#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c7d s ARG 4 N 0.00 0.25 0.42 6.28 6.06 -1.26 -5.02 118.95 125.68 2c7d s ARG 4 Ca 0.00 0.37 -0.24 0.00 -2.50 0.00 0.00 55.73 53.35 2c7d s ARG 4 Cb 0.00 0.19 -0.08 0.00 0.06 0.00 0.00 34.95 35.12 2c7d s ARG 4 CO 0.00 -0.36 1.17 -1.25 -2.50 0.00 0.00 175.30 172.36 2c7d s PRO 5 N 2.93 3.95 -1.06 5.12 0.04 -1.26 -4.91 135.00 139.82 2c7d s PRO 5 Ca 0.12 1.82 -0.05 0.00 0.04 0.00 0.00 61.00 62.93 2c7d s PRO 5 Cb -0.08 -2.58 0.12 0.00 0.04 0.00 0.00 34.50 32.00 2c7d s PRO 5 CO -0.17 -0.40 2.45 -0.11 0.04 0.00 0.00 177.00 178.81 2c7d n LEU 6 N -0.12 7.58 -1.04 -3.56 -0.00 -1.26 -3.91 117.00 114.68 2c7d n LEU 6 Ca 0.05 -4.70 0.00 0.00 -0.00 0.00 0.00 56.01 51.36 2c7d n LEU 6 Cb 0.47 -1.31 0.00 0.00 -0.00 0.00 0.00 43.42 42.58 2c7d n LEU 6 CO 0.50 1.97 -0.28 0.00 -0.00 0.00 0.00 177.39 179.57 2c7d n HIS 7 N 1.34 -2.80 0.00 1.96 1.44 -1.26 -4.68 115.22 111.22 2c7d n HIS 7 Ca 0.58 1.48 0.00 0.00 -2.01 0.00 0.00 57.72 57.76 2c7d n HIS 7 Cb 0.33 -2.67 0.00 0.00 0.12 0.00 0.00 29.99 27.77 2c7d n HIS 7 CO 0.00 0.00 0.00 -3.47 -2.81 0.00 0.00 176.34 170.06 2c7d n ASP 8 N -0.54 0.00 -4.77 4.39 4.64 0.46 -4.91 116.55 115.82 2c7d n ASP 8 Ca 0.00 0.00 -0.40 0.00 -1.38 0.00 0.00 54.79 53.01 2c7d n ASP 8 Cb 0.00 0.00 0.01 0.00 -1.04 0.00 0.00 41.12 40.09 2c7d n ASP 8 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2c7d s ARG 9 N 0.00 3.82 0.02 -0.67 3.03 -1.26 -0.84 118.95 123.06 2c7d s ARG 9 Ca 0.00 2.30 0.01 0.00 2.03 0.00 0.00 55.73 60.07 2c7d s ARG 9 Cb 0.00 -2.71 -0.01 0.00 -1.03 0.00 0.00 34.95 31.20 2c7d s ARG 9 CO 0.00 -0.66 -0.05 0.08 -1.13 0.00 0.00 175.30 173.54 2c7d s VAL 10 N -1.23 0.34 -0.19 4.99 1.01 0.89 -3.81 120.40 122.40 2c7d s VAL 10 Ca 0.59 -0.67 -0.06 0.00 0.00 0.00 0.00 61.98 61.84 2c7d s VAL 10 Cb -0.41 -0.38 -0.03 0.00 0.00 0.00 0.00 36.38 35.55 2c7d s VAL 10 CO 0.53 -0.22 0.04 -0.63 0.00 0.00 0.00 175.10 174.82 2c7d s ILE 11 N -0.87 4.43 0.25 2.22 1.01 0.34 -1.66 121.20 126.91 2c7d s ILE 11 Ca -0.07 -0.16 0.03 0.00 0.00 0.00 0.00 60.65 60.46 2c7d s ILE 11 Cb -0.06 -3.00 -0.05 0.00 0.01 0.00 0.00 42.46 39.35 2c7d s ILE 11 CO -0.00 0.44 0.01 0.68 0.00 0.00 0.00 174.94 176.07 2c7d s VAL 12 N 0.65 1.02 -0.01 2.92 -7.23 0.11 -0.64 120.40 117.22 2c7d s VAL 12 Ca 0.02 -2.03 0.03 0.00 -1.81 0.00 0.00 61.98 58.19 2c7d s VAL 12 Cb -0.14 -2.43 -0.03 0.00 0.56 0.00 0.00 36.38 34.34 2c7d s VAL 12 CO 0.02 -0.25 -0.08 -1.59 -0.31 0.00 0.00 175.10 172.89 2c7d s LYS 13 N -3.88 2.56 0.63 4.82 -2.85 -0.47 -0.91 119.74 119.64 2c7d s LYS 13 Ca 0.30 -0.70 -0.16 0.00 -1.00 0.00 0.00 55.97 54.41 2c7d s LYS 13 Cb 0.06 -2.50 -0.01 0.00 -2.06 0.00 0.00 37.83 33.32 2c7d s LYS 13 CO 0.10 0.61 1.13 1.03 0.10 0.00 0.00 175.35 178.32 2c7d s ARG 14 N -1.29 2.91 0.86 1.78 0.52 -1.26 -0.96 118.95 121.52 2c7d s ARG 14 Ca 0.16 1.49 -0.08 0.00 -0.52 0.00 0.00 55.73 56.78 2c7d s ARG 14 Cb -0.11 -1.96 0.19 0.00 0.52 0.00 0.00 34.95 33.59 2c7d s ARG 14 CO 0.06 -1.18 1.18 0.15 0.02 0.00 0.00 175.30 175.53 2c7d