#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 2.44 -0.94 2.02 -4.36 -1.26 -4.83 121.20 114.27 2jor s ILE 2 Ca 0.00 0.35 -0.07 0.00 -0.26 0.00 0.00 60.65 60.68 2jor s ILE 2 Cb 0.00 -3.19 -0.10 0.00 1.25 0.00 0.00 42.46 40.42 2jor s ILE 2 CO 0.00 0.02 2.58 -0.90 0.24 0.00 0.00 174.94 176.88 2jor n ASP 3 N -0.49 6.00 -2.91 4.36 5.75 -1.26 -4.43 116.55 123.57 2jor n ASP 3 Ca 0.07 -2.39 0.01 0.00 -0.01 0.00 0.00 54.79 52.47 2jor n ASP 3 Cb 0.45 -1.25 0.00 0.00 -1.03 0.00 0.00 41.12 39.29 2jor n ASP 3 CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 2jor s ASN 4 N 2.71 -0.82 0.47 -1.12 2.47 -1.26 -5.14 114.94 112.25 2jor s ASN 4 Ca 0.52 -0.50 -0.23 0.00 0.42 0.00 0.00 52.86 53.07 2jor s ASN 4 Cb 0.16 1.05 -0.07 0.00 -1.45 0.00 0.00 41.25 40.94 2jor s ASN 4 CO -0.03 -0.08 1.24 -1.61 -3.72 0.00 0.00 177.10 172.90 2jor s GLU 5 N 1.77 3.66 -0.30 0.43 2.02 -1.26 -5.02 118.70 120.01 2jor s GLU 5 Ca 0.17 1.97 -0.16 0.00 0.02 0.00 0.00 54.97 56.97 2jor s GLU 5 Cb 0.01 -2.45 0.17 0.00 0.10 0.00 0.00 34.13 31.95 2jor s GLU 5 CO -0.11 -0.69 1.03 0.21 0.02 0.00 0.00 175.26 175.72 2jor s LYS 6 N -2.63 0.28 -0.12 1.61 2.47 -1.26 -5.17 119.74 114.91 2jor s LYS 6 Ca 0.64 0.60 -0.14 0.00 -1.56 0.00 0.00 55.97 55.51 2jor s LYS 6 Cb -0.34 0.26 0.04 0.00 -1.46 0.00 0.00 37.83 36.33 2jor s LYS 6 CO 0.41 -0.08 0.38 0.14 0.16 0.00 0.00 175.35 176.36 2jor s VAL 7 N 1.97 0.01 0.00 4.02 -7.23 -1.26 -5.10 120.40 112.80 2jor s VAL 7 Ca -0.05 -0.07 0.00 0.00 -1.81 0.00 0.00 61.98 60.05 2jor s VAL 7 Cb -0.05 -0.56 0.00 0.00 0.56 0.00 0.00 36.38 36.33 2jor s VAL 7 CO -0.16 -0.04 0.25 0.41 -0.31 0.00 0.00 175.10 175.26 2jor n THR 8 N 2.60 0.00 0.11 5.32 -1.04 -1.26 -4.57 114.28 115.44 2jor n THR 8 Ca -0.14 0.58 -0.05 0.00 -2.04 0.00 0.00 64.05 62.40 2jor n THR 8 Cb 0.57 -1.23 -0.02 0.00 -1.82 0.00 0.00 70.33 67.83 2jor n THR 8 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 2jor h SER 9 N 0.00 -0.26 0.00 8.00 4.64 -2.05 -3.50 113.55 120.38 2jor h SER 9 Ca 0.00 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2jor h SER 9 Cb 0.00 0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 2jor h SER 9 CO 0.00 -0.06 0.00 0.61 -0.87 0.00 0.00 176.83 176.51 2jor n GLY 10 N 0.37 -0.63 3.46 -0.77 0.00 -1.26 -5.05 105.19 101.32 2jor n GLY 10 Ca -0.04 -0.58 -0.19 0.00 0.00 0.00 0.00 46.02 45.21 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 2.47 0.09 0.06 1.61 8.25 -1.26 -4.66 115.22 121.78 2jor n HIS 11 Ca 0.00 -0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.39 