#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jor n ILE 2 N 0.00 0.00 0.00 3.17 -5.35 -1.26 -4.41 119.36 111.51 2jor n ILE 2 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 2jor n ILE 2 Cb 0.00 -0.51 0.00 0.00 -1.74 0.00 0.00 39.64 37.39 2jor n ILE 2 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 2jor n ASP 3 N -1.31 0.00 -3.70 7.28 2.03 -1.26 -4.66 116.55 114.93 2jor n ASP 3 Ca 0.00 0.00 -0.03 0.00 0.52 0.00 0.00 54.79 55.28 2jor n ASP 3 Cb 0.00 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.39 2jor n ASP 3 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 2jor s ASN 4 N -4.00 -0.19 -0.27 1.67 2.47 -1.26 -5.14 114.94 108.22 2jor s ASN 4 Ca 0.00 -0.31 -0.26 0.00 0.42 0.00 0.00 52.86 52.72 2jor s ASN 4 Cb 0.00 0.43 0.14 0.00 -1.45 0.00 0.00 41.25 40.36 2jor s ASN 4 CO 0.00 -0.77 1.12 -0.70 -3.72 0.00 0.00 177.10 173.02 2jor s GLU 5 N -3.14 0.41 -1.47 0.43 2.56 -1.26 -4.93 118.70 111.31 2jor s GLU 5 Ca 0.11 0.43 0.00 0.00 0.00 0.00 0.00 54.97 55.51 2jor s GLU 5 Cb -0.01 0.20 0.00 0.00 2.00 0.00 0.00 34.13 36.33 2jor s GLU 5 CO -0.00 -0.06 0.00 1.17 -0.56 0.00 0.00 175.26 175.81 2jor n LYS 6 N 1.88 -1.87 0.00 4.30 3.00 -1.26 -0.99 118.16 123.23 2jor n LYS 6 Ca -0.11 0.83 0.00 0.00 -0.00 0.00 0.00 58.31 59.03 2jor n LYS 6 Cb 0.56 -5.41 0.00 0.00 0.00 0.00 0.00 35.03 30.18 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 -3.44 0.00 -3.70 3.15 0.31 -1.26 -3.96 118.33 109.43 2jor n VAL 7 Ca -0.19 0.00 -0.25 0.00 -0.01 0.00 0.00 64.34 63.88 2jor n VAL 7 Cb 0.63 0.00 0.01 0.00 -0.91 0.00 0.00 33.84 33.57 2jor n VAL 7 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2jor n THR 8 N -1.97 -4.86 -1.68 2.52 -2.24 -0.16 -4.64 114.28 101.25 2jor n THR 8 Ca 0.00 -0.33 -0.17 0.00 -2.27 0.00 0.00 64.05 61.29 2jor n THR 8 Cb 0.00 -3.77 -0.09 0.00 -2.10 0.00 0.00 70.33 64.37 2jor n THR 8 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2jor s SER 9 N -3.17 3.83 1.34 3.42 0.15 -1.25 -4.73 113.70 113.30 2jor s SER 9 Ca 0.17 -0.77 0.00 0.00 0.70 0.00 0.00 55.95 56.05 2jor s SER 9 Cb -0.08 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.65 2jor s SER 9 CO 0.88 -4.23 0.00 0.61 1.20 0.00 0.00 173.24 171.70 2jor n GLY 10 N 6.33 2.73 7.00 9.45 0.00 -1.26 -4.94 105.19 124.50 2jor n GLY 10 Ca 0.43 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2jor n GLY 10 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2jor n HIS 11 N 13.59 -0.58 0.00 1.61 -0.00 -1.26 -4.67 115.22 123.92 2jor n HIS 11 