s LYS 15 N -3.83 0.97 0.47 3.54 1.02 -0.10 -4.81 119.74 116.99 2c7d s LYS 15 Ca 0.69 -0.93 -0.23 0.00 0.02 0.00 0.00 55.97 55.52 2c7d s LYS 15 Cb -0.22 -2.10 -0.08 0.00 -0.52 0.00 0.00 37.83 34.91 2c7d s LYS 15 CO 0.37 -2.05 1.17 0.39 -0.92 0.00 0.00 175.35 174.31 2c7d n GLU 16 N -3.34 1.57 -2.57 1.68 -0.58 -1.26 -4.94 120.64 111.20 2c7d n GLU 16 Ca 0.17 0.57 -0.41 0.00 -0.42 0.00 0.00 57.16 57.07 2c7d n GLU 16 Cb 0.60 -2.29 -0.04 0.00 -0.57 0.00 0.00 31.44 29.14 2c7d n GLU 16 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2c7d s VAL 17 N -1.29 4.13 -1.36 2.62 1.01 -1.26 -4.27 120.40 119.98 2c7d s VAL 17 Ca 0.66 1.74 -0.10 0.00 0.00 0.00 0.00 61.98 64.28 2c7d s VAL 17 Cb -0.49 -4.11 0.01 0.00 0.00 0.00 0.00 36.38 31.79 2c7d s VAL 17 CO 0.54 0.25 0.42 -0.62 0.00 0.00 0.00 175.10 175.70 2c7d n GLU 18 N 2.82 -1.74 -1.47 2.72 1.02 -0.01 -4.58 120.64 119.41 2c7d n GLU 18 Ca 0.04 0.26 -0.46 0.00 -0.02 0.00 0.00 57.16 56.99 2c7d n GLU 18 Cb 0.47 -3.82 -0.08 0.00 -0.02 0.00 0.00 31.44 27.99 2c7d n GLU 18 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 2c7d n THR 19 N -4.54 0.08 1.50 2.62 -1.04 -1.26 -4.76 114.28 106.88 2c7d n THR 19 Ca -0.24 -0.32 0.05 0.00 -2.04 0.00 0.00 64.05 61.49 2c7d n THR 19 Cb 0.65 -1.65 0.29 0.00 -1.82 0.00 0.00 70.33 67.80 2c7d n THR 19 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 2c7d n LYS 20 N 8.43 0.75 0.00 -2.82 4.01 -1.26 -3.35 118.16 123.92 2c7d n LYS 20 Ca 0.46 0.00 0.07 0.00 -0.51 0.00 0.00 58.31 58.33 2c7d n LYS 20 Cb 0.26 -1.21 0.04 0.00 -0.51 0.00 0.00 35.03 33.61 2c7d n LYS 20 CO 0.00 0.00 0.00 -1.13 -1.11 0.00 0.00 177.40 175.16 2c7d n SER 21 N -0.71 1.92 0.00 4.39 3.41 -1.26 -1.10 113.62 120.27 2c7d n SER 21 Ca 0.07 -1.46 0.02 0.00 -0.26 0.00 0.00 58.87 57.24 2c7d n SER 21 Cb 0.03 0.20 0.11 0.00 -0.26 0.00 0.00 64.21 64.29 2c7d n SER 21 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2c7d n ALA 22 N 0.41 1.64 -0.00 7.33 0.00 -1.21 -1.88 120.51 126.80 2c7d n ALA 22 Ca 0.07 -0.02 -0.10 0.00 0.00 0.00 0.00 53.44 53.40 2c7d n ALA 22 Cb 0.34 -1.06 -0.14 0.00 0.00 0.00 0.00 19.45 18.59 2c7d n ALA 22 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2c7d h GLY 23 N 0.62 0.04 0.00 0.00 0.00 -1.88 -3.50 103.07 98.35 2c7d h GLY 23 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.23 2c7d h GLY 23 CO 0.00 0.09 0.00 0.61 0.00 0.00 0.00 176.54 177.24 2c7d n GLY 24 N 1.56 3.41 0.31 4.60 0.00 -0.79 -4.83 105.19 109.45 2c7d n GLY 24 Ca -0.15 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.13 2c7d n GLY 24 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2c7d n ILE 25 N 0.00 0.00 -2.08 -0.61 5.41 -1.26 -5.09 119.36 115.73 2c7d n ILE 25 Ca 0.00 0.00 -0.41 0.00 1.00 0.00 0.00 62.75 63.34 2c7d n ILE 25 Cb 0.00 -0.58 -0.02 0.00 -0.71 0.00 0.00 39.64 38.33 2c7d n ILE 25 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 2c7d s VAL 26 N -1.80 2.67 -1.06 1.39 1.01 -1.26 -4.93 120.40 116.43 2c7d s VAL 26 Ca 0.00 0.66 -0.23 0.00 0.00 0.00 0.00 61.98 62.41 2c7d s VAL 26 Cb 