#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jor s ILE 2 N 0.00 2.05 0.31 2.02 -4.36 -1.26 -5.04 121.20 114.92 2jor s ILE 2 Ca 0.00 0.02 -0.10 0.00 -0.26 0.00 0.00 60.65 60.31 2jor s ILE 2 Cb 0.00 -2.07 0.04 0.00 1.25 0.00 0.00 42.46 41.68 2jor s ILE 2 CO 0.00 -0.02 0.58 0.47 0.24 0.00 0.00 174.94 176.21 2jor n ASP 3 N -4.75 -1.69 -4.56 4.36 8.00 -1.26 -5.06 116.55 111.60 2jor n ASP 3 Ca 0.05 -2.33 -0.24 0.00 0.71 0.00 0.00 54.79 52.98 2jor n ASP 3 Cb 0.54 2.86 -0.05 0.00 -0.02 0.00 0.00 41.12 44.44 2jor n ASP 3 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 2jor s ASN 4 N -2.68 4.63 0.00 -2.24 -0.87 -1.26 -4.87 114.94 107.65 2jor s ASN 4 Ca 0.15 -0.10 0.00 0.00 -1.57 0.00 0.00 52.86 51.34 2jor s ASN 4 Cb -0.03 -2.55 0.00 0.00 -0.02 0.00 0.00 41.25 38.65 2jor s ASN 4 CO 0.11 -3.12 0.00 -0.62 -2.57 0.00 0.00 177.10 170.90 2jor n GLU 5 N 8.90 0.00 -3.74 -0.60 1.02 -1.26 -4.84 120.64 120.12 2jor n GLU 5 Ca 0.40 0.00 -0.23 0.00 -0.02 0.00 0.00 57.16 57.31 2jor n GLU 5 Cb 0.47 0.00 0.03 0.00 -0.02 0.00 0.00 31.44 31.92 2jor n GLU 5 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 2jor n LYS 6 N 0.00 -5.08 0.00 3.49 0.00 -1.26 -4.92 118.16 110.38 2jor n LYS 6 Ca 0.00 0.62 0.00 0.00 0.00 0.00 0.00 58.31 58.93 2jor n LYS 6 Cb 0.00 -5.25 0.00 0.00 0.00 0.00 0.00 35.03 29.78 2jor n LYS 6 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 2jor n VAL 7 N -4.36 0.00 -3.64 3.15 0.31 -1.26 -4.96 118.33 107.57 2jor n VAL 7 Ca -0.23 1.01 -0.09 0.00 -0.01 0.00 0.00 64.34 65.02 2jor n VAL 7 Cb 0.65 -1.89 -0.07 0.00 -0.91 0.00 0.00 33.84 31.62 2jor n VAL 7 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2jor s THR 8 N -1.72 0.00 0.63 2.52 2.01 -1.26 -5.14 115.64 112.68 2jor s THR 8 Ca 0.00 0.00 -0.18 0.00 0.31 0.00 0.00 61.69 61.82 2jor s THR 8 Cb 0.00 -1.00 -0.05 0.00 0.01 0.00 0.00 72.50 71.46 2jor s THR 8 CO 0.00 0.00 0.77 -1.20 -0.69 0.00 0.00 174.62 173.50 2jor n SER 9 N 2.82 -0.11 -2.71 3.53 7.64 -1.26 -4.96 113.62 118.57 2jor n SER 9 Ca -0.15 0.73 -0.06 0.00 1.01 0.00 0.00 58.87 60.40 2jor n SER 9 Cb 0.56 -1.30 0.06 0.00 -1.01 0.00 0.00 64.21 62.52 2jor n SER 9 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jor n GLY 10 N 1.47 -0.85 3.74 0.23 0.00 -1.26 -5.13 105.19 103.39 2jor n GLY 10 Ca 0.13 0.58 -0.41 0.00 0.00 0.00 0.00 46.02 46.32 2jor n GLY 10 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2jor s HIS 11 N 0.46 3.45 0.16 1.61 -3.43 -1.26 -4.81 115.29 111.47 2jor s HIS 11 Ca 0.29 1.45 0.00 0.00 -0.80 0.00 0.00 55.06 56.00 