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2jor n HIS 11 Cb 0.00 0.12 0.00 0.00 -0.00 0.00 0.00 29.99 30.11 2jor n HIS 11 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 176.34 178.75 2jor n THR 12 N 0.00 0.00 -3.26 1.59 -1.04 -1.26 -4.01 114.28 106.30 2jor n THR 12 Ca 0.00 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 61.96 2jor n THR 12 Cb 0.00 0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 68.47 2jor n THR 12 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2jor s THR 13 N 0.00 -0.75 -0.16 12.58 2.01 -1.26 -5.13 115.64 122.93 2jor s THR 13 Ca 0.00 -0.18 -0.07 0.00 0.31 0.00 0.00 61.69 61.76 2jor s THR 13 Cb 0.00 -0.98 0.07 0.00 0.01 0.00 0.00 72.50 71.60 2jor s THR 13 CO 0.00 -0.17 0.34 0.42 -0.69 0.00 0.00 174.62 174.52 2jor s THR 14 N 2.64 -0.35 0.17 -0.82 -4.23 -1.26 -5.16 115.64 106.64 2jor s THR 14 Ca 0.11 0.18 0.06 0.00 -1.18 0.00 0.00 61.69 60.86 2jor s THR 14 Cb -0.12 -0.54 -0.04 0.00 1.34 0.00 0.00 72.50 73.13 2jor s THR 14 CO -0.27 0.08 -0.12 0.28 -0.54 0.00 0.00 174.62 174.04 2jor s THR 15 N 2.08 1.43 0.03 3.99 -1.32 -1.26 -4.98 115.64 115.61 2jor s THR 15 Ca -0.04 -2.10 -0.01 0.00 -1.21 0.00 0.00 61.69 58.33 2jor s THR 15 Cb -0.11 -1.91 -0.02 0.00 -1.51 0.00 0.00 72.50 68.95 2jor s THR 15 CO -0.11 -0.65 -0.00 0.00 -2.21 0.00 0.00 174.62 171.65 2jor s ARG 16 N -3.61 0.46 0.00 7.08 1.70 -1.26 -4.90 118.95 118.43 2jor s ARG 16 Ca 0.19 -0.83 0.00 0.00 -0.47 0.00 0.00 55.73 54.61 2jor s ARG 16 Cb 0.00 0.17 0.00 0.00 -0.57 0.00 0.00 34.95 34.55 2jor s ARG 16 CO 0.03 -0.09 0.00 -2.13 -1.08 0.00 0.00 175.30 172.04 2jor n ARG 17 N 0.95 0.00 -0.22 3.89 0.63 -1.26 -4.82 116.66 115.85 2jor n ARG 17 Ca -0.20 0.00 0.17 0.00 -0.92 0.00 0.00 57.85 56.90 2jor n ARG 17 Cb 0.58 0.00 0.49 0.00 0.45 0.00 0.00 32.46 33.98 2jor n ARG 17 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 2jor h SER 18 N 0.00 0.43 -1.76 6.15 4.64 -1.90 -0.76 113.55 120.35 2jor h SER 18 Ca 0.00 0.03 -0.62 0.00 -0.47 0.00 0.00 61.79 60.73 2jor h SER 18 Cb 0.00 -0.05 -0.13 0.00 -0.31 0.00 0.00 62.40 61.91 2jor h SER 18 CO 0.00 0.20 -0.61 0.00 -0.87 0.00 0.00 176.83 175.55 2jor s SER 20 N -3.69 6.81 -0.19 0.00 0.15 -1.26 -4.27 113.70 111.26 2jor s SER 20 Ca 0.35 2.11 -0.05 0.00 0.70 0.00 0.00 55.95 59.06 2jor s SER 20 Cb 0.09 -2.55 0.07 0.00 -1.71 0.00 0.00 66.02 61.92 2jor s SER 20 CO 0.18 -0.78 0.10 -0.54 1.20 0.00 0.00 173.24 173.40 2jor s LYS 21 N 2.88 0.09 -0.17 5.44 -0.14 -1.11 -4.18 119.74 122.54 2jor s LYS 21 Ca 0.65 -0.14 