0.00 -3.42 -0.01 0.00 0.00 0.00 0.00 36.38 32.96 2c7d s VAL 26 CO 0.00 0.15 1.76 -0.22 0.00 0.00 0.00 175.10 176.78 2c7d s LEU 27 N -1.55 3.36 -0.85 3.92 0.20 -1.26 -4.43 118.68 118.07 2c7d s LEU 27 Ca 0.51 -1.40 -0.25 0.00 0.69 0.00 0.00 54.13 53.68 2c7d s LEU 27 Cb -0.40 -2.57 -0.00 0.00 -0.43 0.00 0.00 46.19 42.78 2c7d s LEU 27 CO 0.52 -2.16 1.67 0.28 -0.29 0.00 0.00 176.35 176.36 2c7d s THR 28 N 7.70 3.62 0.00 3.68 -1.32 -0.26 -4.97 115.64 124.09 2c7d s THR 28 Ca 0.60 -0.24 0.00 0.00 -1.21 0.00 0.00 61.69 60.83 2c7d s THR 28 Cb -0.02 -4.46 0.00 0.00 -1.51 0.00 0.00 72.50 66.51 2c7d s THR 28 CO 0.01 -1.39 0.00 0.61 -2.21 0.00 0.00 174.62 171.63 2c7d n GLY 29 N 6.39 -1.53 3.73 6.08 0.00 -1.26 -4.31 105.19 114.29 2c7d n GLY 29 Ca 0.28 -1.56 -0.41 0.00 0.00 0.00 0.00 46.02 44.33 2c7d n GLY 29 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2c7d s SER 30 N -1.21 7.10 0.00 1.61 0.01 -1.26 -4.92 113.70 115.03 2c7d s SER 30 Ca 0.00 2.18 0.00 0.00 1.31 0.00 0.00 55.95 59.44 2c7d s SER 30 Cb 0.00 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.63 2c7d s SER 30 CO 0.00 -0.38 0.40 0.00 0.41 0.00 0.00 173.24 173.66 2c7d n ALA 31 N 2.80 0.92 0.00 1.44 0.00 -1.26 -5.04 120.51 119.37 2c7d n ALA 31 Ca 0.05 -0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.10 2c7d n ALA 31 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.90 2c7d n ALA 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c7d n ALA 32 N 0.00 0.00 -1.70 0.00 0.00 -1.26 -5.15 120.51 112.40 2c7d n ALA 32 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.27 2c7d n ALA 32 Cb 0.48 0.00 0.16 0.00 0.00 0.00 0.00 19.45 20.09 2c7d n ALA 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c7d n ALA 33 N 0.00 -1.26 -2.00 0.00 0.00 -1.26 -5.11 120.51 110.87 2c7d n ALA 33 Ca 0.00 -1.36 0.00 0.00 0.00 0.00 0.00 53.44 52.08 2c7d n ALA 33 Cb 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 19.45 19.38 2c7d n ALA 33 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2c7d n LYS 34 N -3.25 0.00 -3.64 0.00 4.01 -1.26 -4.72 118.16 109.30 2c7d n LYS 34 Ca 0.13 0.00 -0.00 0.00 -0.51 0.00 0.00 58.31 57.93 2c7d n LYS 34 Cb 0.46 0.00 -0.06 0.00 -0.51 0.00 0.00 35.03 34.91 2c7d n LYS 34 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 2c7d s SER 35 N 0.88 -0.31 0.23 4.39 0.15 -1.26 -0.83 113.70 116.94 2c7d s SER 35 Ca 0.00 0.49 0.26 0.00 0.70 0.00 0.00 55.95 57.40 2c7d s SER 35 Cb 0.00 1.13 0.79 0.00 -1.71 0.00 0.00 66.02 66.23 2c7d s SER 35 CO 0.00 -0.08 1.77 0.71 1.20 0.00 0.00 173.24 176.84 2c7d h THR 36 N 5.00 0.00 -4.07 6.45 1.35 -1.92 -3.47 112.91 116.25 2c7d h THR 36 Ca -0.27 -0.50 -0.66 0.00 -0.55 0.00 0.00 66.41 64.43 2c7d h THR 36 Cb 1.17 1.50 -0.31 0.00 -1.73 0.00 0.00 68.15 68.78 2c7d h THR 36 CO 0.21 0.00 -0.87 -0.13 -0.25 0.00 0.00 175.52 174.48 2c7d s ARG 37 N -3.11 2.30 0.09 4.72 0.52 -1.26 -0.86 118.95 121.35 2c7d s ARG 37 Ca 0.10 -0.84 -0.13 0.00 -0.52 0.00 0.00 55.73 54.35 2c7d s ARG 37 Cb 0.12 -1.99 0.02 0.00 0.52 0.00 0.00 34.95 33.62 2c7d s ARG 37 