#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 -8.21 0.00 2.02 5.41 -1.26 -4.99 119.36 112.33 2jor n ILE 2 Ca 0.00 0.79 0.00 0.00 1.00 0.00 0.00 62.75 64.54 2jor n ILE 2 Cb 0.00 -5.69 0.00 0.00 -0.71 0.00 0.00 39.64 33.24 2jor n ILE 2 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 2jor n ASP 3 N 0.09 0.00 -3.64 4.38 8.00 -1.26 -5.09 116.55 119.03 2jor n ASP 3 Ca 0.03 0.00 -0.05 0.00 0.71 0.00 0.00 54.79 55.47 2jor n ASP 3 Cb 0.45 0.00 -0.07 0.00 -0.02 0.00 0.00 41.12 41.48 2jor n ASP 3 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 2jor s ASN 4 N -1.58 -0.52 0.02 -2.24 3.84 -1.26 -5.17 114.94 108.02 2jor s ASN 4 Ca 0.00 0.90 -0.08 0.00 0.21 0.00 0.00 52.86 53.89 2jor s ASN 4 Cb 0.00 1.10 0.03 0.00 -0.55 0.00 0.00 41.25 41.82 2jor s ASN 4 CO 0.00 -0.15 0.36 -1.84 -2.79 0.00 0.00 177.10 172.68 2jor n GLU 5 N 3.17 0.11 -0.32 0.43 0.28 -1.26 -4.98 120.64 118.07 2jor n GLU 5 Ca -0.16 -0.31 -0.02 0.00 -0.16 0.00 0.00 57.16 56.51 2jor n GLU 5 Cb 0.57 0.47 -0.02 0.00 1.43 0.00 0.00 31.44 33.89 2jor n GLU 5 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2jor n LYS 6 N -0.25 0.64 -1.49 3.44 5.02 -1.26 -4.89 118.16 119.38 2jor n LYS 6 Ca 0.01 -0.13 -0.54 0.00 -2.02 0.00 0.00 58.31 55.62 2jor n LYS 6 Cb 0.17 -1.38 -0.06 0.00 -0.02 0.00 0.00 35.03 33.75 2jor n LYS 6 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 2jor n VAL 7 N 2.01 0.72 -3.62 -0.18 3.14 -1.26 -4.96 118.33 114.18 2jor n VAL 7 Ca 0.06 -0.18 -0.15 0.00 -2.96 0.00 0.00 64.34 61.10 2jor n VAL 7 Cb 0.31 -0.18 -0.07 0.00 -1.06 0.00 0.00 33.84 32.84 2jor n VAL 7 CO 0.00 0.00 0.00 -0.89 -6.46 0.00 0.00 176.83 169.48 2jor s THR 8 N -0.30 0.01 0.02 1.55 2.01 -1.26 -5.07 115.64 112.60 2jor s THR 8 Ca 0.80 -0.07 0.00 0.00 0.31 0.00 0.00 61.69 62.73 2jor s THR 8 Cb -1.09 -0.88 0.00 0.00 0.01 0.00 0.00 72.50 70.54 2jor s THR 8 CO 0.55 -0.04 0.00 -1.20 -0.69 0.00 0.00 174.62 173.25 2jor n SER 9 N 1.80 -0.15 0.00 3.53 7.64 -1.26 -5.04 113.62 120.13 2jor n SER 9 Ca -0.17 0.10 0.00 0.00 1.01 0.00 0.00 58.87 59.81 2jor n SER 9 Cb 0.56 0.29 0.00 0.00 -1.01 0.00 0.00 64.21 64.06 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 -1.43 0.00 7.00 0.23 0.00 -1.26 -5.03 105.19 104.70 2jor n GLY 10 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 0.00 -0.29 1.61 -0.00 -1.26 -0.56 115.22 114.71 2jor n HIS 11 Ca 0.00 0.00 0.08 0.00 -0.00 0.00 0.00 57.72 57.80 2jor n HIS 11 Cb 0.00 0.00 0.24 0.00 -0.00 0.00 