2jor s HIS 11 Cb 0.21 -3.41 0.00 0.00 -1.43 0.00 0.00 32.58 27.95 2jor s HIS 11 CO -0.16 -1.12 0.00 2.41 -2.00 0.00 0.00 174.74 173.87 2jor n THR 12 N 2.46 0.00 0.98 -5.38 -1.04 -1.26 -2.71 114.28 107.33 2jor n THR 12 Ca 0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.05 2jor n THR 12 Cb 0.45 -0.24 0.00 0.00 -1.82 0.00 0.00 70.33 68.72 2jor n THR 12 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 2jor n THR 13 N -2.36 0.00 -0.09 12.58 -2.24 -1.26 -4.95 114.28 115.96 2jor n THR 13 Ca 0.00 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.80 2jor n THR 13 Cb 0.32 -0.28 -0.00 0.00 -2.10 0.00 0.00 70.33 68.27 2jor n THR 13 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2jor n THR 14 N -0.09 0.00 -3.09 4.28 -1.04 -1.10 -4.86 114.28 108.39 2jor n THR 14 Ca 0.00 0.01 -0.39 0.00 -2.04 0.00 0.00 64.05 61.63 2jor n THR 14 Cb 0.12 -0.04 -0.06 0.00 -1.82 0.00 0.00 70.33 68.53 2jor n THR 14 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 2jor s THR 15 N -1.44 4.50 0.06 12.58 -1.32 -1.26 -5.06 115.64 123.70 2jor s THR 15 Ca 0.00 1.50 -0.18 0.00 -1.21 0.00 0.00 61.69 61.80 2jor s THR 15 Cb 0.00 -4.03 0.04 0.00 -1.51 0.00 0.00 72.50 67.00 2jor s THR 15 CO 0.00 0.50 0.42 0.00 -2.21 0.00 0.00 174.62 173.33 2jor s ARG 16 N -1.24 0.96 0.00 7.08 1.70 -1.26 -4.98 118.95 121.21 2jor s ARG 16 Ca 0.34 -0.41 0.00 0.00 -0.47 0.00 0.00 55.73 55.20 2jor s ARG 16 Cb -0.21 0.43 0.00 0.00 -0.57 0.00 0.00 34.95 34.59 2jor s ARG 16 CO 0.23 -0.34 0.00 -2.13 -1.08 0.00 0.00 175.30 171.99 2jor n ARG 17 N 0.37 0.00 0.23 3.89 3.00 -1.26 -4.72 116.66 118.17 2jor n ARG 17 Ca -0.18 0.00 0.04 0.00 -0.00 0.00 0.00 57.85 57.71 2jor n ARG 17 Cb 0.60 0.00 0.21 0.00 0.00 0.00 0.00 32.46 33.27 2jor n ARG 17 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.63 178.40 2jor h SER 18 N 0.00 0.00 -5.04 6.15 0.02 -1.94 -3.27 113.55 109.47 2jor h SER 18 Ca 0.00 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.82 2jor h SER 18 Cb 0.00 0.00 -0.19 0.00 0.14 0.00 0.00 62.40 62.35 2jor h SER 18 CO 0.00 0.00 -0.47 0.00 -1.14 0.00 0.00 176.83 175.22 2jor s SER 20 N -1.80 6.68 -0.10 0.00 0.01 -1.26 -4.63 113.70 112.60 2jor s SER 20 Ca -0.09 2.28 -0.02 0.00 1.31 0.00 0.00 55.95 59.43 2jor s SER 20 Cb -0.04 -2.55 0.04 0.00 0.21 0.00 0.00 66.02 63.68 2jor s SER 20 CO -0.02 -0.88 0.02 -0.54 0.41 0.00 0.00 173.24 172.23 2jor s LYS 21 N 3.39 0.56 -0.18 12.44 -0.14 -1.09 -4.32 119.74 130.39 2jor s LYS 21 Ca 0.72 0.00 0.01 0.00 -1.36 0.00 0.00 55.97 55.34 2jor s LYS 21 Cb -0.35 -1.23 0.03 