#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 -0.41 0.34 1.61 0.15 -1.26 -5.17 113.70 108.95 1x4z s SER 2 Ca 0.00 0.47 -0.02 0.00 0.70 0.00 0.00 55.95 57.10 1x4z s SER 2 Cb 0.00 0.36 -0.04 0.00 -1.71 0.00 0.00 66.02 64.63 1x4z s SER 2 CO 0.00 -0.37 0.56 -0.44 1.20 0.00 0.00 173.24 174.20 1x4z s SER 3 N -1.05 6.34 0.20 5.45 0.01 -1.26 -5.11 113.70 118.28 1x4z s SER 3 Ca -0.03 0.56 0.00 0.00 1.31 0.00 0.00 55.95 57.80 1x4z s SER 3 Cb -0.01 -2.08 0.00 0.00 0.21 0.00 0.00 66.02 64.14 1x4z s SER 3 CO 0.02 -0.28 0.00 0.61 0.41 0.00 0.00 173.24 174.00 1x4z n GLY 4 N -1.53 0.45 2.77 3.44 0.00 -1.26 -5.11 105.19 103.95 1x4z n GLY 4 Ca -0.03 -1.85 -0.20 0.00 0.00 0.00 0.00 46.02 43.93 1x4z n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x4z s SER 5 N -1.00 1.08 0.58 1.61 1.04 -1.26 -5.14 113.70 110.61 1x4z s SER 5 Ca 0.00 -0.03 -0.18 0.00 0.48 0.00 0.00 55.95 56.22 1x4z s SER 5 Cb 0.00 -0.30 -0.04 0.00 0.10 0.00 0.00 66.02 65.78 1x4z s SER 5 CO 0.00 -0.17 1.13 -0.55 0.98 0.00 0.00 173.24 174.63 1x4z s SER 6 N 1.66 5.47 0.10 7.02 0.15 -1.26 -5.05 113.70 121.78 1x4z s SER 6 Ca -0.01 2.16 0.00 0.00 0.70 0.00 0.00 55.95 58.80 1x4z s SER 6 Cb -0.13 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.61 1x4z s SER 6 CO -0.03 -1.39 0.00 0.61 1.20 0.00 0.00 173.24 173.62 1x4z n GLY 7 N 0.02 -0.27 3.73 9.45 0.00 -1.26 -5.00 105.19 111.86 1x4z n GLY 7 Ca 0.12 -1.72 -0.42 0.00 0.00 0.00 0.00 46.02 44.00 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 -1.00 6.82 -0.07 1.61 0.15 -1.26 -4.98 113.70 114.97 1x4z s SER 8 Ca 0.00 2.42 -0.12 0.00 0.70 0.00 0.00 55.95 58.95 1x4z s SER 8 Cb 0.00 -2.60 -0.05 0.00 -1.71 0.00 0.00 66.02 61.66 1x4z s SER 8 CO 0.00 -0.61 0.29 -1.58 1.20 0.00 0.00 173.24 172.53 1x4z s GLN 9 N 0.38 3.77 0.00 5.44 0.74 -1.26 -4.96 119.66 123.77 1x4z s GLN 9 Ca 0.61 0.16 0.10 0.00 0.05 0.00 0.00 55.36 56.27 1x4z s GLN 9 Cb -0.38 -3.23 0.57 0.00 1.10 0.00 0.00 33.01 31.07 1x4z s GLN 9 CO 0.35 0.67 1.02 -0.35 -0.55 0.00 0.00 175.29 176.43 1x4z n PRO 10 N 2.10 0.49 -3.98 1.67 -0.04 -1.26 -4.68 135.00 129.30 1x4z n PRO 10 Ca -0.16 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.21 1x4z n PRO 10 Cb 0.53 -1.31 -0.11 0.00 -0.04 0.00 0.00 33.50 32.57 1x4z n PRO 10 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1x4z s ASP 11 N -1.81 0.26 -0.38 3.54 2.15 -1.26 -5.09 116.67 114.08 1x4z s ASP 11 Ca 0.14 -0.48 -0.40 0.00 0.43 0.00 0.00 52.55 52.24 1x4z s ASP 11 Cb 0.07 0.09 -0.15 0.00 -0.30 0.00 0.00 42.92 42.63 1x4z s ASP 11 CO 0.11 -0.28 2.01 1.41 -0.17 0.00 0.00 175.17 178.25 1x4z n HIS 12 N 1.65 1.63 0.00 -5.34 8.25 -1.26 -4.51 115.22 115.64 1x4z n HIS 12 Ca -0.23 0.54 0.00 0.00 -0.26 0.00 0.00 57.72 57.76 1x4z n HIS 12 Cb 0.55 -2.43 0.00 0.00 1.12 0.00 0.00 29.99 29.23 1x4z n HIS 12 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1x4z n GLY 13 N 5.96 -1.96 3.56 -1.41 0.00 -1.26 -5.06 105.19 105.02 1x4z n GLY 13 Ca 0.40 0.58 -0.33 0.00 0.00 0.00 0.00 46.02 46.67 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 -0.15 2.86 0.41 1.61 1.81 -1.26 -4.96 118.95 119.28 1x4z s ARG 14 Ca 0.00 -0.34 0.00 0.00 -1.72 0.00 0.00 55.73 53.67 1x4z s ARG 14 Cb 0.00 -4.96 0.08 0.00 -0.45 0.00 0.00 34.95 29.62 1x4z s ARG 14 CO 0.00 -2.90 0.56 1.28 -0.68 0.00 0.00 175.30 173.56 1x4z n LEU 15 N 12.20 0.00 -4.20 2.53 4.77 -1.26 -4.92 117.00 126.12 1x4z n LEU 15 Ca 0.32 -1.20 -0.12 0.00 -0.03 0.00 0.00 56.01 54.99 1x4z n LEU 15 Cb 0.49 -0.36 -0.10 0.00 -2.33 0.00 0.00 43.42 41.12 1x4z n LEU 15 CO 0.64 -0.77 -0.39 -0.94 -1.33 0.00 0.00 177.39 174.61 1x4z s SER 16 N -3.28 1.35 1.02 -1.43 1.04 -1.05 -5.11 113.70 106.23 1x4z s SER 16 Ca 0.37 -1.03 -0.13 0.00 0.48 0.00 0.00 55.95 55.65 1x4z s SER 16 Cb -0.02 0.07 0.20 0.00 0.10 0.00 0.00 66.02 66.36 1x4z s SER 16 CO 0.25 -0.44 1.09 -2.16 0.98 0.00 0.00 173.24 172.96 1x4z s PRO 17 N -3.82 0.29 0.60 4.02 0.04 -1.26 -4.10 135.00 130.77 1x4z s PRO 17 Ca 0.15 0.47 -0.17 0.00 0.04 0.00 0.00 61.00 61.49 1x4z s PRO 17 Cb 0.05 -1.72 -0.03 0.00 0.04 0.00 0.00 34.50 32.83 1x4z s PRO 17 CO -0.02 -2.81 1.12 -1.25 0.04 0.00 0.00 177.00 174.07 1x4z s PRO 18 N -4.97 3.09 0.33 0.56 0.04 -1.23 -3.35 135.00 129.47 1x4z s PRO 18 Ca 0.66 1.50 0.02 0.00 0.04 0.00 0.00 61.00 63.22 1x4z s PRO 18 Cb -0.19 -1.98 -0.03 0.00 0.04 0.00 0.00 34.50 32.35 1x4z s PRO 18 CO 0.58 -1.04 0.51 -1.83 0.04 0.00 0.00 177.00 175.26 1x4z s GLU 19 N -3.68 3.38 0.08 4.56 -1.05 -1.23 -3.61 118.70 117.15 1x4z s GLU 19 Ca 0.70 -0.52 -0.32 0.00 -0.15 0.00 0.00 54.97 54.68 1x4z s GLU 19 Cb -0.22 -2.72 -0.11 0.00 -0.44 0.00 0.00 34.13 30.64 1x4z s GLU 19 CO 0.34 0.15 1.85 0.00 0.95 0.00 0.00 175.26 178.55 1x4z n ALA 20 N -1.72 1.80 -1.20 -0.84 0.00 -1.26 -4.60 120.51 112.70 1x4z n ALA 20 Ca -0.05 0.30 -0.30 0.00 0.00 0.00 0.00 53.44 53.40 1x4z n ALA 20 Cb 0.57 -2.57 0.14 0.00 0.00 0.00 0.00 19.45 17.59 1x4z n ALA 20 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1x4z s PRO 21 N 3.09 1.11 1.18 0.00 0.04 -1.26 -4.71 135.00 134.44 1x4z s PRO 21 Ca 0.85 0.76 -0.17 0.00 0.04 0.00 0.00 61.00 62.48 1x4z s PRO 21 Cb -0.52 -1.80 0.24 0.00 0.04 0.00 0.00 34.50 32.46 1x4z s PRO 21 CO 0.40 -2.33 0.51 -3.47 0.04 0.00 0.00 177.00 172.15 1x4z n ASP 22 N -3.94 -3.21 -4.68 6.66 2.03 0.29 -4.46 116.55 109.24 1x4z n ASP 22 Ca 0.07 -0.49 -0.43 0.00 0.52 0.00 0.00 54.79 54.46 1x4z n ASP 22 Cb 0.56 -0.90 -0.02 0.00 -0.72 0.00 0.00 41.12 40.03 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 -4.03 4.37 0.41 -0.67 3.52 -1.26 -4.52 118.95 116.76 1x4z s ARG 23 Ca 0.51 1.38 -0.25 0.00 -0.13 0.00 0.00 55.73 57.24 1x4z s ARG 23 Cb -0.10 -3.58 -0.08 0.00 -1.56 0.00 0.00 34.95 29.63 1x4z s ARG 23 CO 0.47 -0.42 1.18 -1.25 -0.81 0.00 0.00 175.30 174.47 1x4z s PRO 24 N 2.41 3.99 0.45 5.12 0.04 -1.26 -4.73 135.00 141.03 1x4z s PRO 24 Ca 0.47 1.87 0.01 0.00 0.04 0.00 0.00 61.00 63.39 1x4z s PRO 24 Cb -0.17 -2.64 0.00 0.00 0.04 0.00 0.00 34.50 31.73 1x4z s PRO 24 CO 0.14 -0.38 0.66 -0.08 0.04 0.00 0.00 177.00 177.39 1x4z s THR 25 N -1.42 3.74 -0.10 1.26 -1.32 -0.33 -4.65 115.64 112.82 1x4z s THR 25 Ca 0.58 -0.60 -0.00 0.00 -1.21 0.00 0.00 61.69 60.46 1x4z s THR 25 Cb -0.31 -3.37 0.02 0.00 -1.51 0.00 0.00 72.50 67.33 1x4z s THR 25 CO 0.39 -0.24 -0.08 -0.63 -2.21 0.00 0.00 174.62 171.85 1x4z s ILE 26 N -2.55 0.98 0.30 5.08 -1.09 -1.26 -3.31 121.20 119.35 1x4z s ILE 26 Ca 0.50 -0.28 0.01 0.00 -2.23 0.00 0.00 60.65 58.64 1x4z s ILE 26 Cb -0.10 -0.99 -0.00 0.00 -1.58 0.00 0.00 42.46 39.78 1x4z s ILE 26 CO 0.37 0.35 0.03 -1.20 -1.23 0.00 0.00 174.94 173.26 1x4z n SER 27 N 4.78 2.39 -4.32 3.58 7.64 -0.42 -4.97 113.62 122.31 1x4z n SER 27 Ca -0.14 -2.38 -0.46 0.00 1.01 0.00 0.00 58.87 56.90 1x4z n SER 27 Cb 0.50 0.34 -0.04 0.00 -1.01 0.00 0.00 64.21 64.00 1x4z n SER 27 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1x4z s THR 28 N -2.24 5.30 -0.24 0.44 2.01 -1.26 -3.32 115.64 116.32 1x4z s THR 28 Ca 0.04 -1.72 -0.04 0.00 0.31 0.00 0.00 61.69 60.27 1x4z s THR 28 Cb 0.00 -4.38 -0.17 0.00 0.01 0.00 0.00 72.50 67.96 1x4z s THR 28 CO 0.03 -0.92 -0.16 0.00 -0.69 0.00 0.00 174.62 172.88 1x4z n ALA 29 N 4.97 1.28 -3.52 7.40 0.00 -1.26 -4.81 120.51 124.57 1x4z n ALA 29 Ca -0.07 -1.01 -0.02 0.00 0.00 0.00 0.00 53.44 52.34 1x4z n ALA 29 Cb 0.42 -0.15 0.01 0.00 0.00 0.00 0.00 19.45 19.73 1x4z n ALA 29 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1x4z n SER 30 N -3.57 -1.27 0.18 0.00 2.88 -0.97 -4.93 113.62 105.93 1x4z n SER 30 Ca -0.45 -2.01 0.09 0.00 -1.33 0.00 0.00 58.87 55.17 1x4z n SER 30 Cb 0.96 2.15 0.10 0.00 -0.75 0.00 0.00 64.21 66.68 1x4z n SER 30 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 1x4z h GLU 31 N 0.00 0.00 0.00 -1.46 4.81 -1.91 -3.32 114.58 112.70 1x4z h GLU 31 Ca -0.20 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.03 