0.01 0.00 -1.36 0.00 0.00 55.97 55.13 2jor s LYS 21 Cb -0.31 -1.70 0.02 0.00 -1.68 0.00 0.00 37.83 34.16 2jor s LYS 21 CO 0.26 -0.73 -0.16 0.08 -0.76 0.00 0.00 175.35 174.04 2jor s VAL 22 N 2.14 1.82 -0.24 3.17 1.01 -1.26 -2.30 120.40 124.74 2jor s VAL 22 Ca 0.03 -0.84 0.02 0.00 0.00 0.00 0.00 61.98 61.19 2jor s VAL 22 Cb -0.16 -1.70 0.06 0.00 0.00 0.00 0.00 36.38 34.58 2jor s VAL 22 CO -0.14 0.45 -0.08 -0.63 0.00 0.00 0.00 175.10 174.71 2jor s ILE 23 N 1.38 1.80 -0.20 2.22 1.09 -1.07 -4.65 121.20 121.76 2jor s ILE 23 Ca 0.04 -1.36 0.01 0.00 -1.10 0.00 0.00 60.65 58.24 2jor s ILE 23 Cb -0.13 -1.98 0.05 0.00 -1.06 0.00 0.00 42.46 39.33 2jor s ILE 23 CO -0.11 -0.04 -0.08 -0.89 -0.10 0.00 0.00 174.94 173.72 2jor s THR 24 N 1.28 1.55 -0.24 2.92 2.01 -1.25 -1.29 115.64 120.61 2jor s THR 24 Ca -0.06 -1.02 0.02 0.00 0.31 0.00 0.00 61.69 60.94 2jor s THR 24 Cb -0.19 -1.69 0.05 0.00 0.01 0.00 0.00 72.50 70.69 2jor s THR 24 CO -0.06 0.10 -0.11 -0.54 -0.69 0.00 0.00 174.62 173.32 2jor s LYS 25 N 1.42 2.23 -0.19 4.92 1.02 0.71 -4.93 119.74 124.92 2jor s LYS 25 Ca -0.02 -1.22 -0.03 0.00 0.02 0.00 0.00 55.97 54.71 2jor s LYS 25 Cb -0.17 -2.79 -0.02 0.00 -0.52 0.00 0.00 37.83 34.34 2jor s LYS 25 CO -0.08 -0.53 -0.05 0.99 -0.92 0.00 0.00 175.35 174.77 2jor s THR 26 N 1.17 3.51 -0.18 2.17 2.01 -1.26 -0.77 115.64 122.30 2jor s THR 26 Ca -0.07 -0.46 -0.01 0.00 0.31 0.00 0.00 61.69 61.46 2jor s THR 26 Cb -0.19 -2.57 0.05 0.00 0.01 0.00 0.00 72.50 69.80 2jor s THR 26 CO -0.06 0.45 -0.02 0.54 -0.69 0.00 0.00 174.62 174.83 2jor s VAL 27 N 1.05 0.96 -0.24 3.82 0.11 -0.94 -4.69 120.40 120.47 2jor s VAL 27 Ca 0.01 -0.64 -0.09 0.00 -2.93 0.00 0.00 61.98 58.33 2jor s VAL 27 Cb -0.15 -1.24 -0.04 0.00 -1.53 0.00 0.00 36.38 33.43 2jor s VAL 27 CO 0.00 0.02 0.12 0.42 -3.33 0.00 0.00 175.10 172.32 2jor s THR 28 N 1.68 4.93 -0.28 5.04 -4.23 -1.26 -2.83 115.64 118.68 2jor s THR 28 Ca -0.00 0.03 -0.09 0.00 -1.18 0.00 0.00 61.69 60.45 2jor s THR 28 Cb -0.16 -3.29 -0.02 0.00 1.34 0.00 0.00 72.50 70.37 2jor s THR 28 CO -0.07 0.35 0.12 0.20 -0.54 0.00 0.00 174.62 174.68 2jor s ASN 29 N 1.17 5.40 0.30 3.99 -0.87 0.32 -4.94 114.94 120.32 2jor s ASN 29 Ca 0.06 -0.36 0.09 0.00 -1.57 0.00 0.00 52.86 51.08 2jor s ASN 29 Cb -0.14 -1.98 0.47 0.00 -0.02 0.00 0.00 41.25 39.58 2jor s ASN 29 CO 0.05 -0.12 1.10 0.00 -2.57 0.00 0.00 177.10 175.56 2jor n ALA 30 N 4.96 0.44 1.02 0.60 0.00 -1.26 0.28 120.51 126.55 2jor n ALA 30 Ca -0.15 0.08 0.10 0.00 0.00 0.00 0.00 53.44 53.47 2jor