#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 -0.17 1.04 1.61 0.01 -1.26 -5.16 113.70 109.77 1x4z s SER 2 Ca 0.00 0.05 -0.13 0.00 1.31 0.00 0.00 55.95 57.17 1x4z s SER 2 Cb 0.00 0.30 0.14 0.00 0.21 0.00 0.00 66.02 66.68 1x4z s SER 2 CO 0.00 -0.45 0.64 -1.20 0.41 0.00 0.00 173.24 172.64 1x4z n SER 3 N 1.26 -1.49 0.00 2.44 7.64 -1.26 -4.90 113.62 117.31 1x4z n SER 3 Ca -0.22 0.12 0.00 0.00 1.01 0.00 0.00 58.87 59.79 1x4z n SER 3 Cb 0.56 -1.23 0.00 0.00 -1.01 0.00 0.00 64.21 62.53 1x4z n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x4z n GLY 4 N 1.21 0.47 3.74 0.23 0.00 -1.26 -5.07 105.19 104.51 1x4z n GLY 4 Ca 0.06 -2.20 -0.35 0.00 0.00 0.00 0.00 46.02 43.53 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 -4.00 4.79 0.13 1.61 0.01 -1.26 -4.97 113.70 110.01 1x4z s SER 5 Ca 0.00 2.30 0.00 0.00 1.31 0.00 0.00 55.95 59.56 1x4z s SER 5 Cb 0.00 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.64 1x4z s SER 5 CO 0.00 -1.86 0.00 -1.20 0.41 0.00 0.00 173.24 170.59 1x4z n SER 6 N -2.18 0.18 0.00 2.44 7.64 -1.26 -5.12 113.62 115.32 1x4z n SER 6 Ca 0.13 0.21 0.00 0.00 1.01 0.00 0.00 58.87 60.22 1x4z n SER 6 Cb 0.50 0.07 0.00 0.00 -1.01 0.00 0.00 64.21 63.78 1x4z n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x4z n GLY 7 N 2.19 1.74 3.70 0.23 0.00 -1.26 -4.96 105.19 106.83 1x4z n GLY 7 Ca 0.00 -1.67 -0.42 0.00 0.00 0.00 0.00 46.02 43.93 1x4z n GLY 7 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x4z s SER 8 N -0.24 6.55 0.28 1.61 0.15 -1.26 -4.95 113.70 115.84 1x4z s SER 8 Ca 0.00 2.59 -0.29 0.00 0.70 0.00 0.00 55.95 58.95 1x4z s SER 8 Cb 0.00 -2.57 -0.10 0.00 -1.71 0.00 0.00 66.02 61.64 1x4z s SER 8 CO 0.00 -0.91 1.23 -1.10 1.20 0.00 0.00 173.24 173.67 1x4z s GLN 9 N 2.33 4.46 1.17 5.44 -0.21 -1.26 -5.02 119.66 126.57 1x4z s GLN 9 Ca 0.75 2.04 -0.18 0.00 0.02 0.00 0.00 55.36 57.98 1x4z s GLN 9 Cb -0.42 -3.14 0.27 0.00 1.00 0.00 0.00 33.01 30.72 1x4z s GLN 9 CO 0.33 -0.06 1.11 -1.25 -2.12 0.00 0.00 175.29 173.29 1x4z s PRO 10 N -1.32 -0.99 -0.93 2.91 0.04 -1.26 -4.76 135.00 128.69 1x4z s PRO 10 Ca 0.49 0.02 -0.31 0.00 0.04 0.00 0.00 61.00 61.24 1x4z s PRO 10 Cb -0.36 -1.61 -0.21 0.00 0.04 0.00 0.00 34.50 32.36 1x4z s PRO 10 CO 0.46 -3.58 2.64 -0.40 0.04 0.00 0.00 177.00 176.16 1x4z n ASP 11 N -4.68 0.49 -3.42 6.66 5.75 -1.26 -4.84 116.55 115.25 1x4z n ASP 11 Ca 0.12 0.16 -0.21 0.00 -0.01 0.00 0.00 54.79 54.85 1x4z n ASP 11 Cb 0.59 -0.97 -0.08 0.00 -1.03 0.00 0.00 41.12 39.63 1x4z n ASP 11 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1x4z n HIS 12 N 10.73 -0.53 0.00 2.11 1.44 -1.26 -5.16 115.22 122.55 1x4z n HIS 12 Ca 0.63 -2.76 0.00 0.00 -2.01 0.00 0.00 57.72 53.58 1x4z n HIS 12 Cb 0.07 0.21 0.00 0.00 0.12 0.00 0.00 29.99 30.38 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 -0.70 0.78 3.57 -1.39 0.00 -1.26 -5.10 105.19 101.09 1x4z n GLY 13 Ca 0.04 0.58 -0.40 0.00 0.00 0.00 0.00 46.02 46.24 1x4z n GLY 13 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1x4z s ARG 14 N 0.00 2.82 0.38 1.61 0.52 -1.26 -4.96 118.95 118.07 1x4z s ARG 14 Ca 0.00 1.15 0.06 0.00 -0.52 0.00 0.00 55.73 56.42 1x4z s ARG 14 Cb 0.00 -4.35 0.06 0.00 0.52 0.00 0.00 34.95 31.18 1x4z s ARG 14 CO 0.00 -2.47 0.53 1.28 0.02 0.00 0.00 175.30 174.66 1x4z n LEU 15 N 12.35 0.00 -3.95 2.53 4.77 -1.26 -5.15 117.00 126.29 1x4z n LEU 15 Ca 0.25 -1.65 -0.09 0.00 -0.03 0.00 0.00 56.01 54.49 1x4z n LEU 15 Cb 0.50 -0.28 -0.08 0.00 -2.33 0.00 0.00 43.42 41.23 1x4z n LEU 15 CO 0.70 -0.64 -0.15 -0.44 -1.33 0.00 0.00 177.39 175.52 1x4z s SER 16 N -3.38 0.20 1.02 -1.43 0.01 -1.09 -5.12 113.70 103.92 1x4z s SER 16 Ca 0.40 -0.82 -0.13 0.00 1.31 0.00 0.00 55.95 56.71 1x4z s SER 16 Cb -0.03 0.33 0.20 0.00 0.21 0.00 0.00 66.02 66.73 1x4z s SER 16 CO 0.26 -0.74 1.09 -2.16 0.41 0.00 0.00 173.24 172.10 1x4z s PRO 17 N -3.91 0.22 0.67 12.44 0.04 -1.26 -3.96 135.00 139.24 1x4z