1x4z h GLU 31 Cb 0.75 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.13 1x4z h GLU 31 CO 0.25 0.12 0.00 0.25 -0.73 0.00 0.00 179.01 178.90 1x4z n THR 32 N -3.06 0.00 -4.34 0.32 -2.24 -1.26 -4.55 114.28 99.15 1x4z n THR 32 Ca 0.02 -0.48 -0.18 0.00 -2.27 0.00 0.00 64.05 61.14 1x4z n THR 32 Cb 0.59 1.03 -0.09 0.00 -2.10 0.00 0.00 70.33 69.75 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 -0.07 1.47 -0.15 3.42 1.04 -1.25 -1.81 113.70 116.35 1x4z s SER 33 Ca 0.00 -1.51 -0.20 0.00 0.48 0.00 0.00 55.95 54.72 1x4z s SER 33 Cb 0.00 0.33 0.05 0.00 0.10 0.00 0.00 66.02 66.50 1x4z s SER 33 CO 0.00 -0.85 0.52 0.68 0.98 0.00 0.00 173.24 174.58 1x4z s VAL 34 N -3.64 0.01 -0.17 5.02 -7.23 -0.92 -2.30 120.40 111.17 1x4z s VAL 34 Ca 0.36 -0.07 -0.29 0.00 -1.81 0.00 0.00 61.98 60.17 1x4z s VAL 34 Cb 0.06 -0.76 -0.01 0.00 0.56 0.00 0.00 36.38 36.23 1x4z s VAL 34 CO 0.16 -0.04 1.18 -0.31 -0.31 0.00 0.00 175.10 175.78 1x4z s TYR 35 N -0.16 3.06 -0.15 2.82 2.02 -1.21 -1.25 117.35 122.47 1x4z s TYR 35 Ca -0.04 1.19 0.00 0.00 -0.37 0.00 0.00 57.07 57.86 1x4z s TYR 35 Cb -0.03 -3.41 -0.00 0.00 -0.40 0.00 0.00 41.96 38.11 1x4z s TYR 35 CO 0.03 -1.23 -0.15 0.08 -1.57 0.00 0.00 175.55 172.71 1x4z s VAL 36 N 3.24 2.70 -0.13 0.71 1.01 0.67 -1.30 120.40 127.30 1x4z s VAL 36 Ca 0.51 -0.76 0.01 0.00 0.00 0.00 0.00 61.98 61.74 1x4z s VAL 36 Cb -0.20 -2.14 0.02 0.00 0.00 0.00 0.00 36.38 34.06 1x4z s VAL 36 CO 0.13 0.51 -0.13 -0.89 0.00 0.00 0.00 175.10 174.72 1x4z s THR 37 N 0.80 1.40 0.42 3.92 2.01 -1.21 -0.74 115.64 122.25 1x4z s THR 37 Ca -0.05 -0.54 0.06 0.00 0.31 0.00 0.00 61.69 61.47 1x4z s THR 37 Cb -0.15 -1.33 -0.07 0.00 0.01 0.00 0.00 72.50 70.96 1x4z s THR 37 CO 0.00 0.43 0.04 -1.66 -0.69 0.00 0.00 174.62 172.74 1x4z s TRP 38 N 1.40 2.44 -0.23 4.92 -2.14 -0.10 -1.19 118.94 124.05 1x4z s TRP 38 Ca 0.02 -0.69 -0.02 0.00 2.66 0.00 0.00 56.10 58.06 1x4z s TRP 38 Cb -0.13 -1.79 0.07 0.00 -3.10 0.00 0.00 33.47 28.52 1x4z s TRP 38 CO -0.07 0.38 0.05 0.42 -2.66 0.00 0.00 176.95 175.06 1x4z s ILE 39 N -2.72 0.60 0.13 0.66 -1.09 -1.26 -4.73 121.20 112.78 1x4z s ILE 39 Ca 0.32 -0.77 -0.31 0.00 -2.23 0.00 0.00 60.65 57.66 1x4z s ILE 39 Cb 0.08 -1.19 -0.08 0.00 -1.58 0.00 0.00 42.46 39.69 1x4z s ILE 39 CO 0.17 -0.34 1.35 -2.16 -1.23 0.00 0.00 174.94 172.73 1x4z s PRO 40 N 1.81 4.35 -0.04 2.79 0.04 -1.26 -0.55 135.00 142.14 1x4z s PRO 40 Ca 0.02 2.04 -0.03 0.00 0.04 0.00 0.00 61.00 63.06 1x4z s PRO 40 Cb -0.17 -3.25 -0.01 0.00 0.04 0.00 0.00 34.50 31.11 1x4z s PRO 40 CO -0.13 -0.38 -0.06 0.54 0.04 0.00 0.00 177.00 177.01 1x4z n ARG 41 N 3.68 0.11 -4.16 4.56 5.12 -1.26 -4.91 116.66 119.80 1x4z n ARG 41 Ca 0.10 0.20 -0.23 0.00 -1.93 0.00 0.00 57.85 56.00 1x4z n ARG 41 Cb 0.43 -0.86 -0.06 0.00 -1.16 0.00 0.00 32.46 30.81 1x4z n ARG 41 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 1x4z s GLY 42 N -3.11 1.68 0.00 -0.13 0.00 -1.26 -5.03 107.32 99.47 1x4z s GLY 42 Ca -0.05 -1.64 0.00 0.00 0.00 0.00 0.00 44.72 43.03 1x4z s GLY 42 CO 0.07 -1.65 0.59 1.16 0.00 0.00 0.00 173.10 173.27 1x4z n ASN 43 N -1.08 1.05 0.00 1.64 6.94 -1.26 -3.57 115.26 118.98 1x4z n ASN 43 Ca -0.05 -1.33 0.00 0.00 -0.02 0.00 0.00 54.58 53.17 1x4z n ASN 43 Cb 0.59 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 38.01 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 -0.17 0.86 0.00 4.83 0.00 -1.21 -3.42 105.19 106.09 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 -2.21 2.28 3.78 -0.02 0.00 -1.26 -2.53 105.19 105.23 1x4z n GLY 45 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1x4z n GLY 45 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1x4z s PHE 46 N -2.27 2.91 -0.19 1.61 0.08 -1.22 -5.07 117.98 113.83 1x4z s PHE 46 Ca 0.00 -0.22 -0.29 0.00 0.12 0.00 0.00 56.93 56.53 1x4z s PHE 46 Cb 0.00 -1.49 -0.03 0.00 -0.57 0.00 0.00 43.02 40.93 1x4z s PHE 46 CO 0.00 0.43 1.59 -1.25 -0.10 0.00 0.00 