CO 0.60 0.37 0.30 0.20 0.02 0.00 0.00 175.30 176.79 2c7d s GLY 38 N -0.19 -0.11 -0.18 -3.53 0.00 -0.78 -0.92 107.32 101.62 2c7d s GLY 38 Ca -0.02 -0.24 -0.11 0.00 0.00 0.00 0.00 44.72 44.35 2c7d s GLY 38 CO 0.03 -0.46 0.19 1.85 0.00 0.00 0.00 173.10 174.71 2c7d s GLU 39 N -3.53 4.18 0.02 2.90 2.12 -0.13 -0.51 118.70 123.76 2c7d s GLU 39 Ca 0.02 -0.10 -0.30 0.00 0.36 0.00 0.00 54.97 54.94 2c7d s GLU 39 Cb 0.02 -3.41 -0.04 0.00 0.26 0.00 0.00 34.13 30.96 2c7d s GLU 39 CO -0.10 0.30 1.14 0.08 -0.54 0.00 0.00 175.26 176.14 2c7d s VAL 40 N 0.34 4.31 -0.21 3.70 1.01 0.33 -1.37 120.40 128.51 2c7d s VAL 40 Ca 0.11 1.65 0.03 0.00 0.00 0.00 0.00 61.98 63.78 2c7d s VAL 40 Cb -0.12 -4.06 -0.15 0.00 0.00 0.00 0.00 36.38 32.06 2c7d s VAL 40 CO 0.00 0.11 -0.16 0.18 0.00 0.00 0.00 175.10 175.23 2c7d n LEU 41 N 4.14 2.62 -3.63 3.92 4.77 0.19 -1.90 117.00 127.11 2c7d n LEU 41 Ca 0.08 -0.10 -0.15 0.00 -0.03 0.00 0.00 56.01 55.82 2c7d n LEU 41 Cb 0.48 -0.61 -0.07 0.00 -2.33 0.00 0.00 43.42 40.89 2c7d n LEU 41 CO 0.54 0.81 0.37 0.00 -1.33 0.00 0.00 177.39 177.78 2c7d s ALA 42 N -2.42 -1.65 0.09 -1.18 0.00 -0.62 -4.88 121.76 111.09 2c7d s ALA 42 Ca -0.26 1.74 0.07 0.00 0.00 0.00 0.00 51.96 53.51 2c7d s ALA 42 Cb 0.07 -0.87 -0.03 0.00 0.00 0.00 0.00 23.12 22.29 2c7d s ALA 42 CO 0.51 -0.32 -0.19 0.08 0.00 0.00 0.00 175.76 175.84 2c7d s VAL 43 N 0.04 1.52 0.00 0.00 1.01 -1.26 -0.51 120.40 121.20 2c7d s VAL 43 Ca -0.02 -1.43 0.00 0.00 0.00 0.00 0.00 61.98 60.52 2c7d s VAL 43 Cb -0.04 -1.40 0.00 0.00 0.00 0.00 0.00 36.38 34.95 2c7d s VAL 43 CO 0.03 -0.08 0.00 0.61 0.00 0.00 0.00 175.10 175.65 2c7d n GLY 44 N 1.22 -0.09 0.00 4.51 0.00 -1.25 -4.56 105.19 105.03 2c7d n GLY 44 Ca -0.20 -1.78 0.09 0.00 0.00 0.00 0.00 46.02 44.13 2c7d n GLY 44 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2c7d n ASN 45 N -1.61 0.00 0.00 1.61 4.13 -1.26 -4.95 115.26 113.18 2c7d n ASN 45 Ca 0.00 0.26 0.00 0.00 1.68 0.00 0.00 54.58 56.52 2c7d n ASN 45 Cb 0.00 -0.39 0.00 0.00 -1.54 0.00 0.00 39.78 37.85 2c7d n ASN 45 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2c7d n GLY 46 N 0.37 0.20 3.20 7.41 0.00 -1.26 -4.71 105.19 110.41 2c7d n GLY 46 Ca 0.07 -1.48 -0.06 0.00 0.00 0.00 0.00 46.02 44.55 2c7d n GLY 46 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2c7d s ARG 47 N 0.00 0.40 -1.04 1.61 3.52 -0.50 -0.40 118.95 122.53 2c7d s ARG 47 Ca 0.00 0.95 -0.03 0.00 -0.13 0.00 0.00 55.73 56.52 2c7d s ARG 47 Cb 0.00 0.21 0.31 0.00 -1.56 0.00 0.00 34.95 33.90 2c7d s ARG 47 CO 0.00 -0.40 1.43 -0.89 -0.81 0.00 0.00 175.30 174.63 2c7d n ILE 48 N 5.40 5.13 -3.72 4.11 5.41 -1.26 -2.68 119.36 131.75 2c7d n ILE 48 Ca -0.07 -5.89 -0.11 0.00 1.00 0.00 0.00 62.75 57.68 2c7d n ILE 48 Cb 0.50 -2.07 -0.07 0.00 -0.71 0.00 0.00 39.64 37.29 2c7d n ILE 48 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 2c7d s LEU 49 N -2.81 0.74 -0.58 1.39 1.43 -1.26 -4.99 118.68 112.60 2c7d s LEU 49 Ca 0.32 -0.20 -0.02 0.00 -1.03 0.00 0.00 54.13 53.20 2c7d s LEU 49 Cb 0.06 1.49 -0.02 0.00 0.03 0.00 