#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 -0.49 0.72 1.61 0.01 -1.26 -5.18 113.70 109.11 1x4z s SER 2 Ca 0.00 -0.04 -0.05 0.00 1.31 0.00 0.00 55.95 57.17 1x4z s SER 2 Cb 0.00 0.56 0.10 0.00 0.21 0.00 0.00 66.02 66.89 1x4z s SER 2 CO 0.00 -0.92 1.01 -0.44 0.41 0.00 0.00 173.24 173.30 1x4z s SER 3 N -2.68 4.50 0.36 2.44 0.01 -1.26 -5.02 113.70 112.05 1x4z s SER 3 Ca 0.01 0.11 -0.28 0.00 1.31 0.00 0.00 55.95 57.10 1x4z s SER 3 Cb -0.00 -0.63 -0.12 0.00 0.21 0.00 0.00 66.02 65.48 1x4z s SER 3 CO -0.12 -1.77 1.42 0.61 0.41 0.00 0.00 173.24 173.79 1x4z n GLY 4 N -2.93 0.97 3.83 3.44 0.00 -1.26 -4.99 105.19 104.25 1x4z n GLY 4 Ca 0.11 0.33 -0.07 0.00 0.00 0.00 0.00 46.02 46.38 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 -0.15 -0.09 -0.19 1.61 0.01 -1.26 -5.11 113.70 108.52 1x4z s SER 5 Ca 0.55 -0.87 -0.29 0.00 1.31 0.00 0.00 55.95 56.66 1x4z s SER 5 Cb -0.51 0.75 -0.05 0.00 0.21 0.00 0.00 66.02 66.41 1x4z s SER 5 CO 0.62 -1.44 2.07 -0.94 0.41 0.00 0.00 173.24 173.96 1x4z s SER 6 N -3.05 5.76 0.00 2.44 1.04 -1.26 -4.82 113.70 113.81 1x4z s SER 6 Ca 0.14 1.94 0.00 0.00 0.48 0.00 0.00 55.95 58.51 1x4z s SER 6 Cb -0.05 -2.52 0.00 0.00 0.10 0.00 0.00 66.02 63.55 1x4z s SER 6 CO 0.09 -1.71 0.00 0.61 0.98 0.00 0.00 173.24 173.21 1x4z n GLY 7 N 5.41 2.95 3.21 7.32 0.00 -1.26 -5.18 105.19 117.63 1x4z n GLY 7 Ca 0.26 0.06 -0.12 0.00 0.00 0.00 0.00 46.02 46.22 1x4z n GLY 7 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x4z s SER 8 N 0.00 -0.11 0.03 1.61 1.04 -1.26 -5.17 113.70 109.84 1x4z s SER 8 Ca 0.00 -0.08 0.09 0.00 0.48 0.00 0.00 55.95 56.43 1x4z s SER 8 Cb 0.00 0.30 -0.03 0.00 0.10 0.00 0.00 66.02 66.39 1x4z s SER 8 CO 0.00 -0.48 -0.25 -1.10 0.98 0.00 0.00 173.24 172.39 1x4z s GLN 9 N -1.76 1.92 -0.39 4.02 1.11 -1.26 -5.08 119.66 118.22 1x4z s GLN 9 Ca -0.11 -1.05 -0.28 0.00 0.01 0.00 0.00 55.36 53.93 1x4z s GLN 9 Cb -0.04 -2.03 -0.01 0.00 -1.01 0.00 0.00 33.01 29.91 1x4z s GLN 9 CO 0.01 0.53 1.72 -1.25 0.01 0.00 0.00 175.29 176.31 1x4z s PRO 10 N -1.13 3.29 -0.24 2.91 0.04 -1.26 -4.94 135.00 133.68 1x4z s PRO 10 Ca 0.12 1.21 -0.27 0.00 0.04 0.00 0.00 61.00 62.10 1x4z s PRO 10 Cb -0.10 -4.19 0.12 0.00 0.04 0.00 0.00 34.50 30.38 1x4z s PRO 10 CO 0.02 -1.91 1.01 0.34 0.04 0.00 0.00 177.00 176.50 1x4z s ASP 11 N 5.88 -0.43 -0.57 6.66 2.15 -1.26 -5.10 116.67 124.00 1x4z s ASP 11 Ca 0.74 0.72 -0.26 0.00 0.43 0.00 0.00 52.55 54.18 1x4z s ASP 11 Cb -0.19 0.69 -0.05 0.00 -0.30 0.00 0.00 42.92 43.07 1x4z s ASP 11 CO 0.32 -0.23 2.13 -2.28 -0.17 0.00 0.00 175.17 174.94 1x4z s HIS 12 N -0.24 1.38 0.00 -5.34 5.65 -1.26 -3.72 115.29 111.76 1x4z s HIS 12 Ca 0.01 1.17 0.00 0.00 0.25 0.00 0.00 55.06 56.49 1x4z s HIS 12 Cb -0.03 -3.84 0.00 0.00 -1.18 0.00 0.00 32.58 27.52 1x4z s HIS 12 CO -0.03 -2.38 0.00 0.41 -0.65 0.00 0.00 174.74 172.09 1x4z n GLY 13 N 5.89 -0.68 3.52 1.59 0.00 -1.26 -5.07 105.19 109.19 1x4z n GLY 13 Ca 0.29 0.21 -0.21 0.00 0.00 0.00 0.00 46.02 46.32 1x4z n GLY 13 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x4z n ARG 14 N 0.00 0.24 -1.73 1.61 1.74 -1.24 -4.86 116.66 112.42 1x4z n ARG 14 Ca 0.00 -0.31 -0.11 0.00 -0.77 0.00 0.00 57.85 56.66 1x4z n ARG 14 Cb 0.00 -2.11 0.05 0.00 -1.02 0.00 0.00 32.46 29.39 1x4z n ARG 14 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1x4z n LEU 15 N 11.03 0.00 -4.03 0.55 4.77 -1.26 -5.12 117.00 122.94 1x4z n LEU 15 Ca 0.59 -1.13 -0.07 0.00 -0.03 0.00 0.00 56.01 55.37 1x4z n LEU 15 Cb 0.25 -0.29 -0.09 0.00 -2.33 0.00 0.00 43.42 40.96 1x4z n LEU 15 CO 0.87 -0.70 -0.30 -0.94 -1.33 0.00 0.00 177.39 175.00 1x4z s SER 16 N -2.97 0.40 1.00 -1.43 1.04 -1.07 -5.11 113.70 105.55 1x4z s SER 16 Ca 0.33 -0.92 -0.12 0.00 0.48 0.00 0.00 55.95 55.72 1x4z s SER 16 Cb -0.02 0.23 0.19 0.00 0.10 0.00 0.00 66.02 66.52 1x4z s SER 16 CO 0.21 -0.63 1.09 -2.16 0.98 0.00 0.00 173.24 172.73 1x4z