEU 58 Ca -0.00 0.13 0.38 0.00 -0.03 0.00 0.00 56.01 56.50 1x4z n LEU 58 Cb 0.44 -0.49 0.68 0.00 -2.33 0.00 0.00 43.42 41.73 1x4z n LEU 58 CO 0.54 0.43 1.29 0.11 -1.33 0.00 0.00 177.39 178.43 1x4z h LYS 59 N -0.45 0.09 -3.54 3.23 1.57 -1.93 -3.42 116.57 112.11 1x4z h LYS 59 Ca -0.39 -0.01 -0.05 0.00 -1.87 0.00 0.00 60.65 58.33 1x4z h LYS 59 Cb 1.40 -0.02 -0.11 0.00 0.08 0.00 0.00 32.23 33.58 1x4z h LYS 59 CO -0.20 0.06 -0.11 -1.59 -0.57 0.00 0.00 179.45 177.03 1x4z s LYS 60 N -5.21 1.33 1.03 3.15 0.00 -1.26 -5.09 119.74 113.69 1x4z s LYS 60 Ca -0.07 -1.02 -0.19 0.00 0.00 0.00 0.00 55.97 54.68 1x4z s LYS 60 Cb 0.28 0.47 -0.04 0.00 0.00 0.00 0.00 37.83 38.54 1x4z s LYS 60 CO 0.83 -0.54 -0.47 1.55 0.00 0.00 0.00 175.35 176.72 1x4z n VAL 61 N -0.30 0.00 0.00 1.79 3.14 -1.26 -4.66 118.33 117.03 1x4z n VAL 61 Ca -0.08 -0.24 0.00 0.00 -2.96 0.00 0.00 64.34 61.06 1x4z n VAL 61 Cb 0.62 -0.34 0.00 0.00 -1.06 0.00 0.00 33.84 33.07 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 2.57 2.14 3.04 7.55 0.00 -1.26 -4.84 105.19 114.39 1x4z n GLY 62 Ca 0.01 -0.10 -0.20 0.00 0.00 0.00 0.00 46.02 45.72 1x4z n GLY 62 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1x4z n ASP 63 N 0.00 -2.85 -4.76 1.61 2.03 -1.26 -3.68 116.55 107.64 1x4z n ASP 63 Ca 0.00 -0.30 -0.36 0.00 0.52 0.00 0.00 54.79 54.65 1x4z n ASP 63 Cb 0.00 -0.76 0.02 0.00 -0.72 0.00 0.00 41.12 39.66 1x4z n ASP 63 CO 0.00 0.00 0.00 0.26 -1.92 0.00 0.00 177.20 175.54 1x4z s TRP 64 N -2.09 2.55 0.13 -0.67 0.52 -1.26 -4.50 118.94 113.63 1x4z s TRP 64 Ca 0.37 1.52 0.06 0.00 0.02 0.00 0.00 56.10 58.07 1x4z s TRP 64 Cb -0.05 -3.42 -0.04 0.00 -1.15 0.00 0.00 33.47 28.81 1x4z s TRP 64 CO 0.38 -1.92 -0.15 0.42 0.02 0.00 0.00 176.95 175.70 1x4z s ILE 65 N -1.63 1.44 -0.34 2.03 -1.09 0.16 -4.92 121.20 116.84 1x4z s ILE 65 Ca 0.74 -1.75 -0.23 0.00 -2.23 0.00 0.00 60.65 57.18 1x4z s ILE 65 Cb -0.28 -1.59 0.00 0.00 -1.58 0.00 0.00 42.46 39.01 1x4z s ILE 65 CO 0.32 -0.38 0.77 -0.22 -1.23 0.00 0.00 174.94 174.20 1x4z s LEU 66 N -2.47 4.12 -0.12 2.97 2.96 -1.26 -0.48 118.68 124.39 1x4z s LEU 66 Ca 0.10 0.47 -0.07 0.00 -0.22 0.00 0.00 54.13 54.41 1x4z s LEU 66 Cb -0.05 -3.03 -0.05 0.00 0.50 0.00 0.00 46.19 43.57 1x4z s LEU 66 CO 0.04 -0.67 0.03 0.00 -1.32 0.00 0.00 176.35 174.42 1x4z h ALA 67 N 8.33 0.02 -2.88 5.97 0.00 -1.33 -3.48 119.26 