0.00 29.99 30.23 2jor n HIS 11 CO 0.00 0.00 0.00 1.79 -0.00 0.00 0.00 176.34 178.13 2jor h THR 12 N 0.00 0.65 0.00 1.59 1.35 -2.06 -3.46 112.91 110.98 2jor h THR 12 Ca 0.00 -0.18 0.00 0.00 -0.55 0.00 0.00 66.41 65.68 2jor h THR 12 Cb 0.00 0.07 0.00 0.00 -1.73 0.00 0.00 68.15 66.49 2jor h THR 12 CO 0.00 0.10 0.00 0.41 -0.25 0.00 0.00 175.52 175.78 2jor n THR 13 N -4.94 0.00 -3.49 6.82 -1.04 0.27 -4.90 114.28 107.00 2jor n THR 13 Ca 0.18 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 62.09 2jor n THR 13 Cb 0.49 0.00 -0.02 0.00 -1.82 0.00 0.00 70.33 68.98 2jor n THR 13 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2jor s THR 14 N 0.00 0.00 -0.17 12.58 2.01 -1.26 -5.11 115.64 123.69 2jor s THR 14 Ca 0.00 -0.08 -0.07 0.00 0.31 0.00 0.00 61.69 61.84 2jor s THR 14 Cb 0.00 -1.10 -0.04 0.00 0.01 0.00 0.00 72.50 71.37 2jor s THR 14 CO 0.00 0.00 0.08 0.42 -0.69 0.00 0.00 174.62 174.43 2jor s THR 15 N -3.50 4.98 0.29 -0.82 -4.23 -1.26 -5.10 115.64 105.99 2jor s THR 15 Ca 0.04 0.03 0.12 0.00 -1.18 0.00 0.00 61.69 60.69 2jor s THR 15 Cb -0.01 -3.23 -0.05 0.00 1.34 0.00 0.00 72.50 70.55 2jor s THR 15 CO -0.10 0.49 -0.17 -0.13 -0.54 0.00 0.00 174.62 174.17 2jor s ARG 16 N 0.07 1.74 0.00 3.99 0.52 -1.26 -4.68 118.95 119.33 2jor s ARG 16 Ca 0.06 -1.76 0.00 0.00 -0.52 0.00 0.00 55.73 53.51 2jor s ARG 16 Cb -0.12 -1.79 0.00 0.00 0.52 0.00 0.00 34.95 33.56 2jor s ARG 16 CO 0.00 0.31 0.00 -2.13 0.02 0.00 0.00 175.30 173.51 2jor n ARG 17 N -0.66 0.00 0.00 3.54 0.63 -1.26 -4.83 116.66 114.08 2jor n ARG 17 Ca -0.05 0.40 0.00 0.00 -0.92 0.00 0.00 57.85 57.28 2jor n ARG 17 Cb 0.60 -3.38 0.00 0.00 0.45 0.00 0.00 32.46 30.13 2jor n ARG 17 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 2jor n SER 18 N 1.71 0.28 -3.94 6.15 3.41 -1.26 -4.48 113.62 115.48 2jor n SER 18 Ca 0.00 -0.17 -0.09 0.00 -0.26 0.00 0.00 58.87 58.35 2jor n SER 18 Cb 0.03 0.39 -0.06 0.00 -0.26 0.00 0.00 64.21 64.31 2jor n SER 18 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jor s SER 20 N -2.98 6.64 -0.13 0.00 1.04 -1.26 -4.13 113.70 112.88 2jor s SER 20 Ca 0.18 2.15 -0.02 0.00 0.48 0.00 0.00 55.95 58.74 2jor s SER 20 Cb 0.01 -2.53 0.04 0.00 0.10 0.00 0.00 66.02 63.64 2jor s SER 20 CO 0.04 -0.96 0.02 -0.54 0.98 0.00 0.00 173.24 172.78 2jor s LYS 21 N 4.10 0.62 -0.14 4.02 -0.14 -1.14 -3.36 119.74 123.69 2jor s LYS 21 Ca 0.73 -0.16 0.00 0.00 -1.36 0.00 0.00 55.97 55.18 2jor s LYS 21 Cb -0.32 -1.57 0.03 0.00 -1.68 