#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 3.36 0.00 3.17 1.01 -1.26 -4.97 121.20 122.52 2jor s ILE 2 Ca 0.00 0.30 0.00 0.00 0.00 0.00 0.00 60.65 60.95 2jor s ILE 2 Cb 0.00 -3.67 0.00 0.00 0.01 0.00 0.00 42.46 38.80 2jor s ILE 2 CO 0.00 -0.56 0.00 -0.67 0.00 0.00 0.00 174.94 173.71 2jor n ASP 3 N 11.99 -1.22 -2.75 3.58 2.03 -1.26 -5.08 116.55 123.84 2jor n ASP 3 Ca 0.24 -0.26 -0.10 0.00 0.52 0.00 0.00 54.79 55.19 2jor n ASP 3 Cb 0.50 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.91 2jor n ASP 3 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 2jor n ASN 4 N -2.60 -1.94 -3.58 1.67 4.13 -1.26 -5.17 115.26 106.50 2jor n ASN 4 Ca 0.00 -2.59 -0.02 0.00 1.68 0.00 0.00 54.58 53.65 2jor n ASN 4 Cb 0.00 3.31 -0.06 0.00 -1.54 0.00 0.00 39.78 41.49 2jor n ASN 4 CO 0.00 0.00 0.00 -1.83 0.28 0.00 0.00 177.26 175.71 2jor s GLU 5 N -2.27 0.44 0.22 3.52 -1.05 -1.26 -5.14 118.70 113.16 2jor s GLU 5 Ca 0.19 0.86 0.00 0.00 -0.15 0.00 0.00 54.97 55.87 2jor s GLU 5 Cb -0.04 0.27 0.00 0.00 -0.44 0.00 0.00 34.13 33.92 2jor s GLU 5 CO 0.14 -0.11 0.00 1.63 0.95 0.00 0.00 175.26 177.87 2jor n LYS 6 N 4.33 -1.79 0.02 -4.83 4.76 -1.26 -4.46 118.16 114.93 2jor n LYS 6 Ca -0.16 1.22 -0.11 0.00 -2.87 0.00 0.00 58.31 56.39 2jor n LYS 6 Cb 0.56 -2.22 -0.08 0.00 -1.84 0.00 0.00 35.03 31.45 2jor n LYS 6 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 2jor h VAL 7 N -0.91 1.02 -2.92 -0.18 2.07 -2.01 -3.43 116.25 109.89 2jor h VAL 7 Ca 0.00 -1.35 -0.55 0.00 0.82 0.00 0.00 66.70 65.62 2jor h VAL 7 Cb 1.21 1.76 -0.02 0.00 -1.52 0.00 0.00 31.29 32.73 2jor h VAL 7 CO 0.01 0.28 0.85 0.28 0.02 0.00 0.00 177.57 179.01 2jor s THR 8 N -3.14 3.95 -0.99 2.57 -1.32 -1.26 -4.93 115.64 110.52 2jor s THR 8 Ca -0.13 1.26 -0.23 0.00 -1.21 0.00 0.00 61.69 61.38 2jor s THR 8 Cb -0.00 -3.81 0.04 0.00 -1.51 0.00 0.00 72.50 67.21 2jor s THR 8 CO 0.50 -0.04 1.52 -0.55 -2.21 0.00 0.00 174.62 173.84 2jor s SER 9 N 1.97 6.29 0.00 8.08 0.15 -1.26 -4.75 113.70 124.19 2jor s SER 9 Ca 0.61 -1.30 0.00 0.00 0.70 0.00 0.00 55.95 55.96 2jor s SER 9 Cb -0.28 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.46 2jor s SER 9 CO 0.23 -1.70 0.00 0.61 1.20 0.00 0.00 173.24 173.58 2jor n GLY 10 N 6.84 0.91 3.04 9.45 0.00 -1.26 -5.00 105.19 119.16 2jor n GLY 10 Ca 0.33 0.04 -0.20 0.00 0.00 0.00 0.00 46.02 46.19 2jor n GLY 10 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2jor n HIS 11 N 0.00 -1.71 0.00 1.61 -0.00 -1.26 -4.92 115.22 108.94 2jor n HIS 11 Ca 0.00 0.34 0.00 0.00 -0.00 