2jor n HIS 11 Cb 0.00 -0.66 -0.11 0.00 1.12 0.00 0.00 29.99 30.34 2jor n HIS 11 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 2jor h THR 12 N 7.05 1.70 0.00 1.59 2.02 -2.00 -3.41 112.91 119.86 2jor h THR 12 Ca 0.03 -3.38 0.00 0.00 0.77 0.00 0.00 66.41 63.84 2jor h THR 12 Cb 1.11 2.82 0.00 0.00 -1.74 0.00 0.00 68.15 70.34 2jor h THR 12 CO 1.53 0.96 0.00 0.35 0.37 0.00 0.00 175.52 178.73 2jor n THR 13 N -3.36 0.00 -1.95 3.16 -2.24 -1.26 -4.86 114.28 103.77 2jor n THR 13 Ca -0.00 0.23 -0.29 0.00 -2.27 0.00 0.00 64.05 61.72 2jor n THR 13 Cb 0.93 -1.08 0.08 0.00 -2.10 0.00 0.00 70.33 68.16 2jor n THR 13 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2jor s THR 14 N 0.00 2.26 -0.11 4.28 -4.23 -1.26 -5.09 115.64 111.48 2jor s THR 14 Ca 0.00 0.02 -0.05 0.00 -1.18 0.00 0.00 61.69 60.48 2jor s THR 14 Cb 0.00 -3.07 0.05 0.00 1.34 0.00 0.00 72.50 70.82 2jor s THR 14 CO 0.00 -0.09 0.25 0.42 -0.54 0.00 0.00 174.62 174.66 2jor s THR 15 N -3.49 -0.10 -0.03 3.99 -4.23 -1.26 -4.83 115.64 105.68 2jor s THR 15 Ca 0.61 0.17 0.03 0.00 -1.18 0.00 0.00 61.69 61.32 2jor s THR 15 Cb -0.11 -0.39 0.00 0.00 1.34 0.00 0.00 72.50 73.34 2jor s THR 15 CO 0.49 0.07 -0.12 -0.13 -0.54 0.00 0.00 174.62 174.39 2jor s ARG 16 N 1.45 1.22 0.00 3.99 0.52 -1.26 -4.79 118.95 120.08 2jor s ARG 16 Ca -0.08 -0.40 0.00 0.00 -0.52 0.00 0.00 55.73 54.74 2jor s ARG 16 Cb -0.11 -1.10 0.00 0.00 0.52 0.00 0.00 34.95 34.26 2jor s ARG 16 CO -0.09 0.15 0.00 -2.13 0.02 0.00 0.00 175.30 173.26 2jor n ARG 17 N 3.26 0.00 0.08 3.54 0.63 -1.21 -4.66 116.66 118.30 2jor n ARG 17 Ca -0.18 0.00 0.15 0.00 -0.92 0.00 0.00 57.85 56.90 2jor n ARG 17 Cb 0.54 0.00 0.32 0.00 0.45 0.00 0.00 32.46 33.77 2jor n ARG 17 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 2jor h SER 18 N 0.00 0.00 -3.91 6.15 0.87 -1.90 0.64 113.55 115.40 2jor h SER 18 Ca 0.00 0.00 -0.47 0.00 -1.23 0.00 0.00 61.79 60.09 2jor h SER 18 Cb 0.00 0.00 -0.19 0.00 -0.44 0.00 0.00 62.40 61.77 2jor h SER 18 CO 0.00 0.00 -0.77 0.00 -0.53 0.00 0.00 176.83 175.53 2jor s SER 20 N -2.45 6.86 -0.09 0.00 0.01 -1.25 -4.23 113.70 112.55 2jor s SER 20 Ca 0.11 1.78 -0.02 0.00 1.31 0.00 0.00 55.95 59.12 2jor s SER 20 Cb -0.06 -2.54 0.03 0.00 0.21 0.00 0.00 66.02 63.67 2jor s SER 20 CO 0.04 -0.82 0.02 -0.54 0.41 0.00 0.00 173.24 172.34 2jor s LYS 21 N 3.67 0.53 -0.18 12.44 -0.14 -1.13 -4.12 119.74 130.82 2jor s LYS 21 Ca 0.59 0.06 0.00 0.00 -1.36 0.00 0.00 55.97 55.26 2jor s LYS 21 Cb -0.24 -1.11 0.04 0.00 -1.68 0.00 0.00 37.83 34.83 2jor