s PRO 17 N -3.91 0.45 0.71 4.02 0.04 -1.26 -4.03 135.00 131.03 1x4z s PRO 17 Ca 0.07 0.53 -0.13 0.00 0.04 0.00 0.00 61.00 61.51 1x4z s PRO 17 Cb 0.07 -1.74 0.03 0.00 0.04 0.00 0.00 34.50 32.90 1x4z s PRO 17 CO -0.10 -2.72 1.10 -1.25 0.04 0.00 0.00 177.00 174.07 1x4z s PRO 18 N -4.96 2.54 0.31 0.56 0.04 -1.21 -3.39 135.00 128.89 1x4z s PRO 18 Ca 0.65 1.28 0.05 0.00 0.04 0.00 0.00 61.00 63.03 1x4z s PRO 18 Cb -0.19 -1.92 -0.02 0.00 0.04 0.00 0.00 34.50 32.41 1x4z s PRO 18 CO 0.58 -1.44 0.45 -1.83 0.04 0.00 0.00 177.00 174.80 1x4z s GLU 19 N -4.48 3.24 0.04 4.56 -1.05 -1.23 -3.68 118.70 116.09 1x4z s GLU 19 Ca 0.64 -0.86 -0.32 0.00 -0.15 0.00 0.00 54.97 54.28 1x4z s GLU 19 Cb -0.19 -2.82 -0.11 0.00 -0.44 0.00 0.00 34.13 30.58 1x4z s GLU 19 CO 0.48 0.16 1.89 0.00 0.95 0.00 0.00 175.26 178.74 1x4z n ALA 20 N -1.60 1.59 -1.22 -0.84 0.00 -1.26 -4.63 120.51 112.54 1x4z n ALA 20 Ca -0.03 0.28 -0.30 0.00 0.00 0.00 0.00 53.44 53.38 1x4z n ALA 20 Cb 0.58 -2.59 0.13 0.00 0.00 0.00 0.00 19.45 17.56 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 3.60 1.52 1.02 0.00 0.04 -1.26 -4.74 135.00 135.18 1x4z s PRO 21 Ca 0.87 0.91 -0.14 0.00 0.04 0.00 0.00 61.00 62.68 1x4z s PRO 21 Cb -0.53 -1.83 0.17 0.00 0.04 0.00 0.00 34.50 32.35 1x4z s PRO 21 CO 0.43 -2.08 0.29 -3.47 0.04 0.00 0.00 177.00 172.21 1x4z n ASP 22 N -3.79 -2.99 -4.68 6.66 2.03 0.32 -4.46 116.55 109.64 1x4z n ASP 22 Ca 0.08 -0.38 -0.42 0.00 0.52 0.00 0.00 54.79 54.59 1x4z n ASP 22 Cb 0.55 -0.78 -0.04 0.00 -0.72 0.00 0.00 41.12 40.13 1x4z n ASP 22 CO 0.00 0.00 0.00 -0.60 -1.92 0.00 0.00 177.20 174.68 1x4z s ARG 23 N -3.48 4.34 0.48 -0.67 3.52 -1.26 -4.54 118.95 117.34 1x4z s ARG 23 Ca 0.38 1.11 -0.22 0.00 -0.13 0.00 0.00 55.73 56.87 1x4z s ARG 23 Cb -0.06 -3.56 -0.07 0.00 -1.56 0.00 0.00 34.95 29.70 1x4z s ARG 23 CO 0.36 -0.31 1.16 -1.25 -0.81 0.00 0.00 175.30 174.45 1x4z s PRO 24 N 2.06 3.65 0.33 5.12 0.04 -1.26 -4.71 135.00 140.23 1x4z s PRO 24 Ca 0.41 1.73 0.06 0.00 0.04 0.00 0.00 61.00 63.24 1x4z s PRO 24 Cb -0.17 -2.30 -0.01 0.00 0.04 0.00 0.00 34.50 32.06 1x4z s PRO 24 CO 0.14 -0.63 0.47 -0.08 0.04 0.00 0.00 177.00 176.94 1x4z s THR 25 N -1.61 4.22 -0.18 1.26 -1.32 -0.01 -4.60 115.64 113.41 1x4z s THR 25 Ca 0.66 -0.96 0.01 0.00 -1.21 0.00 0.00 61.69 60.18 1x4z s THR 25 Cb -0.27 -3.47 0.03 0.00 -1.51 0.00 0.00 72.50 67.27 1x4z s THR 25 CO 0.33 -0.19 -0.15 -0.63 -2.21 0.00 0.00 174.62 171.76 1x4z s ILE 26 N -2.17 1.79 0.33 5.08 -1.09 -1.26 -3.10 121.20 120.78 1x4z s ILE 26 Ca 0.44 -0.88 0.08 0.00 -2.23 0.00 0.00 60.65 58.07 1x4z s ILE 26 Cb -0.09 -1.71 -0.06 0.00 -1.58 0.00 0.00 42.46 39.02 1x4z s ILE 26 CO 0.31 0.39 -0.08 -0.44 -1.23 0.00 0.00 174.94 173.90 1x4z s SER 27 N 1.38 3.45 -0.60 3.58 0.01 -0.07 -4.98 113.70 116.48 1x4z s SER 27 Ca 0.03 -1.21 -0.26 0.00 1.31 0.00 0.00 55.95 55.82 1x4z s SER 27 Cb -0.14 -0.30 0.04 0.00 0.21 0.00 0.00 66.02 65.83 1x4z s SER 27 CO -0.11 -0.26 1.09 -0.89 0.41 0.00 0.00 173.24 173.48 1x4z s THR 28 N -2.74 4.14 -0.14 1.44 2.01 -1.26 -2.03 115.64 117.06 1x4z s THR 28 Ca 0.32 0.51 0.03 0.00 0.31 0.00 0.00 61.69 62.86 1x4z s THR 28 Cb 0.03 -4.68 -0.11 0.00 0.01 0.00 0.00 72.50 67.76 1x4z s THR 28 CO 0.15 -1.33 -0.10 0.00 -0.69 0.00 0.00 174.62 172.65 1x4z n ALA 29 N 8.14 1.68 -3.83 7.40 0.00 -1.26 -4.79 120.51 127.86 1x4z n ALA 29 Ca 0.04 -0.67 -0.04 0.00 0.00 0.00 0.00 53.44 52.77 1x4z n ALA 29 Cb 0.48 0.12 0.01 0.00 0.00 0.00 0.00 19.45 20.06 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 -5.25 -0.06 0.30 0.00 0.01 -0.80 -4.87 113.70 103.04 1x4z s SER 30 Ca -0.17 -0.66 0.25 0.00 1.31 0.00 0.00 55.95 56.67 1x4z s SER 30 Cb 0.05 0.56 0.65 0.00 0.21 0.00 0.00 66.02 67.49 1x4z s SER 30 CO 0.37 -1.09 1.72 1.05 0.41 0.00 0.00 173.24 175.70 1x4z h GLU 31 N 2.00 0.00 -0.00 12.44 9.09 -1.85 -3.26 114.58 133.00 1x4z h GLU 31 Ca -0.27 