0.00 0.00 37.83 34.29 2jor s LYS 21 CO 0.29 -0.48 -0.11 0.08 -0.76 0.00 0.00 175.35 174.37 2jor s VAL 22 N 1.92 1.33 -0.24 3.17 1.01 -1.26 -1.88 120.40 124.45 2jor s VAL 22 Ca 0.02 -0.52 0.02 0.00 0.00 0.00 0.00 61.98 61.50 2jor s VAL 22 Cb -0.15 -1.31 0.05 0.00 0.00 0.00 0.00 36.38 34.98 2jor s VAL 22 CO -0.07 0.38 -0.11 -0.63 0.00 0.00 0.00 175.10 174.67 2jor s ILE 23 N 1.58 2.04 -0.23 2.22 1.09 -1.11 -4.74 121.20 122.05 2jor s ILE 23 Ca 0.04 -1.47 0.01 0.00 -1.10 0.00 0.00 60.65 58.14 2jor s ILE 23 Cb -0.13 -2.13 0.05 0.00 -1.06 0.00 0.00 42.46 39.19 2jor s ILE 23 CO -0.09 0.04 -0.08 0.28 -0.10 0.00 0.00 174.94 174.98 2jor s THR 24 N 1.18 1.71 -0.26 2.92 -1.32 -1.25 -1.66 115.64 116.95 2jor s THR 24 Ca -0.07 -1.23 0.02 0.00 -1.21 0.00 0.00 61.69 59.20 2jor s THR 24 Cb -0.19 -1.87 0.07 0.00 -1.51 0.00 0.00 72.50 69.00 2jor s THR 24 CO -0.06 0.01 -0.06 -0.54 -2.21 0.00 0.00 174.62 171.76 2jor s LYS 25 N 1.33 1.87 -0.29 7.08 1.02 0.02 -4.44 119.74 126.34 2jor s LYS 25 Ca -0.05 -1.25 -0.10 0.00 0.02 0.00 0.00 55.97 54.59 2jor s LYS 25 Cb -0.18 -2.78 -0.03 0.00 -0.52 0.00 0.00 37.83 34.33 2jor s LYS 25 CO -0.07 -0.63 0.15 0.99 -0.92 0.00 0.00 175.35 174.87 2jor s THR 26 N 1.21 4.77 -0.33 2.17 2.01 -1.26 -1.81 115.64 122.40 2jor s THR 26 Ca -0.05 -0.17 -0.09 0.00 0.31 0.00 0.00 61.69 61.70 2jor s THR 26 Cb -0.19 -3.33 0.02 0.00 0.01 0.00 0.00 72.50 69.00 2jor s THR 26 CO -0.06 0.19 0.14 -0.69 -0.69 0.00 0.00 174.62 173.51 2jor s VAL 27 N 1.66 4.28 -0.41 3.82 1.01 -0.80 -4.56 120.40 125.40 2jor s VAL 27 Ca 0.06 -0.76 -0.08 0.00 0.00 0.00 0.00 61.98 61.20 2jor s VAL 27 Cb -0.16 -3.30 0.08 0.00 0.00 0.00 0.00 36.38 33.00 2jor s VAL 27 CO 0.07 -0.07 0.24 0.42 0.00 0.00 0.00 175.10 175.75 2jor s THR 28 N 1.53 4.00 -0.29 3.92 -4.23 -1.26 -2.86 115.64 116.44 2jor s THR 28 Ca 0.02 -1.51 -0.13 0.00 -1.18 0.00 0.00 61.69 58.89 2jor s THR 28 Cb -0.18 -3.49 -0.04 0.00 1.34 0.00 0.00 72.50 70.13 2jor s THR 28 CO 0.05 -0.52 0.26 0.21 -0.54 0.00 0.00 174.62 174.08 2jor s ASN 29 N 2.04 6.10 0.21 3.99 3.04 -1.07 -4.93 114.94 124.33 2jor s ASN 29 Ca 0.03 -0.00 0.05 0.00 0.04 0.00 0.00 52.86 52.98 2jor s ASN 29 Cb -0.23 -2.15 0.30 0.00 -1.54 0.00 0.00 41.25 37.62 2jor s ASN 29 CO 0.01 -0.14 0.95 0.00 -3.04 0.00 0.00 177.10 174.88 2jor n ALA 30 N 5.17 0.39 0.77 1.71 0.00 -1.26 -0.02 120.51 127.28 2jor n ALA 30 Ca -0.12 0.05 0.09 0.00 0.00 0.00 0.00 53.44 53.46 2jor n ALA 30 Cb 0.51 -0.46 0.42 