s LYS 21 CO 0.18 -0.37 -0.11 0.08 -0.76 0.00 0.00 175.35 174.38 2jor s VAL 22 N 1.98 1.53 -0.29 3.17 1.01 -1.26 -2.59 120.40 123.95 2jor s VAL 22 Ca 0.04 -0.81 0.02 0.00 0.00 0.00 0.00 61.98 61.23 2jor s VAL 22 Cb -0.13 -1.56 0.07 0.00 0.00 0.00 0.00 36.38 34.76 2jor s VAL 22 CO -0.06 0.26 -0.05 -0.63 0.00 0.00 0.00 175.10 174.63 2jor s ILE 23 N 1.47 2.37 -0.11 2.22 1.09 -1.11 -4.75 121.20 122.38 2jor s ILE 23 Ca 0.01 -1.77 -0.00 0.00 -1.10 0.00 0.00 60.65 57.79 2jor s ILE 23 Cb -0.15 -2.48 0.03 0.00 -1.06 0.00 0.00 42.46 38.80 2jor s ILE 23 CO -0.09 -0.19 -0.07 -0.89 -0.10 0.00 0.00 174.94 173.60 2jor s THR 24 N 1.08 1.01 -0.28 2.92 2.01 -1.26 -1.64 115.64 119.48 2jor s THR 24 Ca -0.04 -0.28 0.03 0.00 0.31 0.00 0.00 61.69 61.71 2jor s THR 24 Cb -0.20 -1.04 0.07 0.00 0.01 0.00 0.00 72.50 71.34 2jor s THR 24 CO -0.05 0.36 -0.07 -0.75 -0.69 0.00 0.00 174.62 173.42 2jor s LYS 25 N 1.72 2.13 -0.21 4.92 2.20 0.93 -4.68 119.74 126.75 2jor s LYS 25 Ca 0.05 -1.43 -0.01 0.00 -0.36 0.00 0.00 55.97 54.21 2jor s LYS 25 Cb -0.13 -2.98 0.01 0.00 -1.51 0.00 0.00 37.83 33.23 2jor s LYS 25 CO -0.08 -0.64 -0.12 0.99 -0.36 0.00 0.00 175.35 175.14 2jor s THR 26 N 1.08 2.67 -0.32 3.43 2.01 -1.26 -0.59 115.64 122.66 2jor s THR 26 Ca -0.05 -0.80 -0.02 0.00 0.31 0.00 0.00 61.69 61.13 2jor s THR 26 Cb -0.20 -2.21 0.06 0.00 0.01 0.00 0.00 72.50 70.17 2jor s THR 26 CO -0.05 0.44 0.04 -0.69 -0.69 0.00 0.00 174.62 173.67 2jor s VAL 27 N 1.36 3.01 -0.48 3.82 1.01 -0.92 -4.48 120.40 123.72 2jor s VAL 27 Ca 0.04 -1.56 -0.20 0.00 0.00 0.00 0.00 61.98 60.26 2jor s VAL 27 Cb -0.14 -2.82 0.04 0.00 0.00 0.00 0.00 36.38 33.46 2jor s VAL 27 CO -0.08 -0.24 0.66 -0.89 0.00 0.00 0.00 175.10 174.55 2jor s THR 28 N 1.21 4.81 -0.34 3.92 2.01 -1.26 -2.88 115.64 123.12 2jor s THR 28 Ca -0.02 -0.18 -0.17 0.00 0.31 0.00 0.00 61.69 61.64 2jor s THR 28 Cb -0.20 -4.28 -0.01 0.00 0.01 0.00 0.00 72.50 68.02 2jor s THR 28 CO -0.02 -0.75 0.44 0.21 -0.69 0.00 0.00 174.62 173.81 2jor s ASN 29 N 2.42 6.26 0.00 3.53 3.04 -0.76 -4.91 114.94 124.52 2jor s ASN 29 Ca 0.19 -0.08 0.00 0.00 0.04 0.00 0.00 52.86 53.02 2jor s ASN 29 Cb -0.16 -2.24 0.00 0.00 -1.54 0.00 0.00 41.25 37.31 2jor s ASN 29 CO 0.15 -0.40 0.71 0.00 -3.04 0.00 0.00 177.10 174.52 2jor n ALA 30 N 5.56 0.45 0.87 1.71 0.00 -1.26 -1.23 120.51 126.61 2jor n ALA 30 Ca -0.07 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.42 2jor n ALA 30 Cb 0.49 -0.45 0.30 0.00 0.00 0.00 0.00 19.45 19.79 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 -1.21 0.00 0.00 0.00 9.92 -1.26 -4.75 116.55 119.26 2jor n ASP 31 Ca 0.00 -0.55 0.00 0.00 -0.53 0.00 0.00 54.79 53.71 2jor n ASP 31 Cb 0.27 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.75 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 -0.12 0.84 3.15 0.44 0.00 -0.37 -5.07 105.19 104.06 2jor n GLY 32 Ca 0.08 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.98 2jor n GLY 32 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2jor s ARG 33 N -0.78 0.78 -0.17 1.61 1.04 -1.14 -5.06 118.95 115.23 2jor s ARG 33 Ca 0.00 -1.22 -0.25 0.00 -1.04 0.00 0.00 55.73 53.22 2jor s ARG 33 Cb 0.00 -0.23 0.06 0.00 -2.04 0.00 0.00 34.95 32.74 2jor s ARG 33 CO 0.00 -0.00 0.65 -0.08 -0.04 0.00 0.00 175.30 175.82 2jor s THR 34 N -3.16 0.00 0.02 4.99 -1.32 -1.26 -1.82 115.64 113.10 2jor s THR 34 Ca 0.07 -0.03 0.04 0.00 -1.21 0.00 0.00 61.69 60.57 2jor s THR 34 Cb 0.02 -0.93 -0.03 0.00 -1.51 0.00 0.00 72.50 70.05 2jor s THR 34 CO -0.04 -0.02 -0.09 -1.61 -2.21 0.00 0.00 174.62 170.66 2jor s GLU 35 N -0.27 2.42 -0.19 7.08 0.41 -1.14 -5.00 118.70 122.01 2jor s GLU 35 Ca -0.05 -0.80 -0.02 0.00 -0.41 0.00 0.00 54.97 53.69 2jor s GLU 35 Cb -0.03 -2.42 0.05 0.00 -1.78 0.00 0.00 34.13 29.95 2jor s GLU 35 CO 0.04 0.58 0.01 0.99 -0.49 0.00 0.00 175.26 176.39 2jor s THR 36 N -1.00 0.74 -0.33 3.63 2.01 -1.26 -2.16 115.64 117.27 2jor s THR 36 Ca 0.17 -0.61 -0.16 0.00 0.31 0.00 0.00 61.69 61.40 2jor s THR 36 Cb -0.11 -1.14 -0.01 0.00 0.01 0.00 0.00 72.50 71.25 2jor s THR 36 CO 0.08 -0.11 0.43 -0.89 -0.69 0.00 0.00 174.62 173.44 2jor s THR 37 N 1.77 5.11 0.08 -0.82 2.01 0.24 -4.95 115.64 119.08 2jor s THR 37 Ca -0.01 0.29 0.06 0.00 0.31 0.00 0.00 61.69 62.34 2jor s THR 37 Cb -0.17 -3.85 -0.03 0.00 0.01 0.00 0.00 72.50 68.46 2jor s THR 37 CO -0.07 -0.09 -0.15 -1.59 -0.69 0.00 0.00 174.62 172.03 2jor s LYS 38 N 2.18 0.90 -0.42 4.92 -2.85 -1.26 -0.05 119.74 123.17 2jor s LYS 38 Ca 0.15 -1.04 0.03 0.00 -1.00 0.00 0.00 55.97 54.11 2jor s LYS 38 Cb -0.16 -0.93 0.19 0.00 -2.06 0.00 0.00 37.83 34.87 2jor s LYS 38 CO 0.12 0.20 0.79 -2.00 0.10 0.00 0.00 175.35 174.57 2jor s GLU 39 N -1.93 0.71 -0.30 1.78 2.56 -0.65 -4.98 118.70 115.89 2jor s GLU 39 Ca 0.01 -0.46 -0.12 0.00 0.00 0.00 0.00 54.97 54.40 2jor s GLU 39 Cb -0.09 0.03 -0.04 0.00 2.00 0.00 0.00 34.13 36.02 2jor s GLU 39 CO 0.03 -0.95 0.21 0.08 -0.56 0.00 0.00 175.26 174.06 2jor s VAL 40 N 1.46 5.30 -0.22 3.70 1.01 -1.26 -2.75 120.40 127.64 2jor s VAL 40 Ca 0.21 0.07 -0.02 0.00 0.00 0.00 0.00 61.98 62.24 2jor s