s PRO 17 Ca 0.10 0.45 -0.15 0.00 0.04 0.00 0.00 61.00 61.45 1x4z s PRO 17 Cb 0.05 -1.72 0.00 0.00 0.04 0.00 0.00 34.50 32.88 1x4z s PRO 17 CO -0.07 -2.86 1.11 -1.25 0.04 0.00 0.00 177.00 173.97 1x4z s PRO 18 N -4.98 2.76 0.40 0.56 0.04 -1.23 -2.92 135.00 129.63 1x4z s PRO 18 Ca 0.66 1.37 0.07 0.00 0.04 0.00 0.00 61.00 63.14 1x4z s PRO 18 Cb -0.18 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.41 1x4z s PRO 18 CO 0.58 -1.28 0.55 -1.83 0.04 0.00 0.00 177.00 175.06 1x4z s GLU 19 N -4.16 2.93 0.02 4.56 -1.05 -0.94 -3.71 118.70 116.36 1x4z s GLU 19 Ca 0.66 -1.09 -0.30 0.00 -0.15 0.00 0.00 54.97 54.10 1x4z s GLU 19 Cb -0.20 -2.76 -0.08 0.00 -0.44 0.00 0.00 34.13 30.65 1x4z s GLU 19 CO 0.43 -0.17 1.81 0.00 0.95 0.00 0.00 175.26 178.28 1x4z s ALA 20 N -2.32 3.63 0.81 -0.84 0.00 -1.26 -4.48 121.76 117.30 1x4z s ALA 20 Ca 0.51 1.20 -0.11 0.00 0.00 0.00 0.00 51.96 53.56 1x4z s ALA 20 Cb -0.10 -3.78 0.08 0.00 0.00 0.00 0.00 23.12 19.32 1x4z s ALA 20 CO 0.33 -1.41 1.09 -1.25 0.00 0.00 0.00 175.76 174.52 1x4z s PRO 21 N 3.87 1.93 0.97 0.00 0.04 -1.26 -4.75 135.00 135.81 1x4z s PRO 21 Ca 0.81 1.06 -0.16 0.00 0.04 0.00 0.00 61.00 62.75 1x4z s PRO 21 Cb -0.40 -1.87 0.05 0.00 0.04 0.00 0.00 34.50 32.32 1x4z s PRO 21 CO 0.36 -1.84 -0.23 -3.47 0.04 0.00 0.00 177.00 171.86 1x4z n ASP 22 N -3.64 -2.70 -4.68 6.66 2.03 0.80 -4.44 116.55 110.58 1x4z n ASP 22 Ca 0.08 -0.18 -0.43 0.00 0.52 0.00 0.00 54.79 54.79 1x4z n ASP 22 Cb 0.54 -0.72 -0.02 0.00 -0.72 0.00 0.00 41.12 40.19 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 -2.93 4.38 0.33 -0.67 3.52 -1.26 -4.48 118.95 117.84 1x4z s ARG 23 Ca 0.36 1.38 -0.28 0.00 -0.13 0.00 0.00 55.73 57.06 1x4z s ARG 23 Cb -0.03 -3.57 -0.10 0.00 -1.56 0.00 0.00 34.95 29.70 1x4z s ARG 23 CO 0.45 -0.39 1.22 -1.25 -0.81 0.00 0.00 175.30 174.52 1x4z s PRO 24 N 2.30 4.38 0.28 5.12 0.04 -1.26 -4.70 135.00 141.16 1x4z s PRO 24 Ca 0.47 2.03 -0.03 0.00 0.04 0.00 0.00 61.00 63.51 1x4z s PRO 24 Cb -0.17 -3.03 -0.04 0.00 0.04 0.00 0.00 34.50 31.29 1x4z s PRO 24 CO 0.15 -0.09 0.51 -0.08 0.04 0.00 0.00 177.00 177.52 1x4z s THR 25 N -1.20 5.09 -0.13 1.26 -1.32 0.33 -4.55 115.64 115.13 1x4z s THR 25 Ca 0.49 -0.17 0.02 0.00 -1.21 0.00 0.00 61.69 60.81 1x4z s THR 25 Cb -0.36 -3.76 -0.00 0.00 -1.51 0.00 0.00 72.50 66.87 1x4z s THR 25 CO 0.47 -0.33 -0.18 -0.63 -2.21 0.00 0.00 174.62 171.73 1x4z s ILE 26 N -2.07 2.51 0.36 5.08 -1.09 -1.26 -2.71 121.20 122.01 1x4z s ILE 26 Ca 0.41 -0.84 0.04 0.00 -2.23 0.00 0.00 60.65 58.03 1x4z s ILE 26 Cb -0.11 -2.02 -0.03 0.00 -1.58 0.00 0.00 42.46 38.72 1x4z s ILE 26 CO 0.31 0.54 0.15 -0.44 -1.23 0.00 0.00 174.94 174.26 1x4z s SER 27 N 0.50 2.22 -0.42 3.58 0.01 -0.02 -4.98 113.70 114.58 1x4z s SER 27 Ca -0.12 -1.61 -0.19 0.00 1.31 0.00 0.00 55.95 55.33 1x4z s SER 27 Cb -0.16 0.41 0.02 0.00 0.21 0.00 0.00 66.02 66.50 1x4z s SER 27 CO 0.05 -0.90 0.57 -0.89 0.41 0.00 0.00 173.24 172.48 1x4z s THR 28 N -3.38 4.93 -0.10 1.44 2.01 -1.26 -2.37 115.64 116.91 1x4z s THR 28 Ca 0.31 0.00 0.02 0.00 0.31 0.00 0.00 61.69 62.33 1x4z s THR 28 Cb 0.04 -4.13 -0.07 0.00 0.01 0.00 0.00 72.50 68.34 1x4z s THR 28 CO 0.17 -0.50 -0.07 0.00 -0.69 0.00 0.00 174.62 173.52 1x4z n ALA 29 N 6.01 1.78 -3.72 7.40 0.00 -1.26 -4.73 120.51 125.99 1x4z n ALA 29 Ca -0.04 -0.47 0.00 0.00 0.00 0.00 0.00 53.44 52.94 1x4z n ALA 29 Cb 0.48 0.22 0.02 0.00 0.00 0.00 0.00 19.45 20.18 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 -2.72 -1.96 0.08 0.00 7.64 -0.93 -4.95 113.62 110.79 1x4z n SER 30 Ca -0.18 -2.31 0.12 0.00 1.01 0.00 0.00 58.87 57.52 1x4z n SER 30 Cb 0.71 3.25 0.28 0.00 -1.01 0.00 0.00 64.21 67.43 1x4z n SER 30 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 1x4z n GLU 31 N -0.50 0.27 0.00 1.43 0.00 -1.26 -3.75 120.64 116.83 1x4z n GLU 31 Ca -0.07 0.14 0.00 0.00 0.00 0.00 0.00 57.16 57.23 1x4z n GLU 31 Cb 0.52 -1.73 0.00 0.00 0.00 0.00 0.00 