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 -1.67 0.00 0.00 0.00 8.00 -1.26 -4.81 116.55 116.81 2jor n ASP 31 Ca -0.00 0.15 0.00 0.00 0.71 0.00 0.00 54.79 55.64 2jor n ASP 31 Cb 0.41 -0.34 0.00 0.00 -0.02 0.00 0.00 41.12 41.18 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 0.22 0.97 3.93 0.44 0.00 0.97 -5.10 105.19 106.62 2jor n GLY 32 Ca 0.07 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.78 3.54 -0.27 1.61 0.52 -1.12 -5.00 118.95 117.44 2jor s ARG 33 Ca 0.00 -0.29 -0.04 0.00 -0.52 0.00 0.00 55.73 54.88 2jor s ARG 33 Cb 0.00 -2.78 0.15 0.00 0.52 0.00 0.00 34.95 32.84 2jor s ARG 33 CO 0.00 0.34 0.54 0.95 0.02 0.00 0.00 175.30 177.14 2jor s THR 34 N -1.97 -0.87 -0.00 0.02 -4.23 -1.26 -2.61 115.64 104.72 2jor s THR 34 Ca 0.40 0.01 0.06 0.00 -1.18 0.00 0.00 61.69 60.97 2jor s THR 34 Cb -0.11 -0.92 -0.03 0.00 1.34 0.00 0.00 72.50 72.79 2jor s THR 34 CO 0.30 -0.02 -0.19 -1.61 -0.54 0.00 0.00 174.62 172.56 2jor s GLU 35 N 2.77 2.21 -0.18 3.99 0.41 -1.14 -5.01 118.70 121.74 2jor s GLU 35 Ca 0.11 -0.88 -0.01 0.00 -0.41 0.00 0.00 54.97 53.77 2jor s GLU 35 Cb -0.14 -2.20 0.05 0.00 -1.78 0.00 0.00 34.13 30.06 2jor s GLU 35 CO -0.18 0.57 -0.02 0.95 -0.49 0.00 0.00 175.26 176.09 2jor s THR 36 N -0.78 0.92 -0.44 3.63 -4.23 -1.26 -1.91 115.64 111.57 2jor s THR 36 Ca 0.12 -0.67 -0.16 0.00 -1.18 0.00 0.00 61.69 59.81 2jor s THR 36 Cb -0.10 -1.24 0.04 0.00 1.34 0.00 0.00 72.50 72.54 2jor s THR 36 CO 0.02 -0.04 0.39 -0.89 -0.54 0.00 0.00 174.62 173.56 2jor s THR 37 N 1.70 5.18 -0.55 3.99 2.01 -0.75 -4.96 115.64 122.26 2jor s THR 37 Ca -0.01 -0.66 0.07 0.00 0.31 0.00 0.00 61.69 61.39 2jor s THR 37 Cb -0.16 -4.04 0.31 0.00 0.01 0.00 0.00 72.50 68.62 2jor s THR 37 CO -0.07 -0.44 0.84 0.29 -0.69 0.00 0.00 174.62 174.54 2jor n LYS 38 N 5.37 2.54 -2.33 4.92 5.02 -1.25 -0.80 118.16 131.62 2jor n LYS 38 Ca -0.10 -4.47 -0.35 0.00 -2.02 0.00 0.00 58.31 51.37 2jor n LYS 38 Cb 0.46 -2.09 -0.03 0.00 -0.02 0.00 0.00 35.03 33.35 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 -2.92 3.21 -0.28 1.97 0.41 -0.66 -4.89 118.70 115.53 2jor s GLU 39 Ca 0.44 -1.22 -0.11 0.00 -0.41 0.00 0.00 54.97 53.68 2jor s GLU 39 Cb 0.25 -5.32 -0.04 0.00 -1.78 0.00 0.00 34.13 27.24 2jor s GLU 39 CO -0.10 -2.92 0.18 0.14 -0.49 0.00 0.00 175.26 172.07 2jor s VAL 40 N 7.36 5.19 -0.17 2.63 -7.23 -1.26 -2.75 120.40 124.17 2jor s VAL 40 Ca 0.59 0.08 -0.03 0.00 -1.81 0.00 0.00 61.98 60.81 2jor s VAL 40 Cb -0.00 -3.50 0.06 0.00 0.56 0.00 0.00 36.38 33.50 2jor s VAL 40 CO 0.03 0.23 0.04 0.68 -0.31 0.00 0.00 175.10 175.77 2jor s VAL 41 N 1.74 0.40 -0.27 1.32 -7.23 -0.79 -5.04 120.40 110.53 2jor s VAL 41 Ca 0.07 -0.40 -0.06 0.00 -1.81 0.00 0.00 61.98 59.78 2jor s VAL 41 Cb -0.16 -0.88 0.00 0.00 0.56 0.00 0.00 36.38 35.90 2jor s VAL 41 CO 0.10 -0.16 0.05 -0.54 -0.31 0.00 0.00 175.10 174.24 2jor s LYS 42 N 1.92 3.18 1.16 4.82 1.02 -1.26 -2.91 119.74 127.67 2jor s LYS 42 Ca 0.00 -0.78 -0.15 0.00 0.02 0.00 0.00 55.97 55.06 2jor s LYS 42 Cb -0.16 -3.27 0.27 0.00 -0.52 0.00 0.00 37.83 34.15 2jor s LYS 42 CO -0.08 -0.37 1.05 0.45 -0.92 0.00 0.00 175.35 175.48 2jor s SER 43 N 1.49 1.19 0.02 2.83 0.15 -1.26 -4.99 113.70 113.13 2jor s SER 43 Ca 0.03 1.13 -0.10 0.00 0.70 0.00 0.00 55.95 57.72 2jor s SER 43 Cb -0.16 -1.74 0.01 0.00 -1.71 0.00 0.00 66.02 62.41 2jor s SER 43 CO 0.01 -4.02 0.20 -0.70 1.20 0.00 0.00 173.24 169.93 2jor s GLU 44 N -4.88 0.61 -0.69 5.44 2.56 -1.26 -4.85 118.70 115.63 2jor s GLU 44 Ca 0.68 -0.46 -0.03 0.00 0.00 0.00 0.00 54.97 55.16 2jor s GLU 44 Cb -0.19 0.26 0.03 0.00 2.00 0.00 0.00 34.13 36.23 2jor s GLU 44 CO 0.60 -0.17 0.12 -0.25 -0.56 0.00 0.00 175.26 175.00 2jor n ASP 45 N 1.08 -2.50 -3.26 -1.70 8.00 -1.26 -4.83 116.55 112.08 2jor n ASP 45 Ca -0.21 0.14 -0.07 0.00 0.71 0.00 0.00 54.79 55.36 2jor n ASP 45 Cb 0.57 -2.18 0.01 0.00 -0.02 0.00 0.00 41.12 39.50 2jor n ASP 45 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2jor s GLY 46 N -2.20 0.18 0.30 0.44 0.00 -1.26 -5.19 107.32 99.58 2jor s GLY 46 Ca 0.12 -0.51 -0.19 0.00 0.00 0.00 0.00 44.72 44.13 2jor s GLY 46 CO 0.14 0.26 0.80 -1.35 0.00 0.00 0.00 173.10 172.95 2jor s SER 47 N -3.09 -0.13 0.00 1.64 1.04 -1.23 -4.89 113.70 107.04 2jor s SER 47 Ca 0.15 -0.80 0.00 0.00 0.48 0.00 0.00 55.95 55.78 2jor s SER 47 Cb -0.04 0.73 0.00 0.00 0.10 0.00 0.00 66.02 66.81 2jor s SER 47 CO 0.09 -1.41 0.13 -0.67 0.98 0.00 0.00 173.24 172.36 2jor n ASP 48 N -0.89 0.00 -4.54 7.02 2.03 0.15 -4.71 116.55 115.60 2jor n ASP 48 Ca -0.06 -1.01 -0.26 0.00 0.52 0.00 0.00 54.79 53.98 2jor n ASP 48 Cb 0.60 -0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.90 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 -0.23 -1.52 2.75 0.00 0.00 -1.26 -4.22 105.19 100.71 2jor n GLY 50 Ca -0.09 0.29 -0.08 0.00 0.00 0.00 0.00 46.02 46.14 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 -2.14 -2.88 0.05 1.61 2.03 0.13 -4.80 116.55 110.55 