VAL 40 Cb 0.01 -3.58 0.07 0.00 0.00 0.00 0.00 36.38 32.87 2jor s VAL 40 CO -0.08 0.18 0.05 0.68 0.00 0.00 0.00 175.10 175.92 2jor s VAL 41 N 1.75 0.59 -0.08 2.92 -7.23 -1.07 -5.06 120.40 112.23 2jor s VAL 41 Ca 0.07 -0.74 0.05 0.00 -1.81 0.00 0.00 61.98 59.55 2jor s VAL 41 Cb -0.16 -1.17 -0.01 0.00 0.56 0.00 0.00 36.38 35.60 2jor s VAL 41 CO 0.11 -0.31 -0.23 -0.54 -0.31 0.00 0.00 175.10 173.82 2jor s LYS 42 N 1.81 2.79 -0.92 4.82 1.02 -1.26 -2.85 119.74 125.15 2jor s LYS 42 Ca 0.01 -0.87 -0.27 0.00 0.02 0.00 0.00 55.97 54.86 2jor s LYS 42 Cb -0.17 -2.26 -0.21 0.00 -0.52 0.00 0.00 37.83 34.67 2jor s LYS 42 CO -0.12 0.31 2.44 0.45 -0.92 0.00 0.00 175.35 177.52 2jor n SER 43 N 3.15 0.17 0.00 2.83 2.88 0.22 -4.69 113.62 118.19 2jor n SER 43 Ca -0.18 0.13 0.16 0.00 -1.33 0.00 0.00 58.87 57.64 2jor n SER 43 Cb 0.52 -0.82 0.91 0.00 -0.75 0.00 0.00 64.21 64.08 2jor n SER 43 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2jor n GLU 44 N 7.63 0.91 -2.69 -1.46 1.02 -1.26 -4.05 120.64 120.74 2jor n GLU 44 Ca 0.61 0.00 -0.06 0.00 -0.02 0.00 0.00 57.16 57.69 2jor n GLU 44 Cb 0.03 -1.50 0.08 0.00 -0.02 0.00 0.00 31.44 30.03 2jor n GLU 44 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2jor n ASP 45 N -1.04 -1.70 0.00 1.62 8.00 -1.26 -5.06 116.55 117.12 2jor n ASP 45 Ca 0.22 -2.46 0.00 0.00 0.71 0.00 0.00 54.79 53.26 2jor n ASP 45 Cb 0.13 1.28 0.00 0.00 -0.02 0.00 0.00 41.12 42.50 2jor n ASP 45 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jor n GLY 46 N -0.11 -1.98 3.86 0.44 0.00 -1.26 -5.03 105.19 101.11 2jor n GLY 46 Ca -0.07 0.63 -0.27 0.00 0.00 0.00 0.00 46.02 46.31 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 -0.73 -3.46 -2.96 1.61 2.88 -1.25 -4.91 113.62 104.79 2jor n SER 47 Ca 0.00 -0.81 -0.15 0.00 -1.33 0.00 0.00 58.87 56.58 2jor n SER 47 Cb 0.00 -3.88 -0.00 0.00 -0.75 0.00 0.00 64.21 59.58 2jor n SER 47 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2jor n ASP 48 N -2.91 -1.37 -4.02 -3.46 2.03 -1.25 -4.69 116.55 100.88 2jor n ASP 48 Ca -0.08 -3.05 -0.19 0.00 0.52 0.00 0.00 54.79 51.99 2jor n ASP 48 Cb 0.58 0.66 -0.15 0.00 -0.72 0.00 0.00 41.12 41.49 2jor n ASP 48 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jor n GLY 50 N 2.90 -1.89 0.00 0.00 0.00 -1.26 -1.96 105.19 102.98 2jor n GLY 50 Ca -0.14 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.23 2jor n GLY 50 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2jor n ASP 51 N 0.51 0.00 0.00 1.61 5.68 -1.19 -4.58 116.55 118.59 2jor n ASP 51 Ca 0.00 -1.07 