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.14 1x4z h GLU 31 Cb 1.23 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.33 1x4z h GLU 31 CO 0.33 0.00 -0.03 0.25 0.05 0.00 0.00 179.01 179.61 1x4z n THR 32 N -2.58 0.00 -4.25 -1.06 -2.24 -1.26 -4.72 114.28 98.17 1x4z n THR 32 Ca 0.05 -0.48 -0.15 0.00 -2.27 0.00 0.00 64.05 61.20 1x4z n THR 32 Cb 0.46 1.01 -0.10 0.00 -2.10 0.00 0.00 70.33 69.60 1x4z n THR 32 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1x4z s SER 33 N -0.74 0.73 -0.07 3.42 1.04 -1.23 -2.19 113.70 114.67 1x4z s SER 33 Ca 0.01 -1.47 -0.14 0.00 0.48 0.00 0.00 55.95 54.84 1x4z s SER 33 Cb 0.01 0.37 0.03 0.00 0.10 0.00 0.00 66.02 66.53 1x4z s SER 33 CO 0.03 -0.86 0.32 0.68 0.98 0.00 0.00 173.24 174.40 1x4z s VAL 34 N -3.92 0.03 -0.35 5.02 -7.23 -0.62 -1.90 120.40 111.44 1x4z s VAL 34 Ca 0.39 -0.26 -0.28 0.00 -1.81 0.00 0.00 61.98 60.02 1x4z s VAL 34 Cb 0.06 -0.55 0.02 0.00 0.56 0.00 0.00 36.38 36.46 1x4z s VAL 34 CO 0.15 -0.14 1.02 -0.31 -0.31 0.00 0.00 175.10 175.51 1x4z s TYR 35 N -0.65 3.10 -0.18 2.82 2.02 -0.86 -0.66 117.35 122.95 1x4z s TYR 35 Ca -0.07 1.01 -0.04 0.00 -0.37 0.00 0.00 57.07 57.59 1x4z s TYR 35 Cb -0.04 -3.71 -0.02 0.00 -0.40 0.00 0.00 41.96 37.79 1x4z s TYR 35 CO 0.03 -0.81 -0.02 0.08 -1.57 0.00 0.00 175.55 173.25 1x4z s VAL 36 N 3.62 3.87 -0.13 0.71 1.01 0.51 -0.89 120.40 129.10 1x4z s VAL 36 Ca 0.43 -0.35 0.01 0.00 0.00 0.00 0.00 61.98 62.06 1x4z s VAL 36 Cb -0.12 -2.72 0.02 0.00 0.00 0.00 0.00 36.38 33.56 1x4z s VAL 36 CO 0.18 0.46 -0.13 -0.89 0.00 0.00 0.00 175.10 174.72 1x4z s THR 37 N 0.68 1.44 0.41 3.92 2.01 -1.18 -0.90 115.64 122.02 1x4z s THR 37 Ca -0.01 -0.56 0.06 0.00 0.31 0.00 0.00 61.69 61.48 1x4z s THR 37 Cb -0.14 -1.35 -0.07 0.00 0.01 0.00 0.00 72.50 70.95 1x4z s THR 37 CO 0.02 0.43 0.02 -1.66 -0.69 0.00 0.00 174.62 172.75 1x4z s TRP 38 N 1.37 2.35 -0.22 4.92 -2.14 0.01 -0.83 118.94 124.39 1x4z s TRP 38 Ca 0.01 -0.76 -0.03 0.00 2.66 0.00 0.00 56.10 57.99 1x4z s TRP 38 Cb -0.13 -1.67 0.07 0.00 -3.10 0.00 0.00 33.47 28.64 1x4z s TRP 38 CO -0.07 0.34 0.06 0.42 -2.66 0.00 0.00 176.95 175.04 1x4z s ILE 39 N -2.83 0.48 0.31 0.66 -1.09 -1.26 -4.72 121.20 112.74 1x4z s ILE 39 Ca 0.32 -0.70 -0.29 0.00 -2.23 0.00 0.00 60.65 57.74 1x4z s ILE 39 Cb 0.09 -1.11 -0.10 0.00 -1.58 0.00 0.00 42.46 39.76 1x4z s ILE 39 CO 0.16 -0.36 1.23 -2.16 -1.23 0.00 0.00 174.94 172.58 1x4z s PRO 40 N 1.86 4.46 0.00 2.79 0.04 -1.26 -0.52 135.00 142.37 1x4z s PRO 40 Ca 0.02 2.06 0.00 0.00 0.04 0.00 0.00 61.00 63.12 1x4z s PRO 40 Cb -0.17 -3.12 0.00 0.00 0.04 0.00 0.00 34.50 31.25 1x4z s PRO 40 CO -0.14 -0.04 0.00 0.54 0.04 0.00 0.00 177.00 177.40 1x4z n ARG 41 N 1.01 0.00 -4.13 4.56 5.12 -1.26 -4.88 116.66 117.07 1x4z n ARG 41 Ca -0.00 0.00 -0.23 0.00 -1.93 0.00 0.00 57.85 55.69 1x4z n ARG 41 Cb 0.43 -0.40 -0.05 0.00 -1.16 0.00 0.00 32.46 31.28 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 -2.92 1.48 0.00 -0.13 0.00 -1.26 -5.02 107.32 99.47 1x4z s GLY 42 Ca 0.00 -1.42 0.00 0.00 0.00 0.00 0.00 44.72 43.30 1x4z s GLY 42 CO 0.00 -1.46 0.65 1.16 0.00 0.00 0.00 173.10 173.45 1x4z n ASN 43 N -1.01 1.23 0.00 1.64 6.94 -1.26 -3.48 115.26 119.31 1x4z n ASN 43 Ca -0.08 -1.38 0.00 0.00 -0.02 0.00 0.00 54.58 53.10 1x4z n ASN 43 Cb 0.58 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 38.00 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 -0.19 1.17 0.00 4.83 0.00 -1.22 -3.33 105.19 106.46 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 -2.00 2.12 3.74 -0.02 0.00 -1.26 -2.58 105.19 105.19 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 -2.08 2.82 -0.23 1.61 0.08 -1.22 -5.07 117.98 113.89 1x4z s PHE 46 Ca 0.00 -0.26 -0.29 0.00 0.12 0.00 0.00 56.93 56.50 1x4z s PHE 46 Cb 0.00 -1.46 -0.03 0.00 -0.57 0.00 0.00 43.02 40.97 1x4z s PHE 46 CO 0.00 0.46 1.62 -1.25 -0.10 0.00 0.00 175.22 175.94 1x4z s PRO 47 