0.00 0.00 57.72 58.06 2jor n HIS 11 Cb 0.00 -3.17 0.00 0.00 -0.00 0.00 0.00 29.99 26.82 2jor n HIS 11 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.34 176.59 2jor n THR 12 N -3.88 0.00 -2.61 3.57 -2.24 -1.26 -4.88 114.28 102.98 2jor n THR 12 Ca -0.07 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.30 2jor n THR 12 Cb 0.58 -0.03 -0.04 0.00 -2.10 0.00 0.00 70.33 68.74 2jor n THR 12 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2jor s THR 13 N 0.00 4.21 0.00 4.28 -4.23 -1.26 -5.04 115.64 113.61 2jor s THR 13 Ca 0.00 1.82 0.00 0.00 -1.18 0.00 0.00 61.69 62.33 2jor s THR 13 Cb 0.00 -4.16 0.00 0.00 1.34 0.00 0.00 72.50 69.68 2jor s THR 13 CO 0.00 0.27 0.00 0.35 -0.54 0.00 0.00 174.62 174.70 2jor n THR 14 N 2.82 0.00 -3.30 3.99 -2.24 -1.26 -4.96 114.28 109.32 2jor n THR 14 Ca 0.03 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.46 2jor n THR 14 Cb 0.48 -0.02 -0.06 0.00 -2.10 0.00 0.00 70.33 68.63 2jor n THR 14 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2jor s THR 15 N 0.00 4.79 0.03 4.28 -4.23 -1.26 -5.08 115.64 114.17 2jor s THR 15 Ca 0.00 0.95 0.02 0.00 -1.18 0.00 0.00 61.69 61.48 2jor s THR 15 Cb 0.00 -3.77 -0.02 0.00 1.34 0.00 0.00 72.50 70.05 2jor s THR 15 CO 0.00 0.26 -0.07 -0.13 -0.54 0.00 0.00 174.62 174.15 2jor s ARG 16 N -1.89 0.48 0.00 3.99 0.52 -1.26 -4.77 118.95 116.02 2jor s ARG 16 Ca 0.38 -0.68 0.00 0.00 -0.52 0.00 0.00 55.73 54.91 2jor s ARG 16 Cb -0.16 -0.24 0.00 0.00 0.52 0.00 0.00 34.95 35.08 2jor s ARG 16 CO 0.19 0.04 0.00 2.89 0.02 0.00 0.00 175.30 178.44 2jor n ARG 17 N 1.62 0.00 -0.06 3.54 1.85 -1.26 -4.91 116.66 117.45 2jor n ARG 17 Ca -0.22 0.00 -0.05 0.00 -1.00 0.00 0.00 57.85 56.58 2jor n ARG 17 Cb 0.55 -2.05 -0.04 0.00 -1.05 0.00 0.00 32.46 29.87 2jor n ARG 17 CO 0.00 0.00 0.00 0.77 -0.01 0.00 0.00 177.63 178.39 2jor h SER 18 N 0.00 0.00 -2.96 2.89 0.02 -1.85 -3.39 113.55 108.26 2jor h SER 18 Ca 0.00 -0.32 -0.02 0.00 -0.84 0.00 0.00 61.79 60.62 2jor h SER 18 Cb 0.00 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.54 2jor h SER 18 CO 0.00 0.68 -0.01 0.00 -1.14 0.00 0.00 176.83 176.35 2jor s SER 20 N -1.07 6.60 -0.04 0.00 0.15 -1.26 -4.32 113.70 113.76 2jor s SER 20 Ca 0.00 2.51 -0.01 0.00 0.70 0.00 0.00 55.95 59.15 2jor s SER 20 Cb 0.00 -2.57 0.03 0.00 -1.71 0.00 0.00 66.02 61.77 2jor s SER 20 CO 0.00 -0.87 0.09 -0.75 1.20 0.00 0.00 173.24 172.91 2jor s LYS 21 N 2.27 0.02 -0.19 5.44 2.36 -1.10 -3.93 119.74 124.60 2jor s LYS 21 Ca 0.73 0.30 0.01 0.00 -2.55 0.00 0.00 55.97 54.45 2jor s