0.00 -1.68 0.00 0.00 37.83 34.60 2jor s LYS 21 CO 0.30 -0.39 -0.13 0.14 -0.76 0.00 0.00 175.35 174.51 2jor s VAL 22 N 1.97 1.67 -0.27 3.17 -7.23 -1.26 -2.05 120.40 116.39 2jor s VAL 22 Ca 0.04 -0.88 0.01 0.00 -1.81 0.00 0.00 61.98 59.34 2jor s VAL 22 Cb -0.13 -1.65 0.05 0.00 0.56 0.00 0.00 36.38 35.21 2jor s VAL 22 CO -0.06 0.30 -0.07 -0.63 -0.31 0.00 0.00 175.10 174.34 2jor s ILE 23 N 1.41 2.52 -0.22 -0.62 1.09 -1.00 -4.61 121.20 119.77 2jor s ILE 23 Ca 0.01 -1.50 0.01 0.00 -1.10 0.00 0.00 60.65 58.07 2jor s ILE 23 Cb -0.15 -2.45 0.06 0.00 -1.06 0.00 0.00 42.46 38.86 2jor s ILE 23 CO -0.09 -0.04 -0.06 -0.89 -0.10 0.00 0.00 174.94 173.76 2jor s THR 24 N 1.17 1.48 -0.27 2.92 2.01 -1.26 -1.14 115.64 120.56 2jor s THR 24 Ca -0.07 -1.12 0.02 0.00 0.31 0.00 0.00 61.69 60.83 2jor s THR 24 Cb -0.20 -1.72 0.07 0.00 0.01 0.00 0.00 72.50 70.66 2jor s THR 24 CO -0.04 -0.05 -0.04 -0.75 -0.69 0.00 0.00 174.62 173.05 2jor s LYS 25 N 1.43 1.75 -0.27 4.92 2.20 -0.00 -4.99 119.74 124.77 2jor s LYS 25 Ca -0.05 -1.29 -0.08 0.00 -0.36 0.00 0.00 55.97 54.19 2jor s LYS 25 Cb -0.18 -2.77 -0.02 0.00 -1.51 0.00 0.00 37.83 33.34 2jor s LYS 25 CO -0.07 -0.68 0.09 0.95 -0.36 0.00 0.00 175.35 175.29 2jor s THR 26 N 1.21 4.39 -0.34 3.43 -4.23 -1.26 -1.86 115.64 116.97 2jor s THR 26 Ca -0.03 -0.25 -0.09 0.00 -1.18 0.00 0.00 61.69 60.14 2jor s THR 26 Cb -0.19 -3.11 0.02 0.00 1.34 0.00 0.00 72.50 70.56 2jor s THR 26 CO -0.07 0.25 0.16 -0.69 -0.54 0.00 0.00 174.62 173.73 2jor s VAL 27 N 1.61 4.34 -0.41 2.29 1.01 -1.08 -4.86 120.40 123.30 2jor s VAL 27 Ca 0.06 -0.81 -0.08 0.00 0.00 0.00 0.00 61.98 61.15 2jor s VAL 27 Cb -0.16 -3.36 0.08 0.00 0.00 0.00 0.00 36.38 32.94 2jor s VAL 27 CO 0.04 -0.12 0.23 -0.89 0.00 0.00 0.00 175.10 174.36 2jor s THR 28 N 1.53 3.99 -0.28 3.92 2.01 -1.26 -2.89 115.64 122.66 2jor s THR 28 Ca 0.02 -1.48 -0.11 0.00 0.31 0.00 0.00 61.69 60.43 2jor s THR 28 Cb -0.19 -3.47 -0.05 0.00 0.01 0.00 0.00 72.50 68.81 2jor s THR 28 CO 0.05 -0.49 0.19 0.21 -0.69 0.00 0.00 174.62 173.88 2jor s ASN 29 N 2.00 6.02 0.11 3.53 3.84 -0.89 -4.93 114.94 124.63 2jor s ASN 29 Ca 0.03 -0.00 0.03 0.00 0.21 0.00 0.00 52.86 53.13 2jor s ASN 29 Cb -0.23 -2.12 0.17 0.00 -0.55 0.00 0.00 41.25 38.53 2jor s ASN 29 CO 0.01 -0.04 0.85 0.00 -2.79 0.00 0.00 177.10 175.13 2jor n ALA 30 N 4.99 0.42 0.88 1.71 0.00 -1.26 -0.19 120.51 127.05 2jor n ALA 30 Ca -0.14 0.03 0.09 0.00 0.00 0.00 0.00 53.44 53.42 2jor n ALA 30 Cb 0.52 -0.46 0.46 0.00 0.00 0.00 0.00 19.45 19.98 2jor n ALA 30 