0.00 46.19 47.75 2c7d s LEU 49 CO 0.10 -0.67 0.49 1.21 0.23 0.00 0.00 176.35 177.71 2c7d n GLU 50 N 0.39 -2.23 0.00 1.70 4.07 -1.26 -4.78 120.64 118.52 2c7d n GLU 50 Ca -0.18 0.44 0.00 0.00 -0.06 0.00 0.00 57.16 57.36 2c7d n GLU 50 Cb 0.60 -3.97 0.00 0.00 -0.06 0.00 0.00 31.44 28.02 2c7d n GLU 50 CO 0.00 0.00 0.00 -1.71 -0.06 0.00 0.00 177.13 175.36 2c7d n ASN 51 N -2.25 0.00 -4.56 4.31 4.05 -1.26 -4.69 115.26 110.86 2c7d n ASN 51 Ca -0.09 0.00 -0.33 0.00 0.45 0.00 0.00 54.58 54.61 2c7d n ASN 51 Cb 0.57 0.00 -0.04 0.00 1.23 0.00 0.00 39.78 41.54 2c7d n ASN 51 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 177.26 173.38 2c7d s GLY 52 N 0.00 0.51 0.28 8.20 0.00 -1.26 -4.78 107.32 110.28 2c7d s GLY 52 Ca 0.00 -1.57 0.00 0.00 0.00 0.00 0.00 44.72 43.15 2c7d s GLY 52 CO 0.00 3.21 0.00 1.18 0.00 0.00 0.00 173.10 177.49 2c7d n GLU 53 N 8.95 -1.96 -2.82 2.90 1.02 -1.26 -4.66 120.64 122.81 2c7d n GLU 53 Ca 0.33 1.42 -0.43 0.00 -0.02 0.00 0.00 57.16 58.46 2c7d n GLU 53 Cb 0.49 -2.35 -0.04 0.00 -0.02 0.00 0.00 31.44 29.52 2c7d n GLU 53 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2c7d s VAL 54 N -2.53 4.57 -0.06 2.62 1.01 -1.26 -4.74 120.40 120.01 2c7d s VAL 54 Ca 0.00 1.10 -0.30 0.00 0.00 0.00 0.00 61.98 62.78 2c7d s VAL 54 Cb 0.00 -4.35 -0.02 0.00 0.00 0.00 0.00 36.38 32.01 2c7d s VAL 54 CO 0.00 -0.59 1.01 -1.59 0.00 0.00 0.00 175.10 173.94 2c7d s LYS 55 N 3.51 4.47 0.45 2.72 0.00 -1.09 -4.73 119.74 125.06 2c7d s LYS 55 Ca 0.38 1.43 -0.22 0.00 0.00 0.00 0.00 55.97 57.55 2c7d s LYS 55 Cb -0.12 -3.51 -0.08 0.00 0.00 0.00 0.00 37.83 34.12 2c7d s LYS 55 CO 0.20 -0.23 1.06 -1.25 0.00 0.00 0.00 175.35 175.13 2c7d s PRO 56 N 1.66 3.92 0.99 1.78 0.04 -1.26 -1.41 135.00 140.72 2c7d s PRO 56 Ca 0.50 1.47 -0.12 0.00 0.04 0.00 0.00 61.00 62.90 2c7d s PRO 56 Cb -0.20 -2.29 0.18 0.00 0.04 0.00 0.00 34.50 32.24 2c7d s PRO 56 CO 0.22 -0.35 1.08 -0.51 0.04 0.00 0.00 177.00 177.48 2c7d s LEU 57 N -3.13 1.91 -0.03 -3.56 1.43 -1.26 -4.94 118.68 109.11 2c7d s LEU 57 Ca 0.64 1.65 0.19 0.00 -1.03 0.00 0.00 54.13 55.58 2c7d s LEU 57 Cb -0.20 -3.89 -0.29 0.00 0.03 0.00 0.00 46.19 41.84 2c7d s LEU 57 CO 0.24 -3.27 0.41 0.47 0.23 0.00 0.00 176.35 174.44 2c7d n ASP 58 N -4.31 0.67 -4.83 2.29 9.92 -1.26 -4.95 116.55 114.09 2c7d n ASP 58 Ca 0.07 0.00 -0.30 0.00 -0.53 0.00 0.00 54.79 54.02 2c7d n ASP 58 Cb 0.54 1.86 0.06 0.00 -0.64 0.00 0.00 41.12 42.95 2c7d n ASP 58 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 2c7d s VAL 59 N -3.31 3.60 0.27 2.53 -7.23 -1.26 -5.12 120.40 109.87 2c7d s VAL 59 Ca -0.07 0.52 -0.14 0.00 -1.81 0.00 0.00 61.98 60.48 2c7d s VAL 59 Cb 0.12 -3.33 0.00 0.00 0.56 0.00 0.00 36.38 33.73 2c7d s VAL 59 CO 0.79 -0.68 0.55 -1.59 -0.31 0.00 0.00 175.10 173.86 2c7d s LYS 60 N -5.16 1.67 0.25 4.82 0.00 -1.26 -5.12 119.74 114.93 2c7d s LYS 60 Ca 0.59 -1.25 -0.30 0.00 0.00 0.00 0.00 55.97 55.01 2c7d s LYS 60 Cb -0.13 0.51 -0.10 0.00 0.00 0.00 0.00 37.83 38.11 2c7d s LYS 60 CO 0.54 -0.72 1.37 0.08 0.00 0.00 0.00 175.35 176.62 2c7d