LYS 21 Cb -0.41 -0.23 0.04 0.00 -1.05 0.00 0.00 37.83 36.18 2jor s LYS 21 CO 0.32 -0.18 -0.11 0.08 1.55 0.00 0.00 175.35 177.01 2jor s VAL 22 N 1.23 1.66 -0.21 4.02 1.01 -1.26 -2.39 120.40 124.45 2jor s VAL 22 Ca -0.08 -0.99 0.00 0.00 0.00 0.00 0.00 61.98 60.92 2jor s VAL 22 Cb -0.12 -1.71 0.05 0.00 0.00 0.00 0.00 36.38 34.60 2jor s VAL 22 CO -0.04 0.20 -0.05 -0.51 0.00 0.00 0.00 175.10 174.70 2jor s ILE 23 N 1.39 1.37 -0.13 2.22 2.07 -1.16 -4.86 121.20 122.10 2jor s ILE 23 Ca -0.01 -1.02 0.00 0.00 -1.41 0.00 0.00 60.65 58.21 2jor s ILE 23 Cb -0.16 -1.62 0.02 0.00 0.13 0.00 0.00 42.46 40.84 2jor s ILE 23 CO -0.08 -0.04 -0.11 0.28 -1.91 0.00 0.00 174.94 173.08 2jor s THR 24 N 1.48 1.27 -0.27 4.00 -1.32 -1.26 -2.06 115.64 117.48 2jor s THR 24 Ca -0.04 -0.45 0.03 0.00 -1.21 0.00 0.00 61.69 60.03 2jor s THR 24 Cb -0.18 -1.23 0.06 0.00 -1.51 0.00 0.00 72.50 69.64 2jor s THR 24 CO -0.07 0.41 -0.09 -0.54 -2.21 0.00 0.00 174.62 172.12 2jor s LYS 25 N 1.57 2.12 -0.25 7.08 1.02 -0.14 -4.54 119.74 126.61 2jor s LYS 25 Ca 0.04 -1.39 -0.06 0.00 0.02 0.00 0.00 55.97 54.58 2jor s LYS 25 Cb -0.13 -2.91 -0.02 0.00 -0.52 0.00 0.00 37.83 34.26 2jor s LYS 25 CO -0.09 -0.61 0.03 0.95 -0.92 0.00 0.00 175.35 174.71 2jor s THR 26 N 1.09 3.93 -0.34 2.17 -4.23 -1.26 -1.07 115.64 115.93 2jor s THR 26 Ca -0.07 -0.37 -0.09 0.00 -1.18 0.00 0.00 61.69 59.99 2jor s THR 26 Cb -0.20 -2.86 0.02 0.00 1.34 0.00 0.00 72.50 70.81 2jor s THR 26 CO -0.05 0.33 0.15 -0.69 -0.54 0.00 0.00 174.62 173.81 2jor s VAL 27 N 1.55 4.30 -0.40 2.29 1.01 -0.81 -4.15 120.40 124.19 2jor s VAL 27 Ca 0.06 -0.80 -0.08 0.00 0.00 0.00 0.00 61.98 61.16 2jor s VAL 27 Cb -0.15 -3.33 0.07 0.00 0.00 0.00 0.00 36.38 32.97 2jor s VAL 27 CO 0.01 -0.11 0.22 -0.89 0.00 0.00 0.00 175.10 174.33 2jor s THR 28 N 1.52 4.05 -0.34 3.92 2.01 -1.26 -2.12 115.64 123.42 2jor s THR 28 Ca 0.02 -1.39 -0.14 0.00 0.31 0.00 0.00 61.69 60.49 2jor s THR 28 Cb -0.18 -3.46 -0.01 0.00 0.01 0.00 0.00 72.50 68.86 2jor s THR 28 CO 0.05 -0.44 0.31 0.20 -0.69 0.00 0.00 174.62 174.05 2jor s ASN 29 N 1.92 6.13 0.14 3.53 0.01 -1.05 -4.93 114.94 120.70 2jor s ASN 29 Ca 0.02 -0.31 0.05 0.00 -0.71 0.00 0.00 52.86 51.91 2jor s ASN 29 Cb -0.22 -2.17 0.26 0.00 0.41 0.00 0.00 41.25 39.52 2jor s ASN 29 CO 0.02 -0.30 0.94 0.00 -1.51 0.00 0.00 177.10 176.25 2jor n ALA 30 N 5.27 0.50 1.06 0.60 0.00 -1.26 -1.20 120.51 125.48 2jor n ALA 30 Ca -0.11 0.04 0.06 0.00 0.00 0.00 0.00 53.44 53.44 2jor n ALA 30 Cb 0.49 -0.56 0.38 0.00 0.00 0.00 0.00 19.45 19.77 