125.88 1x4z h ALA 67 Ca -0.25 -0.28 -0.49 0.00 0.00 0.00 0.00 54.91 53.90 1x4z h ALA 67 Cb 1.10 0.21 -0.13 0.00 0.00 0.00 0.00 17.79 18.96 1x4z h ALA 67 CO 0.89 0.20 -0.48 -0.08 0.00 0.00 0.00 179.25 179.78 1x4z s THR 68 N -1.88 0.01 0.01 0.00 -1.32 -1.17 -4.92 115.64 106.37 1x4z s THR 68 Ca -0.08 -2.00 -0.29 0.00 -1.21 0.00 0.00 61.69 58.11 1x4z s THR 68 Cb 0.01 -2.49 0.11 0.00 -1.51 0.00 0.00 72.50 68.61 1x4z s THR 68 CO 0.17 0.00 1.25 -0.55 -2.21 0.00 0.00 174.62 173.28 1x4z s SER 69 N -3.39 -0.05 -0.68 8.08 0.15 -1.26 -2.99 113.70 113.56 1x4z s SER 69 Ca 0.40 -0.20 -0.02 0.00 0.70 0.00 0.00 55.95 56.84 1x4z s SER 69 Cb 0.02 0.20 0.00 0.00 -1.71 0.00 0.00 66.02 64.53 1x4z s SER 69 CO 0.28 -0.38 0.20 0.00 1.20 0.00 0.00 173.24 174.55 1x4z n ALA 70 N -0.58 -0.38 -2.34 5.45 0.00 -1.19 -5.01 120.51 116.46 1x4z n ALA 70 Ca -0.06 0.11 -0.39 0.00 0.00 0.00 0.00 53.44 53.11 1x4z n ALA 70 Cb 0.62 -1.79 -0.06 0.00 0.00 0.00 0.00 19.45 18.22 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 -2.72 4.78 0.74 0.00 1.01 -1.24 -4.90 121.20 118.86 1x4z s ILE 71 Ca 0.10 1.27 -0.12 0.00 0.00 0.00 0.00 60.65 61.90 1x4z s ILE 71 Cb -0.04 -3.93 0.04 0.00 0.01 0.00 0.00 42.46 38.53 1x4z s ILE 71 CO 0.13 0.50 1.10 -2.16 0.00 0.00 0.00 174.94 174.50 1x4z s PRO 72 N -0.73 2.42 0.55 2.79 0.04 -1.26 -1.83 135.00 136.98 1x4z s PRO 72 Ca 0.30 1.25 0.33 0.00 0.04 0.00 0.00 61.00 62.92 1x4z s PRO 72 Cb -0.19 -1.91 1.38 0.00 0.04 0.00 0.00 34.50 33.81 1x4z s PRO 72 CO 0.19 -1.52 1.99 -1.00 0.04 0.00 0.00 177.00 176.70 1x4z h PRO 73 N -0.75 0.00 0.00 0.56 0.13 -1.86 -2.48 132.00 127.60 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 0.52 0.02 -0.32 -1.13 -0.23 0.00 0.00 178.00 176.86 1x4z n SER 74 N -3.13 0.63 -4.36 1.44 3.41 -1.26 -4.66 113.62 105.69 1x4z n SER 74 Ca 0.00 0.28 -0.44 0.00 -0.26 0.00 0.00 58.87 58.45 1x4z n SER 74 Cb 0.31 -0.23 -0.08 0.00 -0.26 0.00 0.00 64.21 63.95 1x4z n SER 74 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1x4z s ARG 75 N -3.10 2.91 -0.09 4.33 3.52 -0.93 -4.89 118.95 120.69 1x4z s ARG 75 Ca 0.09 -1.41 0.17 0.00 -0.13 0.00 0.00 55.73 54.46 1x4z s ARG 75 Cb 0.14 -4.08 0.63 0.00 -1.56 0.00 0.00 34.95 30.07 1x4z s ARG 75 CO 0.65 -1.05 1.54 1.28 -0.81 0.00 0.00 175.30 176.92 1x4z n LEU 76 N 5.15 4.28 -3.69 -0.88 4.77 -1.26 -4.70 117.00 120.67 1x4z n LEU 