s VAL 61 N -3.82 2.86 0.00 1.79 1.01 -1.26 -3.35 120.40 117.62 2c7d s VAL 61 Ca 0.20 0.74 0.00 0.00 0.00 0.00 0.00 61.98 62.92 2c7d s VAL 61 Cb -0.02 -3.47 0.00 0.00 0.00 0.00 0.00 36.38 32.89 2c7d s VAL 61 CO 0.10 0.13 0.00 0.61 0.00 0.00 0.00 175.10 175.93 2c7d n GLY 62 N 1.97 1.01 3.81 4.51 0.00 -0.80 -5.01 105.19 110.68 2c7d n GLY 62 Ca 0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 2c7d n GLY 62 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2c7d s ASP 63 N -2.89 4.64 -0.23 1.61 1.01 -1.21 -4.77 116.67 114.83 2c7d s ASP 63 Ca 0.00 1.37 -0.05 0.00 0.71 0.00 0.00 52.55 54.58 2c7d s ASP 63 Cb 0.00 -2.13 -0.01 0.00 1.01 0.00 0.00 42.92 41.79 2c7d s ASP 63 CO 0.00 -1.88 -0.01 -0.63 0.21 0.00 0.00 175.17 172.86 2c7d s ILE 64 N -3.13 3.60 0.11 0.77 1.01 -1.26 -0.51 121.20 121.79 2c7d s ILE 64 Ca 0.60 -0.47 0.09 0.00 0.00 0.00 0.00 60.65 60.88 2c7d s ILE 64 Cb -0.14 -2.68 -0.04 0.00 0.01 0.00 0.00 42.46 39.61 2c7d s ILE 64 CO 0.54 0.36 -0.21 0.68 0.00 0.00 0.00 174.94 176.32 2c7d s VAL 65 N 1.50 2.65 -0.18 2.92 -7.23 0.34 -4.67 120.40 115.73 2c7d s VAL 65 Ca 0.05 -1.56 -0.07 0.00 -1.81 0.00 0.00 61.98 58.60 2c7d s VAL 65 Cb -0.15 -2.20 -0.04 0.00 0.56 0.00 0.00 36.38 34.56 2c7d s VAL 65 CO -0.01 0.12 0.05 -0.63 -0.31 0.00 0.00 175.10 174.31 2c7d s ILE 66 N -1.10 4.68 0.08 -0.62 1.01 0.22 -1.86 121.20 123.61 2c7d s ILE 66 Ca 0.16 -0.07 -0.01 0.00 0.00 0.00 0.00 60.65 60.73 2c7d s ILE 66 Cb -0.10 -3.10 -0.04 0.00 0.01 0.00 0.00 42.46 39.23 2c7d s ILE 66 CO 0.08 0.47 0.01 0.72 0.00 0.00 0.00 174.94 176.22 2c7d s PHE 67 N 0.33 0.61 -0.23 3.97 -0.12 -0.04 -0.27 117.98 122.24 2c7d s PHE 67 Ca 0.02 -1.10 -0.29 0.00 -0.05 0.00 0.00 56.93 55.51 2c7d s PHE 67 Cb -0.13 -0.40 -0.00 0.00 -0.63 0.00 0.00 43.02 41.86 2c7d s PHE 67 CO 0.00 -0.43 1.25 1.21 -0.05 0.00 0.00 175.22 177.21 2c7d s ASN 68 N -2.96 6.85 -1.15 1.98 2.47 -0.69 -4.67 114.94 116.77 2c7d s ASN 68 Ca 0.12 1.45 -0.22 0.00 0.42 0.00 0.00 52.86 54.63 2c7d s ASN 68 Cb 0.08 -2.54 -0.04 0.00 -1.45 0.00 0.00 41.25 37.29 2c7d s ASN 68 CO -0.06 -0.89 1.87 -0.62 -3.72 0.00 0.00 177.10 173.68 2c7d s ASP 69 N 2.23 5.46 0.04 -4.21 -1.08 -1.26 -4.69 116.67 113.15 2c7d s ASP 69 Ca 0.54 -1.63 -0.28 0.00 -0.52 0.00 0.00 52.55 50.66 2c7d s ASP 69 Cb -0.19 -2.58 0.10 0.00 -1.46 0.00 0.00 42.92 38.79 2c7d s ASP 69 CO 0.17 -2.59 1.20 -0.83 0.52 0.00 0.00 175.17 173.64 2c7d s GLY 70 N 6.26 -0.27 0.00 2.66 0.00 -1.26 -5.07 107.32 109.64 2c7d s GLY 70 Ca 0.65 0.36 0.02 0.00 0.00 0.00 0.00 44.72 45.75 2c7d s GLY 70 CO 0.09 1.28 0.74 2.98 0.00 0.00 0.00 173.10 178.19 2c7d n TYR 71 N -0.58 0.00 -0.34 1.90 9.36 -1.26 -0.54 117.16 125.69 2c7d n TYR 71 Ca -0.05 0.00 -0.03 0.00 3.32 0.00 0.00 57.90 61.13 2c7d n TYR 71 Cb 0.61 -0.15 0.09 0.00 -0.63 0.00 0.00 39.34 39.26 2c7d n TYR 71 CO 0.00 0.00 0.00 0.78 0.22 0.00 0.00 176.86 177.86 2c7d h GLY 72 N 0.29 1.32 -4.42 2.98 0.00 -1.96 -3.41 103.07 97.88 2c7d h GLY 72 Ca 0.00 -0.54 -0.53 0.00 0.00 0.00 0.00 47.33 46.26 2c7d h GLY 72 CO 0.00 0.52 0.65 