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 -1.57 0.00 0.00 0.00 9.92 -1.26 -4.75 116.55 118.88 2jor n ASP 31 Ca -0.00 -0.67 0.00 0.00 -0.53 0.00 0.00 54.79 53.59 2jor n ASP 31 Cb 0.32 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.80 2jor n ASP 31 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2jor n GLY 32 N 0.05 0.59 3.92 0.44 0.00 -0.34 -5.09 105.19 104.76 2jor n GLY 32 Ca 0.10 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.82 3.55 -0.28 1.61 0.52 -1.06 -5.02 118.95 117.45 2jor s ARG 33 Ca 0.00 -0.25 -0.08 0.00 -0.52 0.00 0.00 55.73 54.89 2jor s ARG 33 Cb 0.00 -2.80 0.14 0.00 0.52 0.00 0.00 34.95 32.81 2jor s ARG 33 CO 0.00 0.36 0.60 -0.08 0.02 0.00 0.00 175.30 176.20 2jor s THR 34 N -1.90 -0.93 0.02 0.02 -1.32 -1.26 -2.51 115.64 107.75 2jor s THR 34 Ca 0.40 0.02 0.08 0.00 -1.21 0.00 0.00 61.69 60.98 2jor s THR 34 Cb -0.11 -0.94 -0.03 0.00 -1.51 0.00 0.00 72.50 69.91 2jor s THR 34 CO 0.29 0.01 -0.23 -1.61 -2.21 0.00 0.00 174.62 170.86 2jor s GLU 35 N 2.84 2.01 -0.18 7.08 0.41 -0.90 -5.04 118.70 124.92 2jor s GLU 35 Ca 0.00 -0.99 -0.01 0.00 -0.41 0.00 0.00 54.97 53.56 2jor s GLU 35 Cb -0.13 -2.08 0.05 0.00 -1.78 0.00 0.00 34.13 30.19 2jor s GLU 35 CO -0.18 0.54 -0.02 0.95 -0.49 0.00 0.00 175.26 176.06 2jor s THR 36 N -0.77 0.96 -0.32 3.63 -4.23 -1.26 -1.92 115.64 111.73 2jor s THR 36 Ca 0.12 -0.68 -0.13 0.00 -1.18 0.00 0.00 61.69 59.82 2jor s THR 36 Cb -0.10 -1.26 -0.03 0.00 1.34 0.00 0.00 72.50 72.45 2jor s THR 36 CO 0.02 -0.02 0.26 -0.89 -0.54 0.00 0.00 174.62 173.45 2jor s THR 37 N 1.68 5.26 -0.43 3.99 2.01 -0.23 -4.97 115.64 122.94 2jor s THR 37 Ca -0.01 0.03 0.08 0.00 0.31 0.00 0.00 61.69 62.10 2jor s THR 37 Cb -0.16 -3.68 0.27 0.00 0.01 0.00 0.00 72.50 68.94 2jor s THR 37 CO -0.07 0.07 0.61 0.29 -0.69 0.00 0.00 174.62 174.83 2jor n LYS 38 N 5.17 1.13 -2.86 4.92 5.02 -1.26 -0.96 118.16 129.32 2jor n LYS 38 Ca -0.12 -3.53 -0.43 0.00 -2.02 0.00 0.00 58.31 52.21 2jor n LYS 38 Cb 0.50 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.98 2jor n LYS 38 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2jor s GLU 39 N -1.72 3.31 -0.23 1.97 2.02 -0.87 -4.99 118.70 118.19 2jor s GLU 39 Ca 0.37 -1.18 -0.08 0.00 0.02 0.00 0.00 54.97 54.11 2jor s GLU 39 Cb 0.21 -4.55 -0.04 0.00 0.10 0.00 0.00 34.13 29.85 2jor s GLU 39 CO -0.09 -1.83 0.09 0.08 0.02 0.00 0.00 175.26 173.53 2jor s VAL 40 N 3.65 4.71 -0.18 2.63 1.01 -1.26 -2.99 120.40 127.98 2jor s VAL 40 Ca 0.28 -0.04 -0.02 0.00 0.00 0.00 0.00 61.98 62.19 2jor s VAL 40 