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2jor n ASP 31 N -1.47 0.00 0.00 0.00 8.00 -1.26 -4.80 116.55 117.02 2jor n ASP 31 Ca -0.00 -0.02 0.00 0.00 0.71 0.00 0.00 54.79 55.48 2jor n ASP 31 Cb 0.35 -0.26 0.00 0.00 -0.02 0.00 0.00 41.12 41.19 2jor n ASP 31 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jor n GLY 32 N 0.24 0.93 3.90 0.44 0.00 0.73 -5.09 105.19 106.34 2jor n GLY 32 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 2jor n GLY 32 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jor s ARG 33 N -0.80 3.55 -0.26 1.61 0.52 -1.11 -5.00 118.95 117.45 2jor s ARG 33 Ca 0.00 -0.18 -0.04 0.00 -0.52 0.00 0.00 55.73 55.00 2jor s ARG 33 Cb 0.00 -3.02 0.14 0.00 0.52 0.00 0.00 34.95 32.59 2jor s ARG 33 CO 0.00 0.60 0.49 0.95 0.02 0.00 0.00 175.30 177.36 2jor s THR 34 N -1.43 -0.78 0.14 0.02 -4.23 -1.26 -2.09 115.64 106.01 2jor s THR 34 Ca 0.32 0.00 0.09 0.00 -1.18 0.00 0.00 61.69 60.92 2jor s THR 34 Cb -0.13 -0.87 -0.04 0.00 1.34 0.00 0.00 72.50 72.81 2jor s THR 34 CO 0.21 -0.03 -0.13 -0.70 -0.54 0.00 0.00 174.62 173.42 2jor s GLU 35 N 2.70 1.95 -0.18 3.99 2.12 -1.14 -5.02 118.70 123.11 2jor s GLU 35 Ca 0.11 -1.19 -0.01 0.00 0.36 0.00 0.00 54.97 54.23 2jor s GLU 35 Cb -0.14 -2.16 0.05 0.00 0.26 0.00 0.00 34.13 32.14 2jor s GLU 35 CO -0.17 0.47 -0.01 0.95 -0.54 0.00 0.00 175.26 175.95 2jor s THR 36 N -1.39 0.87 -0.40 -1.70 -4.23 -1.26 -2.65 115.64 104.88 2jor s THR 36 Ca 0.21 -0.65 -0.14 0.00 -1.18 0.00 0.00 61.69 59.93 2jor s THR 36 Cb -0.10 -1.21 0.02 0.00 1.34 0.00 0.00 72.50 72.55 2jor s THR 36 CO 0.13 -0.05 0.28 -0.89 -0.54 0.00 0.00 174.62 173.55 2jor s THR 37 N 1.71 5.15 -0.15 3.99 2.01 -0.78 -4.99 115.64 122.59 2jor s THR 37 Ca -0.01 -0.66 -0.02 0.00 0.31 0.00 0.00 61.69 61.31 2jor s THR 37 Cb -0.16 -3.85 0.04 0.00 0.01 0.00 0.00 72.50 68.54 2jor s THR 37 CO -0.07 -0.28 -0.00 -0.54 -0.69 0.00 0.00 174.62 173.04 2jor s LYS 38 N 1.66 0.89 -0.42 4.92 1.02 -1.26 -0.82 119.74 125.73 2jor s LYS 38 Ca 0.05 -0.28 0.02 0.00 0.02 0.00 0.00 55.97 55.77 2jor s LYS 38 Cb -0.19 -1.72 0.13 0.00 -0.52 0.00 0.00 37.83 35.53 2jor s LYS 38 CO 0.09 -0.47 0.22 -1.21 -0.92 0.00 0.00 175.35 173.07 2jor s GLU 39 N 1.82 1.15 -0.27 1.68 8.01 -0.29 -5.01 118.70 125.79 2jor s GLU 39 Ca 0.01 -1.86 -0.13 0.00 0.01 0.00 0.00 54.97 53.01 2jor s GLU 39 Cb -0.15 -2.18 -0.04 0.00 -4.31 0.00 0.00 34.13 27.45 2jor s GLU 39 CO -0.07 -1.16 0.29 0.14 0.01 0.00 0.00 175.26 174.47 2jor s VAL 40 N 0.53 5.24 -0.23 2.63 -7.23 -1.26 -2.37 120.40 117.71 2jor s VAL 40 Ca 0.17 0.39 -0.02 0.00 -1.81 