76 Ca -0.12 -2.38 -0.10 0.00 -0.03 0.00 0.00 56.01 53.38 1x4z n LEU 76 Cb 0.43 -0.51 -0.10 0.00 -2.33 0.00 0.00 43.42 40.91 1x4z n LEU 76 CO 0.46 0.81 0.08 -0.55 -1.33 0.00 0.00 177.39 176.86 1x4z s SER 77 N -1.05 -0.55 0.08 -1.43 0.15 -1.26 -0.67 113.70 108.97 1x4z s SER 77 Ca 0.45 0.95 -0.08 0.00 0.70 0.00 0.00 55.95 57.97 1x4z s SER 77 Cb 0.29 0.84 -0.01 0.00 -1.71 0.00 0.00 66.02 65.43 1x4z s SER 77 CO 0.23 -0.20 0.17 0.68 1.20 0.00 0.00 173.24 175.31 1x4z s VAL 78 N 1.45 0.15 -0.35 4.45 -7.23 0.39 -4.97 120.40 114.29 1x4z s VAL 78 Ca -0.09 -1.22 -0.14 0.00 -1.81 0.00 0.00 61.98 58.71 1x4z s VAL 78 Cb -0.08 -1.32 -0.01 0.00 0.56 0.00 0.00 36.38 35.53 1x4z s VAL 78 CO -0.13 -0.68 0.31 -0.70 -0.31 0.00 0.00 175.10 173.59 1x4z s GLU 79 N -3.75 3.47 -0.64 4.82 2.12 -1.26 -0.18 118.70 123.27 1x4z s GLU 79 Ca 0.04 -0.58 -0.26 0.00 0.36 0.00 0.00 54.97 54.53 1x4z s GLU 79 Cb 0.05 -3.83 0.04 0.00 0.26 0.00 0.00 34.13 30.65 1x4z s GLU 79 CO -0.10 -0.52 1.15 0.42 -0.54 0.00 0.00 175.26 175.67 1x4z s ILE 80 N 1.87 4.02 0.31 -3.70 -1.09 -0.17 -4.84 121.20 117.59 1x4z s ILE 80 Ca 0.09 0.48 0.07 0.00 -2.23 0.00 0.00 60.65 59.05 1x4z s ILE 80 Cb -0.17 -4.76 -0.02 0.00 -1.58 0.00 0.00 42.46 35.93 1x4z s ILE 80 CO 0.11 -1.49 0.39 0.42 -1.23 0.00 0.00 174.94 173.14 1x4z s THR 81 N 4.94 4.16 0.00 2.92 -4.23 -1.26 -2.54 115.64 119.64 1x4z s THR 81 Ca 0.36 -1.11 0.00 0.00 -1.18 0.00 0.00 61.69 59.75 1x4z s THR 81 Cb -0.10 -3.43 0.00 0.00 1.34 0.00 0.00 72.50 70.32 1x4z s THR 81 CO 0.19 -0.20 0.00 0.61 -0.54 0.00 0.00 174.62 174.68 1x4z n GLY 82 N -1.51 1.01 3.92 3.99 0.00 -1.20 -4.99 105.19 106.42 1x4z n GLY 82 Ca -0.02 -0.32 -0.23 0.00 0.00 0.00 0.00 46.02 45.44 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 -0.41 3.00 -0.07 0.99 1.43 -0.97 -5.10 118.68 117.55 1x4z s LEU 83 Ca 0.00 -1.00 0.05 0.00 -1.03 0.00 0.00 54.13 52.15 1x4z s LEU 83 Cb 0.00 -1.56 -0.01 0.00 0.03 0.00 0.00 46.19 44.66 1x4z s LEU 83 CO 0.00 -1.02 -0.25 -1.61 0.23 0.00 0.00 176.35 173.71 1x4z s GLU 84 N -4.32 2.72 0.80 1.70 0.41 -1.26 -4.92 118.70 113.83 1x4z s GLU 84 Ca 0.44 -0.89 -0.10 0.00 -0.41 0.00 0.00 54.97 54.01 1x4z s GLU 84 Cb -0.03 -2.20 0.08 0.00 -1.78 0.00 0.00 34.13 30.19 1x4z s GLU 84 CO 0.27 0.31 1.10 0.15 -0.49 0.00 0.00 175.26 176.60 1x4z s LYS 85 N 0.02 1.98 -0.65 1.61 1.02 -1.26 -3.17 