31.44 30.23 1x4z n GLU 31 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 1x4z n THR 32 N -2.15 0.00 -4.12 3.84 -2.24 -1.26 -4.66 114.28 103.69 1x4z n THR 32 Ca 0.04 -0.47 -0.13 0.00 -2.27 0.00 0.00 64.05 61.23 1x4z n THR 32 Cb 0.43 1.07 -0.07 0.00 -2.10 0.00 0.00 70.33 69.66 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 -0.00 0.43 -0.05 3.42 1.04 -1.25 -1.87 113.70 115.42 1x4z s SER 33 Ca 0.00 -1.31 -0.13 0.00 0.48 0.00 0.00 55.95 54.99 1x4z s SER 33 Cb 0.00 0.54 0.02 0.00 0.10 0.00 0.00 66.02 66.68 1x4z s SER 33 CO 0.00 -1.08 0.30 0.68 0.98 0.00 0.00 173.24 174.12 1x4z s VAL 34 N -3.75 0.04 -0.12 5.02 -7.23 -1.10 -2.19 120.40 111.07 1x4z s VAL 34 Ca 0.32 -0.31 -0.29 0.00 -1.81 0.00 0.00 61.98 59.88 1x4z s VAL 34 Cb 0.02 -0.54 -0.02 0.00 0.56 0.00 0.00 36.38 36.40 1x4z s VAL 34 CO 0.15 -0.17 1.14 -0.31 -0.31 0.00 0.00 175.10 175.60 1x4z s TYR 35 N -0.78 3.21 -0.15 2.82 2.02 -1.00 -1.50 117.35 121.98 1x4z s TYR 35 Ca -0.09 1.29 0.02 0.00 -0.37 0.00 0.00 57.07 57.93 1x4z s TYR 35 Cb -0.04 -3.36 0.01 0.00 -0.40 0.00 0.00 41.96 38.16 1x4z s TYR 35 CO 0.03 -1.02 -0.21 0.08 -1.57 0.00 0.00 175.55 172.86 1x4z s VAL 36 N 2.64 2.15 -0.11 0.71 1.01 0.56 -0.84 120.40 126.52 1x4z s VAL 36 Ca 0.52 -0.94 0.01 0.00 0.00 0.00 0.00 61.98 61.56 1x4z s VAL 36 Cb -0.21 -1.87 0.02 0.00 0.00 0.00 0.00 36.38 34.32 1x4z s VAL 36 CO 0.17 0.54 -0.12 -0.89 0.00 0.00 0.00 175.10 174.80 1x4z s THR 37 N 0.88 1.31 0.42 3.92 2.01 -1.10 -0.46 115.64 122.61 1x4z s THR 37 Ca -0.05 -0.50 0.06 0.00 0.31 0.00 0.00 61.69 61.50 1x4z s THR 37 Cb -0.15 -1.24 -0.07 0.00 0.01 0.00 0.00 72.50 71.05 1x4z s THR 37 CO -0.03 0.41 0.01 -1.66 -0.69 0.00 0.00 174.62 172.66 1x4z s TRP 38 N 1.27 2.38 -0.24 4.92 -2.14 -0.08 -0.51 118.94 124.54 1x4z s TRP 38 Ca -0.02 -0.74 -0.03 0.00 2.66 0.00 0.00 56.10 57.98 1x4z s TRP 38 Cb -0.14 -1.71 0.08 0.00 -3.10 0.00 0.00 33.47 28.60 1x4z s TRP 38 CO -0.05 0.38 0.07 0.42 -2.66 0.00 0.00 176.95 175.11 1x4z s ILE 39 N -2.79 0.48 0.38 0.66 -1.09 -1.26 -4.74 121.20 112.85 1x4z s ILE 39 Ca 0.31 -0.77 -0.26 0.00 -2.23 0.00 0.00 60.65 57.69 1x4z s ILE 39 Cb 0.09 -1.15 -0.09 0.00 -1.58 0.00 0.00 42.46 39.72 1x4z s ILE 39 CO 0.16 -0.41 1.20 -2.16 -1.23 0.00 0.00 174.94 172.50 1x4z s PRO 40 N 1.85 4.15 0.00 2.79 0.04 -1.26 -0.14 135.00 142.42 1x4z s PRO 40 Ca 0.03 1.93 0.00 0.00 0.04 0.00 0.00 61.00 63.01 1x4z s PRO 40 Cb -0.17 -2.80 0.00 0.00 0.04 0.00 0.00 34.50 31.57 1x4z s PRO 40 CO -0.17 -0.27 0.00 0.54 0.04 0.00 0.00 177.00 177.15 1x4z n ARG 41 N 0.30 0.00 -4.19 4.56 5.12 -1.26 -4.86 116.66 116.34 1x4z n ARG 41 Ca 0.03 0.00 -0.34 0.00 -1.93 0.00 0.00 57.85 55.61 1x4z n ARG 41 Cb 0.45 -0.20 -0.08 0.00 -1.16 0.00 0.00 32.46 31.48 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 -2.89 1.96 -0.11 -0.13 0.00 -1.26 -5.00 107.32 99.88 1x4z s GLY 42 Ca 0.00 -0.86 0.14 0.00 0.00 0.00 0.00 44.72 44.01 1x4z s GLY 42 CO 0.00 -0.69 1.23 1.16 0.00 0.00 0.00 173.10 174.80 1x4z n ASN 43 N 1.51 2.89 0.00 1.64 0.23 -1.26 -2.21 115.26 118.07 1x4z n ASN 43 Ca -0.15 -2.75 0.00 0.00 -0.53 0.00 0.00 54.58 51.15 1x4z n ASN 43 Cb 0.53 -0.37 0.00 0.00 -2.08 0.00 0.00 39.78 37.86 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 -0.72 1.81 0.00 4.83 0.00 -1.15 -2.83 105.19 107.14 1x4z n GLY 44 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 2.34 3.70 -0.02 0.00 -1.25 -2.65 105.19 105.30 1x4z n GLY 45 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.12 2.72 -0.19 1.61 0.08 -1.13 -5.08 117.98 113.88 1x4z s PHE 46 Ca 0.00 -0.31 -0.29 0.00 0.12 0.00 0.00 56.93 56.45 1x4z s PHE 46 Cb 0.00 -1.45 -0.03 0.00 -0.57 0.00 0.00 43.02 40.97 1x4z s PHE 46 CO 0.00 0.46 1.59 -1.25 -0.10 0.00 0.00 175.22 175.92 1x4z s PRO 47 N -3.78 3.88 -0.12 0.24 0.04 -1.26 -4.65 135.00 129.35 1x4z s PRO 47 Ca 0.35 1.73 -0.39 0.00 0.04 0.00 0.00 61.00 62.73 1x4z s PRO 47 Cb -0.04 -4.01 -0.16 0.00 