N -3.81 3.78 0.11 0.24 0.04 -1.26 -4.69 135.00 129.42 1x4z s PRO 47 Ca 0.35 1.65 -0.35 0.00 0.04 0.00 0.00 61.00 62.68 1x4z s PRO 47 Cb -0.05 -4.04 -0.17 0.00 0.04 0.00 0.00 34.50 30.28 1x4z s PRO 47 CO 0.23 -1.31 1.21 -0.89 0.04 0.00 0.00 177.00 176.28 1x4z n ILE 48 N 6.44 0.42 -0.09 0.56 5.41 -1.26 -4.67 119.36 126.17 1x4z n ILE 48 Ca 0.19 -0.10 -0.18 0.00 1.00 0.00 0.00 62.75 63.66 1x4z n ILE 48 Cb 0.45 -0.71 -0.12 0.00 -0.71 0.00 0.00 39.64 38.56 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 3.79 0.00 -3.02 0.38 4.20 -1.58 -3.43 115.11 115.45 1x4z h GLN 49 Ca -0.46 0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.26 1x4z h GLN 49 Cb 1.35 0.00 -0.10 0.00 0.30 0.00 0.00 27.48 29.03 1x4z h GLN 49 CO 0.73 0.96 0.20 -1.54 -0.67 0.00 0.00 178.83 178.51 1x4z s SER 50 N -6.52 -0.46 0.44 1.46 1.04 -0.78 -4.52 113.70 104.36 1x4z s SER 50 Ca -0.24 -0.21 0.07 0.00 0.48 0.00 0.00 55.95 56.05 1x4z s SER 50 Cb 0.02 0.64 -0.01 0.00 0.10 0.00 0.00 66.02 66.76 1x4z s SER 50 CO 0.62 -1.09 0.35 -0.36 0.98 0.00 0.00 173.24 173.74 1x4z s PHE 51 N -3.81 2.46 -0.07 5.02 0.08 -0.99 -1.29 117.98 119.38 1x4z s PHE 51 Ca 0.04 -0.58 -0.03 0.00 0.12 0.00 0.00 56.93 56.48 1x4z s PHE 51 Cb -0.02 -2.08 0.04 0.00 -0.57 0.00 0.00 43.02 40.39 1x4z s PHE 51 CO -0.06 -0.14 0.15 1.03 -0.10 0.00 0.00 175.22 176.09 1x4z s ARG 52 N -4.12 0.08 -0.12 0.44 0.52 0.07 -3.61 118.95 112.21 1x4z s ARG 52 Ca 0.44 0.39 -0.01 0.00 -0.52 0.00 0.00 55.73 56.03 1x4z s ARG 52 Cb -0.01 -0.19 -0.02 0.00 0.52 0.00 0.00 34.95 35.24 1x4z s ARG 52 CO 0.26 -0.18 -0.08 0.08 0.02 0.00 0.00 175.30 175.39 1x4z s VAL 53 N 1.29 3.51 0.06 3.52 1.01 -1.21 0.08 120.40 128.65 1x4z s VAL 53 Ca -0.08 -0.51 0.02 0.00 0.00 0.00 0.00 61.98 61.41 1x4z s VAL 53 Cb -0.12 -2.48 -0.03 0.00 0.00 0.00 0.00 36.38 33.75 1x4z s VAL 53 CO -0.06 0.54 -0.08 -1.61 0.00 0.00 0.00 175.10 173.89 1x4z s GLU 54 N -0.01 0.63 0.39 2.72 2.02 -1.07 -1.76 118.70 121.63 1x4z s GLU 54 Ca -0.01 -0.92 0.04 0.00 0.02 0.00 0.00 54.97 54.10 1x4z s GLU 54 Cb -0.14 -0.32 -0.03 0.00 0.10 0.00 0.00 34.13 33.73 1x4z s GLU 54 CO 0.03 0.05 0.11 1.52 0.02 0.00 0.00 175.26 176.99 1x4z s TYR 55 N -1.90 1.82 -0.12 1.61 -0.85 -0.54 -0.54 117.35 116.82 1x4z s TYR 55 Ca -0.04 -1.19 -0.07 0.00 -0.52 0.00 0.00 57.07 55.25 1x4z s TYR 55 Cb -0.06 -1.19 0.04 0.00 0.38 0.00 0.00 41.96 41.13 1x4z s TYR 55 CO -0.01 -0.21 0.29 0.21 -1.52 0.00 0.00 175.55 174.32 1x4z s LYS 56 N -3.77 0.27 -0.10 -3.49 2.20 -1.17 -0.37 119.74 113.31 1x4z s LYS 56 Ca 0.27 0.55 -0.28 0.00 -0.36 0.00 0.00 55.97 56.15 1x4z s LYS 56 Cb 0.04 -0.04 -0.02 0.00 -1.51 0.00 0.00 37.83 36.31 1x4z s LYS 56 CO 0.14 -0.13 0.94 0.15 -0.36 0.00 0.00 175.35 176.09 1x4z s LYS 57 N 1.04 4.42 -0.12 4.03 1.02 -1.26 -2.15 119.74 126.73 1x4z s LYS 57 Ca -0.07 1.28 -0.08 0.00 0.02 0.00 0.00 55.97 57.11 1x4z s LYS 57 Cb -0.08 -3.53 -0.03 0.00 -0.52 0.00 0.00 37.83 33.68 1x4z s LYS 57 CO -0.07 -0.24 -0.16 1.28 -0.92 0.00 0.00 175.35 175.24 1x4z n LEU 58 N 4.76 1.48 -0.40 3.17 4.77 -0.24 -4.00 117.00 126.54 1x4z n LEU 58 Ca 0.07 0.54 0.35 0.00 -0.03 0.00 0.00 56.01 56.93 1x4z n LEU 58 Cb 0.49 -0.79 0.59 0.00 -2.33 0.00 0.00 43.42 41.38 1x4z n LEU 58 CO 0.51 -0.46 1.06 1.17 -1.33 0.00 0.00 177.39 178.33 1x4z n LYS 59 N -4.17 -0.03 -4.72 3.23 0.00 -1.25 -4.08 118.16 107.13 1x4z n LYS 59 Ca -0.06 1.11 -0.24 0.00 0.00 0.00 0.00 58.31 59.11 1x4z n LYS 59 Cb 0.24 -2.17 -0.16 0.00 0.00 0.00 0.00 35.03 32.94 1x4z n LYS 59 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 1x4z s LYS 60 N -5.07 1.51 -0.04 1.64 1.02 -1.26 -5.10 119.74 112.44 1x4z s LYS 60 Ca -0.07 -0.53 -0.29 0.00 0.02 0.00 0.00 55.97 55.10 1x4z s LYS 60 Cb 0.27 -1.35 -0.08 0.00 -0.52 0.00 0.00 37.83 36.16 1x4z s LYS 60 CO 0.72 0.23 2.03 0.54 -0.92 0.00 0.00 175.35 177.95 1x4z s VAL 61 N -0.00 3.03 -0.29 3.17 0.11 -1.26 -4.58 120.40 