Cb -0.11 -3.18 0.05 0.00 0.00 0.00 0.00 36.38 33.14 2jor s VAL 40 CO 0.02 0.37 0.01 0.68 0.00 0.00 0.00 175.10 176.18 2jor s VAL 41 N 1.14 0.66 -0.18 2.92 -7.23 -1.01 -5.06 120.40 111.65 2jor s VAL 41 Ca 0.05 -0.54 -0.00 0.00 -1.81 0.00 0.00 61.98 59.68 2jor s VAL 41 Cb -0.14 -1.07 0.01 0.00 0.56 0.00 0.00 36.38 35.74 2jor s VAL 41 CO 0.04 -0.10 -0.15 -0.54 -0.31 0.00 0.00 175.10 174.03 2jor s LYS 42 N 1.80 3.12 -0.19 4.82 1.02 -1.26 -2.72 119.74 126.34 2jor s LYS 42 Ca -0.00 -0.77 -0.30 0.00 0.02 0.00 0.00 55.97 54.91 2jor s LYS 42 Cb -0.16 -2.68 0.15 0.00 -0.52 0.00 0.00 37.83 34.61 2jor s LYS 42 CO -0.07 -0.16 1.12 -1.54 -0.92 0.00 0.00 175.35 173.78 2jor s SER 43 N 1.23 -0.25 0.50 2.83 1.04 -1.26 -5.02 113.70 112.77 2jor s SER 43 Ca 0.03 0.22 0.00 0.00 0.48 0.00 0.00 55.95 56.68 2jor s SER 43 Cb -0.14 0.21 0.00 0.00 0.10 0.00 0.00 66.02 66.19 2jor s SER 43 CO -0.08 -0.26 0.00 1.21 0.98 0.00 0.00 173.24 175.09 2jor n GLU 44 N 0.50 -3.16 -2.67 4.02 4.07 -1.26 -4.00 120.64 118.14 2jor n GLU 44 Ca -0.06 2.38 -0.14 0.00 -0.06 0.00 0.00 57.16 59.27 2jor n GLU 44 Cb 0.58 -3.76 0.01 0.00 -0.06 0.00 0.00 31.44 28.21 2jor n GLU 44 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 2jor n ASP 45 N -4.33 1.79 -3.63 4.31 2.03 -1.26 -4.61 116.55 110.86 2jor n ASP 45 Ca -0.04 -2.07 0.00 0.00 0.52 0.00 0.00 54.79 53.20 2jor n ASP 45 Cb 0.68 -0.10 0.01 0.00 -0.72 0.00 0.00 41.12 40.99 2jor n ASP 45 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 2jor s GLY 46 N -3.30 -0.09 0.58 0.27 0.00 -1.26 -4.54 107.32 98.98 2jor s GLY 46 Ca 0.25 0.00 0.35 0.00 0.00 0.00 0.00 44.72 45.32 2jor s GLY 46 CO 0.16 3.50 1.61 0.23 0.00 0.00 0.00 173.10 178.60 2jor h SER 47 N 2.00 0.00 -1.99 1.64 0.87 -2.01 -3.14 113.55 110.92 2jor h SER 47 Ca -0.25 0.00 -0.40 0.00 -1.23 0.00 0.00 61.79 59.91 2jor h SER 47 Cb 1.20 0.00 -0.32 0.00 -0.44 0.00 0.00 62.40 62.84 2jor h SER 47 CO 0.32 0.00 -0.72 -1.81 -0.53 0.00 0.00 176.83 174.09 2jor s ASP 48 N -4.35 1.20 0.14 6.23 1.11 -1.26 -4.99 116.67 114.75 2jor s ASP 48 Ca -0.04 -1.83 0.05 0.00 0.18 0.00 0.00 52.55 50.92 2jor s ASP 48 Cb 0.19 0.44 -0.04 0.00 1.07 0.00 0.00 42.92 44.59 2jor s ASP 48 CO 0.66 -0.24 -0.12 0.00 1.18 0.00 0.00 175.17 176.65 2jor n GLY 50 N 0.16 0.36 0.15 0.00 0.00 -1.26 -0.75 105.19 103.85 2jor n GLY 50 Ca -0.13 0.02 0.04 0.00 0.00 0.00 0.00 46.02 45.95 2jor n GLY 50 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2jor n ASP 51 N 0.77 0.21 0.00 1.61 8.00 -1.26 -4.58 116.55 121.30 2jor n ASP 51 Ca 0.00 