2jor n ASP 51 Ca 0.00 -3.33 0.00 0.00 0.52 0.00 0.00 54.79 51.98 2jor n ASP 51 Cb 0.00 1.84 0.00 0.00 -0.72 0.00 0.00 41.12 42.24 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 1.58 0.00 0.00 -1.67 0.00 -1.26 -4.72 120.51 114.45 2jor n ALA 52 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 2jor n ALA 52 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.08 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 -3.02 -0.49 0.00 0.00 8.00 -1.26 -4.92 116.55 114.85 2jor n ASP 53 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2jor n ASP 53 Cb 0.00 0.50 0.00 0.00 -0.02 0.00 0.00 41.12 41.60 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 0.49 0.00 0.00 1.24 3.72 -1.25 -4.65 117.46 117.00 2jor n PHE 54 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 2jor n PHE 54 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 2jor n PHE 54 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 2jor n ASP 55 N 1.18 0.00 -0.51 4.37 5.75 -1.21 -4.02 116.55 122.10 2jor n ASP 55 Ca 0.00 0.00 0.06 0.00 -0.01 0.00 0.00 54.79 54.84 2jor n ASP 55 Cb 0.00 0.00 0.06 0.00 -1.03 0.00 0.00 41.12 40.15 2jor n ASP 55 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 2jor n TRP 56 N 0.00 0.05 -2.58 2.11 7.02 -1.26 -4.81 117.44 117.98 2jor n TRP 56 Ca 0.00 -0.05 -0.41 0.00 -1.02 0.00 0.00 57.50 56.01 2jor n TRP 56 Cb 0.00 -0.00 -0.03 0.00 -2.42 0.00 0.00 31.31 28.86 2jor n TRP 56 CO 0.00 0.00 0.00 -3.38 -2.02 0.00 0.00 177.69 172.29 2jor s HIS 57 N -1.01 2.47 0.00 -5.99 -3.43 -1.26 -4.66 115.29 101.41 2jor s HIS 57 Ca 0.15 -0.56 0.00 0.00 -0.80 0.00 0.00 55.06 53.85 2jor s HIS 57 Cb 0.10 -4.64 0.00 0.00 -1.43 0.00 0.00 32.58 26.61 2jor s HIS 57 CO 0.15 -1.96 0.00 -2.39 -2.00 0.00 0.00 174.74 168.54 2jor n HIS 58 N 8.93 0.00 -0.17 0.38 1.44 -1.26 -4.80 115.22 119.75 2jor n HIS 58 Ca 0.20 0.00 0.01 0.00 -2.01 0.00 0.00 57.72 55.93 2jor n HIS 58 Cb 0.50 0.00 -0.01 0.00 0.12 0.00 0.00 29.99 30.60 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 0.00 -0.20 -2.44 0.61 -1.04 -1.26 -1.83 114.28 108.11 2jor n THR 59 Ca 0.00 0.13 -0.36 0.00 -2.04 0.00 0.00 64.05 61.79 2jor n THR 59 Cb 0.00 -0.21 -0.03 0.00 -1.82 0.00 0.00 70.33 68.27 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 -3.55 3.03 0.50 -1.42 0.08 -1.26 -4.59 117.98 110.76 2jor s PHE 60 Ca 0.00 1.59 0.18 0.00 0.12 0.00 0.00 56.93 58.81 2jor s PHE 60 Cb 0.00 -3.19 1.22 0.00 -0.57 0.00 0.00 43.02 40.48 2jor s PHE 