0.00 0.00 61.98 60.71 2jor s VAL 40 Cb -0.24 -3.62 0.07 0.00 0.56 0.00 0.00 36.38 33.15 2jor s VAL 40 CO -0.01 0.21 0.05 -0.69 -0.31 0.00 0.00 175.10 174.35 2jor s VAL 41 N 1.84 0.62 -0.14 1.32 1.01 -0.87 -5.04 120.40 119.14 2jor s VAL 41 Ca 0.11 -0.78 0.01 0.00 0.00 0.00 0.00 61.98 61.33 2jor s VAL 41 Cb -0.16 -1.20 -0.00 0.00 0.00 0.00 0.00 36.38 35.02 2jor s VAL 41 CO 0.10 -0.33 -0.17 -0.54 0.00 0.00 0.00 175.10 174.16 2jor s LYS 42 N 1.80 3.19 -1.12 2.72 1.02 -1.26 -2.67 119.74 123.42 2jor s LYS 42 Ca 0.01 -0.77 -0.23 0.00 0.02 0.00 0.00 55.97 55.00 2jor s LYS 42 Cb -0.17 -2.56 -0.08 0.00 -0.52 0.00 0.00 37.83 34.50 2jor s LYS 42 CO -0.13 0.07 1.95 -1.54 -0.92 0.00 0.00 175.35 174.77 2jor s SER 43 N 0.68 5.00 0.57 2.83 1.04 -1.23 -4.72 113.70 117.87 2jor s SER 43 Ca -0.08 -1.41 0.08 0.00 0.48 0.00 0.00 55.95 55.02 2jor s SER 43 Cb -0.16 -2.58 0.43 0.00 0.10 0.00 0.00 66.02 63.81 2jor s SER 43 CO 0.02 -3.06 1.19 -0.33 0.98 0.00 0.00 173.24 172.04 2jor h GLU 44 N 10.15 0.00 -6.14 4.02 3.07 -1.96 -3.38 114.58 120.34 2jor h GLU 44 Ca 0.18 0.00 -0.51 0.00 -0.50 0.00 0.00 59.36 58.53 2jor h GLU 44 Cb 0.96 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.83 2jor h GLU 44 CO 1.21 0.00 -0.37 0.34 -1.40 0.00 0.00 179.01 178.79 2jor s ASP 45 N -3.27 4.95 0.00 1.42 2.15 -1.26 -5.12 116.67 115.54 2jor s ASP 45 Ca -0.01 -0.83 0.00 0.00 0.43 0.00 0.00 52.55 52.14 2jor s ASP 45 Cb 0.02 -0.43 0.00 0.00 -0.30 0.00 0.00 42.92 42.22 2jor s ASP 45 CO 0.07 -0.72 0.00 0.61 -0.17 0.00 0.00 175.17 174.97 2jor n GLY 46 N -1.57 -3.06 0.00 2.66 0.00 -1.26 -5.07 105.19 96.89 2jor n GLY 46 Ca 0.03 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 45.05 2jor n GLY 46 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2jor n SER 47 N 0.00 0.00 -3.80 1.61 2.88 -1.26 -4.94 113.62 108.12 2jor n SER 47 Ca 0.00 0.00 -0.30 0.00 -1.33 0.00 0.00 58.87 57.24 2jor n SER 47 Cb 0.00 0.00 -0.15 0.00 -0.75 0.00 0.00 64.21 63.31 2jor n SER 47 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2jor s ASP 48 N 0.00 4.01 -0.08 -3.46 2.15 -1.26 -5.10 116.67 112.93 2jor s ASP 48 Ca 0.00 -1.59 0.00 0.00 0.43 0.00 0.00 52.55 51.39 2jor s ASP 48 Cb 0.00 -0.98 -0.03 0.00 -0.30 0.00 0.00 42.92 41.61 2jor s ASP 48 CO 0.00 -0.38 -0.05 0.00 -0.17 0.00 0.00 175.17 174.57 2jor n GLY 50 N 2.28 -0.36 0.29 0.00 0.00 -1.26 -2.94 105.19 103.21 2jor n GLY 50 Ca -0.18 0.05 -0.01 0.00 0.00 0.00 0.00 46.02 45.88 2jor n GLY 50 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2jor n ASP 51 N -1.68 -0.08 -2.00 1.61 2.03 -1.26 -4.84 116.55 110.33 2jor n ASP 51 Ca -0.00 -0.27 -0.06 0.00 0.52 0.00 0.00 54.79 54.97 2jor n ASP 51 Cb 0.46 0.02 0.03 0.00 -0.72 0.00 0.00 41.12 40.92 2jor n ASP 51 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jor n ALA 52 N 0.00 -0.89 -0.20 -1.67 0.00 -1.15 -4.67 120.51 111.92 2jor n ALA 52 Ca -0.02 -0.01 0.19 0.00 0.00 0.00 0.00 53.44 53.60 2jor n ALA 52 Cb 0.19 -1.53 0.34 0.00 0.00 0.00 0.00 19.45 18.44 2jor n ALA 52 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2jor n ASP 53 N -1.90 0.16 0.00 0.00 8.00 -1.25 -4.54 116.55 117.03 2jor n ASP 53 Ca -0.09 0.84 0.00 0.00 0.71 0.00 0.00 54.79 56.25 2jor n ASP 53 Cb 0.56 -0.41 0.00 0.00 -0.02 0.00 0.00 41.12 41.25 2jor n ASP 53 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2jor n PHE 54 N -4.05 0.00 -3.62 1.24 3.72 -1.25 -4.06 117.46 109.43 2jor n PHE 54 Ca 0.21 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.37 2jor n PHE 54 Cb 0.75 0.00 0.07 0.00 -0.94 0.00 0.00 39.48 39.37 2jor n PHE 54 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 2jor n ASP 55 N 1.87 -5.32 0.00 4.37 -0.08 -1.26 -4.33 116.55 111.80 2jor n ASP 55 Ca 0.00 -0.59 0.00 0.00 -1.51 0.00 0.00 54.79 52.69 2jor n ASP 55 Cb 0.00 -4.86 0.00 0.00 2.34 0.00 0.00 41.12 38.60 2jor n ASP 55 CO 0.00 0.00 0.00 0.79 0.12 0.00 0.00 177.20 178.11 2jor n TRP 56 N -4.81 0.00 -3.65 -0.67 7.02 -1.26 -4.64 117.44 109.43 2jor n TRP 56 Ca -0.04 0.00 -0.02 0.00 -1.02 0.00 0.00 57.50 56.42 2jor n TRP 56 Cb 0.58 0.00 -0.01 0.00 -2.42 0.00 0.00 31.31 29.46 2jor n TRP 56 CO 0.00 0.00 0.00 -1.58 -2.02 0.00 0.00 177.69 174.09 2jor s HIS 57 N 0.00 -0.11 -0.16 -5.99 2.46 -1.26 -4.03 115.29 106.20 2jor s HIS 57 Ca 0.00 -0.05 0.00 0.00 0.47 0.00 0.00 55.06 55.48 2jor s HIS 57 Cb 0.00 0.57 0.00 0.00 -0.13 0.00 0.00 32.58 33.02 2jor s HIS 57 CO 0.00 -0.48 0.00 -2.39 -2.47 0.00 0.00 174.74 169.40 2jor n HIS 58 N -0.41 0.00 -3.36 3.88 1.44 -1.26 -3.96 115.22 111.55 2jor n HIS 58 Ca -0.07 0.00 -0.30 0.00 -2.01 0.00 0.00 57.72 55.34 2jor n HIS 58 Cb 0.61 0.00 0.03 0.00 0.12 0.00 0.00 29.99 30.75 2jor n HIS 58 CO 0.00 0.00 0.00 2.41 -2.81 0.00 0.00 176.34 175.94 2jor n THR 59 N 0.12 -5.08 -3.97 0.61 -1.04 -1.26 -4.96 114.28 98.69 2jor n THR 59 Ca 0.00 0.29 -0.26 0.00 -2.04 0.00 0.00 64.05 62.04 2jor n THR 59 Cb 0.00 -4.18 -0.03 0.00 -1.82 0.00 0.00 70.33 64.30 2jor n THR 59 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 2jor s PHE 60 N -1.61 3.42 0.15 -1.42 0.40 -1.26 -4.86 117.98 112.80 2jor s PHE 60 Ca 0.32 0.08 -0.17 