n ALA 30 Cb 0.50 -0.55 0.52 0.00 0.00 0.00 0.00 19.45 19.92 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 -1.90 0.00 0.00 0.00 9.92 -1.26 -4.80 116.55 118.51 2jor n ASP 31 Ca -0.01 -0.19 0.00 0.00 -0.53 0.00 0.00 54.79 54.06 2jor n ASP 31 Cb 0.43 -0.19 0.00 0.00 -0.64 0.00 0.00 41.12 40.72 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 0.32 0.80 3.89 0.44 0.00 0.14 -5.09 105.19 105.69 2jor n GLY 32 Ca 0.11 0.00 -0.35 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 -0.79 3.48 -0.21 1.61 0.52 -1.06 -4.97 118.95 117.53 2jor s ARG 33 Ca 0.00 -0.18 -0.04 0.00 -0.52 0.00 0.00 55.73 54.99 2jor s ARG 33 Cb 0.00 -3.14 0.11 0.00 0.52 0.00 0.00 34.95 32.44 2jor s ARG 33 CO 0.00 0.71 0.32 0.95 0.02 0.00 0.00 175.30 177.31 2jor s THR 34 N -1.19 -0.51 -0.04 0.02 -4.23 -1.26 -0.52 115.64 107.91 2jor s THR 34 Ca 0.22 0.00 0.06 0.00 -1.18 0.00 0.00 61.69 60.80 2jor s THR 34 Cb -0.13 -0.70 -0.02 0.00 1.34 0.00 0.00 72.50 73.00 2jor s THR 34 CO 0.12 -0.08 -0.24 -1.61 -0.54 0.00 0.00 174.62 172.27 2jor s GLU 35 N 2.48 2.36 -0.15 3.99 8.01 -1.13 -5.03 118.70 129.23 2jor s GLU 35 Ca 0.08 -0.88 -0.02 0.00 0.01 0.00 0.00 54.97 54.16 2jor s GLU 35 Cb -0.15 -2.15 0.04 0.00 -4.31 0.00 0.00 34.13 27.57 2jor s GLU 35 CO -0.13 0.50 -0.00 0.95 0.01 0.00 0.00 175.26 176.58 2jor s THR 36 N -0.44 0.68 -0.31 3.63 -4.23 -1.26 -2.21 115.64 111.50 2jor s THR 36 Ca 0.05 -0.39 -0.19 0.00 -1.18 0.00 0.00 61.69 59.97 2jor s THR 36 Cb -0.12 -0.98 -0.01 0.00 1.34 0.00 0.00 72.50 72.73 2jor s THR 36 CO 0.01 0.04 0.58 -0.89 -0.54 0.00 0.00 174.62 173.82 2jor s THR 37 N 1.81 4.98 -0.29 3.99 2.01 0.05 -4.92 115.64 123.28 2jor s THR 37 Ca 0.01 0.75 -0.02 0.00 0.31 0.00 0.00 61.69 62.75 2jor s THR 37 Cb -0.15 -3.96 0.10 0.00 0.01 0.00 0.00 72.50 68.49 2jor s THR 37 CO -0.07 -0.12 0.10 -0.75 -0.69 0.00 0.00 174.62 173.10 2jor s LYS 38 N 2.51 0.55 -0.46 4.92 2.20 -1.25 -0.20 119.74 128.00 2jor s LYS 38 Ca 0.23 -0.84 0.01 0.00 -0.36 0.00 0.00 55.97 55.01 2jor s LYS 38 Cb -0.15 -1.75 0.12 0.00 -1.51 0.00 0.00 37.83 34.54 2jor s LYS 38 CO 0.12 -0.96 0.22 -1.21 -0.36 0.00 0.00 175.35 173.15 2jor s GLU 39 N 1.79 1.94 -0.28 4.03 0.41 -0.41 -5.01 118.70 121.17 2jor s GLU 39 Ca 0.08 -2.20 -0.09 0.00 -0.41 0.00 0.00 54.97 52.35 2jor s GLU 39 Cb -0.17 -3.42 -0.02 0.00 -1.78 0.00 0.00 34.13 28.73 2jor s GLU 39 CO -0.27 -1.06 0.14 0.08 -0.49 0.00 0.00 175.26 173.65 2jor s VAL 40 N 0.43 4.69 -0.20 2.63 1.01 -1.26 -2.60 120.40 125.10 2jor s VAL 40 Ca 0.13 -0.20 -0.03 0.00 