175.22 175.89 1x4z s PRO 47 N -3.84 3.90 0.18 0.24 0.04 -1.26 -4.68 135.00 129.57 1x4z s PRO 47 Ca 0.35 1.74 -0.32 0.00 0.04 0.00 0.00 61.00 62.81 1x4z s PRO 47 Cb -0.06 -4.00 -0.16 0.00 0.04 0.00 0.00 34.50 30.32 1x4z s PRO 47 CO 0.24 -1.17 1.03 -0.89 0.04 0.00 0.00 177.00 176.25 1x4z n ILE 48 N 6.16 1.15 -0.09 0.56 5.41 -1.26 -4.69 119.36 126.60 1x4z n ILE 48 Ca 0.18 -0.29 -0.22 0.00 1.00 0.00 0.00 62.75 63.42 1x4z n ILE 48 Cb 0.45 -0.66 -0.12 0.00 -0.71 0.00 0.00 39.64 38.60 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 1.45 0.58 -3.44 0.38 6.02 -0.69 -4.70 117.38 116.98 1x4z n GLN 49 Ca 0.15 0.55 -0.11 0.00 -0.01 0.00 0.00 57.00 57.58 1x4z n GLN 49 Cb 0.24 -1.74 -0.02 0.00 1.02 0.00 0.00 30.24 29.74 1x4z n GLN 49 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1x4z s SER 50 N -6.88 -0.52 0.51 1.08 0.01 -0.75 -4.53 113.70 102.62 1x4z s SER 50 Ca -0.28 -0.01 0.07 0.00 1.31 0.00 0.00 55.95 57.04 1x4z s SER 50 Cb 0.06 0.55 0.03 0.00 0.21 0.00 0.00 66.02 66.87 1x4z s SER 50 CO 0.61 -0.90 0.44 -0.36 0.41 0.00 0.00 173.24 173.44 1x4z s PHE 51 N -3.61 1.92 -0.14 2.43 0.08 -1.01 -0.80 117.98 116.85 1x4z s PHE 51 Ca 0.02 -0.73 -0.07 0.00 0.12 0.00 0.00 56.93 56.27 1x4z s PHE 51 Cb -0.01 -2.02 0.06 0.00 -0.57 0.00 0.00 43.02 40.48 1x4z s PHE 51 CO -0.12 -0.44 0.33 1.03 -0.10 0.00 0.00 175.22 175.92 1x4z s ARG 52 N -4.27 0.29 -0.15 0.44 0.52 0.36 -3.60 118.95 112.54 1x4z s ARG 52 Ca 0.42 0.71 -0.03 0.00 -0.52 0.00 0.00 55.73 56.31 1x4z s ARG 52 Cb -0.03 -0.03 -0.02 0.00 0.52 0.00 0.00 34.95 35.39 1x4z s ARG 52 CO 0.25 -0.18 -0.06 0.08 0.02 0.00 0.00 175.30 175.41 1x4z s VAL 53 N 1.56 3.68 0.19 3.52 1.01 -1.21 0.29 120.40 129.44 1x4z s VAL 53 Ca -0.08 -0.44 0.08 0.00 0.00 0.00 0.00 61.98 61.55 1x4z s VAL 53 Cb -0.10 -2.59 -0.04 0.00 0.00 0.00 0.00 36.38 33.64 1x4z s VAL 53 CO -0.11 0.50 -0.16 -1.61 0.00 0.00 0.00 175.10 173.72 1x4z s GLU 54 N 0.32 1.32 0.01 2.72 2.02 -1.15 -0.99 118.70 122.95 1x4z s GLU 54 Ca -0.06 -1.52 0.00 0.00 0.02 0.00 0.00 54.97 53.42 1x4z s GLU 54 Cb -0.15 -1.25 -0.01 0.00 0.10 0.00 0.00 34.13 32.83 1x4z s GLU 54 CO 0.04 0.23 -0.02 1.52 0.02 0.00 0.00 175.26 177.05 1x4z s TYR 55 N -2.53 0.16 -0.06 1.61 -0.85 -0.35 -0.99 117.35 114.34 1x4z s TYR 55 Ca 0.20 -0.29 0.05 0.00 -0.52 0.00 0.00 57.07 56.52 1x4z s TYR 55 Cb -0.03 -0.11 -0.01 0.00 0.38 0.00 0.00 41.96 42.19 1x4z s TYR 55 CO 0.07 -0.10 -0.24 0.21 -1.52 0.00 0.00 175.55 173.98 1x4z s LYS 56 N -0.79 2.52 -0.06 -3.49 2.20 -1.21 -0.30 119.74 118.60 1x4z s LYS 56 Ca -0.08 -0.85 -0.27 0.00 -0.36 0.00 0.00 55.97 54.40 1x4z s LYS 56 Cb -0.05 -2.09 -0.03 0.00 -1.51 0.00 0.00 37.83 34.15 1x4z s LYS 56 CO -0.01 0.32 0.88 0.15 -0.36 0.00 0.00 175.35 176.33 1x4z s LYS 57 N -0.04 4.47 0.00 4.03 1.02 -1.26 -2.05 119.74 125.91 1x4z s LYS 57 Ca -0.06 1.19 0.00 0.00 0.02 0.00 0.00 55.97 57.12 1x4z s LYS 57 Cb -0.14 -3.48 0.00 0.00 -0.52 0.00 0.00 37.83 33.69 1x4z s LYS 57 CO 0.04 -0.09 0.00 1.28 -0.92 0.00 0.00 175.35 175.67 1x4z n LEU 58 N 4.18 0.16 -0.37 3.17 4.77 0.13 -4.29 117.00 124.75 1x4z n LEU 58 Ca 0.04 0.18 0.36 0.00 -0.03 0.00 0.00 56.01 56.56 1x4z n LEU 58 Cb 0.51 -0.43 0.58 0.00 -2.33 0.00 0.00 43.42 41.74 1x4z n LEU 58 CO 0.50 -0.43 1.34 0.11 -1.33 0.00 0.00 177.39 177.57 1x4z h LYS 59 N 0.00 0.00 -6.56 3.23 1.79 -1.94 -3.36 116.57 109.72 1x4z h LYS 59 Ca 0.00 0.00 -0.70 0.00 -2.18 0.00 0.00 60.65 57.77 1x4z h LYS 59 Cb 0.00 0.00 -0.29 0.00 -1.58 0.00 0.00 32.23 30.36 1x4z h LYS 59 CO 0.00 0.00 -0.87 0.21 -1.08 0.00 0.00 179.45 177.71 1x4z s LYS 60 N -4.59 2.17 0.02 3.15 2.47 -1.26 -5.08 119.74 116.62 1x4z s LYS 60 Ca -0.03 -0.89 -0.30 0.00 -1.56 0.00 0.00 55.97 53.18 1x4z s LYS 60 Cb 0.18 -2.10 -0.05 0.00 -1.46 0.00 0.00 37.83 34.41 1x4z s LYS 60 CO 0.62 0.57 1.23 0.54 0.16 0.00 0.00 175.35 178.47 1x4z s VAL 61 N -0.64 4.04 0.00 4.02 0.11 -1.26 -4.60 120.40 122.07 1x4z s VAL 61 Ca 0.10 