0.00 -0.60 0.00 0.00 56.93 56.56 2jor s PHE 60 Cb -0.04 -1.63 0.05 0.00 0.51 0.00 0.00 43.02 41.91 2jor s PHE 60 CO 0.78 0.51 1.73 -1.00 0.70 0.00 0.00 175.22 177.94 2jor h PRO 61 N 2.09 0.15 0.00 0.24 0.13 -1.93 -3.21 132.00 129.48 2jor h PRO 61 Ca -0.49 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2jor h PRO 61 Cb 1.20 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.29 2jor h PRO 61 CO 0.67 0.10 0.00 -1.13 -0.23 0.00 0.00 178.00 177.41 2jor n SER 62 N -5.11 0.00 -2.67 1.44 3.41 -1.26 -4.83 113.62 104.60 2jor n SER 62 Ca 0.01 0.81 -0.04 0.00 -0.26 0.00 0.00 58.87 59.39 2jor n SER 62 Cb 0.15 -0.31 0.10 0.00 -0.26 0.00 0.00 64.21 63.89 2jor n SER 62 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 2jor n ARG 63 N -1.52 0.22 -2.92 4.33 1.85 -1.21 -5.05 116.66 112.35 2jor n ARG 63 Ca 0.00 -0.81 -0.09 0.00 -1.00 0.00 0.00 57.85 55.95 2jor n ARG 63 Cb 0.00 -0.26 0.01 0.00 -1.05 0.00 0.00 32.46 31.16 2jor n ARG 63 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2jor n GLY 64 N 0.74 -2.03 0.08 2.89 0.00 -1.22 -4.86 105.19 100.80 2jor n GLY 64 Ca -0.03 0.87 -0.15 0.00 0.00 0.00 0.00 46.02 46.71 2jor n GLY 64 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2jor h ASN 65 N 2.52 0.00 -2.87 1.61 -0.73 -1.93 -3.44 115.58 110.75 2jor h ASN 65 Ca -0.07 -0.86 -0.56 0.00 1.87 0.00 0.00 56.30 56.68 2jor h ASN 65 Cb 0.72 0.00 -0.03 0.00 0.27 0.00 0.00 38.32 39.27 2jor h ASN 65 CO 0.15 1.06 0.97 -0.76 -0.37 0.00 0.00 177.43 178.48 2jor s LEU 66 N -8.17 4.14 0.00 0.34 2.01 -1.26 -4.85 118.68 110.88 2jor s LEU 66 Ca -0.20 1.72 0.00 0.00 0.01 0.00 0.00 54.13 55.66 2jor s LEU 66 Cb -0.01 -3.54 0.00 0.00 0.01 0.00 0.00 46.19 42.65 2jor s LEU 66 CO 0.63 -0.89 0.48 0.47 1.01 0.00 0.00 176.35 178.06 2jor n ASP 67 N 7.04 0.92 -2.80 2.29 9.92 -1.26 -4.61 116.55 128.05 2jor n ASP 67 Ca 0.15 -1.88 0.00 0.00 -0.53 0.00 0.00 54.79 52.53 2jor n ASP 67 Cb 0.45 -0.46 0.00 0.00 -0.64 0.00 0.00 41.12 40.47 2jor n ASP 67 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 2jor n ASP 68 N 0.02 -0.26 0.00 -2.24 8.00 -1.26 -5.00 116.55 115.80 2jor n ASP 68 Ca 0.00 -0.35 0.00 0.00 0.71 0.00 0.00 54.79 55.15 2jor n ASP 68 Cb 0.23 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.33 2jor n ASP 68 CO 0.00 0.00 0.00 2.22 -0.39 0.00 0.00 177.20 179.03 2jor n PHE 69 N -1.23 0.00 0.00 1.24 1.16 -1.25 -4.88 117.46 112.50 2jor n PHE 69 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.58 2jor n PHE 69 Cb 0.00 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 37.87 