0.00 0.00 0.00 61.98 61.89 2jor s VAL 40 Cb -0.22 -3.29 0.06 0.00 0.00 0.00 0.00 36.38 32.93 2jor s VAL 40 CO -0.04 0.20 0.04 0.68 0.00 0.00 0.00 175.10 175.97 2jor s VAL 41 N 1.65 0.55 -0.16 2.92 -7.23 -0.97 -5.05 120.40 112.11 2jor s VAL 41 Ca 0.06 -0.63 -0.00 0.00 -1.81 0.00 0.00 61.98 59.60 2jor s VAL 41 Cb -0.16 -1.08 0.00 0.00 0.56 0.00 0.00 36.38 35.69 2jor s VAL 41 CO 0.07 -0.25 -0.15 -0.54 -0.31 0.00 0.00 175.10 173.92 2jor s LYS 42 N 1.84 3.21 0.73 4.82 1.02 -1.26 -2.75 119.74 127.34 2jor s LYS 42 Ca -0.00 -0.74 -0.16 0.00 0.02 0.00 0.00 55.97 55.09 2jor s LYS 42 Cb -0.17 -2.66 0.01 0.00 -0.52 0.00 0.00 37.83 34.49 2jor s LYS 42 CO -0.09 -0.03 1.01 -1.13 -0.92 0.00 0.00 175.35 174.18 2jor n SER 43 N 4.20 0.61 0.00 2.83 3.41 -0.29 -4.95 113.62 119.44 2jor n SER 43 Ca -0.19 0.66 0.00 0.00 -0.26 0.00 0.00 58.87 59.08 2jor n SER 43 Cb 0.51 -1.43 0.00 0.00 -0.26 0.00 0.00 64.21 63.04 2jor n SER 43 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2jor n GLU 44 N -2.02 0.00 -0.82 4.33 4.71 -1.26 -4.88 120.64 120.70 2jor n GLU 44 Ca 0.13 0.00 -0.12 0.00 -0.01 0.00 0.00 57.16 57.16 2jor n GLU 44 Cb 0.49 0.00 0.01 0.00 -1.01 0.00 0.00 31.44 30.94 2jor n GLU 44 CO 0.00 0.00 0.00 -3.47 0.09 0.00 0.00 177.13 173.75 2jor n ASP 45 N -1.57 6.09 0.00 1.62 -0.08 -1.26 -4.67 116.55 116.67 2jor n ASP 45 Ca 0.00 -2.85 0.00 0.00 -1.51 0.00 0.00 54.79 50.43 2jor n ASP 45 Cb 0.00 -1.11 0.00 0.00 2.34 0.00 0.00 41.12 42.35 2jor n ASP 45 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2jor n GLY 46 N 0.82 0.70 0.99 0.27 0.00 -1.26 -5.11 105.19 101.60 2jor n GLY 46 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 2jor n GLY 46 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2jor n SER 47 N 0.00 -0.88 -3.63 1.61 3.41 -1.26 -5.16 113.62 107.71 2jor n SER 47 Ca 0.00 0.30 -0.05 0.00 -0.26 0.00 0.00 58.87 58.86 2jor n SER 47 Cb 0.00 1.06 -0.06 0.00 -0.26 0.00 0.00 64.21 64.95 2jor n SER 47 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2jor s ASP 48 N -1.42 -0.17 0.02 4.04 2.15 -1.26 -5.11 116.67 114.93 2jor s ASP 48 Ca 0.00 0.25 0.01 0.00 0.43 0.00 0.00 52.55 53.25 2jor s ASP 48 Cb 0.00 0.23 -0.02 0.00 -0.30 0.00 0.00 42.92 42.84 2jor s ASP 48 CO 0.00 -0.11 -0.05 0.00 -0.17 0.00 0.00 175.17 174.84 2jor n GLY 50 N 1.93 -0.46 3.20 0.00 0.00 -1.26 0.15 105.19 108.74 2jor n GLY 50 Ca -0.20 0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.48 -2.49 0.04 1.61 -0.08 -1.26 -3.53 116.55 108.35 2jor n ASP 51 Ca 0.05 