0.14 0.00 0.00 0.00 176.54 177.85 2c7d s VAL 73 N -6.00 3.51 -0.14 4.60 1.01 0.30 -4.41 120.40 119.27 2c7d s VAL 73 Ca -0.13 1.13 -0.02 0.00 0.00 0.00 0.00 61.98 62.96 2c7d s VAL 73 Cb 0.17 -3.73 -0.02 0.00 0.00 0.00 0.00 36.38 32.80 2c7d s VAL 73 CO 0.82 0.12 -0.07 -0.54 0.00 0.00 0.00 175.10 175.42 2c7d s LYS 74 N 0.67 3.49 0.21 2.72 -0.14 0.28 -4.87 119.74 122.10 2c7d s LYS 74 Ca 0.60 -0.57 -0.25 0.00 -1.36 0.00 0.00 55.97 54.38 2c7d s LYS 74 Cb -0.34 -2.79 -0.08 0.00 -1.68 0.00 0.00 37.83 32.93 2c7d s LYS 74 CO 0.32 0.28 0.81 0.45 -0.76 0.00 0.00 175.35 176.45 2c7d s SER 75 N 0.24 7.37 0.24 2.83 0.15 -1.26 -1.07 113.70 122.20 2c7d s SER 75 Ca -0.05 1.68 -0.19 0.00 0.70 0.00 0.00 55.95 58.10 2c7d s SER 75 Cb -0.14 -2.51 0.02 0.00 -1.71 0.00 0.00 66.02 61.67 2c7d s SER 75 CO 0.04 0.14 0.62 -1.61 1.20 0.00 0.00 173.24 173.62 2c7d s GLU 76 N -1.41 1.60 -0.43 5.44 0.41 -0.11 -4.95 118.70 119.25 2c7d s GLU 76 Ca 0.40 -0.96 0.02 0.00 -0.41 0.00 0.00 54.97 54.01 2c7d s GLU 76 Cb -0.22 0.56 0.15 0.00 -1.78 0.00 0.00 34.13 32.84 2c7d s GLU 76 CO 0.26 -0.71 0.28 0.21 -0.49 0.00 0.00 175.26 174.81 2c7d s LYS 77 N -3.91 1.10 -0.13 1.61 2.47 -1.26 -0.48 119.74 119.14 2c7d s LYS 77 Ca 0.12 -1.96 -0.02 0.00 -1.56 0.00 0.00 55.97 52.55 2c7d s LYS 77 Cb -0.03 -1.93 -0.03 0.00 -1.46 0.00 0.00 37.83 34.38 2c7d s LYS 77 CO 0.03 -1.24 -0.05 0.42 0.16 0.00 0.00 175.35 174.67 2c7d s ILE 78 N 0.32 3.78 -0.98 5.43 1.09 -1.11 -4.60 121.20 125.13 2c7d s ILE 78 Ca 0.22 -0.41 0.00 0.00 -1.10 0.00 0.00 60.65 59.36 2c7d s ILE 78 Cb -0.15 -2.62 0.00 0.00 -1.06 0.00 0.00 42.46 38.63 2c7d s ILE 78 CO -0.06 0.53 0.00 0.47 -0.10 0.00 0.00 174.94 175.78 2c7d n ASP 79 N 3.11 -2.95 0.00 3.58 9.92 -1.26 -0.57 116.55 128.38 2c7d n ASP 79 Ca -0.18 0.25 0.00 0.00 -0.53 0.00 0.00 54.79 54.33 2c7d n ASP 79 Cb 0.53 -2.72 0.00 0.00 -0.64 0.00 0.00 41.12 38.29 2c7d n ASP 79 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 2c7d n ASN 80 N -0.83 -0.41 -4.79 -2.24 2.85 -1.26 -5.05 115.26 103.52 2c7d n ASN 80 Ca -0.11 0.00 -0.36 0.00 -0.11 0.00 0.00 54.58 54.01 2c7d n ASN 80 Cb 0.44 -0.32 -0.06 0.00 1.24 0.00 0.00 39.78 41.08 2c7d n ASN 80 CO 0.00 0.00 0.00 -1.61 -2.11 0.00 0.00 177.26 173.54 2c7d s GLU 81 N -0.11 4.42 -0.69 1.20 8.01 0.26 -4.99 118.70 126.79 2c7d s GLU 81 Ca 0.00 1.28 -0.26 0.00 0.01 0.00 0.00 54.97 56.00 2c7d s GLU 81 Cb 0.00 -2.56 -0.02 0.00 -4.31 0.00 0.00 34.13 27.24 2c7d s GLU 81 CO 0.00 0.13 1.81 -1.21 0.01 0.00 0.00 175.26 176.00 2c7d s GLU 82 N -2.48 2.70 0.25 1.61 0.41 -1.26 -2.76 118.70 117.16 2c7d s GLU 82 Ca 0.55 0.29 0.05 0.00 -0.41 0.00 0.00 54.97 55.45 2c7d s GLU 82 Cb -0.16 -4.53 -0.03 0.00 -1.78 0.00 0.00 34.13 27.63 2c7d s GLU 82 CO 0.20 -2.79 0.36 0.14 -0.49 0.00 0.00 175.26 172.68 2c7d s VAL 83 N 8.82 5.08 -0.05 2.63 -7.23 0.37 -4.29 120.40 125.72 2c7d s VAL 83 Ca 0.64 -1.03 0.03 0.00 -1.81 0.00 0.00 61.98 59.81 2c7d s VAL 83 Cb -0.11 -3.78 0.01 0.00 0.56 0.00 0.00 36.38 33.06 2c7d s VAL 83 CO 0.15 -0.32 -0.14 -0.76 -0.31 0.00 0.00 