120.58 1x4z s VAL 61 Ca -0.02 0.04 -0.16 0.00 -2.93 0.00 0.00 61.98 58.91 1x4z s VAL 61 Cb -0.10 -3.03 0.12 0.00 -1.53 0.00 0.00 36.38 31.85 1x4z s VAL 61 CO 0.01 -0.01 0.87 -0.83 -3.33 0.00 0.00 175.10 171.82 1x4z s GLY 62 N 5.49 -0.23 0.72 6.54 0.00 -1.26 -5.06 107.32 113.51 1x4z s GLY 62 Ca 0.91 2.89 -0.10 0.00 0.00 0.00 0.00 44.72 48.42 1x4z s GLY 62 CO 0.39 2.57 0.35 2.09 0.00 0.00 0.00 173.10 178.50 1x4z n ASP 63 N 3.99 -2.62 -4.77 1.64 5.75 -1.26 -4.01 116.55 115.27 1x4z n ASP 63 Ca -0.19 -0.35 -0.38 0.00 -0.01 0.00 0.00 54.79 53.86 1x4z n ASP 63 Cb 0.58 -0.53 -0.06 0.00 -1.03 0.00 0.00 41.12 40.08 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 -1.55 3.81 0.33 2.11 0.52 -1.26 -4.41 118.94 118.49 1x4z s TRP 64 Ca 0.27 1.82 0.09 0.00 0.02 0.00 0.00 56.10 58.30 1x4z s TRP 64 Cb -0.05 -2.93 -0.05 0.00 -1.15 0.00 0.00 33.47 29.29 1x4z s TRP 64 CO 0.23 0.32 -0.02 0.42 0.02 0.00 0.00 176.95 177.91 1x4z s ILE 65 N -1.43 2.61 -0.23 2.03 -1.09 0.50 -4.93 121.20 118.66 1x4z s ILE 65 Ca 0.46 -2.03 -0.13 0.00 -2.23 0.00 0.00 60.65 56.71 1x4z s ILE 65 Cb -0.21 -2.74 -0.04 0.00 -1.58 0.00 0.00 42.46 37.88 1x4z s ILE 65 CO 0.27 -0.23 0.29 -0.22 -1.23 0.00 0.00 174.94 173.83 1x4z s LEU 66 N -3.68 4.12 -0.08 2.97 2.96 -1.26 -1.47 118.68 122.23 1x4z s LEU 66 Ca 0.34 0.30 -0.06 0.00 -0.22 0.00 0.00 54.13 54.49 1x4z s LEU 66 Cb -0.00 -2.33 -0.02 0.00 0.50 0.00 0.00 46.19 44.34 1x4z s LEU 66 CO 0.19 -0.04 -0.12 0.00 -1.32 0.00 0.00 176.35 175.06 1x4z n ALA 67 N 4.56 0.29 -2.49 5.97 0.00 -0.72 -4.97 120.51 123.15 1x4z n ALA 67 Ca -0.11 -0.35 -0.25 0.00 0.00 0.00 0.00 53.44 52.73 1x4z n ALA 67 Cb 0.51 0.01 -0.08 0.00 0.00 0.00 0.00 19.45 19.90 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 -1.74 0.44 0.06 0.00 -1.32 -1.24 -4.93 115.64 106.91 1x4z s THR 68 Ca -0.10 -2.00 -0.26 0.00 -1.21 0.00 0.00 61.69 58.12 1x4z s THR 68 Cb 0.01 -2.32 0.09 0.00 -1.51 0.00 0.00 72.50 68.77 1x4z s THR 68 CO 0.14 0.00 1.18 -0.94 -2.21 0.00 0.00 174.62 172.80 1x4z s SER 69 N -3.59 -0.01 -1.35 8.08 1.04 -1.26 -3.36 113.70 113.26 1x4z s SER 69 Ca 0.25 -0.38 -0.02 0.00 0.48 0.00 0.00 55.95 56.29 1x4z s SER 69 Cb 0.02 0.29 0.00 0.00 0.10 0.00 0.00 66.02 66.43 1x4z s SER 69 CO 0.17 -0.57 0.22 0.00 0.98 0.00 0.00 173.24 174.04 1x4z n ALA 70 N -0.78 -0.62 -2.11 5.32 0.00 -1.24 -4.98 120.51 116.11 1x4z n ALA 70 Ca -0.00 0.18 -0.39 0.00 0.00 0.00 0.00 53.44 53.22 1x4z n ALA 70 Cb 0.59 -2.47 -0.06 0.00 0.00 0.00 0.00 19.45 17.51 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 -2.93 4.49 0.70 0.00 1.01 -1.25 -4.91 121.20 118.30 1x4z s ILE 71 Ca 0.11 1.65 -0.13 0.00 0.00 0.00 0.00 60.65 62.28 1x4z s ILE 71 Cb -0.05 -4.12 0.02 0.00 0.01 0.00 0.00 42.46 38.33 1x4z s ILE 71 CO 0.13 0.48 1.10 -2.16 0.00 0.00 0.00 174.94 174.50 1x4z s PRO 72 N -0.86 2.59 0.53 2.79 0.04 -1.26 -2.35 135.00 136.49 1x4z s PRO 72 Ca 0.36 1.31 0.33 0.00 0.04 0.00 0.00 61.00 63.04 1x4z s PRO 72 Cb -0.22 -1.93 1.38 0.00 0.04 0.00 0.00 34.50 33.77 1x4z s PRO 72 CO 0.25 -1.40 1.98 -1.00 0.04 0.00 0.00 177.00 176.87 1x4z h PRO 73 N -0.41 0.00 0.00 0.56 0.13 -1.83 -2.49 132.00 127.96 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 -0.36 1.03 -0.23 0.00 0.00 178.00 178.97 1x4z h SER 74 N 0.00 0.00 -3.12 1.44 0.87 -1.96 -3.42 113.55 107.36 1x4z h SER 74 Ca 0.00 -0.11 -0.75 0.00 -1.23 0.00 0.00 61.79 59.70 1x4z h SER 74 Cb 0.48 0.00 -0.23 0.00 -0.44 0.00 0.00 62.40 62.21 1x4z h SER 74 CO 0.00 0.06 -0.19 -0.60 -0.53 0.00 0.00 176.83 175.56 1x4z s ARG 75 N -3.15 3.00 0.00 2.24 3.52 -0.94 -4.88 118.95 118.74 1x4z s ARG 75 Ca 0.08 -1.56 0.20 0.00 -0.13 0.00 0.00 55.73 54.32 1x4z s ARG 75 Cb 0.12 -4.25 0.54 0.00 -1.56 0.00 0.00 34.95 29.80 1x4z s ARG 75 CO 0.67 -1.29 1.45 1.28 -0.81 0.00 0.00 175.30 176.61 1x4z n LEU 76 N 5.40 3.24 -3.71 -0.88 4.77 -1.26 -4.72 117.00 119.84 1x4z n LEU 76 Ca -0.13 -1.58 -0.12 0.00 -0.03 0.00 0.00 56.01 54.16 1x4z n LEU 76 Cb 0.41 -0.37 -0.11 0.00 -2.33 0.00 0.00 43.42 41.02 1x4z n LEU 76 CO 0.53 0.79 0.06 -0.55 -1.33 0.00 0.00 177.39 176.89 1x4z s SER 77 N -1.10 -0.47 0.11 -1.43 0.15 -1.26 -0.81 113.70 108.88 1x4z s SER 77 Ca 0.41 0.86 -0.08 0.00 0.70 0.00 0.00 55.95 57.83 1x4z s SER 77 Cb 0.22 0.79 -0.01 0.00 -1.71 0.00 0.00 66.02 65.31 1x4z s SER 77 CO 0.29 -0.17 0.20 0.68 1.20 0.00 0.00 173.24 175.44 1x4z s VAL 78 N 0.92 0.12 -0.41 4.45 -7.23 -0.08 -4.98 120.40 113.19 1x4z s VAL 78 Ca -0.06 -1.31 -0.16 0.00 -1.81 0.00 0.00 61.98 58.64 1x4z s VAL 78 Cb -0.06 -1.54 0.02 0.00 0.56 0.00 0.00 36.38 35.35 1x4z s VAL 78 CO -0.07 -0.54 0.38 -0.70 -0.31 0.00 0.00 175.10 173.86 1x4z s GLU 79 N -3.91 3.07 -0.49 4.82 2.12 -1.26 -0.36 118.70 122.69 1x4z s GLU 79 Ca 0.10 -0.84 -0.29 0.00 0.36 0.00 0.00 54.97 54.30 1x4z s GLU 79 Cb 0.05 -3.97 0.03 0.00 0.26 0.00 0.00 34.13 30.50 1x4z s GLU 79 CO -0.07 -0.80 1.14 0.42 -0.54 0.00 0.00 175.26 175.41 1x4z s ILE 80 N 1.96 4.19 0.36 -3.70 -1.09 0.17 -4.82 121.20 118.27 1x4z s ILE 80 Ca 0.09 1.19 0.08 0.00 -2.23 0.00 0.00 60.65 59.78 1x4z s ILE 80 Cb -0.18 -4.61 -0.03 0.00 -1.58 0.00 0.00 42.46 36.06 1x4z s ILE 80 CO 0.12 -1.04 0.28 0.42 -1.23 0.00 0.00 174.94 173.50 1x4z s THR 81 N 4.49 3.19 0.00 2.92 -4.23 -1.26 -1.59 115.64 119.16 1x4z s THR 81 Ca 0.47 -1.43 0.00 0.00 -1.18 0.00 0.00 61.69 59.55 1x4z s THR 81 Cb -0.07 -3.10 0.00 0.00 1.34 0.00 0.00 72.50 70.67 1x4z s THR 81 CO 0.31 -0.13 0.00 0.61 -0.54 0.00 0.00 174.62 174.88 1x4z n GLY 82 N -1.37 1.17 3.98 3.99 0.00 -1.17 -4.95 105.19 106.83 1x4z n GLY 82 Ca -0.01 -0.37 -0.18 0.00 0.00 0.00 0.00 46.02 45.46 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 -0.16 3.58 -0.11 0.99 1.43 -0.93 -5.10 118.68 118.39 1x4z s LEU 83 Ca 0.00 -0.51 0.01 0.00 -1.03 0.00 0.00 54.13 52.60 1x4z s LEU 83 Cb 0.00 -2.48 -0.02 0.00 0.03 0.00 0.00 46.19 43.72 1x4z s LEU 83 CO 0.00 -0.76 -0.14 -1.61 0.23 0.00 0.00 176.35 174.08 1x4z s GLU 84 N -4.31 3.13 0.72 1.70 0.41 -1.26 -4.89 118.70 114.20 1x4z s GLU 84 Ca 0.53 -0.69 -0.13 0.00 -0.41 0.00 0.00 54.97 54.27 1x4z s GLU 84 Cb -0.08 -2.55 0.03 0.00 -1.78 0.00 0.00 34.13 29.75 1x4z s GLU 84 CO 0.32 0.33 1.12 0.15 -0.49 0.00 0.00 175.26 176.69 1x4z s LYS 85 N 0.04 2.39 -0.37 1.61 1.02 -1.26 -2.95 119.74 120.22 1x4z s LYS 85 Ca -0.05 1.38 0.00 0.00 0.02 0.00 0.00 55.97 57.33 1x4z s LYS 85 Cb -0.14 -1.90 0.00 0.00 -0.52 0.00 0.00 37.83 35.27 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 -0.55 0.42 3.02 -3.33 0.00 0.58 -4.94 105.19 100.39 1x4z n GLY 86 Ca 0.10 -0.04 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 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 -1.47 2.16 0.31 -0.61 -1.09 -1.15 -5.01 121.20 114.33 1x4z s ILE 87 Ca 0.00 -2.06 -0.29 0.00 -2.23 0.00 0.00 60.65 56.07 1x4z s ILE 87 Cb 0.00 -2.49 -0.10 0.00 -1.58 0.00 0.00 42.46 38.29 1x4z s ILE 87 CO 0.00 -0.42 1.21 -0.44 -1.23 0.00 0.00 174.94 174.05 1x4z s SER 88 N 1.01 6.99 0.13 3.58 0.01 -1.26 -4.35 113.70 119.81 1x4z s SER 88 Ca 0.05 2.48 -0.25 0.00 1.31 0.00 0.00 55.95 59.54 1x4z s SER 88 Cb -0.19 -2.64 0.07 0.00 0.21 0.00 0.00 66.02 63.47 1x4z s SER 88 CO -0.08 -0.36 0.76 -0.72 0.41 0.00 0.00 173.24 173.25 1x4z s TYR 89 N -1.16 -0.36 0.34 2.43 -0.85 -1.16 -1.08 117.35 115.50 1x4z s TYR 89 Ca 0.47 0.12 0.03 0.00 -0.52 0.00 0.00 57.07 57.17 1x4z s TYR 89 Cb -0.36 0.59 0.03 0.00 0.38 0.00 0.00 41.96 42.60 1x4z s TYR 89 CO 0.47 -0.82 0.27 1.63 -1.52 0.00 0.00 175.55 175.58 1x4z n LYS 90 N -0.37 0.97 -4.09 -3.49 5.02 -0.92 -1.60 118.16 113.69 1x4z n LYS 90 Ca -0.11 -2.10 -0.09 0.00 -2.02 0.00 0.00 58.31 53.99 1x4z n LYS 90 Cb 0.62 0.20 -0.09 0.00 -0.02 0.00 0.00 35.03 35.74 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 -1.64 0.71 0.27 2.13 0.40 -1.26 -3.02 117.98 115.57 1x4z s PHE 91 Ca 