0.04 0.00 0.00 34.50 30.33 1x4z s PRO 47 CO 0.22 -1.19 1.57 -0.89 0.04 0.00 0.00 177.00 176.75 1x4z n ILE 48 N 6.20 0.17 0.00 0.56 5.41 -1.26 -4.73 119.36 125.71 1x4z n ILE 48 Ca 0.18 -0.03 -0.17 0.00 1.00 0.00 0.00 62.75 63.73 1x4z n ILE 48 Cb 0.45 -1.04 -0.13 0.00 -0.71 0.00 0.00 39.64 38.20 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 6.05 0.20 -2.72 0.38 4.20 -1.67 -3.41 115.11 118.15 1x4z h GLN 49 Ca -0.47 -0.31 0.05 0.00 0.06 0.00 0.00 58.65 57.98 1x4z h GLN 49 Cb 1.33 0.11 -0.12 0.00 0.30 0.00 0.00 27.48 29.10 1x4z h GLN 49 CO 0.88 1.11 0.32 -1.12 -0.67 0.00 0.00 178.83 179.36 1x4z s SER 50 N -6.64 -0.44 0.50 1.46 0.01 -0.89 -4.53 113.70 103.16 1x4z s SER 50 Ca -0.15 -0.09 0.07 0.00 1.31 0.00 0.00 55.95 57.08 1x4z s SER 50 Cb -0.00 0.53 0.02 0.00 0.21 0.00 0.00 66.02 66.78 1x4z s SER 50 CO 0.78 -0.89 0.41 -0.36 0.41 0.00 0.00 173.24 173.58 1x4z s PHE 51 N -3.53 2.02 -0.14 2.43 0.08 -0.90 -0.96 117.98 116.98 1x4z s PHE 51 Ca 0.04 -0.71 -0.05 0.00 0.12 0.00 0.00 56.93 56.33 1x4z s PHE 51 Cb -0.02 -2.02 0.07 0.00 -0.57 0.00 0.00 43.02 40.49 1x4z s PHE 51 CO -0.09 -0.36 0.29 1.03 -0.10 0.00 0.00 175.22 175.99 1x4z s ARG 52 N -4.23 0.18 -0.17 0.44 0.52 0.43 -3.66 118.95 112.47 1x4z s ARG 52 Ca 0.41 0.80 -0.07 0.00 -0.52 0.00 0.00 55.73 56.35 1x4z s ARG 52 Cb -0.02 0.03 -0.04 0.00 0.52 0.00 0.00 34.95 35.44 1x4z s ARG 52 CO 0.25 -0.28 0.06 0.08 0.02 0.00 0.00 175.30 175.43 1x4z s VAL 53 N 2.43 4.77 0.16 3.52 1.01 -1.13 -0.45 120.40 130.71 1x4z s VAL 53 Ca 0.01 -0.05 0.04 0.00 0.00 0.00 0.00 61.98 61.98 1x4z s VAL 53 Cb -0.12 -3.13 -0.05 0.00 0.00 0.00 0.00 36.38 33.09 1x4z s VAL 53 CO -0.09 0.49 -0.09 -1.61 0.00 0.00 0.00 175.10 173.80 1x4z s GLU 54 N 0.12 1.10 0.29 2.72 8.01 -1.19 -1.86 118.70 127.90 1x4z s GLU 54 Ca 0.05 -1.49 0.04 0.00 0.01 0.00 0.00 54.97 53.58 1x4z s GLU 54 Cb -0.12 -0.61 -0.03 0.00 -4.31 0.00 0.00 34.13 29.05 1x4z s GLU 54 CO 0.01 0.05 0.21 1.52 0.01 0.00 0.00 175.26 177.06 1x4z s TYR 55 N -3.35 1.57 -0.10 1.61 -0.85 -0.07 -0.79 117.35 115.36 1x4z s TYR 55 Ca 0.19 -1.53 -0.07 0.00 -0.52 0.00 0.00 57.07 55.14 1x4z s TYR 55 Cb 0.03 -0.71 0.04 0.00 0.38 0.00 0.00 41.96 41.70 1x4z s TYR 55 CO 0.02 -0.74 0.24 0.21 -1.52 0.00 0.00 175.55 173.77 1x4z s LYS 56 N -3.71 0.24 -0.27 -3.49 2.20 -1.13 0.01 119.74 113.58 1x4z s LYS 56 Ca 0.39 0.45 -0.27 0.00 -0.36 0.00 0.00 55.97 56.18 1x4z s LYS 56 Cb 0.04 -0.02 0.01 0.00 -1.51 0.00 0.00 37.83 36.35 1x4z s LYS 56 CO 0.21 -0.11 0.98 0.15 -0.36 0.00 0.00 175.35 176.22 1x4z s LYS 57 N 0.80 4.14 -0.09 4.03 1.02 -1.26 -2.26 119.74 126.12 1x4z s LYS 57 Ca -0.06 1.08 -0.14 0.00 0.02 0.00 0.00 55.97 56.87 1x4z s LYS 57 Cb -0.07 -3.69 -0.28 0.00 -0.52 0.00 0.00 37.83 33.27 1x4z s LYS 57 CO -0.05 -0.71 0.58 -0.07 -0.92 0.00 0.00 175.35 174.18 1x4z h LEU 58 N 9.62 0.45 -3.06 3.17 3.38 -1.11 -3.35 115.31 124.42 1x4z h LEU 58 Ca -0.21 -0.88 -0.18 0.00 0.09 0.00 0.00 57.88 56.70 1x4z h LEU 58 Cb 1.07 -0.15 -0.08 0.00 0.09 0.00 0.00 40.66 41.59 1x4z h LEU 58 CO 0.97 1.68 0.23 1.17 0.09 0.00 0.00 178.44 182.58 1x4z n LYS 59 N -3.81 1.44 -3.42 1.13 4.81 -1.23 -4.85 118.16 112.23 1x4z n LYS 59 Ca -0.25 -0.91 0.00 0.00 -0.87 0.00 0.00 58.31 56.28 1x4z n LYS 59 Cb 0.96 -1.36 0.01 0.00 0.02 0.00 0.00 35.03 34.66 1x4z n LYS 59 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 1x4z n LYS 60 N 0.57 0.31 -3.46 1.64 4.81 -1.26 -4.95 118.16 115.83 1x4z n LYS 60 Ca 0.18 -0.85 -0.36 0.00 -0.87 0.00 0.00 58.31 56.40 1x4z n LYS 60 Cb 0.64 1.25 -0.06 0.00 0.02 0.00 0.00 35.03 36.88 1x4z n LYS 60 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1x4z s VAL 61 N -2.11 4.97 0.00 3.15 0.11 -1.26 -4.86 120.40 120.41 1x4z s VAL 61 Ca 0.21 0.77 0.00 0.00 -2.93 0.00 0.00 61.98 60.03 1x4z s VAL 61 Cb -0.01 -3.72 0.00 0.00 -1.53 0.00 0.00 36.38 31.12 1x4z s VAL 61 CO 0.02 0.41 0.00 0.61 -3.33 0.00 0.00 175.10 172.81 1x4z