0.43 0.00 0.00 0.71 0.00 0.00 54.79 55.93 2jor n ASP 51 Cb 0.00 -0.33 0.00 0.00 -0.02 0.00 0.00 41.12 40.77 2jor n ASP 51 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jor n ALA 52 N -1.44 0.00 -3.36 2.24 0.00 0.07 -4.34 120.51 113.68 2jor n ALA 52 Ca -0.01 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.46 2jor n ALA 52 Cb 0.44 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.86 2jor n ALA 52 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2jor s ASP 53 N 1.75 -0.86 -1.38 0.00 -4.77 -1.03 -3.96 116.67 106.42 2jor s ASP 53 Ca 0.00 0.90 -0.16 0.00 -3.30 0.00 0.00 52.55 49.99 2jor s ASP 53 Cb 0.00 1.87 0.05 0.00 -1.09 0.00 0.00 42.92 43.74 2jor s ASP 53 CO 0.00 -0.16 2.00 0.33 0.70 0.00 0.00 175.17 178.04 2jor n PHE 54 N 5.28 4.01 -3.63 2.11 7.35 0.25 -3.97 117.46 128.86 2jor n PHE 54 Ca -0.08 -2.88 -0.08 0.00 -0.76 0.00 0.00 57.45 53.65 2jor n PHE 54 Cb 0.52 -2.58 -0.07 0.00 0.35 0.00 0.00 39.48 37.69 2jor n PHE 54 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 2jor s ASP 55 N 3.72 -0.35 0.00 -2.13 2.15 -1.26 -4.77 116.67 114.03 2jor s ASP 55 Ca 0.51 0.65 0.00 0.00 0.43 0.00 0.00 52.55 54.13 2jor s ASP 55 Cb 0.09 0.65 0.00 0.00 -0.30 0.00 0.00 42.92 43.36 2jor s ASP 55 CO -0.01 -0.14 0.23 0.79 -0.17 0.00 0.00 175.17 175.87 2jor n TRP 56 N 1.91 0.00 -2.52 -5.34 8.01 -1.26 -4.23 117.44 114.01 2jor n TRP 56 Ca -0.12 0.00 -0.04 0.00 -1.31 0.00 0.00 57.50 56.04 2jor n TRP 56 Cb 0.56 0.00 -0.03 0.00 -2.01 0.00 0.00 31.31 29.83 2jor n TRP 56 CO 0.00 0.00 0.00 1.58 -1.01 0.00 0.00 177.69 178.26 2jor n HIS 57 N -0.45 -4.64 0.00 -5.99 -0.00 -1.26 -4.32 115.22 98.56 2jor n HIS 57 Ca 0.00 2.72 0.00 0.00 0.46 0.00 0.00 57.72 60.90 2jor n HIS 57 Cb 0.00 -3.90 0.00 0.00 -0.12 0.00 0.00 29.99 25.97 2jor n HIS 57 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38 2jor n HIS 58 N 1.78 0.00 -3.86 1.57 -0.00 -1.26 -4.81 115.22 108.65 2jor n HIS 58 Ca -0.28 0.00 -0.09 0.00 -0.00 0.00 0.00 57.72 57.35 2jor n HIS 58 Cb 0.43 0.00 -0.08 0.00 -0.00 0.00 0.00 29.99 30.35 2jor n HIS 58 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.34 177.29 2jor s THR 59 N 0.00 0.14 0.28 3.57 -4.23 -1.26 -5.08 115.64 109.06 2jor s THR 59 Ca 0.00 -1.13 -0.12 0.00 -1.18 0.00 0.00 61.69 59.25 2jor s THR 59 Cb 0.00 -1.25 -0.08 0.00 1.34 0.00 0.00 72.50 72.51 2jor s THR 59 CO 0.00 -0.63 0.65 -0.36 -0.54 0.00 0.00 174.62 173.75 2jor s PHE 60 N -3.59 3.40 1.20 3.99 0.40 -1.26 -4.98 117.98 117.14 2jor s PHE 60 Ca 0.03 1.05 -0.18 0.00 -0.60 0.00 0.00 56.93 