119.74 119.30 1x4z s LYS 85 Ca -0.09 1.23 0.00 0.00 0.02 0.00 0.00 55.97 57.13 1x4z s LYS 85 Cb -0.15 -1.86 0.00 0.00 -0.52 0.00 0.00 37.83 35.30 1x4z s LYS 85 CO 0.06 -1.85 0.00 0.41 -0.92 0.00 0.00 175.35 173.04 1x4z n GLY 86 N -0.94 0.69 2.98 -3.33 0.00 -0.49 -4.95 105.19 99.14 1x4z n GLY 86 Ca 0.09 -0.11 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 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 -1.77 1.69 0.09 -0.61 -1.09 -1.19 -5.02 121.20 113.30 1x4z s ILE 87 Ca 0.00 -1.27 -0.29 0.00 -2.23 0.00 0.00 60.65 56.86 1x4z s ILE 87 Cb 0.00 -1.88 -0.05 0.00 -1.58 0.00 0.00 42.46 38.94 1x4z s ILE 87 CO 0.00 -0.03 0.93 -0.44 -1.23 0.00 0.00 174.94 174.17 1x4z s SER 88 N 1.33 7.43 0.18 3.58 0.01 -1.26 -4.19 113.70 120.78 1x4z s SER 88 Ca -0.06 1.72 -0.18 0.00 1.31 0.00 0.00 55.95 58.74 1x4z s SER 88 Cb -0.19 -2.56 0.04 0.00 0.21 0.00 0.00 66.02 63.52 1x4z s SER 88 CO -0.06 -0.07 0.53 -0.72 0.41 0.00 0.00 173.24 173.32 1x4z s TYR 89 N 0.09 -0.20 0.55 2.43 -0.85 -1.23 -0.03 117.35 118.09 1x4z s TYR 89 Ca 0.46 -0.12 0.06 0.00 -0.52 0.00 0.00 57.07 56.95 1x4z s TYR 89 Cb -0.23 0.42 0.05 0.00 0.38 0.00 0.00 41.96 42.58 1x4z s TYR 89 CO 0.28 -0.89 0.47 0.15 -1.52 0.00 0.00 175.55 174.05 1x4z s LYS 90 N -3.84 2.27 0.06 -3.49 1.02 -1.01 -2.17 119.74 112.57 1x4z s LYS 90 Ca 0.07 -1.94 0.02 0.00 0.02 0.00 0.00 55.97 54.14 1x4z s LYS 90 Cb -0.01 -2.20 -0.03 0.00 -0.52 0.00 0.00 37.83 35.07 1x4z s LYS 90 CO -0.05 -0.65 -0.08 -0.06 -0.92 0.00 0.00 175.35 173.59 1x4z s PHE 91 N -2.75 0.77 0.25 3.18 0.40 -1.26 -3.39 117.98 115.18 1x4z s PHE 91 Ca 0.39 -0.61 -0.07 0.00 -0.60 0.00 0.00 56.93 56.04 1x4z s PHE 91 Cb -0.03 -0.45 -0.01 0.00 0.51 0.00 0.00 43.02 43.04 1x4z s PHE 91 CO 0.25 -0.09 0.37 -0.98 0.70 0.00 0.00 175.22 175.46 1x4z s ARG 92 N -2.22 1.51 -0.00 0.44 1.70 -0.63 -1.73 118.95 118.01 1x4z s ARG 92 Ca -0.03 -1.46 0.01 0.00 -0.47 0.00 0.00 55.73 53.78 1x4z s ARG 92 Cb -0.06 0.40 -0.00 0.00 -0.57 0.00 0.00 34.95 34.72 1x4z s ARG 92 CO -0.01 -0.59 -0.03 0.08 -1.08 0.00 0.00 175.30 173.66 1x4z s VAL 93 N -3.89 0.27 -0.04 4.99 1.01 -1.26 -2.74 120.40 118.75 1x4z s VAL 93 Ca 0.29 -0.18 0.03 0.00 0.00 0.00 0.00 61.98 62.13 1x4z s VAL 93 Cb 0.02 -0.24 0.00 0.00 0.00 0.00 0.00 36.38 36.16 1x4z s VAL 93 CO 0.12 0.06 -0.14 -0.13 0.00 0.00 0.00 175.10 175.01 1x4z s ARG 94 N -0.13 1.48 -0.11 2.72 0.52 0.76 -2.58 118.95 121.60 1x4z s ARG 94 Ca 0.01 -0.48 -0.15 0.00 -0.52 0.00 0.00 55.73 54.59 1x4z s ARG 94 Cb -0.02 -1.30 -0.05 0.00 0.52 0.00 0.00 34.95 34.11 1x4z s ARG 94 CO -0.00 0.18 0.36 0.00 0.02 0.00 0.00 175.30 175.86 1x4z s ALA 95 N 0.16 3.60 -0.12 2.13 0.00 -1.26 -1.20 121.76 125.05 1x4z s ALA 95 Ca -0.05 -0.34 0.00 0.00 0.00 0.00 0.00 51.96 51.58 1x4z s ALA 95 Cb -0.11 -2.44 0.02 0.00 0.00 0.00 0.00 23.12 20.59 1x4z s ALA 95 CO 0.02 0.18 -0.11 -0.51 0.00 0.00 0.00 175.76 175.34 1x4z s LEU 96 N 0.10 1.43 0.00 0.00 1.02 -0.61 0.11 118.68 120.73 1x4z s LEU 96 Ca 0.21 -0.38 0.00 0.00 0.02 0.00 0.00 54.13 53.98 1x4z s LEU 96 Cb -0.14 -0.99 -0.00 0.00 0.02 0.00 0.00 46.19 45.08 1x4z s LEU 96 CO 0.08 -0.08 0.01 -0.46 0.02 0.00 0.00 176.35 175.92 1x4z n ASN 97 N 4.79 1.90 0.00 2.29 6.94 0.76 -1.54 115.26 130.40 1x4z n ASN 97 Ca -0.15 -1.52 0.06 0.00 -0.02 0.00 0.00 54.58 52.95 1x4z n ASN 97 Cb 0.50 0.14 0.38 0.00 -2.36 0.00 0.00 39.78 38.43 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 -0.27 0.51 -0.03 -3.83 0.00 -1.26 -2.12 117.12 110.12 1x4z n MET 98 Ca -0.04 0.00 -0.01 0.00 0.00 0.00 0.00 57.70 57.65 1x4z n MET 98 Cb 0.15 -1.38 -0.08 0.00 0.00 0.00 0.00 33.22 31.90 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 -0.88 0.00 0.00 3.17 4.77 -1.26 -5.06 117.00 117.73 1x4z n LEU 99 Ca 0.09 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 1x4z n LEU 99 Cb 0.04 0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 1x4z n LEU 99 CO 0.07 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 176.90 1x4z n GLY 100 N 2.18 0.04 3.84 -0.72 0.00 -0.90 -4.74 105.19 104.89 1x4z n GLY 100 Ca -0.11 -1.53 -0.23 0.00 0.00 0.00 0.00 46.02 44.14 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 3.00 0.57 1.61 1.03 -1.26 -0.17 118.70 121.48 1x4z s GLU 101 Ca 0.00 -0.95 0.05 0.00 0.03 0.00 0.00 54.97 54.10 1x4z s GLU 101 Cb 0.00 -2.64 0.07 0.00 -0.80 0.00 0.00 34.13 30.76 1x4z s GLU 101 CO 0.00 0.43 0.79 -1.54 -1.33 0.00 0.00 175.26 173.61 1x4z s SER 102 N -3.64 5.06 0.71 0.83 1.04 0.31 -4.60 113.70 113.41 1x4z s SER 102 Ca 0.33 -0.50 -0.13 0.00 0.48 0.00 0.00 55.95 56.13 1x4z s SER 102 Cb -0.09 -0.18 0.02 0.00 0.10 0.00 0.00 66.02 65.87 1x4z s SER 102 CO 0.25 -1.31 1.09 -1.61 0.98 0.00 0.00 173.24 172.64 1x4z s GLU 103 N -4.73 2.63 -0.47 