n GLY 62 N 1.30 4.86 0.00 6.54 0.00 -1.26 -4.89 105.19 111.73 1x4z n GLY 62 Ca -0.10 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 44.90 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 0.00 -3.68 1.61 9.92 -1.26 -4.42 116.55 118.72 1x4z n ASP 63 Ca 0.00 0.33 -0.15 0.00 -0.53 0.00 0.00 54.79 54.44 1x4z n ASP 63 Cb 0.00 -0.31 -0.08 0.00 -0.64 0.00 0.00 41.12 40.09 1x4z n ASP 63 CO 0.00 0.00 0.00 0.26 0.13 0.00 0.00 177.20 177.59 1x4z s TRP 64 N -0.67 -0.34 0.08 1.24 0.52 -1.26 -4.47 118.94 114.04 1x4z s TRP 64 Ca 0.00 0.55 0.05 0.00 0.02 0.00 0.00 56.10 56.71 1x4z s TRP 64 Cb 0.00 0.20 -0.03 0.00 -1.15 0.00 0.00 33.47 32.49 1x4z s TRP 64 CO 0.00 -0.46 -0.13 0.42 0.02 0.00 0.00 176.95 176.80 1x4z s ILE 65 N -1.28 1.05 0.04 2.03 -1.09 0.10 -4.94 121.20 117.11 1x4z s ILE 65 Ca -0.13 -1.37 -0.25 0.00 -2.23 0.00 0.00 60.65 56.68 1x4z s ILE 65 Cb -0.04 -1.10 -0.05 0.00 -1.58 0.00 0.00 42.46 39.69 1x4z s ILE 65 CO 0.06 -0.31 0.76 -0.22 -1.23 0.00 0.00 174.94 174.00 1x4z s LEU 66 N -1.89 4.45 -0.02 2.97 2.96 -1.26 -0.90 118.68 124.99 1x4z s LEU 66 Ca -0.01 1.44 -0.03 0.00 -0.22 0.00 0.00 54.13 55.31 1x4z s LEU 66 Cb -0.09 -3.22 -0.01 0.00 0.50 0.00 0.00 46.19 43.38 1x4z s LEU 66 CO 0.02 0.02 -0.05 0.00 -1.32 0.00 0.00 176.35 175.02 1x4z n ALA 67 N 2.80 0.60 -2.41 5.97 0.00 -0.78 -4.96 120.51 121.74 1x4z n ALA 67 Ca -0.03 -0.29 -0.20 0.00 0.00 0.00 0.00 53.44 52.92 1x4z n ALA 67 Cb 0.50 0.01 -0.11 0.00 0.00 0.00 0.00 19.45 19.86 1x4z n ALA 67 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1x4z s THR 68 N -1.29 1.81 0.25 0.00 -1.32 -1.24 -4.99 115.64 108.85 1x4z s THR 68 Ca -0.04 -2.09 -0.14 0.00 -1.21 0.00 0.00 61.69 58.21 1x4z s THR 68 Cb 0.01 -1.96 0.00 0.00 -1.51 0.00 0.00 72.50 69.04 1x4z s THR 68 CO 0.06 -0.46 0.52 -0.94 -2.21 0.00 0.00 174.62 171.59 1x4z s SER 69 N -3.03 -0.13 -0.50 8.08 1.04 -1.26 -2.85 113.70 115.05 1x4z s SER 69 Ca 0.20 -0.84 0.00 0.00 0.48 0.00 0.00 55.95 55.79 1x4z s SER 69 Cb -0.03 0.61 0.00 0.00 0.10 0.00 0.00 66.02 66.69 1x4z s SER 69 CO 0.07 -1.16 0.00 0.00 0.98 0.00 0.00 173.24 173.13 1x4z n ALA 70 N -0.39 -0.12 -1.91 5.32 0.00 -1.24 -5.01 120.51 117.17 1x4z n ALA 70 Ca -0.03 0.06 -0.40 0.00 0.00 0.00 0.00 53.44 53.07 1x4z n ALA 70 Cb 0.61 -0.91 -0.05 0.00 0.00 0.00 0.00 19.45 19.11 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 -2.23 3.90 0.73 0.00 1.01 -1.26 -4.89 121.20 118.46 1x4z s ILE 71 Ca 0.00 1.78 -0.12 0.00 0.00 0.00 0.00 60.65 62.31 1x4z s ILE 71 Cb 0.00 -4.13 0.03 0.00 0.01 0.00 0.00 42.46 38.37 1x4z s ILE 71 CO 0.00 0.37 1.10 -2.16 0.00 0.00 0.00 174.94 174.25 1x4z s PRO 72 N -0.88 2.47 0.46 2.79 0.04 -1.26 -2.12 135.00 136.51 1x4z s PRO 72 Ca 0.45 1.26 0.25 0.00 0.04 0.00 0.00 61.00 63.00 1x4z s PRO 72 Cb -0.28 -1.92 1.07 0.00 0.04 0.00 0.00 34.50 33.40 1x4z s PRO 72 CO 0.35 -1.49 1.89 -1.00 0.04 0.00 0.00 177.00 176.80 1x4z h PRO 73 N -0.66 0.00 0.00 0.56 0.13 -1.80 -2.86 132.00 127.37 1x4z h PRO 73 Ca -0.45 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.51 1x4z h PRO 73 Cb 1.24 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.34 1x4z h PRO 73 CO 0.52 0.20 -0.82 1.03 -0.23 0.00 0.00 178.00 178.70 1x4z h SER 74 N 0.00 0.00 -2.72 1.44 0.87 -1.95 -3.42 113.55 107.78 1x4z h SER 74 Ca -0.00 0.00 -0.58 0.00 -1.23 0.00 0.00 61.79 59.98 1x4z h SER 74 Cb 0.64 0.00 -0.11 0.00 -0.44 0.00 0.00 62.40 62.49 1x4z h SER 74 CO 0.03 0.82 0.79 -0.60 -0.53 0.00 0.00 176.83 177.34 1x4z s ARG 75 N -2.93 3.23 -0.04 2.24 3.52 -1.08 -4.84 118.95 119.06 1x4z s ARG 75 Ca 0.01 -0.36 0.21 0.00 -0.13 0.00 0.00 55.73 55.46 1x4z s ARG 75 Cb 0.10 -4.15 0.67 0.00 -1.56 0.00 0.00 34.95 30.01 1x4z s ARG 75 CO 0.79 -1.86 1.56 1.28 -0.81 0.00 0.00 175.30 176.27 1x4z n LEU 76 N 8.37 4.17 -3.68 -0.88 4.77 -1.26 -4.73 117.00 123.76 1x4z n LEU 76 Ca 0.01 -2.09 -0.10 0.00 -0.03 0.00 0.00 56.01 53.80 1x4z n LEU 76 Cb 0.48 -0.52 -0.10 0.00 -2.33 0.00 0.00 43.42 40.95 1x4z n LEU 76 CO 0.68 0.91 0.14 -0.55 -1.33 0.00 0.00 177.39 177.23 1x4z s SER 77 N -0.96 -0.63 0.09 -1.43 0.15 -1.26 -0.90 113.70 108.76 1x4z s SER 77 Ca 0.49 1.07 -0.08 0.00 0.70 0.00 0.00 55.95 58.13 1x4z s SER 77 Cb 0.28 0.95 -0.01 0.00 -1.71 0.00 0.00 66.02 65.53 1x4z s SER 77 CO 0.30 -0.21 0.18 0.68 1.20 0.00 0.00 173.24 175.39 1x4z s VAL 78 N 1.43 0.14 -0.39 4.45 -7.23 0.39 -4.97 120.40 114.23 1x4z s VAL 78 Ca -0.09 -1.24 -0.15 0.00 -1.81 0.00 0.00 61.98 58.69 1x4z s VAL 78 Cb -0.07 -1.38 0.01 0.00 0.56 0.00 0.00 36.38 35.49 1x4z s VAL 78 CO -0.14 -0.66 0.31 -0.70 -0.31 0.00 0.00 175.10 173.60 1x4z s GLU 79 N -3.87 3.18 -0.64 4.82 2.12 -1.26 -0.32 118.70 122.72 1x4z s GLU 79 Ca 0.06 -0.83 -0.27 0.00 0.36 0.00 0.00 54.97 54.29 1x4z s GLU 79 Cb 0.05 -3.92 0.02 0.00 0.26 0.00 0.00 34.13 30.54 1x4z s GLU 79 CO -0.10 -0.66 1.37 0.42 -0.54 0.00 0.00 175.26 175.74 1x4z s ILE 80 N 1.79 3.76 0.34 -3.70 -1.09 -0.56 -4.84 121.20 116.89 1x4z s ILE 80 Ca 0.07 0.56 0.03 0.00 -2.23 0.00 0.00 60.65 59.08 1x4z s ILE 80 Cb -0.18 -4.64 -0.02 0.00 -1.58 0.00 0.00 42.46 36.04 1x4z s ILE 80 CO 0.11 -1.46 0.51 0.42 -1.23 0.00 0.00 174.94 173.29 1x4z s THR 81 N 6.04 4.59 0.00 2.92 -4.23 -1.26 -2.71 115.64 120.99 1x4z s THR 81 Ca 0.45 -0.76 0.00 0.00 -1.18 0.00 0.00 61.69 60.20 1x4z s THR 81 Cb -0.09 -3.64 0.00 0.00 1.34 0.00 0.00 72.50 70.11 1x4z s THR 81 CO 0.21 -0.33 0.00 0.61 -0.54 0.00 0.00 174.62 174.56 1x4z n GLY 82 N -1.71 0.95 3.95 3.99 0.00 -1.15 -4.96 105.19 106.26 1x4z n GLY 82 Ca -0.03 -0.29 -0.23 0.00 0.00 0.00 0.00 46.02 45.47 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 -0.46 2.91 -0.10 0.99 1.43 -0.78 -5.08 118.68 117.59 1x4z s LEU 83 Ca 0.00 -1.05 0.03 0.00 -1.03 0.00 0.00 54.13 52.08 1x4z s LEU 83 Cb 0.00 -1.43 0.01 0.00 0.03 0.00 0.00 46.19 44.80 1x4z s LEU 83 CO 0.00 -1.16 -0.19 -1.61 0.23 0.00 0.00 176.35 173.62 1x4z s GLU 84 N -4.42 2.48 0.71 1.70 8.01 -1.26 -4.92 118.70 121.01 1x4z s GLU 84 Ca 0.46 -0.68 -0.14 0.00 0.01 0.00 0.00 54.97 54.62 1x4z s GLU 84 Cb -0.04 -1.97 0.03 0.00 -4.31 0.00 0.00 34.13 27.85 1x4z s GLU 84 CO 0.28 0.07 1.14 0.15 0.01 0.00 0.00 175.26 176.91 1x4z s LYS 85 N 0.61 2.41 -0.73 1.61 1.02 -1.26 -3.02 119.74 120.38 1x4z s LYS 85 Ca -0.14 1.47 0.00 0.00 0.02 0.00 0.00 55.97 57.32 1x4z s LYS 85 Cb -0.17 -1.90 0.00 0.00 -0.52 0.00 0.00 37.83 35.25 1x4z s LYS 85 CO 0.04 -1.57 0.00 0.41 -0.92 0.00 0.00 175.35 173.32 1x4z n GLY 86 N -0.33 0.80 2.90 -3.33 0.00 0.12 -4.97 105.19 100.40 1x4z n GLY 86 Ca 0.11 -0.18 -0.29 0.00 0.00 0.00 0.00 46.02 45.66 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 -1.92 1.25 0.29 -0.61 -1.09 -1.17 -5.01 121.20 112.94 1x4z s ILE 87 Ca 0.00 -0.88 -0.28 0.00 -2.23 0.00 0.00 60.65 57.26 1x4z s ILE 87 Cb 0.00 -1.49 -0.09 0.00 -1.58 0.00 0.00 42.46 39.30 1x4z s ILE 87 CO 0.00 0.01 1.02 -0.44 -1.23 0.00 0.00 174.94 174.30 1x4z s SER 88 N 1.55 7.31 0.10 3.58 0.01 -1.26 -4.18 113.70 120.81 1x4z s SER 88 Ca -0.02 2.07 -0.25 0.00 1.31 0.00 0.00 55.95 59.06 1x4z s SER 88 Cb -0.17 -2.61 0.08 0.00 0.21 0.00 0.00 66.02 63.53 1x4z s SER 88 CO -0.07 -0.10 0.69 -0.72 0.41 0.00 0.00 173.24 173.45 1x4z s TYR 89 N -1.32 -0.48 0.56 2.43 -0.85 -1.17 -0.44 117.35 116.08 1x4z s TYR 89 Ca 0.47 0.31 0.06 0.00 -0.52 0.00 0.00 57.07 57.39 1x4z s TYR 89 Cb -0.26 0.55 0.06 0.00 0.38 0.00 0.00 41.96 42.68 1x4z s TYR 89 CO 0.33 -0.75 0.51 0.15 -1.52 0.00 0.00 175.55 174.28 1x4z s LYS 90 N -3.50 2.25 0.07 -3.49 1.02 -0.96 -1.91 119.74 113.21 1x4z s LYS 90 Ca 0.02 -1.96 -0.02 0.00 0.02 0.00 0.00 55.97 54.03 1x4z s LYS 90 Cb -0.01 -2.22 -0.04 0.00 -0.52 0.00 0.00 37.83 35.04 1x4z s LYS 90 CO -0.11 -0.72 0.01 -0.06 -0.92 0.00 0.00 175.35 173.54 1x4z s PHE 91 N -2.77 0.54 0.32 3.18 0.40 -1.26 -2.86 117.98 115.53 1x4z s PHE 91 Ca 0.40 -1.05 -0.05 0.00 -0.60 0.00 0.00 56.93 55.63 1x4z