60 CO 0.00 -1.00 2.06 -1.00 -0.10 0.00 0.00 175.22 175.18 2jor h PRO 61 N 1.99 0.13 -1.04 0.24 0.13 -1.87 -1.89 132.00 129.68 2jor h PRO 61 Ca -0.49 -0.01 0.31 0.00 -0.87 0.00 0.00 66.00 64.94 2jor h PRO 61 Cb 1.23 -0.03 -0.13 0.00 0.13 0.00 0.00 31.00 32.20 2jor h PRO 61 CO 0.60 0.08 0.62 0.77 -0.23 0.00 0.00 178.00 179.84 2jor h SER 62 N 0.13 0.52 -0.78 1.44 0.02 -1.90 0.96 113.55 113.93 2jor h SER 62 Ca 0.15 0.16 -0.40 0.00 -0.84 0.00 0.00 61.79 60.86 2jor h SER 62 Cb 0.42 0.09 -0.24 0.00 0.14 0.00 0.00 62.40 62.81 2jor h SER 62 CO -0.02 -0.05 0.41 -1.14 -1.14 0.00 0.00 176.83 174.89 2jor n ARG 63 N -4.92 2.20 -2.50 3.45 0.63 -0.71 -5.00 116.66 109.81 2jor n ARG 63 Ca 0.30 -3.07 -0.03 0.00 -0.92 0.00 0.00 57.85 54.14 2jor n ARG 63 Cb 0.95 -2.07 -0.02 0.00 0.45 0.00 0.00 32.46 31.77 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 -1.09 -4.67 3.34 5.14 0.00 0.33 -4.86 105.19 103.38 2jor n GLY 64 Ca 0.51 0.83 -0.33 0.00 0.00 0.00 0.00 46.02 47.02 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 1.88 -2.65 -4.46 1.61 6.94 -1.25 -4.84 115.26 112.48 2jor n ASN 65 Ca -0.19 0.25 -0.44 0.00 -0.02 0.00 0.00 54.58 54.19 2jor n ASN 65 Cb 0.29 -1.11 -0.00 0.00 -2.36 0.00 0.00 39.78 36.59 2jor n ASN 65 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 2jor s LEU 66 N 0.23 5.04 -0.79 -4.53 2.96 -0.76 -4.93 118.68 115.89 2jor s LEU 66 Ca 0.54 -2.87 -0.23 0.00 -0.22 0.00 0.00 54.13 51.35 2jor s LEU 66 Cb -0.19 -2.40 -0.18 0.00 0.50 0.00 0.00 46.19 43.92 2jor s LEU 66 CO 0.69 -0.79 2.42 -0.67 -1.32 0.00 0.00 176.35 176.68 2jor n ASP 67 N 5.79 0.98 0.00 3.68 2.03 -1.26 -4.10 116.55 123.66 2jor n ASP 67 Ca 0.35 -0.69 0.00 0.00 0.52 0.00 0.00 54.79 54.97 2jor n ASP 67 Cb 0.44 -1.26 0.00 0.00 -0.72 0.00 0.00 41.12 39.57 2jor n ASP 67 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2jor n ASP 68 N 13.60 0.00 0.00 1.67 2.03 -1.26 -5.06 116.55 127.53 2jor n ASP 68 Ca 0.52 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.83 2jor n ASP 68 Cb 0.33 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.73 2jor n ASP 68 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 2jor n PHE 69 N 0.00 0.00 -3.81 -0.67 3.72 -1.26 -4.89 117.46 110.55 2jor n PHE 69 Ca 0.00 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.30 2jor n PHE 69 Cb 0.00 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.49 2jor n PHE 69 CO 0.00 0.00 0.00 -0.59 -0.05 0.00 0.00 176.76 176.12 2jor s PHE 70 N 