0.21 -1.10 -0.18 0.00 -0.60 0.00 0.00 56.93 55.25 1x4z s PHE 91 Cb -0.02 -0.37 0.01 0.00 0.51 0.00 0.00 43.02 43.16 1x4z s PHE 91 CO 0.13 -0.55 0.65 -0.98 0.70 0.00 0.00 175.22 175.17 1x4z s ARG 92 N -4.01 1.72 -0.00 0.44 1.70 0.30 -2.13 118.95 116.96 1x4z s ARG 92 Ca 0.20 -1.07 0.01 0.00 -0.47 0.00 0.00 55.73 54.40 1x4z s ARG 92 Cb 0.07 0.57 -0.00 0.00 -0.57 0.00 0.00 34.95 35.01 1x4z s ARG 92 CO -0.00 -0.77 -0.04 0.08 -1.08 0.00 0.00 175.30 173.49 1x4z s VAL 93 N -3.93 0.29 -0.03 4.99 1.01 -1.26 -2.58 120.40 118.89 1x4z s VAL 93 Ca 0.14 -0.17 0.04 0.00 0.00 0.00 0.00 61.98 61.99 1x4z s VAL 93 Cb -0.04 -0.25 -0.00 0.00 0.00 0.00 0.00 36.38 36.08 1x4z s VAL 93 CO 0.08 0.07 -0.13 -0.13 0.00 0.00 0.00 175.10 174.99 1x4z s ARG 94 N -0.11 1.31 -0.16 2.72 0.52 0.11 -2.69 118.95 120.66 1x4z s ARG 94 Ca 0.01 -0.46 -0.16 0.00 -0.52 0.00 0.00 55.73 54.60 1x4z s ARG 94 Cb -0.02 -1.19 -0.04 0.00 0.52 0.00 0.00 34.95 34.23 1x4z s ARG 94 CO -0.00 0.20 0.41 0.00 0.02 0.00 0.00 175.30 175.92 1x4z s ALA 95 N 0.04 3.53 -0.15 2.13 0.00 -1.26 -0.76 121.76 125.29 1x4z s ALA 95 Ca -0.02 -0.36 0.00 0.00 0.00 0.00 0.00 51.96 51.59 1x4z s ALA 95 Cb -0.09 -2.58 0.02 0.00 0.00 0.00 0.00 23.12 20.47 1x4z s ALA 95 CO 0.01 -0.08 -0.15 -0.51 0.00 0.00 0.00 175.76 175.03 1x4z s LEU 96 N 0.81 1.77 0.00 0.00 1.02 -0.41 0.61 118.68 122.48 1x4z s LEU 96 Ca 0.22 -0.52 0.00 0.00 0.02 0.00 0.00 54.13 53.85 1x4z s LEU 96 Cb -0.14 -1.24 -0.00 0.00 0.02 0.00 0.00 46.19 44.83 1x4z s LEU 96 CO 0.08 -0.04 0.01 -0.46 0.02 0.00 0.00 176.35 175.96 1x4z n ASN 97 N 4.73 1.94 0.00 2.29 6.94 0.82 -1.43 115.26 130.55 1x4z n ASN 97 Ca -0.18 -1.64 0.07 0.00 -0.02 0.00 0.00 54.58 52.81 1x4z n ASN 97 Cb 0.50 0.17 0.39 0.00 -2.36 0.00 0.00 39.78 38.48 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 -0.33 0.49 -0.04 -3.83 0.00 -1.26 -2.05 117.12 110.09 1x4z n MET 98 Ca -0.05 0.00 -0.01 0.00 0.00 0.00 0.00 57.70 57.64 1x4z n MET 98 Cb 0.18 -1.42 -0.09 0.00 0.00 0.00 0.00 33.22 31.89 1x4z n MET 98 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1x4z n LEU 99 N -0.92 0.00 0.00 3.17 4.77 -1.26 -5.12 117.00 117.64 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 0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 1x4z n LEU 99 CO 0.07 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 176.92 1x4z n GLY 100 N 2.12 0.18 3.78 -0.72 0.00 -0.87 -4.73 105.19 104.93 1x4z n GLY 100 Ca -0.12 -1.54 -0.24 0.00 0.00 0.00 0.00 46.02 44.12 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 2.79 0.58 1.61 1.03 -1.26 -0.13 118.70 121.33 1x4z s GLU 101 Ca 0.00 -1.03 0.05 0.00 0.03 0.00 0.00 54.97 54.02 1x4z s GLU 101 Cb 0.00 -2.53 0.07 0.00 -0.80 0.00 0.00 34.13 30.87 1x4z s GLU 101 CO 0.00 0.44 0.81 -1.54 -1.33 0.00 0.00 175.26 173.63 1x4z s SER 102 N -3.44 5.01 0.74 0.83 1.04 0.20 -4.63 113.70 113.46 1x4z s SER 102 Ca 0.31 -0.45 -0.12 0.00 0.48 0.00 0.00 55.95 56.16 1x4z s SER 102 Cb -0.09 -0.21 0.04 0.00 0.10 0.00 0.00 66.02 65.87 1x4z s SER 102 CO 0.23 -1.35 1.11 -1.61 0.98 0.00 0.00 173.24 172.60 1x4z s GLU 103 N -4.77 2.33 -0.32 4.02 2.02 -1.26 -4.62 118.70 116.10 1x4z s GLU 103 Ca 0.61 1.32 -0.29 0.00 0.02 0.00 0.00 54.97 56.63 1x4z s GLU 103 Cb -0.07 -1.90 -0.01 0.00 0.10 0.00 0.00 34.13 32.25 1x4z s GLU 103 CO 0.39 -1.60 1.67 -1.25 0.02 0.00 0.00 175.26 174.49 1x4z s PRO 104 N -4.53 3.51 0.74 0.39 0.04 -1.26 -4.02 135.00 129.87 1x4z s PRO 104 Ca 0.65 1.39 -0.16 0.00 0.04 0.00 0.00 61.00 62.92 1x4z s PRO 104 Cb -0.20 -4.12 -0.04 0.00 0.04 0.00 0.00 34.50 30.18 1x4z s PRO 104 CO 0.50 -1.65 0.45 -1.13 0.04 0.00 0.00 177.00 175.22 1x4z n SER 105 N 9.50 -1.51 -4.53 6.66 3.41 -1.10 -4.82 113.62 121.23 1x4z n SER 105 Ca 0.21 0.56 -0.45 0.00 -0.26 0.00 0.00 58.87 58.93 1x4z n SER 105 Cb 0.47 -1.19 -0.01 0.00 -0.26 0.00 0.00 64.21 63.22 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 -2.43 -0.95 -2.04 7.33 0.00 -1.26 -4.65 120.51 116.51 1x4z n ALA 106 Ca 0.09 0.36 -0.36 0.00 0.00 0.00 0.00 53.44 53.53 1x4z n ALA 106 Cb 0.50 -1.90 -0.03 0.00 0.00 0.00 0.00 19.45 18.02 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 -1.47 2.61 1.01 0.00 0.04 -1.26 -4.58 135.00 131.35 1x4z s PRO 107 Ca 0.61 0.44 -0.19 0.00 0.04 0.00 0.00 61.00 61.89 1x4z s PRO 107 Cb -0.73 -4.52 -0.07 0.00 0.04 0.00 0.00 34.50 29.22 1x4z s PRO 107 CO 0.59 -2.86 -0.59 -1.13 0.04 0.00 0.00 177.00 173.05 1x4z n SER 108 N 13.01 -3.61 -4.67 6.66 3.41 -0.91 -4.86 113.62 122.66 1x4z n SER 108 Ca 0.24 0.10 -0.36 0.00 -0.26 0.00 0.00 58.87 58.59 1x4z n SER 108 Cb 0.51 -0.83 0.08 0.00 -0.26 0.00 0.00 64.21 63.72 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 0.64 0.72 -2.16 4.33 1.74 -1.26 -4.43 116.66 116.24 1x4z n ARG 109 Ca 0.00 0.30 -0.42 0.00 -0.77 0.00 0.00 57.85 56.96 1x4z n ARG 109 Cb 0.62 -2.38 -0.03 0.00 -1.02 0.00 0.00 32.46 29.66 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 -3.44 4.23 -0.21 5.56 0.04 -1.26 -4.66 135.00 135.26 1x4z s PRO 110 Ca 0.77 2.02 -0.04 0.00 0.04 0.00 0.00 61.00 63.79 1x4z s PRO 110 Cb -0.36 -3.74 -0.01 0.00 0.04 0.00 0.00 34.50 30.43 1x4z s PRO 110 CO 0.46 -0.70 -0.05 -0.47 0.04 0.00 0.00 177.00 176.28 1x4z s TYR 111 N 3.14 2.95 -0.50 0.56 5.04 -0.62 -4.91 117.35 123.00 1x4z s TYR 111 Ca 0.66 -0.89 -0.19 0.00 -2.44 0.00 0.00 57.07 54.21 1x4z s TYR 111 Cb -0.31 -2.08 0.06 0.00 0.35 0.00 0.00 41.96 39.98 1x4z s TYR 111 CO 0.26 -0.50 0.59 0.08 -1.34 0.00 0.00 175.55 174.64 1x4z s VAL 112 N 1.35 4.92 -0.45 3.14 1.01 -1.26 -3.00 120.40 126.12 1x4z s VAL 112 Ca 0.04 -0.57 -0.28 0.00 0.00 0.00 0.00 61.98 61.16 1x4z s VAL 112 Cb -0.14 -4.27 0.01 0.00 0.00 0.00 0.00 36.38 31.97 1x4z s VAL 112 CO -0.03 -0.77 1.44 -0.69 0.00 0.00 0.00 175.10 175.05 1x4z s VAL 113 N 2.49 3.85 0.33 2.92 1.01 -1.26 -4.93 120.40 124.81 1x4z s VAL 113 Ca 0.14 0.83 0.08 0.00 0.00 0.00 0.00 61.98 63.02 1x4z s VAL 113 Cb -0.20 -4.23 -0.03 0.00 0.00 0.00 0.00 36.38 31.91 1x4z s VAL 113 CO 0.11 -0.85 0.22 -0.55 0.00 0.00 0.00 175.10 174.04 1x4z s SER 114 N 4.22 5.09 0.19 3.32 0.15 -1.26 -0.31 113.70 125.11 1x4z s SER 114 Ca 0.60 -0.57 -0.19 0.00 0.70 0.00 0.00 55.95 56.49 1x4z s SER 114 Cb -0.13 -0.93 0.15 0.00 -1.71 0.00 0.00 66.02 63.40 1x4z s SER 114 CO 0.31 -0.29 1.59 1.23 1.20 0.00 0.00 173.24 177.28 1x4z h GLY 115 N 1.39 0.01 -4.38 9.45 0.00 -1.94 -3.43 103.07 104.17 1x4z h GLY 115 Ca -0.45 0.39 -0.58 0.00 0.00 0.00 0.00 47.33 46.69 1x4z h GLY 115 CO 0.60 -0.22 -0.29 1.44 0.00 0.00 0.00 176.54 178.07 1x4z n SER 116 N -5.44 -0.72 0.00 0.19 7.64 -1.26 -4.74 113.62 109.29 1x4z n SER 116 Ca 0.05 0.94 0.00 0.00 1.01 0.00 0.00 58.87 60.87 1x4z n SER 116 Cb 0.36 -0.78 0.00 0.00 -1.01 0.00 0.00 64.21 62.78 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 1.53 1.03 0.00 0.23 0.00 -1.26 -4.63 105.19 102.09 1x4z n GLY 117 Ca 0.15 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.37 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 -0.26 -0.89 -4.91 1.61 -0.04 -1.26 -4.97 135.00 124.29 1x4z n PRO 118 Ca 0.00 0.00 -0.26 0.00 -0.04 0.00 0.00 63.50 63.20 1x4z n PRO 118 Cb 0.00 0.00 -0.16 0.00 -0.04 0.00 0.00 33.50 33.30 1x4z n PRO 118 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1x4z s SER 119 N -1.52 2.21 -0.13 3.54 1.04 -1.26 -4.87 113.70 112.72 1x4z s SER 119 Ca 0.00 -0.34 -0.21 0.00 0.48 0.00 0.00 55.95 55.88 1x4z s SER 119 Cb 0.00 -0.31 -0.18 0.00 0.10 0.00 0.00 66.02 65.63 1x4z s SER 119 CO 0.00 0.22 0.53 -1.28 0.98 0.00 0.00 173.24 173.69 1x4z h SER 120 N 5.76 0.00 0.00 7.02 0.87 -1.98 -3.54 113.55 121.68 1x4z h SER 120 Ca -0.37 -0.70 0.00 0.00 -1.23 0.00 0.00 61.79 59.49 1x4z h SER 120 Cb 1.15 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.11 1x4z h SER 120 CO 0.48 0.89 0.00 0.61 -0.53 0.00 0.00 176.83 178.28