1.43 0.00 0.00 -2.93 0.00 0.00 61.98 60.58 1x4z s VAL 61 Cb -0.10 -3.92 0.00 0.00 -1.53 0.00 0.00 36.38 30.83 1x4z s VAL 61 CO -0.01 0.06 0.00 0.61 -3.33 0.00 0.00 175.10 172.44 1x4z n GLY 62 N 3.33 -1.05 2.26 6.54 0.00 -1.26 -5.06 105.19 109.95 1x4z n GLY 62 Ca 0.10 -1.04 -0.12 0.00 0.00 0.00 0.00 46.02 44.97 1x4z n GLY 62 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1x4z n ASP 63 N 0.00 1.30 -4.76 1.61 5.75 -1.26 -4.78 116.55 114.41 1x4z n ASP 63 Ca 0.00 -1.91 -0.40 0.00 -0.01 0.00 0.00 54.79 52.47 1x4z n ASP 63 Cb 0.00 -0.22 -0.05 0.00 -1.03 0.00 0.00 41.12 39.82 1x4z n ASP 63 CO 0.00 0.00 0.00 0.26 -0.11 0.00 0.00 177.20 177.35 1x4z s TRP 64 N -1.13 3.64 0.31 2.11 0.52 -1.26 -4.42 118.94 118.71 1x4z s TRP 64 Ca 0.34 1.73 0.09 0.00 0.02 0.00 0.00 56.10 58.28 1x4z s TRP 64 Cb -0.03 -3.24 -0.05 0.00 -1.15 0.00 0.00 33.47 29.01 1x4z s TRP 64 CO 0.21 -0.39 -0.00 0.42 0.02 0.00 0.00 176.95 177.21 1x4z s ILE 65 N -1.12 2.92 -0.30 2.03 -1.09 0.58 -4.92 121.20 119.29 1x4z s ILE 65 Ca 0.44 -1.97 -0.13 0.00 -2.23 0.00 0.00 60.65 56.76 1x4z s ILE 65 Cb -0.31 -2.77 -0.03 0.00 -1.58 0.00 0.00 42.46 37.76 1x4z s ILE 65 CO 0.39 -0.28 0.26 -0.22 -1.23 0.00 0.00 174.94 173.86 1x4z s LEU 66 N -3.69 4.22 -0.02 2.97 2.96 -1.26 -1.22 118.68 122.64 1x4z s LEU 66 Ca 0.33 -0.11 -0.00 0.00 -0.22 0.00 0.00 54.13 54.13 1x4z s LEU 66 Cb -0.03 -2.20 -0.00 0.00 0.50 0.00 0.00 46.19 44.45 1x4z s LEU 66 CO 0.19 -0.16 -0.01 0.00 -1.32 0.00 0.00 176.35 175.05 1x4z h ALA 67 N 8.39 0.00 -1.62 5.97 0.00 -1.41 -3.49 119.26 127.10 1x4z h ALA 67 Ca -0.33 -0.10 -0.55 0.00 0.00 0.00 0.00 54.91 53.94 1x4z h ALA 67 Cb 1.17 0.02 -0.13 0.00 0.00 0.00 0.00 17.79 18.85 1x4z h ALA 67 CO 0.61 0.02 -0.54 -0.08 0.00 0.00 0.00 179.25 179.26 1x4z s THR 68 N -1.11 0.82 0.08 0.00 -1.32 -1.22 -4.97 115.64 107.92 1x4z s THR 68 Ca -0.01 -2.00 -0.27 0.00 -1.21 0.00 0.00 61.69 58.20 1x4z s THR 68 Cb 0.00 -2.45 0.08 0.00 -1.51 0.00 0.00 72.50 68.62 1x4z s THR 68 CO 0.01 0.00 0.99 -0.94 -2.21 0.00 0.00 174.62 172.47 1x4z s SER 69 N -3.60 -0.20 -0.55 8.08 1.04 -1.26 -3.32 113.70 113.88 1x4z s SER 69 Ca 0.26 -0.27 0.00 0.00 0.48 0.00 0.00 55.95 56.42 1x4z s SER 69 Cb 0.04 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.57 1x4z s SER 69 CO 0.14 -0.74 0.00 0.00 0.98 0.00 0.00 173.24 173.62 1x4z n ALA 70 N -0.41 -0.14 -2.00 5.32 0.00 -1.24 -5.00 120.51 117.04 1x4z n ALA 70 Ca -0.07 0.07 -0.41 0.00 0.00 0.00 0.00 53.44 53.03 1x4z n ALA 70 Cb 0.61 -0.96 -0.04 0.00 0.00 0.00 0.00 19.45 19.05 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 -2.26 3.95 0.70 0.00 1.01 -1.26 -4.89 121.20 118.45 1x4z s ILE 71 Ca 0.00 1.76 -0.13 0.00 0.00 0.00 0.00 60.65 62.27 1x4z s ILE 71 Cb 0.00 -4.12 0.02 0.00 0.01 0.00 0.00 42.46 38.37 1x4z s ILE 71 CO 0.00 0.34 1.10 -2.16 0.00 0.00 0.00 174.94 174.22 1x4z s PRO 72 N -0.61 2.62 0.48 2.79 0.04 -1.26 -2.39 135.00 136.66 1x4z s PRO 72 Ca 0.47 1.32 0.31 0.00 0.04 0.00 0.00 61.00 63.14 1x4z s PRO 72 Cb -0.28 -1.93 1.30 0.00 0.04 0.00 0.00 34.50 33.63 1x4z s PRO 72 CO 0.34 -1.38 1.93 -1.00 0.04 0.00 0.00 177.00 176.93 1x4z h PRO 73 N -0.36 0.00 0.00 0.56 0.13 -1.84 -2.43 132.00 128.06 1x4z h PRO 73 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1x4z h PRO 73 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1x4z h PRO 73 CO 0.53 0.00 -0.43 -1.13 -0.23 0.00 0.00 178.00 176.74 1x4z n SER 74 N -2.86 0.58 -4.29 1.44 3.41 -1.26 -4.65 113.62 106.00 1x4z n SER 74 Ca 0.01 0.14 -0.45 0.00 -0.26 0.00 0.00 58.87 58.31 1x4z n SER 74 Cb 0.27 -0.03 -0.06 0.00 -0.26 0.00 0.00 64.21 64.14 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 2.93 -0.03 4.33 3.52 -0.92 -4.88 118.95 120.80 1x4z s ARG 75 Ca 0.09 -1.80 0.18 0.00 -0.13 0.00 0.00 55.73 54.07 1x4z s ARG 75 Cb 0.15 -4.22 0.58 0.00 -1.56 0.00 0.00 34.95 29.89 1x4z s ARG 75 CO 0.67 -1.30 1.48 1.28 -0.81 0.00 0.00 175.30 176.63 1x4z n LEU 