0.00 0.00 -0.50 0.00 0.00 54.79 53.22 2jor n ASP 51 Cb 0.00 -0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 2jor n ASP 51 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2jor n ALA 52 N -0.50 0.00 0.00 2.12 0.00 -1.24 -5.00 120.51 115.89 2jor n ALA 52 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2jor n ALA 52 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2jor n ALA 52 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2jor n ASP 53 N -0.90 0.00 -0.01 0.00 5.68 -0.83 -2.44 116.55 118.05 2jor n ASP 53 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 2jor n ASP 53 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 2jor n ASP 53 CO 0.00 0.00 0.00 0.33 -1.33 0.00 0.00 177.20 176.20 2jor n PHE 54 N 3.30 -0.22 0.00 2.11 7.35 -1.26 -4.64 117.46 124.10 2jor n PHE 54 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 2jor n PHE 54 Cb 0.00 0.04 0.00 0.00 0.35 0.00 0.00 39.48 39.87 2jor n PHE 54 CO 0.00 0.00 0.00 -3.47 -0.76 0.00 0.00 176.76 172.53 2jor n ASP 55 N -0.51 0.00 -2.08 -2.13 2.03 -1.26 -3.88 116.55 108.72 2jor n ASP 55 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2jor n ASP 55 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 2jor n ASP 55 CO 0.00 0.00 0.00 0.79 -1.92 0.00 0.00 177.20 176.07 2jor n TRP 56 N -1.08 -4.79 0.00 -0.67 7.02 -1.26 -4.49 117.44 112.17 2jor n TRP 56 Ca 0.00 2.88 0.00 0.00 -1.02 0.00 0.00 57.50 59.36 2jor n TRP 56 Cb 0.00 -3.51 0.00 0.00 -2.42 0.00 0.00 31.31 25.38 2jor n TRP 56 CO 0.00 0.00 0.00 -2.39 -2.02 0.00 0.00 177.69 173.28 2jor n HIS 57 N 1.92 0.00 0.00 -5.99 1.44 -1.26 -4.71 115.22 106.62 2jor n HIS 57 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 2jor n HIS 57 Cb 0.00 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.11 2jor n HIS 57 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 2jor n HIS 58 N 0.00 -0.01 -3.63 -1.40 -0.00 -1.26 -4.65 115.22 104.27 2jor n HIS 58 Ca 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 57.72 57.58 2jor n HIS 58 Cb 0.00 0.03 -0.07 0.00 -0.00 0.00 0.00 29.99 29.95 2jor n HIS 58 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.34 177.33 2jor s THR 59 N -0.07 0.00 0.35 1.59 2.01 -1.26 -4.48 115.64 113.77 2jor s THR 59 Ca 0.00 0.00 -0.11 0.00 0.31 0.00 0.00 61.69 61.89 2jor s THR 59 Cb 0.00 -1.00 -0.07 0.00 0.01 0.00 0.00 72.50 71.44 2jor s THR 59 CO 0.00 0.00 0.71 0.72 -0.69 0.00 0.00 174.62 175.36 2jor s PHE 60 N 0.41 3.44 -0.93 4.92 -0.71 -1.26 -4.95 117.98 118.89 2jor s PHE 60 Ca -0.00 1.03 -0.25 0.00 -1.04 0.00 0.00 56.93 56.67 2jor s PHE 60 Cb -0.05 -2.41 -0.10 0.00 -1.21 0.00 0.00 43.02 39.25 2jor s PHE 60 CO 0.01 0.03 2.10 -1.25 -1.34 0.00 0.00 175.22 174.77 2jor s PRO 61 N -3.44 2.11 0.00 1.99 0.04 -1.26 -4.30 135.00 130.14 2jor s PRO 61 Ca 0.51 -0.19 0.00 0.00 0.04 0.00 0.00 61.00 61.36 2jor s PRO 61 Cb -0.10 -4.99 0.00 0.00 0.04 0.00 0.00 34.50 29.44 2jor s PRO 61 CO 0.26 -4.01 0.00 0.43 0.04 0.00 0.00 177.00 173.71 2jor n SER 62 N 16.07 0.00 -3.76 6.66 7.64 -1.26 -4.65 113.62 134.31 2jor n SER 62 Ca 0.43 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 60.18 2jor n SER 62 Cb 0.46 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.54 2jor n SER 62 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2jor s ARG 63 N 0.00 0.34 0.00 1.43 0.52 -1.26 -4.44 118.95 115.54 2jor s ARG 63 Ca 0.00 0.45 0.00 0.00 -0.52 0.00 0.00 55.73 55.66 2jor s ARG 63 Cb 0.00 0.13 0.00 0.00 0.52 0.00 0.00 34.95 35.60 2jor s ARG 63 CO 0.00 -0.06 0.00 0.41 0.02 0.00 0.00 175.30 175.67 2jor n GLY 64 N 3.13 -0.87 2.61 -3.53 0.00 -1.26 -4.95 105.19 100.32 2jor n GLY 64 Ca -0.15 -0.89 -0.10 0.00 0.00 0.00 0.00 46.02 44.89 2jor n GLY 64 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2jor n ASN 65 N 0.56 -0.99 0.13 1.61 2.04 -1.26 -4.98 115.26 112.37 2jor n ASN 65 Ca 0.00 -3.01 -0.13 0.00 -0.44 0.00 0.00 54.58 51.00 2jor n ASN 65 Cb 0.00 0.76 -0.06 0.00 -2.53 0.00 0.00 39.78 37.95 2jor n ASN 65 CO 0.00 0.00 0.00 0.25 -0.44 0.00 0.00 177.26 177.07 2jor h LEU 66 N 2.67 -0.48 -0.74 -4.53 7.12 -1.97 -3.48 115.31 113.91 2jor h LEU 66 Ca -0.12 0.05 0.10 0.00 0.13 0.00 0.00 57.88 58.03 2jor h LEU 66 Cb 1.16 0.17 -0.05 0.00 -0.53 0.00 0.00 40.66 41.40 2jor h LEU 66 CO 0.19 -0.27 -1.03 -0.67 -0.13 0.00 0.00 178.44 176.54 2jor n ASP 67 N -5.30 -8.02 -4.34 1.25 -0.08 -1.26 -4.74 116.55 94.05 2jor n ASP 67 Ca -0.08 1.71 -0.36 0.00 -1.51 0.00 0.00 54.79 54.55 2jor n ASP 67 Cb 0.22 -5.00 0.06 0.00 2.34 0.00 0.00 41.12 38.73 2jor n ASP 67 CO 0.00 0.00 0.00 -0.90 0.12 0.00 0.00 177.20 176.42 2jor n ASP 68 N -3.11 -2.55 0.00 1.67 5.68 -1.26 -4.60 116.55 112.39 2jor n ASP 68 Ca -0.03 0.52 0.00 0.00 -0.50 0.00 0.00 54.79 54.78 2jor n ASP 68 Cb 0.53 -1.07 0.00 0.00 -1.14 0.00 0.00 41.12 39.44 2jor n ASP 68 CO 0.00 0.00 0.00 0.33 -1.33 0.00 0.00 177.20 176.20 2jor n PHE 69 N -2.31 0.00 0.36 2.11 7.35 -1.26 -4.95 117.46 118.76 2jor n PHE 69 Ca 0.07 0.00 -0.18 0.00 -0.76 0.00 0.00 57.45 56.58 2jor n PHE 69 Cb 0.51 0.00 -0.10 0.00 0.35 0.00 0.00 39.48 40.24 2jor n PHE 69 CO 0.00 