57.23 2jor s PHE 60 Cb 0.04 -2.41 0.23 0.00 0.51 0.00 0.00 43.02 41.39 2jor s PHE 60 CO -0.10 0.16 0.49 -2.30 0.70 0.00 0.00 175.22 174.18 2jor n PRO 61 N -0.31 -2.86 -2.52 0.24 -0.01 -1.26 -4.30 135.00 123.98 2jor n PRO 61 Ca 0.02 -0.84 -0.06 0.00 -0.01 0.00 0.00 63.50 62.62 2jor n PRO 61 Cb 0.53 -1.77 0.03 0.00 -0.01 0.00 0.00 33.50 32.28 2jor n PRO 61 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 175.50 175.94 2jor n SER 62 N -3.21 -2.31 -2.69 2.55 2.88 -1.26 -4.98 113.62 104.60 2jor n SER 62 Ca 0.06 -0.18 -0.06 0.00 -1.33 0.00 0.00 58.87 57.35 2jor n SER 62 Cb 0.52 -1.90 0.08 0.00 -0.75 0.00 0.00 64.21 62.16 2jor n SER 62 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 2jor n ARG 63 N -1.93 0.78 -2.99 -1.46 0.63 -1.26 -5.05 116.66 105.37 2jor n ARG 63 Ca -0.07 -1.42 -0.04 0.00 -0.92 0.00 0.00 57.85 55.40 2jor n ARG 63 Cb 0.54 -0.22 0.00 0.00 0.45 0.00 0.00 32.46 33.24 2jor n ARG 63 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2jor n GLY 64 N -0.29 -1.93 7.00 5.14 0.00 -1.26 -4.64 105.19 109.21 2jor n GLY 64 Ca -0.08 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.34 2jor n GLY 64 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2jor n ASN 65 N 0.79 -2.69 -0.22 1.61 2.85 -1.26 -4.62 115.26 111.71 2jor n ASN 65 Ca 0.00 0.00 0.01 0.00 -0.11 0.00 0.00 54.58 54.48 2jor n ASN 65 Cb 0.30 0.00 0.01 0.00 1.24 0.00 0.00 39.78 41.33 2jor n ASN 65 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2jor n LEU 66 N 0.00 0.36 -4.52 1.20 -0.00 -1.26 -4.83 117.00 107.95 2jor n LEU 66 Ca 0.00 -0.85 -0.53 0.00 -0.00 0.00 0.00 56.01 54.63 2jor n LEU 66 Cb 0.00 -0.04 -0.06 0.00 -0.00 0.00 0.00 43.42 43.33 2jor n LEU 66 CO 0.00 0.21 0.57 0.47 -0.00 0.00 0.00 177.39 178.64 2jor n ASP 67 N -0.16 0.45 0.04 1.45 9.92 -1.26 -4.40 116.55 122.59 2jor n ASP 67 Ca 0.01 1.14 0.00 0.00 -0.53 0.00 0.00 54.79 55.42 2jor n ASP 67 Cb 0.58 -1.06 0.00 0.00 -0.64 0.00 0.00 41.12 40.00 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 1.89 -0.54 -3.04 -2.24 8.00 -1.26 -4.98 116.55 114.38 2jor n ASP 68 Ca 0.18 0.15 0.04 0.00 0.71 0.00 0.00 54.79 55.88 2jor n ASP 68 Cb 0.18 0.76 0.00 0.00 -0.02 0.00 0.00 41.12 42.04 2jor n ASP 68 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 2jor s PHE 69 N -1.20 -0.48 0.00 1.24 5.36 -1.26 -5.03 117.98 116.61 2jor s PHE 69 Ca 0.00 0.21 0.00 0.00 -0.96 0.00 0.00 56.93 56.18 2jor s PHE 69 Cb 0.00 0.08 0.00 0.00 -0.34 0.00 0.00 43.02 42.76 2jor s PHE 69 CO 0.00 -0.29 0.00 1.97 -1.46 0.00 0.00 175.22 175.44 