0.00 0.06 0.00 1.38 -0.12 -1.26 -4.06 117.98 113.98 2jor s PHE 70 Ca 0.00 -0.41 0.00 0.00 -0.05 0.00 0.00 56.93 56.47 2jor s PHE 70 Cb 0.00 0.20 0.00 0.00 -0.63 0.00 0.00 43.02 42.59 2jor s PHE 70 CO 0.00 -0.80 0.00 1.58 -0.05 0.00 0.00 175.22 175.95 2jor n HIS 71 N -0.27 -2.07 -2.20 3.49 -0.00 -1.26 -4.89 115.22 108.02 2jor n HIS 71 Ca -0.10 0.00 -0.32 0.00 0.46 0.00 0.00 57.72 57.76 2jor n HIS 71 Cb 0.63 0.41 -0.04 0.00 -0.12 0.00 0.00 29.99 30.87 2jor n HIS 71 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 2jor s ARG 72 N -1.97 2.88 -0.05 1.57 1.81 -1.26 -4.82 118.95 117.11 2jor s ARG 72 Ca 0.00 -1.16 -0.29 0.00 -1.72 0.00 0.00 55.73 52.56 2jor s ARG 72 Cb 0.00 -5.28 0.11 0.00 -0.45 0.00 0.00 34.95 29.33 2jor s ARG 72 CO 0.00 -3.40 0.91 0.16 -0.68 0.00 0.00 175.30 172.29 2jor s ASP 73 N 6.23 -0.38 0.08 0.23 -4.77 -1.26 -4.28 116.67 112.51 2jor s ASP 73 Ca 0.64 0.14 -0.27 0.00 -3.30 0.00 0.00 52.55 49.77 2jor s ASP 73 Cb -0.01 0.37 0.09 0.00 -1.09 0.00 0.00 42.92 42.28 2jor s ASP 73 CO 0.08 -0.54 1.15 -1.59 0.70 0.00 0.00 175.17 174.97 2jor s LYS 74 N -2.49 0.82 0.35 2.11 -2.85 -1.26 -4.90 119.74 111.53 2jor s LYS 74 Ca 0.02 -0.49 -0.16 0.00 -1.00 0.00 0.00 55.97 54.35 2jor s LYS 74 Cb -0.01 0.25 0.04 0.00 -2.06 0.00 0.00 37.83 36.05 2jor s LYS 74 CO -0.05 -0.38 0.74 0.34 0.10 0.00 0.00 175.35 176.10 2jor s ASP 75 N -3.26 0.02 1.28 0.03 2.15 -1.26 -0.70 116.67 114.93 2jor s ASP 75 Ca 0.19 -1.05 -0.17 0.00 0.43 0.00 0.00 52.55 51.96 2jor s ASP 75 Cb 0.00 0.80 0.31 0.00 -0.30 0.00 0.00 42.92 43.73 2jor s ASP 75 CO 0.01 -1.56 0.87 -0.67 -0.17 0.00 0.00 175.17 173.64 2jor n ASP 76 N -1.16 -2.66 -4.76 -0.34 2.03 -1.26 -4.90 116.55 103.50 2jor n ASP 76 Ca -0.06 -0.41 -0.38 0.00 0.52 0.00 0.00 54.79 54.46 2jor n ASP 76 Cb 0.60 -1.14 0.01 0.00 -0.72 0.00 0.00 41.12 39.87 2jor n ASP 76 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 2jor s PHE 77 N -2.28 2.69 0.00 -0.67 5.36 -1.26 -4.86 117.98 116.96 2jor s PHE 77 Ca 0.66 1.46 0.00 0.00 -0.96 0.00 0.00 56.93 58.09 2jor s PHE 77 Cb -0.20 -3.57 0.00 0.00 -0.34 0.00 0.00 43.02 38.90 2jor s PHE 77 CO 0.62 -2.06 0.03 0.34 -1.46 0.00 0.00 175.22 172.70 2jor n PHE 78 N -0.49 0.00 -1.46 10.12 7.35 -1.26 -5.34 117.46 126.38 2jor n PHE 78 Ca 0.07 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.76 2jor n PHE 78 Cb 0.46 0.12 0.00 0.00 0.35 0.00 0.00 39.48 40.41 2jor n PHE 78 CO 0.00 0.00 0.00 2.41 -0.76 0.00 0.00 176.76 178.41