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.33 2jor n ASP 51 Cb 0.51 -2.48 0.00 0.00 2.34 0.00 0.00 41.12 41.49 2jor n ASP 51 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2jor n ALA 52 N 0.90 0.00 -3.10 -1.67 0.00 0.40 -4.98 120.51 112.05 2jor n ALA 52 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 2jor n ALA 52 Cb 0.21 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.66 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 -1.93 -0.48 0.52 0.00 -4.77 0.29 -4.38 116.67 105.92 2jor s ASP 53 Ca 0.00 0.01 -0.21 0.00 -3.30 0.00 0.00 52.55 49.05 2jor s ASP 53 Cb 0.00 1.20 -0.06 0.00 -1.09 0.00 0.00 42.92 42.97 2jor s ASP 53 CO 0.00 -0.08 1.21 0.12 0.70 0.00 0.00 175.17 177.11 2jor s PHE 54 N 2.81 2.63 0.33 2.11 5.36 -1.25 -4.39 117.98 125.58 2jor s PHE 54 Ca 0.25 1.50 0.00 0.00 -0.96 0.00 0.00 56.93 57.72 2jor s PHE 54 Cb -0.02 -3.47 0.00 0.00 -0.34 0.00 0.00 43.02 39.20 2jor s PHE 54 CO -0.22 -1.93 0.00 -3.47 -1.46 0.00 0.00 175.22 168.14 2jor n ASP 55 N -0.94 -6.20 0.16 6.13 -0.08 -1.26 -4.09 116.55 110.27 2jor n ASP 55 Ca 0.10 0.69 0.00 0.00 -1.51 0.00 0.00 54.79 54.07 2jor n ASP 55 Cb 0.48 -3.72 0.00 0.00 2.34 0.00 0.00 41.12 40.22 2jor n ASP 55 CO 0.00 0.00 0.00 1.87 0.12 0.00 0.00 177.20 179.19 2jor n TRP 56 N -3.58 -3.54 -1.79 -0.67 -0.00 -1.26 -4.70 117.44 101.91 2jor n TRP 56 Ca -0.02 0.98 0.00 0.00 -0.00 0.00 0.00 57.50 58.46 2jor n TRP 56 Cb 0.63 2.43 0.00 0.00 -0.00 0.00 0.00 31.31 34.37 2jor n TRP 56 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 177.69 179.27 2jor n HIS 57 N -3.24 -4.75 -3.15 5.87 -0.00 -1.26 -4.24 115.22 104.46 2jor n HIS 57 Ca 0.00 2.49 0.05 0.00 -0.00 0.00 0.00 57.72 60.27 2jor n HIS 57 Cb 0.00 -3.68 -0.01 0.00 -0.00 0.00 0.00 29.99 26.30 2jor n HIS 57 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2jor s HIS 58 N -2.64 -0.64 -0.19 1.57 5.04 -1.26 -4.74 115.29 112.43 2jor s HIS 58 Ca 0.00 0.56 -0.07 0.00 -1.54 0.00 0.00 55.06 54.01 2jor s HIS 58 Cb 0.00 0.18 0.09 0.00 0.04 0.00 0.00 32.58 32.89 2jor s HIS 58 CO 0.00 -0.36 0.42 0.95 -2.34 0.00 0.00 174.74 173.41 2jor s THR 59 N 2.94 -0.54 0.54 0.89 -4.23 -1.26 -2.10 115.64 111.89 2jor s THR 59 Ca 0.09 0.15 -0.17 0.00 -1.18 0.00 0.00 61.69 60.59 2jor s THR 59 Cb -0.08 -0.66 -0.06 0.00 1.34 0.00 0.00 72.50 73.03 2jor s THR 59 CO -0.16 0.06 1.02 -0.36 -0.54 0.00 0.00 174.62 174.64 2jor s PHE 60 N 2.39 3.22 0.66 3.99 0.40 -0.35 -4.86 117.98 123.43 2jor s PHE 60 Ca -0.03 1.50 -0.17 0.00 -0.60 0.00 0.00 56.93 57.63 2jor s PHE 