s PHE 91 Cb -0.03 -0.37 0.02 0.00 0.51 0.00 0.00 43.02 43.15 1x4z s PHE 91 CO 0.25 -0.42 0.52 2.89 0.70 0.00 0.00 175.22 179.16 1x4z n ARG 92 N 0.06 0.75 -3.86 0.44 1.85 0.03 -2.50 116.66 113.43 1x4z n ARG 92 Ca -0.13 -2.32 -0.11 0.00 -1.00 0.00 0.00 57.85 54.29 1x4z n ARG 92 Cb 0.62 2.42 -0.11 0.00 -1.05 0.00 0.00 32.46 34.33 1x4z n ARG 92 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 1x4z s VAL 93 N -2.59 0.06 -0.01 8.89 1.01 -1.26 -3.19 120.40 123.31 1x4z s VAL 93 Ca 0.22 -0.47 0.00 0.00 0.00 0.00 0.00 61.98 61.73 1x4z s VAL 93 Cb -0.02 -0.36 0.02 0.00 0.00 0.00 0.00 36.38 36.01 1x4z s VAL 93 CO 0.16 -0.26 0.00 -0.13 0.00 0.00 0.00 175.10 174.87 1x4z s ARG 94 N -0.91 0.14 -0.17 2.72 0.52 0.40 -2.16 118.95 119.49 1x4z s ARG 94 Ca -0.10 0.04 -0.13 0.00 -0.52 0.00 0.00 55.73 55.02 1x4z s ARG 94 Cb -0.06 -0.26 -0.05 0.00 0.52 0.00 0.00 34.95 35.11 1x4z s ARG 94 CO 0.01 -0.07 0.27 0.00 0.02 0.00 0.00 175.30 175.54 1x4z s ALA 95 N 0.56 3.60 -0.16 2.13 0.00 -1.26 -0.43 121.76 126.20 1x4z s ALA 95 Ca -0.05 -0.51 0.01 0.00 0.00 0.00 0.00 51.96 51.41 1x4z s ALA 95 Cb -0.08 -2.38 0.02 0.00 0.00 0.00 0.00 23.12 20.69 1x4z s ALA 95 CO -0.01 0.06 -0.17 -0.51 0.00 0.00 0.00 175.76 175.12 1x4z s LEU 96 N 0.54 1.93 0.00 0.00 1.02 -0.13 0.15 118.68 122.19 1x4z s LEU 96 Ca 0.15 -0.58 0.00 0.00 0.02 0.00 0.00 54.13 53.73 1x4z s LEU 96 Cb -0.13 -1.34 -0.00 0.00 0.02 0.00 0.00 46.19 44.74 1x4z s LEU 96 CO 0.03 -0.02 0.02 -0.46 0.02 0.00 0.00 176.35 175.94 1x4z n ASN 97 N 4.67 1.92 0.00 2.29 6.94 0.33 -1.65 115.26 129.76 1x4z n ASN 97 Ca -0.19 -1.65 0.07 0.00 -0.02 0.00 0.00 54.58 52.79 1x4z n ASN 97 Cb 0.50 0.18 0.41 0.00 -2.36 0.00 0.00 39.78 38.50 1x4z n ASN 97 CO 0.00 0.00 0.00 1.15 -1.03 0.00 0.00 177.26 177.38 1x4z n MET 98 N -0.34 0.48 -0.03 -3.83 0.00 -1.26 -2.00 117.12 110.15 1x4z n MET 98 Ca -0.05 0.00 0.01 0.00 0.00 0.00 0.00 57.70 57.66 1x4z n MET 98 Cb 0.19 -1.44 -0.09 0.00 0.00 0.00 0.00 33.22 31.88 1x4z n MET 98 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1x4z n LEU 99 N -0.94 0.00 0.00 3.17 4.77 -1.26 -5.12 117.00 117.61 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 0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 1x4z n LEU 99 CO 0.08 0.12 0.00 0.61 -1.33 0.00 0.00 177.39 176.87 1x4z n GLY 100 N 2.08 0.24 3.94 -0.72 0.00 -0.85 -4.70 105.19 105.19 1x4z n GLY 100 Ca -0.09 -1.69 -0.24 0.00 0.00 0.00 0.00 46.02 43.99 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 3.49 0.62 1.61 1.03 -1.26 -0.51 118.70 121.69 1x4z s GLU 101 Ca 0.00 -0.40 0.03 0.00 0.03 0.00 0.00 54.97 54.62 1x4z s GLU 101 Cb 0.00 -2.75 0.09 0.00 -0.80 0.00 0.00 34.13 30.67 1x4z s GLU 101 CO 0.00 0.27 0.86 -1.54 -1.33 0.00 0.00 175.26 173.52 1x4z s SER 102 N -3.77 4.84 0.73 0.83 1.04 0.39 -4.54 113.70 113.21 1x4z s SER 102 Ca 0.39 -0.39 -0.12 0.00 0.48 0.00 0.00 55.95 56.30 1x4z s SER 102 Cb -0.10 -0.20 0.03 0.00 0.10 0.00 0.00 66.02 65.85 1x4z s SER 102 CO 0.33 -1.49 1.10 -1.61 0.98 0.00 0.00 173.24 172.55 1x4z s GLU 103 N -4.89 2.45 -0.48 4.02 2.02 -1.26 -4.61 118.70 115.96 1x4z s GLU 103 Ca 0.62 1.27 -0.27 0.00 0.02 0.00 0.00 54.97 56.61 1x4z s GLU 103 Cb -0.07 -1.91 -0.02 0.00 0.10 0.00 0.00 34.13 32.23 1x4z s GLU 103 CO 0.41 -1.50 1.79 -1.25 0.02 0.00 0.00 175.26 174.72 1x4z s PRO 104 N -4.56 3.00 0.50 0.39 0.04 -1.26 -4.03 135.00 129.08 1x4z s PRO 104 Ca 0.64 0.96 -0.20 0.00 0.04 0.00 0.00 61.00 62.44 1x4z s PRO 104 Cb -0.19 -4.27 -0.11 0.00 0.04 0.00 0.00 34.50 29.97 1x4z s PRO 104 CO 0.50 -2.27 0.47 -1.13 0.04 0.00 0.00 177.00 174.62 1x4z n SER 105 N 11.37 -1.21 -4.53 6.66 3.41 -0.92 -4.78 113.62 123.63 1x4z n SER 105 Ca 0.21 0.80 -0.48 0.00 -0.26 0.00 0.00 58.87 59.14 1x4z n SER 105 Cb 0.50 -1.12 -0.03 0.00 -0.26 0.00 0.00 64.21 63.29 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 -1.33 -1.42 -2.04 7.33 0.00 -1.26 -4.56 120.51 117.23 1x4z n ALA 