76 N 5.03 3.62 -3.69 -0.88 4.77 -1.26 -4.71 117.00 119.88 1x4z n LEU 76 Ca -0.10 -1.82 -0.10 0.00 -0.03 0.00 0.00 56.01 53.96 1x4z n LEU 76 Cb 0.41 -0.46 -0.10 0.00 -2.33 0.00 0.00 43.42 40.94 1x4z n LEU 76 CO 0.49 0.79 0.13 -0.55 -1.33 0.00 0.00 177.39 176.92 1x4z s SER 77 N -0.94 -0.59 0.14 -1.43 0.15 -1.26 -0.92 113.70 108.84 1x4z s SER 77 Ca 0.43 1.02 -0.07 0.00 0.70 0.00 0.00 55.95 58.03 1x4z s SER 77 Cb 0.24 0.92 -0.01 0.00 -1.71 0.00 0.00 66.02 65.46 1x4z s SER 77 CO 0.26 -0.20 0.21 0.68 1.20 0.00 0.00 173.24 175.39 1x4z s VAL 78 N 1.25 0.10 -0.42 4.45 -7.23 0.08 -4.98 120.40 113.65 1x4z s VAL 78 Ca -0.08 -1.46 -0.15 0.00 -1.81 0.00 0.00 61.98 58.48 1x4z s VAL 78 Cb -0.07 -1.76 0.03 0.00 0.56 0.00 0.00 36.38 35.15 1x4z s VAL 78 CO -0.12 -0.44 0.31 -0.70 -0.31 0.00 0.00 175.10 173.85 1x4z s GLU 79 N -3.96 2.95 -0.49 4.82 2.12 -1.26 -0.24 118.70 122.64 1x4z s GLU 79 Ca 0.15 -1.11 -0.28 0.00 0.36 0.00 0.00 54.97 54.09 1x4z s GLU 79 Cb 0.05 -3.99 0.01 0.00 0.26 0.00 0.00 34.13 30.46 1x4z s GLU 79 CO -0.02 -0.81 1.41 0.42 -0.54 0.00 0.00 175.26 175.71 1x4z s ILE 80 N 1.66 3.85 0.35 -3.70 -1.09 -0.38 -4.83 121.20 117.06 1x4z s ILE 80 Ca 0.04 0.80 0.07 0.00 -2.23 0.00 0.00 60.65 59.33 1x4z s ILE 80 Cb -0.20 -4.34 -0.02 0.00 -1.58 0.00 0.00 42.46 36.32 1x4z s ILE 80 CO 0.09 -0.98 0.40 0.42 -1.23 0.00 0.00 174.94 173.64 1x4z s THR 81 N 5.76 3.69 0.00 2.92 -4.23 -1.26 -2.16 115.64 120.36 1x4z s THR 81 Ca 0.56 -1.17 0.00 0.00 -1.18 0.00 0.00 61.69 59.91 1x4z s THR 81 Cb -0.12 -3.26 0.00 0.00 1.34 0.00 0.00 72.50 70.46 1x4z s THR 81 CO 0.29 -0.14 0.00 0.61 -0.54 0.00 0.00 174.62 174.84 1x4z n GLY 82 N -1.55 0.91 3.60 3.99 0.00 -1.21 -4.97 105.19 105.96 1x4z n GLY 82 Ca 0.00 -0.50 -0.18 0.00 0.00 0.00 0.00 46.02 45.33 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 -0.43 0.00 -4.03 0.99 4.77 -0.75 -5.09 117.00 112.47 1x4z n LEU 83 Ca 0.00 -2.27 -0.29 0.00 -0.03 0.00 0.00 56.01 53.42 1x4z n LEU 83 Cb 0.38 -0.41 -0.17 0.00 -2.33 0.00 0.00 43.42 40.89 1x4z n LEU 83 CO 0.00 -0.72 -0.49 -1.61 -1.33 0.00 0.00 177.39 173.24 1x4z s GLU 84 N -4.47 2.23 0.89 3.23 2.02 -1.26 -4.95 118.70 116.38 1x4z s GLU 84 Ca 0.57 -0.54 -0.10 0.00 0.02 0.00 0.00 54.97 54.91 1x4z s GLU 84 Cb -0.04 -1.99 0.13 0.00 0.10 0.00 0.00 34.13 32.33 1x4z s GLU 84 CO 0.36 -0.16 1.12 0.15 0.02 0.00 0.00 175.26 176.75 1x4z s LYS 85 N 1.28 1.24 -0.40 1.61 1.02 -1.26 -2.69 119.74 120.54 1x4z s LYS 85 Ca -0.00 1.34 0.00 0.00 0.02 0.00 0.00 55.97 57.33 1x4z s LYS 85 Cb -0.14 -1.77 0.00 0.00 -0.52 0.00 0.00 37.83 35.40 1x4z s LYS 85 CO -0.07 -2.41 0.00 0.41 -0.92 0.00 0.00 175.35 172.37 1x4z n GLY 86 N -0.25 0.36 3.01 -3.33 0.00 -0.11 -4.91 105.19 99.96 1x4z n GLY 86 Ca 0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 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 -1.24 1.94 0.20 -0.61 -1.09 -1.10 -5.01 121.20 114.29 1x4z s ILE 87 Ca 0.00 -1.60 -0.30 0.00 -2.23 0.00 0.00 60.65 56.53 1x4z s ILE 87 Cb 0.00 -2.16 -0.08 0.00 -1.58 0.00 0.00 42.46 38.64 1x4z s ILE 87 CO 0.00 -0.15 1.13 -0.44 -1.23 0.00 0.00 174.94 174.25 1x4z s SER 88 N 1.18 7.20 0.25 3.58 0.01 -1.26 -4.32 113.70 120.35 1x4z s SER 88 Ca -0.05 2.18 -0.19 0.00 1.31 0.00 0.00 55.95 59.21 1x4z s SER 88 Cb -0.19 -2.61 0.02 0.00 0.21 0.00 0.00 66.02 63.44 1x4z s SER 88 CO -0.06 -0.26 0.63 -0.72 0.41 0.00 0.00 173.24 173.24 1x4z s TYR 89 N -0.39 -0.08 0.30 2.43 -0.85 -1.17 -0.70 117.35 116.89 1x4z s TYR 89 Ca 0.49 -0.33 0.02 0.00 -0.52 0.00 0.00 57.07 56.73 1x4z s TYR 89 Cb -0.31 0.54 0.02 0.00 0.38 0.00 0.00 41.96 42.58 1x4z s TYR 89 CO 0.37 -1.11 0.13 1.63 -1.52 0.00 0.00 175.55 175.05 1x4z n LYS 90 N -0.42 1.15 -3.95 -3.49 5.02 -0.87 -1.40 118.16 114.20 1x4z n LYS 90 Ca -0.05 -2.00 -0.08 0.00 -2.02 0.00 0.00 58.31 54.15 1x4z n LYS 90 Cb 0.61 0.36 -0.09 0.00 -0.02 0.00 0.00 35.03 35.88 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 -1.74 0.28 0.31 2.13 0.40 -1.26 -3.34 117.98 114.75 1x4z s PHE 91 Ca 0.10 -0.71 -0.08 0.00 -0.60 0.00 0.00 56.93 55.65 1x4z s PHE 91 Cb -0.01 -0.19 0.00 0.00 0.51 0.00 0.00 43.02 43.34 1x4z s PHE 91 CO 0.06 -0.44 0.50 -0.98 0.70 0.00 0.00 175.22 175.06 1x4z s ARG 92 N -3.49 1.79 -0.05 0.44 1.70 -0.16 -1.49 118.95 117.70 1x4z s ARG 92 Ca 0.03 -1.54 -0.03 0.00 -0.47 0.00 0.00 55.73 53.72 1x4z s ARG 92 Cb 0.04 0.47 0.02 0.00 -0.57 0.00 0.00 34.95 34.91 1x4z s ARG 92 CO -0.09 -0.75 0.12 0.08 -1.08 0.00 0.00 175.30 173.58 1x4z s VAL 93 N -3.35 -0.02 0.03 4.99 1.01 -1.26 -2.96 120.40 118.85 1x4z s VAL 93 Ca 0.26 0.08 0.06 0.00 0.00 0.00 0.00 61.98 62.39 1x4z s VAL 93 Cb -0.01 -0.19 -0.02 0.00 0.00 0.00 0.00 36.38 36.16 1x4z s VAL 93 CO 0.15 0.03 -0.18 -0.13 0.00 0.00 0.00 175.10 174.97 1x4z s ARG 94 N 0.55 1.26 -0.18 2.72 0.52 0.15 -2.75 118.95 121.22 1x4z s ARG 94 Ca -0.04 -0.84 -0.07 0.00 -0.52 0.00 0.00 55.73 54.27 1x4z s ARG 94 Cb -0.06 -1.32 -0.04 0.00 0.52 0.00 0.00 34.95 34.05 1x4z s ARG 94 CO -0.02 0.34 0.04 0.00 0.02 0.00 0.00 175.30 175.68 1x4z s ALA 95 N -0.75 3.32 -0.18 2.13 0.00 -1.26 -0.48 121.76 124.53 1x4z s ALA 95 Ca 0.06 -0.78 0.01 0.00 0.00 0.00 0.00 51.96 51.25 1x4z s ALA 95 Cb -0.08 -1.86 0.03 0.00 0.00 0.00 0.00 23.12 21.22 1x4z s ALA 95 CO 0.01 0.16 -0.13 -0.51 0.00 0.00 0.00 175.76 175.29 1x4z s LEU 96 N 0.42 2.09 0.00 0.00 1.02 0.02 0.13 118.68 122.36 1x4z s LEU 96 Ca 0.02 -0.72 0.00 0.00 0.02 0.00 0.00 54.13 53.44 1x4z s LEU 96 Cb -0.13 -1.27 0.00 0.00 0.02 0.00 0.00 46.19 44.81 1x4z s LEU 96 CO 0.01 -0.09 0.00 -0.46 0.02 0.00 0.00 176.35 175.83 1x4z n ASN 97 N 4.69 2.37 0.00 2.29 6.94 0.10 -1.70 115.26 129.95 1x4z n ASN 97 Ca -0.17 -1.60 0.06 0.00 -0.02 0.00 0.00 54.58 52.86 1x4z n ASN 97 Cb 0.48 0.09 0.39 0.00 -2.36 0.00 0.00 39.78 38.38 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 -0.35 0.47 -0.04 -3.83 0.00 -1.26 -2.03 117.12 110.08 1x4z n MET 98 Ca -0.06 0.00 -0.02 0.00 0.00 0.00 0.00 57.70 57.63 1x4z n MET 98 Cb 0.17 -1.43 -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 -0.93 0.00 0.00 3.17 4.77 -1.26 -5.12 117.00 117.63 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 0.04 0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 1x4z n LEU 99 CO 0.07 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 176.93 1x4z n GLY 100 N 2.13 0.06 3.84 -0.72 0.00 -0.86 -4.72 105.19 104.93 1x4z n GLY 100 Ca -0.13 -1.50 -0.23 0.00 0.00 0.00 0.00 46.02 44.16 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 3.02 0.60 1.61 -1.05 -1.26 0.03 118.70 119.65 1x4z s GLU 101 Ca 0.00 -0.93 0.04 0.00 -0.15 0.00 0.00 54.97 53.93 1x4z s GLU 101 Cb 0.00 -2.66 0.08 0.00 -0.44 0.00 0.00 34.13 31.11 1x4z s GLU 101 CO 0.00 0.44 0.83 -1.54 0.95 0.00 0.00 175.26 175.94 1x4z s SER 102 N -3.60 4.94 0.69 0.83 1.04 0.36 -4.55 113.70 113.41 1x4z s SER 102 Ca 0.33 -0.41 -0.13 0.00 0.48 0.00 0.00 55.95 56.21 1x4z s SER 102 Cb -0.09 -0.23 0.01 0.00 0.10 0.00 0.00 66.02 65.82 1x4z s SER 102 CO 0.25 -1.41 1.09 -1.61 0.98 0.00 0.00 173.24 172.55 1x4z s GLU 103 N -4.82 2.70 -0.47 4.02 2.02 -1.26 -4.60 118.70 116.28 1x4z s GLU 103 Ca 0.61 1.26 -0.28 0.00 0.02 0.00 0.00 54.97 56.59 1x4z s GLU 103 Cb -0.07 -1.95 -0.02 0.00 0.10 0.00 0.00 34.13 32.20 1x4z s GLU 103 CO 0.40 -1.31 1.78 -1.25 0.02 0.00 0.00 175.26 174.90 1x4z s PRO 104 N -4.43 3.03 0.57 0.39 0.04 -1.26 -4.05 135.00 129.28 1x4z s PRO 104 Ca 0.64 0.98 -0.18 0.00 0.04 0.00 0.00 61.00 62.48 1x4z s PRO 104 Cb -0.18 -4.27 -0.11 0.00 0.04 0.00 0.00 34.50 29.98 1x4z s PRO 104 CO 0.47 -2.24 0.27 -1.13 0.04 0.00 0.00 177.00 174.42 1x4z n SER 105 N 11.27 -2.06 -4.46 6.66 3.41 -1.11 -4.78 113.62 122.56 1x4z n SER 105 Ca 0.21 0.69 -0.45 0.00 -0.26 0.00 0.00 58.87 59.05 1x4z n SER 105 Cb 0.49 -1.06 -0.02 0.00 -0.26 0.00 0.00 64.21 63.37 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 -1.70 -1.87 -2.04 7.33 