60 Cb -0.11 -2.90 -0.03 0.00 0.51 0.00 0.00 43.02 40.48 2jor s PHE 60 CO -0.13 -0.70 0.87 -2.30 0.70 0.00 0.00 175.22 173.66 2jor n PRO 61 N -1.69 0.64 -0.85 0.24 -0.01 -1.26 -1.16 135.00 130.91 2jor n PRO 61 Ca 0.08 0.26 -0.03 0.00 -0.01 0.00 0.00 63.50 63.80 2jor n PRO 61 Cb 0.53 -2.10 -0.01 0.00 -0.01 0.00 0.00 33.50 31.91 2jor n PRO 61 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 175.50 175.92 2jor n SER 62 N -0.92 -1.19 -3.26 2.55 7.64 -1.26 -4.77 113.62 112.40 2jor n SER 62 Ca 0.13 0.08 -0.04 0.00 1.01 0.00 0.00 58.87 60.04 2jor n SER 62 Cb 0.49 -1.34 -0.04 0.00 -1.01 0.00 0.00 64.21 62.31 2jor n SER 62 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 2jor s ARG 63 N -1.79 0.46 0.58 1.43 3.00 -0.31 -5.15 118.95 117.16 2jor s ARG 63 Ca 0.00 0.36 -0.16 0.00 -1.00 0.00 0.00 55.73 54.93 2jor s ARG 63 Cb 0.00 -0.11 -0.04 0.00 0.00 0.00 0.00 34.95 34.80 2jor s ARG 63 CO 0.00 -0.96 1.05 0.20 0.00 0.00 0.00 175.30 175.59 2jor s GLY 64 N 2.65 2.16 0.00 8.12 0.00 -1.25 -1.21 107.32 117.77 2jor s GLY 64 Ca 0.11 0.39 0.00 0.00 0.00 0.00 0.00 44.72 45.22 2jor s GLY 64 CO -0.27 0.71 0.00 -2.01 0.00 0.00 0.00 173.10 171.53 2jor n ASN 65 N -1.89 0.00 0.05 1.64 4.05 -1.25 -4.79 115.26 113.06 2jor n ASN 65 Ca 0.09 -0.12 0.00 0.00 0.45 0.00 0.00 54.58 54.99 2jor n ASN 65 Cb 0.53 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.54 2jor n ASN 65 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 177.26 174.10 2jor n LEU 66 N 0.00 -0.86 -3.37 1.20 7.94 -0.89 -4.94 117.00 116.07 2jor n LEU 66 Ca 0.00 0.19 -0.16 0.00 -1.11 0.00 0.00 56.01 54.92 2jor n LEU 66 Cb 0.03 1.18 0.08 0.00 0.53 0.00 0.00 43.42 45.25 2jor n LEU 66 CO 0.00 -0.34 0.08 -0.67 -1.11 0.00 0.00 177.39 175.36 2jor n ASP 67 N -2.70 -3.50 -1.40 1.96 2.03 -1.25 -4.67 116.55 107.02 2jor n ASP 67 Ca 0.00 -0.65 0.15 0.00 0.52 0.00 0.00 54.79 54.81 2jor n ASP 67 Cb 0.00 -5.15 -0.08 0.00 -0.72 0.00 0.00 41.12 35.16 2jor n ASP 67 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2jor n ASP 68 N -3.16 -7.32 0.00 1.67 9.92 -1.26 -4.98 116.55 111.42 2jor n ASP 68 Ca -0.22 1.39 0.00 0.00 -0.53 0.00 0.00 54.79 55.43 2jor n ASP 68 Cb 0.65 -4.79 0.00 0.00 -0.64 0.00 0.00 41.12 36.34 2jor n ASP 68 CO 0.00 0.00 0.00 0.33 0.13 0.00 0.00 177.20 177.66 2jor n PHE 69 N -4.18 0.00 -3.06 1.24 7.35 -1.26 -4.92 117.46 112.63 2jor n PHE 69 Ca -0.08 0.00 -0.16 0.00 -0.76 0.00 0.00 57.45 56.44 2jor n PHE 69 Cb 0.63 0.02 0.02 0.00 0.35 0.00 0.00 39.48 40.49 2jor n PHE 69 CO 0.00 0.00 