175.10 173.73 2c7d s LEU 84 N -3.99 1.76 -0.29 1.32 1.02 -0.08 -0.93 118.68 117.49 2c7d s LEU 84 Ca 0.35 -0.30 -0.03 0.00 0.02 0.00 0.00 54.13 54.17 2c7d s LEU 84 Cb -0.09 -0.84 0.04 0.00 0.02 0.00 0.00 46.19 45.32 2c7d s LEU 84 CO 0.29 0.08 0.01 -0.63 0.02 0.00 0.00 176.35 176.11 2c7d s ILE 85 N 0.39 3.15 0.19 -0.59 1.01 -0.23 -0.72 121.20 124.40 2c7d s ILE 85 Ca -0.10 -1.21 0.05 0.00 0.00 0.00 0.00 60.65 59.39 2c7d s ILE 85 Cb -0.13 -2.74 -0.05 0.00 0.01 0.00 0.00 42.46 39.55 2c7d s ILE 85 CO 0.03 -0.03 -0.08 0.00 0.00 0.00 0.00 174.94 174.86 2c7d s MET 86 N 1.31 1.21 0.52 2.79 0.23 -0.66 -0.56 119.30 124.14 2c7d s MET 86 Ca -0.03 -1.56 -0.20 0.00 -1.03 0.00 0.00 55.69 52.88 2c7d s MET 86 Cb -0.19 -0.73 -0.07 0.00 -1.53 0.00 0.00 34.83 32.32 2c7d s MET 86 CO -0.01 0.04 1.07 -1.12 -2.03 0.00 0.00 175.02 172.97 2c7d s SER 87 N -3.25 6.05 0.49 -1.18 0.01 -1.26 -0.08 113.70 114.48 2c7d s SER 87 Ca 0.22 2.01 0.14 0.00 1.31 0.00 0.00 55.95 59.63 2c7d s SER 87 Cb 0.03 -2.57 1.17 0.00 0.21 0.00 0.00 66.02 64.86 2c7d s SER 87 CO 0.04 -0.99 2.11 -0.08 0.41 0.00 0.00 173.24 174.74 2c7d h GLU 88 N 1.31 0.15 0.00 12.44 4.81 -1.33 -0.58 114.58 131.39 2c7d h GLU 88 Ca -0.49 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 2c7d h GLU 88 Cb 1.24 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.58 2c7d h GLU 88 CO 0.58 0.10 0.00 0.43 -0.73 0.00 0.00 179.01 179.39 2c7d n SER 89 N -4.51 0.00 -0.06 1.04 7.64 -1.26 -1.00 113.62 115.46 2c7d n SER 89 Ca -0.00 -0.08 0.05 0.00 1.01 0.00 0.00 58.87 59.84 2c7d n SER 89 Cb 0.12 -0.05 -0.04 0.00 -1.01 0.00 0.00 64.21 63.23 2c7d n SER 89 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2c7d n ASP 90 N -1.05 0.66 -4.81 6.43 8.00 -0.24 -5.04 116.55 120.51 2c7d n ASP 90 Ca 0.03 -0.83 -0.37 0.00 0.71 0.00 0.00 54.79 54.34 2c7d n ASP 90 Cb 0.02 0.86 -0.06 0.00 -0.02 0.00 0.00 41.12 41.92 2c7d n ASP 90 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2c7d s ILE 91 N -1.77 4.50 -0.15 0.53 1.01 -0.17 -1.70 121.20 123.45 2c7d s ILE 91 Ca 0.05 1.41 -0.02 0.00 0.00 0.00 0.00 60.65 62.08 2c7d s ILE 91 Cb 0.08 -3.91 -0.08 0.00 0.01 0.00 0.00 42.46 38.56 2c7d s ILE 91 CO 0.36 0.23 -0.15 0.18 0.00 0.00 0.00 174.94 175.55 2c7d n LEU 92 N 0.79 2.21 -3.85 2.97 4.77 0.63 -4.92 117.00 119.60 2c7d n LEU 92 Ca -0.02 0.03 0.01 0.00 -0.03 0.00 0.00 56.01 56.00 2c7d n LEU 92 Cb 0.51 -0.48 0.01 0.00 -2.33 0.00 0.00 43.42 41.13 2c7d n LEU 92 CO 0.44 0.57 1.00 0.00 -1.33 0.00 0.00 177.39 178.06 2c7d s ALA 93 N -2.28 -2.16 0.09 -1.18 0.00 -1.12 -5.03 121.76 110.08 2c7d s ALA 93 Ca -0.20 0.14 0.07 0.00 0.00 0.00 0.00 51.96 51.97 2c7d s ALA 93 Cb 0.06 0.70 -0.03 0.00 0.00 0.00 0.00 23.12 23.85 2c7d s ALA 93 CO 0.30 -1.10 -0.18 0.42 0.00 0.00 0.00 175.76 175.20 2c7d s ILE 94 N -2.24 1.47 0.00 0.00 1.01 -1.26 -0.61 121.20 119.57 2c7d s ILE 94 Ca 0.22 -1.45 0.00 0.00 0.00 0.00 0.00 60.65 59.43 2c7d s ILE 94 Cb 0.00 -1.36 0.00 0.00 0.01 0.00 0.00 42.46 41.12 2c7d s ILE 94 CO -0.00 -0.13 0.00 0.52 0.00 0.00 0.00 174.94 175.33