2jor n PHE 69 CO 0.00 0.00 0.00 1.19 -1.87 0.00 0.00 176.76 176.08 2jor n PHE 70 N 0.00 0.00 -1.94 2.97 3.01 -1.26 -4.74 117.46 115.50 2jor n PHE 70 Ca 0.00 0.00 -0.16 0.00 1.01 0.00 0.00 57.45 58.30 2jor n PHE 70 Cb 0.00 -0.09 -0.04 0.00 -0.01 0.00 0.00 39.48 39.34 2jor n PHE 70 CO 0.00 0.00 0.00 0.72 1.01 0.00 0.00 176.76 178.49 2jor n HIS 71 N -1.19 -0.70 -3.51 1.38 8.25 -1.26 -4.88 115.22 113.31 2jor n HIS 71 Ca 0.00 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.08 2jor n HIS 71 Cb 0.00 -3.15 -0.10 0.00 1.12 0.00 0.00 29.99 27.86 2jor n HIS 71 CO 0.00 0.00 0.00 0.50 0.64 0.00 0.00 176.34 177.48 2jor s ARG 72 N -4.19 4.03 0.08 -0.41 3.52 -1.26 -4.93 118.95 115.79 2jor s ARG 72 Ca 0.00 -0.12 -0.26 0.00 -0.13 0.00 0.00 55.73 55.22 2jor s ARG 72 Cb 0.00 -3.62 0.09 0.00 -1.56 0.00 0.00 34.95 29.86 2jor s ARG 72 CO 0.00 -0.15 1.14 0.34 -0.81 0.00 0.00 175.30 175.82 2jor s ASP 73 N 1.49 -0.06 -0.26 -2.12 2.15 -1.26 -3.74 116.67 112.86 2jor s ASP 73 Ca 0.11 -0.37 -0.26 0.00 0.43 0.00 0.00 52.55 52.47 2jor s ASP 73 Cb -0.15 0.33 0.00 0.00 -0.30 0.00 0.00 42.92 42.80 2jor s ASP 73 CO 0.09 -0.64 0.91 -1.59 -0.17 0.00 0.00 175.17 173.77 2jor s LYS 74 N -2.49 4.14 -0.30 4.34 -2.85 -1.26 -4.97 119.74 116.35 2jor s LYS 74 Ca 0.19 1.00 -0.12 0.00 -1.00 0.00 0.00 55.97 56.03 2jor s LYS 74 Cb 0.00 -3.67 0.18 0.00 -2.06 0.00 0.00 37.83 32.28 2jor s LYS 74 CO 0.01 -0.64 0.99 0.34 0.10 0.00 0.00 175.35 176.15 2jor s ASP 75 N 1.41 -0.59 -0.05 0.03 -1.08 -1.26 -5.11 116.67 110.01 2jor s ASP 75 Ca 0.38 0.43 -0.29 0.00 -0.52 0.00 0.00 52.55 52.55 2jor s ASP 75 Cb -0.14 1.52 -0.07 0.00 -1.46 0.00 0.00 42.92 42.76 2jor s ASP 75 CO 0.09 -0.11 2.03 -1.81 0.52 0.00 0.00 175.17 175.89 2jor s ASP 76 N 2.85 6.14 -0.28 -0.34 1.11 -1.26 -4.87 116.67 120.03 2jor s ASP 76 Ca 0.02 2.39 -0.28 0.00 0.18 0.00 0.00 52.55 54.85 2jor s ASP 76 Cb -0.10 -2.52 -0.03 0.00 1.07 0.00 0.00 42.92 41.34 2jor s ASP 76 CO -0.13 -1.34 1.89 -0.36 1.18 0.00 0.00 175.17 176.41 2jor s PHE 77 N 5.67 1.66 1.05 4.23 0.08 -1.26 -4.95 117.98 124.46 2jor s PHE 77 Ca 0.91 0.56 -0.12 0.00 0.12 0.00 0.00 56.93 58.40 2jor s PHE 77 Cb -0.39 -4.07 0.19 0.00 -0.57 0.00 0.00 43.02 38.18 2jor s PHE 77 CO 0.39 -3.32 0.86 1.19 -0.10 0.00 0.00 175.22 174.24 2jor n PHE 78 N 10.34 -0.55 1.01 0.36 3.72 -1.26 -5.36 117.46 125.71 2jor n PHE 78 Ca 0.24 0.13 0.08 0.00 -0.05 0.00 0.00 57.45 57.85 2jor n PHE 78 Cb 0.46 -1.80 0.48 0.00 -0.94 0.00 0.00 39.48 37.68 2jor n PHE 78 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12