0.00 0.00 0.74 -0.76 0.00 0.00 176.76 176.74 2jor h PHE 70 N 0.00 -1.31 -2.09 -5.13 -1.00 -1.93 -3.45 116.94 102.04 2jor h PHE 70 Ca 0.00 -0.00 -0.30 0.00 2.81 0.00 0.00 57.97 60.47 2jor h PHE 70 Cb 0.00 0.48 -0.08 0.00 3.61 0.00 0.00 35.95 39.96 2jor h PHE 70 CO 0.00 -0.68 -0.31 0.72 -1.61 0.00 0.00 178.31 176.42 2jor n HIS 71 N -5.44 -0.64 -0.60 -0.55 8.25 -1.26 -4.76 115.22 110.22 2jor n HIS 71 Ca -0.13 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.18 2jor n HIS 71 Cb 0.47 -2.89 -0.04 0.00 1.12 0.00 0.00 29.99 28.65 2jor n HIS 71 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2jor n ARG 72 N -2.29 1.56 -2.70 -0.41 5.12 -1.26 -3.61 116.66 113.06 2jor n ARG 72 Ca -0.16 -1.05 -0.02 0.00 -1.93 0.00 0.00 57.85 54.69 2jor n ARG 72 Cb 0.54 -2.17 0.12 0.00 -1.16 0.00 0.00 32.46 29.78 2jor n ARG 72 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 2jor n ASP 73 N 3.75 -1.04 -4.35 0.55 8.00 -1.26 -3.33 116.55 118.86 2jor n ASP 73 Ca 0.33 -2.23 -0.33 0.00 0.71 0.00 0.00 54.79 53.27 2jor n ASP 73 Cb 0.24 0.54 0.11 0.00 -0.02 0.00 0.00 41.12 41.98 2jor n ASP 73 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 2jor n LYS 74 N -1.30 -0.25 -2.91 -1.24 4.81 -1.24 -4.27 118.16 111.77 2jor n LYS 74 Ca -0.13 -0.04 -0.04 0.00 -0.87 0.00 0.00 58.31 57.24 2jor n LYS 74 Cb 0.86 -1.72 0.02 0.00 0.02 0.00 0.00 35.03 34.22 2jor n LYS 74 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 2jor n ASP 75 N -0.53 -1.32 -2.70 3.14 2.03 -1.26 -3.16 116.55 112.76 2jor n ASP 75 Ca 0.05 -1.82 -0.07 0.00 0.52 0.00 0.00 54.79 53.48 2jor n ASP 75 Cb 0.54 2.17 0.11 0.00 -0.72 0.00 0.00 41.12 43.22 2jor n ASP 75 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 2jor n ASP 76 N -1.20 -1.87 0.00 1.67 5.68 -1.26 -4.94 116.55 114.63 2jor n ASP 76 Ca -0.04 -2.44 0.05 0.00 -0.50 0.00 0.00 54.79 51.86 2jor n ASP 76 Cb 0.38 1.05 0.26 0.00 -1.14 0.00 0.00 41.12 41.67 2jor n ASP 76 CO 0.00 0.00 0.00 0.33 -1.33 0.00 0.00 177.20 176.20 2jor n PHE 77 N -0.56 0.00 -1.81 2.11 7.35 -1.26 -4.52 117.46 118.77 2jor n PHE 77 Ca -0.04 0.00 -0.20 0.00 -0.76 0.00 0.00 57.45 56.45 2jor n PHE 77 Cb 0.83 -0.20 -0.06 0.00 0.35 0.00 0.00 39.48 40.40 2jor n PHE 77 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 2jor s PHE 78 N -2.39 1.47 -2.00 -5.13 0.08 -1.26 -5.36 117.98 103.40 2jor s PHE 78 Ca 0.11 1.32 0.02 0.00 0.12 0.00 0.00 56.93 58.50 2jor s PHE 78 Cb 0.06 -3.74 0.14 0.00 -0.57 0.00 0.00 43.02 38.92 2jor s PHE 78 CO 0.13 -1.63 0.63 0.25 -0.10 0.00 0.00 175.22 174.50