106 Ca 0.11 0.45 -0.38 0.00 0.00 0.00 0.00 53.44 53.62 1x4z n ALA 106 Cb 0.44 -1.89 -0.03 0.00 0.00 0.00 0.00 19.45 17.97 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 -0.83 2.62 1.07 0.00 0.04 -1.26 -4.52 135.00 132.13 1x4z s PRO 107 Ca 0.68 0.56 -0.22 0.00 0.04 0.00 0.00 61.00 62.07 1x4z s PRO 107 Cb -0.87 -4.42 0.00 0.00 0.04 0.00 0.00 34.50 29.26 1x4z s PRO 107 CO 0.56 -2.76 -0.53 -1.13 0.04 0.00 0.00 177.00 173.17 1x4z n SER 108 N 12.80 -2.60 -4.73 6.66 3.41 -1.04 -4.87 113.62 123.24 1x4z n SER 108 Ca 0.21 -0.10 -0.37 0.00 -0.26 0.00 0.00 58.87 58.35 1x4z n SER 108 Cb 0.52 -0.79 0.06 0.00 -0.26 0.00 0.00 64.21 63.75 1x4z n SER 108 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1x4z s ARG 109 N -2.94 2.65 -0.04 4.33 1.70 -1.26 -4.52 118.95 118.87 1x4z s ARG 109 Ca 0.48 2.07 -0.30 0.00 -0.47 0.00 0.00 55.73 57.51 1x4z s ARG 109 Cb -0.03 -1.90 -0.05 0.00 -0.57 0.00 0.00 34.95 32.39 1x4z s ARG 109 CO 0.64 -1.53 1.48 -1.25 -1.08 0.00 0.00 175.30 173.57 1x4z s PRO 110 N -3.32 4.23 -0.21 3.89 0.04 -1.26 -4.70 135.00 133.68 1x4z s PRO 110 Ca 0.81 2.02 -0.05 0.00 0.04 0.00 0.00 61.00 63.82 1x4z s PRO 110 Cb -0.38 -3.74 -0.02 0.00 0.04 0.00 0.00 34.50 30.41 1x4z s PRO 110 CO 0.40 -0.70 0.00 -0.47 0.04 0.00 0.00 177.00 176.28 1x4z s TYR 111 N 3.11 3.03 -0.48 0.56 5.04 -0.80 -4.91 117.35 122.90 1x4z s TYR 111 Ca 0.66 -0.55 -0.17 0.00 -2.44 0.00 0.00 57.07 54.57 1x4z s TYR 111 Cb -0.31 -2.11 0.06 0.00 0.35 0.00 0.00 41.96 39.94 1x4z s TYR 111 CO 0.26 -0.32 0.48 0.08 -1.34 0.00 0.00 175.55 174.71 1x4z s VAL 112 N 1.20 5.08 -0.50 3.14 1.01 -1.26 -3.04 120.40 126.03 1x4z s VAL 112 Ca 0.03 -0.76 -0.28 0.00 0.00 0.00 0.00 61.98 60.97 1x4z s VAL 112 Cb -0.15 -4.18 0.01 0.00 0.00 0.00 0.00 36.38 32.07 1x4z s VAL 112 CO 0.01 -0.64 1.38 -0.69 0.00 0.00 0.00 175.10 175.16 1x4z s VAL 113 N 2.07 3.88 -0.16 2.92 1.01 -1.26 -4.81 120.40 124.06 1x4z s VAL 113 Ca 0.09 0.83 0.00 0.00 0.00 0.00 0.00 61.98 62.91 1x4z s VAL 113 Cb -0.21 -4.38 -0.10 0.00 0.00 0.00 0.00 36.38 31.69 1x4z s VAL 113 CO 0.09 -1.01 -0.15 -0.24 0.00 0.00 0.00 175.10 173.80 1x4z n SER 114 N 9.08 2.59 0.00 3.32 2.88 -1.26 0.15 113.62 130.38 1x4z n SER 114 Ca 0.14 -0.05 0.00 0.00 -1.33 0.00 0.00 58.87 57.62 1x4z n SER 114 Cb 0.49 -0.28 0.00 0.00 -0.75 0.00 0.00 64.21 63.67 1x4z n SER 114 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x4z n GLY 115 N 2.65 0.66 0.66 0.46 0.00 -1.26 -4.76 105.19 103.60 1x4z n GLY 115 Ca -0.29 -0.67 -0.04 0.00 0.00 0.00 0.00 46.02 45.02 1x4z n GLY 115 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1x4z n SER 116 N 0.00 1.42 0.00 1.61 7.64 -1.26 -5.08 113.62 117.95 1x4z n SER 116 Ca 0.00 0.21 0.00 0.00 1.01 0.00 0.00 58.87 60.09 1x4z n SER 116 Cb 0.00 -0.49 0.00 0.00 -1.01 0.00 0.00 64.21 62.71 1x4z n SER 116 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x4z n GLY 117 N 2.66 2.54 3.68 0.23 0.00 -1.26 -5.04 105.19 108.00 1x4z n GLY 117 Ca -0.06 -2.09 -0.42 0.00 0.00 0.00 0.00 46.02 43.44 1x4z n GLY 117 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x4z s PRO 118 N -1.92 4.26 -0.19 1.61 0.04 -1.26 -4.93 135.00 132.60 1x4z s PRO 118 Ca 0.00 2.02 -0.23 0.00 0.04 0.00 0.00 61.00 62.82 1x4z s PRO 118 Cb 0.00 -3.64 -0.21 0.00 0.04 0.00 0.00 34.50 30.70 1x4z s PRO 118 CO 0.00 -0.64 0.35 0.77 0.04 0.00 0.00 177.00 177.53 1x4z h SER 119 N 8.12 0.00 -2.90 6.66 0.02 -1.96 -3.42 113.55 120.07 1x4z h SER 119 Ca -0.38 -0.63 -0.71 0.00 -0.84 0.00 0.00 61.79 59.23 1x4z h SER 119 Cb 1.18 0.00 -0.20 0.00 0.14 0.00 0.00 62.40 63.52 1x4z h SER 119 CO 0.92 1.36 0.41 -0.94 -1.14 0.00 0.00 176.83 177.44 1x4z s SER 120 N -6.68 6.48 0.00 3.07 1.04 -1.26 -5.34 113.70 111.00 1x4z s SER 120 Ca -0.26 -1.90 0.00 0.00 0.48 0.00 0.00 55.95 54.27 1x4z s SER 120 Cb 0.04 -2.33 0.00 0.00 0.10 0.00 0.00 66.02 63.83 1x4z s SER 120 CO 0.61 -1.00 0.22 0.61 0.98 0.00 0.00 173.24 174.66