2jor n PHE 70 N 4.67 -0.51 -0.70 10.12 -1.74 -1.26 -4.05 117.46 123.99 2jor n PHE 70 Ca 0.08 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.97 2jor n PHE 70 Cb 0.59 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.59 2jor n PHE 70 CO 0.00 0.00 0.00 1.58 -0.56 0.00 0.00 176.76 177.78 2jor n HIS 71 N -0.51 0.00 -1.52 2.97 -0.00 -1.25 -4.83 115.22 110.07 2jor n HIS 71 Ca 0.00 0.00 -0.38 0.00 0.46 0.00 0.00 57.72 57.80 2jor n HIS 71 Cb 0.00 -1.27 -0.11 0.00 -0.12 0.00 0.00 29.99 28.49 2jor n HIS 71 CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 2jor n ARG 72 N -1.51 0.38 -3.55 1.57 5.12 -1.26 -4.86 116.66 112.56 2jor n ARG 72 Ca 0.00 -0.02 -0.41 0.00 -1.93 0.00 0.00 57.85 55.49 2jor n ARG 72 Cb 0.09 -2.23 -0.11 0.00 -1.16 0.00 0.00 32.46 29.06 2jor n ARG 72 CO 0.00 0.00 0.00 0.16 -1.93 0.00 0.00 177.63 175.86 2jor s ASP 73 N 10.00 5.88 0.27 0.55 -4.77 -1.26 -3.66 116.67 123.68 2jor s ASP 73 Ca 1.22 -0.88 0.00 0.00 -3.30 0.00 0.00 52.55 49.58 2jor s ASP 73 Cb -0.84 -2.08 0.00 0.00 -1.09 0.00 0.00 42.92 38.91 2jor s ASP 73 CO 0.40 -0.38 0.00 0.29 0.70 0.00 0.00 175.17 176.18 2jor n LYS 74 N 5.06 -5.57 -2.83 2.11 5.02 -1.26 -5.02 118.16 115.67 2jor n LYS 74 Ca -0.12 3.96 -0.09 0.00 -2.02 0.00 0.00 58.31 60.04 2jor n LYS 74 Cb 0.47 -4.31 0.02 0.00 -0.02 0.00 0.00 35.03 31.18 2jor n LYS 74 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2jor n ASP 75 N 1.51 -2.73 -0.03 4.39 2.03 -1.26 -4.99 116.55 115.46 2jor n ASP 75 Ca 0.00 -3.06 -0.15 0.00 0.52 0.00 0.00 54.79 52.10 2jor n ASP 75 Cb 0.00 1.47 -0.12 0.00 -0.72 0.00 0.00 41.12 41.76 2jor n ASP 75 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 2jor h ASP 76 N 4.47 0.20 0.00 1.67 5.19 -1.95 -3.45 116.42 122.55 2jor h ASP 76 Ca -0.03 -0.80 0.00 0.00 -0.62 0.00 0.00 57.03 55.58 2jor h ASP 76 Cb 1.04 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 40.49 2jor h ASP 76 CO 0.22 0.98 0.00 0.49 -3.12 0.00 0.00 179.24 177.81 2jor n PHE 77 N -4.51 0.00 0.00 4.55 3.72 -1.26 -5.09 117.46 114.87 2jor n PHE 77 Ca -0.10 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.30 2jor n PHE 77 Cb 0.51 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.05 2jor n PHE 77 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 2jor n PHE 78 N -0.10 0.00 0.00 1.38 7.35 -1.26 -5.32 117.46 119.51 2jor n PHE 78 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 2jor n PHE 78 Cb 0.00 0.00 0.00 0.00 0.35 0.00 0.00 39.48 39.83 2jor n PHE 78 CO 0.00 0.00 0.00 -2.37 -0.76 0.00 0.00 176.76 173.63