0.00 -1.26 -4.60 120.51 116.37 1x4z n ALA 106 Ca 0.10 0.36 -0.36 0.00 0.00 0.00 0.00 53.44 53.54 1x4z n ALA 106 Cb 0.48 -1.75 -0.03 0.00 0.00 0.00 0.00 19.45 18.14 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 -1.26 2.60 0.73 0.00 0.04 -1.26 -4.61 135.00 131.24 1x4z s PRO 107 Ca 0.62 0.40 -0.17 0.00 0.04 0.00 0.00 61.00 61.89 1x4z s PRO 107 Cb -0.79 -4.55 -0.11 0.00 0.04 0.00 0.00 34.50 29.09 1x4z s PRO 107 CO 0.58 -2.89 -0.13 0.45 0.04 0.00 0.00 177.00 175.05 1x4z n SER 108 N 13.07 -3.66 -4.47 6.66 2.88 -0.55 -4.83 113.62 122.71 1x4z n SER 108 Ca 0.25 0.48 -0.36 0.00 -1.33 0.00 0.00 58.87 57.91 1x4z n SER 108 Cb 0.51 -0.94 0.07 0.00 -0.75 0.00 0.00 64.21 63.10 1x4z n SER 108 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1x4z n ARG 109 N 1.08 0.30 -2.16 -1.46 1.74 -1.26 -4.25 116.66 110.65 1x4z n ARG 109 Ca 0.05 0.14 -0.42 0.00 -0.77 0.00 0.00 57.85 56.85 1x4z n ARG 109 Cb 0.51 -1.85 -0.03 0.00 -1.02 0.00 0.00 32.46 30.08 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 -2.79 4.22 -0.21 5.56 0.04 -1.26 -4.65 135.00 135.91 1x4z s PRO 110 Ca 0.66 2.01 -0.03 0.00 0.04 0.00 0.00 61.00 63.68 1x4z s PRO 110 Cb -0.35 -3.79 -0.01 0.00 0.04 0.00 0.00 34.50 30.40 1x4z s PRO 110 CO 0.58 -0.72 -0.06 -0.47 0.04 0.00 0.00 177.00 176.36 1x4z s TYR 111 N 3.33 2.94 -0.51 0.56 6.14 -0.49 -4.92 117.35 124.39 1x4z s TYR 111 Ca 0.66 -1.00 -0.19 0.00 0.64 0.00 0.00 57.07 57.18 1x4z s TYR 111 Cb -0.31 -2.08 0.06 0.00 0.42 0.00 0.00 41.96 40.05 1x4z s TYR 111 CO 0.25 -0.57 0.63 0.08 0.64 0.00 0.00 175.55 176.59 1x4z s VAL 112 N 1.44 4.87 -0.49 3.14 1.01 -1.26 -3.06 120.40 126.05 1x4z s VAL 112 Ca 0.05 -0.54 -0.28 0.00 0.00 0.00 0.00 61.98 61.21 1x4z s VAL 112 Cb -0.14 -4.32 0.00 0.00 0.00 0.00 0.00 36.38 31.93 1x4z s VAL 112 CO -0.04 -0.83 1.54 -0.69 0.00 0.00 0.00 175.10 175.08 1x4z s VAL 113 N 2.63 3.70 -0.22 2.92 1.01 -1.26 -4.81 120.40 124.37 1x4z s VAL 113 Ca 0.15 0.64 -0.05 0.00 0.00 0.00 0.00 61.98 62.71 1x4z s VAL 113 Cb -0.20 -4.17 -0.12 0.00 0.00 0.00 0.00 36.38 31.89 1x4z s VAL 113 CO 0.11 -0.90 -0.24 -0.24 0.00 0.00 0.00 175.10 173.83 1x4z n SER 114 N 9.95 1.96 -1.99 3.32 2.88 -1.26 -0.94 113.62 127.54 1x4z n SER 114 Ca 0.16 0.09 -0.03 0.00 -1.33 0.00 0.00 58.87 57.77 1x4z n SER 114 Cb 0.49 -0.51 0.01 0.00 -0.75 0.00 0.00 64.21 63.45 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 2.02 1.19 3.53 0.46 0.00 -1.26 -4.82 105.19 106.30 1x4z n GLY 115 Ca -0.41 -1.07 -0.43 0.00 0.00 0.00 0.00 46.02 44.11 1x4z n GLY 115 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x4z s SER 116 N -2.08 6.36 0.55 1.61 1.04 -1.26 -4.35 113.70 115.57 1x4z s SER 116 Ca 0.09 -0.29 0.00 0.00 0.48 0.00 0.00 55.95 56.23 1x4z s SER 116 Cb -0.02 -2.44 0.00 0.00 0.10 0.00 0.00 66.02 63.66 1x4z s SER 116 CO 0.04 -1.21 0.00 0.61 0.98 0.00 0.00 173.24 173.66 1x4z n GLY 117 N 5.10 0.82 0.00 7.32 0.00 -1.26 -1.93 105.19 115.24 1x4z n GLY 117 Ca 0.02 -0.76 0.05 0.00 0.00 0.00 0.00 46.02 45.33 1x4z n GLY 117 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x4z n PRO 118 N 0.00 0.50 -0.23 1.61 -0.04 -1.26 -4.06 135.00 131.52 1x4z n PRO 118 Ca 0.00 0.00 0.22 0.00 -0.04 0.00 0.00 63.50 63.68 1x4z n PRO 118 Cb 0.00 -1.30 0.40 0.00 -0.04 0.00 0.00 33.50 32.56 1x4z n PRO 118 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1x4z n SER 119 N -0.80 0.23 -0.04 3.54 2.88 -0.81 -1.57 113.62 117.04 1x4z n SER 119 Ca 0.07 1.16 -0.03 0.00 -1.33 0.00 0.00 58.87 58.75 1x4z n SER 119 Cb 0.03 -0.56 -0.01 0.00 -0.75 0.00 0.00 64.21 62.92 1x4z n SER 119 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1x4z h SER 120 N 0.00 0.00 0.00 -3.46 0.02 -1.80 -3.51 113.55 104.80 1x4z h SER 120 Ca 0.59 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.54 1x4z h SER 120 Cb 1.54 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.08 1x4z h SER 120 CO -0.55 0.42 0.00 0.61 -1.14 0.00 0.00 176.83 176.18