0.00 1.19 -0.76 0.00 0.00 176.76 177.19 2jor n PHE 70 N 0.00 -3.08 -0.01 -5.13 3.72 -1.26 -4.93 117.46 106.77 2jor n PHE 70 Ca 0.00 1.27 -0.12 0.00 -0.05 0.00 0.00 57.45 58.55 2jor n PHE 70 Cb 0.09 -3.17 -0.10 0.00 -0.94 0.00 0.00 39.48 35.37 2jor n PHE 70 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 2jor h HIS 71 N 2.26 -0.06 -5.59 1.38 -0.00 -1.90 -3.47 115.15 107.76 2jor h HIS 71 Ca -0.18 -0.00 -0.09 0.00 -0.00 0.00 0.00 60.37 60.10 2jor h HIS 71 Cb 1.02 0.02 0.00 0.00 -0.00 0.00 0.00 27.41 28.45 2jor h HIS 71 CO 0.05 0.56 -0.72 -2.13 -0.00 0.00 0.00 177.93 175.69 2jor n ARG 72 N -4.79 -2.32 -1.30 5.26 0.63 -1.26 -4.73 116.66 108.14 2jor n ARG 72 Ca -0.08 1.99 0.15 0.00 -0.92 0.00 0.00 57.85 58.99 2jor n ARG 72 Cb 0.32 -4.71 -0.07 0.00 0.45 0.00 0.00 32.46 28.45 2jor n ARG 72 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2jor n ASP 73 N -0.14 -6.77 0.00 6.15 9.92 -1.24 -4.90 116.55 119.57 2jor n ASP 73 Ca 0.06 1.14 0.00 0.00 -0.53 0.00 0.00 54.79 55.46 2jor n ASP 73 Cb 0.47 -4.39 0.00 0.00 -0.64 0.00 0.00 41.12 36.57 2jor n ASP 73 CO 0.00 0.00 0.00 2.29 0.13 0.00 0.00 177.20 179.62 2jor n LYS 74 N -4.09 0.00 -3.08 -1.24 2.85 -1.26 -4.75 118.16 106.59 2jor n LYS 74 Ca -0.07 0.00 -0.22 0.00 -1.05 0.00 0.00 58.31 56.97 2jor n LYS 74 Cb 0.60 0.00 0.01 0.00 -0.65 0.00 0.00 35.03 34.99 2jor n LYS 74 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 2jor n ASP 75 N 0.00 -5.00 0.00 -5.58 2.03 -1.26 -4.95 116.55 101.79 2jor n ASP 75 Ca 0.00 -0.27 0.00 0.00 0.52 0.00 0.00 54.79 55.04 2jor n ASP 75 Cb 0.00 -4.09 0.00 0.00 -0.72 0.00 0.00 41.12 36.31 2jor n ASP 75 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2jor n ASP 76 N -2.35 0.00 -2.08 1.67 2.03 -1.26 -4.65 116.55 109.91 2jor n ASP 76 Ca -0.08 0.00 -0.14 0.00 0.52 0.00 0.00 54.79 55.08 2jor n ASP 76 Cb 0.59 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.97 2jor n ASP 76 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 2jor n PHE 77 N 0.00 -0.98 -3.22 -0.67 7.35 -1.26 -4.88 117.46 113.80 2jor n PHE 77 Ca 0.00 0.00 -0.01 0.00 -0.76 0.00 0.00 57.45 56.68 2jor n PHE 77 Cb 0.00 -2.91 -0.03 0.00 0.35 0.00 0.00 39.48 36.90 2jor n PHE 77 CO 0.00 0.00 0.00 0.12 -0.76 0.00 0.00 176.76 176.12 2jor s PHE 78 N -2.53 -1.45 -2.00 -5.13 5.36 -1.26 -5.34 117.98 105.63 2jor s PHE 78 Ca 0.00 0.93 0.05 0.00 -0.96 0.00 0.00 56.93 56.96 2jor s PHE 78 Cb 0.00 0.18 0.31 0.00 -0.34 0.00 0.00 43.02 43.17 2jor s PHE 78 CO 0.00 -0.98 0.78 0.25 -1.46 0.00 0.00 175.22 173.81