4.02 2.02 -1.26 -4.60 118.70 116.30 1x4z s GLU 103 Ca 0.61 1.23 -0.28 0.00 0.02 0.00 0.00 54.97 56.55 1x4z s GLU 103 Cb -0.07 -1.94 -0.02 0.00 0.10 0.00 0.00 34.13 32.20 1x4z s GLU 103 CO 0.39 -1.36 1.77 -1.25 0.02 0.00 0.00 175.26 174.83 1x4z s PRO 104 N -4.55 3.04 0.87 0.39 0.04 -1.26 -4.13 135.00 129.40 1x4z s PRO 104 Ca 0.63 0.98 -0.16 0.00 0.04 0.00 0.00 61.00 62.49 1x4z s PRO 104 Cb -0.18 -4.26 -0.09 0.00 0.04 0.00 0.00 34.50 30.01 1x4z s PRO 104 CO 0.49 -2.22 -0.23 -1.13 0.04 0.00 0.00 177.00 173.95 1x4z n SER 105 N 11.22 -4.06 -4.59 6.66 3.41 -1.07 -4.79 113.62 120.41 1x4z n SER 105 Ca 0.21 0.35 -0.44 0.00 -0.26 0.00 0.00 58.87 58.73 1x4z n SER 105 Cb 0.49 -0.94 -0.01 0.00 -0.26 0.00 0.00 64.21 63.49 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 -2.58 -0.13 -2.04 7.33 0.00 -1.26 -4.65 120.51 117.17 1x4z n ALA 106 Ca 0.03 0.35 -0.39 0.00 0.00 0.00 0.00 53.44 53.44 1x4z n ALA 106 Cb 0.53 -2.03 -0.03 0.00 0.00 0.00 0.00 19.45 17.92 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 -1.65 2.70 0.93 0.00 0.04 -1.26 -4.57 135.00 131.18 1x4z s PRO 107 Ca 0.59 0.68 -0.15 0.00 0.04 0.00 0.00 61.00 62.17 1x4z s PRO 107 Cb -0.66 -4.37 -0.04 0.00 0.04 0.00 0.00 34.50 29.47 1x4z s PRO 107 CO 0.60 -2.65 0.02 -1.13 0.04 0.00 0.00 177.00 173.88 1x4z n SER 108 N 12.50 -3.29 -4.49 6.66 3.41 -0.71 -4.85 113.62 122.85 1x4z n SER 108 Ca 0.21 0.32 -0.37 0.00 -0.26 0.00 0.00 58.87 58.77 1x4z n SER 108 Cb 0.52 -1.06 0.06 0.00 -0.26 0.00 0.00 64.21 63.47 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 -0.17 0.45 -2.18 4.33 1.74 -1.26 -4.29 116.66 115.26 1x4z n ARG 109 Ca 0.04 0.19 -0.42 0.00 -0.77 0.00 0.00 57.85 56.89 1x4z n ARG 109 Cb 0.54 -1.84 -0.03 0.00 -1.02 0.00 0.00 32.46 30.11 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 -2.56 4.29 -0.25 5.56 0.04 -1.26 -4.65 135.00 136.16 1x4z s PRO 110 Ca 0.68 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.75 1x4z s PRO 110 Cb -0.39 -3.47 0.04 0.00 0.04 0.00 0.00 34.50 30.72 1x4z s PRO 110 CO 0.55 -0.54 -0.09 -0.47 0.04 0.00 0.00 177.00 176.49 1x4z s TYR 111 N 2.00 3.10 -0.52 0.56 6.14 -0.92 -4.94 117.35 122.77 1x4z s TYR 111 Ca 0.65 -1.82 -0.23 0.00 0.64 0.00 0.00 57.07 56.30 1x4z s TYR 111 Cb -0.34 -2.01 0.04 0.00 0.42 0.00 0.00 41.96 40.08 1x4z s TYR 111 CO 0.28 -0.79 0.85 0.08 0.64 0.00 0.00 175.55 176.61 1x4z s VAL 112 N 1.25 4.53 -0.46 3.14 1.01 -1.26 -3.56 120.40 125.05 1x4z s VAL 112 Ca -0.02 0.21 -0.28 0.00 0.00 0.00 0.00 61.98 61.89 1x4z s VAL 112 Cb -0.17 -4.44 -0.00 0.00 0.00 0.00 0.00 36.38 31.76 1x4z s VAL 112 CO -0.06 -0.96 1.62 -0.69 0.00 0.00 0.00 175.10 175.01 1x4z s VAL 113 N 3.57 3.64 0.41 2.92 1.01 -1.26 -4.95 120.40 125.74 1x4z s VAL 113 Ca 0.28 0.59 0.08 0.00 0.00 0.00 0.00 61.98 62.93 1x4z s VAL 113 Cb -0.13 -4.04 -0.02 0.00 0.00 0.00 0.00 36.38 32.19 1x4z s VAL 113 CO 0.19 -0.78 0.37 -0.55 0.00 0.00 0.00 175.10 174.34 1x4z s SER 114 N 5.49 5.06 -0.81 3.32 0.15 -1.26 -1.40 113.70 124.26 1x4z s SER 114 Ca 0.66 -0.73 -0.26 0.00 0.70 0.00 0.00 55.95 56.32 1x4z s SER 114 Cb -0.15 -0.60 0.03 0.00 -1.71 0.00 0.00 66.02 63.59 1x4z s SER 114 CO 0.29 -0.63 1.36 -0.83 1.20 0.00 0.00 173.24 174.63 1x4z s GLY 115 N -4.12 0.93 0.06 9.45 0.00 -1.26 -4.82 107.32 107.56 1x4z s GLY 115 Ca 0.48 -1.56 -0.28 0.00 0.00 0.00 0.00 44.72 43.36 1x4z s GLY 115 CO 0.28 2.71 1.15 -0.45 0.00 0.00 0.00 173.10 176.79 1x4z s SER 116 N 4.33 -0.09 0.22 1.64 0.15 -1.26 -5.15 113.70 113.54 1x4z s SER 116 Ca 0.40 -0.28 -0.22 0.00 0.70 0.00 0.00 55.95 56.55 1x4z s SER 116 Cb -0.06 0.30 0.05 0.00 -1.71 0.00 0.00 66.02 64.60 1x4z s SER 116 CO 0.09 -0.57 0.89 -0.83 1.20 0.00 0.00 173.24 174.02 1x4z s GLY 117 N -3.05 -0.06 -0.41 9.45 0.00 -1.26 -4.07 107.32 107.92 1x4z s GLY 117 Ca 0.15 -0.18 -0.28 0.00 0.00 0.00 0.00 44.72 44.41 1x4z s GLY 117 CO -0.01 0.29 1.74 2.56 0.00 0.00 0.00 173.10 177.68 1x4z s PRO 118 N -3.15 3.23 -0.14 2.90 0.04 -1.26 -4.93 135.00 131.69 1x4z s PRO 118 Ca 0.14 1.15 -0.37 0.00 0.04 0.00 0.00 61.00 61.96 1x4z s PRO 118 Cb -0.03 -4.20 -0.14 0.00 0.04 0.00 0.00 34.50 30.16 1x4z s PRO 118 CO 0.05 -1.99 1.73 0.43 0.04 0.00 0.00 177.00 177.27 1x4z n SER 119 N 10.52 2.71 -3.64 6.66 7.64 -1.26 -4.94 113.62 131.31 1x4z n SER 119 Ca 0.21 1.05 -0.05 0.00 1.01 0.00 0.00 58.87 61.09 1x4z n SER 119 Cb 0.48 -1.24 -0.07 0.00 -1.01 0.00 0.00 64.21 62.37 1x4z n SER 119 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1x4z s SER 120 N 3.19 -0.63 0.00 6.43 0.01 -1.26 -5.36 113.70 116.08 1x4z s SER 120 Ca 0.94 1.03 0.00 0.00 1.31 0.00 0.00 55.95 59.23 1x4z s SER 120 Cb -0.90 1.23 0.00 0.00 0.21 0.00 0.00 66.02 66.56 1x4z s SER 120 CO 0.57 -0.16 0.00 0.61 0.41 0.00 0.00 173.24 174.66