#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2tmp n SER 2 N 0.00 0.00 -4.95 0.00 3.41 -1.26 -4.85 113.62 105.97 2tmp n SER 2 Ca 0.00 0.00 -0.23 0.00 -0.26 0.00 0.00 58.87 58.38 2tmp n SER 2 Cb 0.00 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 63.94 2tmp n SER 2 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2tmp s SER 4 N -4.06 6.32 -0.64 0.00 1.04 -1.26 -4.56 113.70 110.54 2tmp s SER 4 Ca 0.40 0.36 -0.27 0.00 0.48 0.00 0.00 55.95 56.93 2tmp s SER 4 Cb -0.10 -2.16 0.01 0.00 0.10 0.00 0.00 66.02 63.87 2tmp s SER 4 CO 0.34 0.06 1.55 -2.16 0.98 0.00 0.00 173.24 174.01 2tmp s PRO 5 N 0.82 3.00 0.00 4.02 0.04 -1.26 -4.74 135.00 136.88 2tmp s PRO 5 Ca 0.14 0.28 0.00 0.00 0.04 0.00 0.00 61.00 61.46 2tmp s PRO 5 Cb -0.13 -4.25 0.00 0.00 0.04 0.00 0.00 34.50 30.16 2tmp s PRO 5 CO 0.04 -2.32 0.00 1.55 0.04 0.00 0.00 177.00 176.31 2tmp n VAL 6 N 6.83 0.00 -3.10 -0.36 3.14 -1.26 -5.02 118.33 118.56 2tmp n VAL 6 Ca 0.12 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.50 2tmp n VAL 6 Cb 0.50 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.28 2tmp n VAL 6 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2tmp n HIS 7 N 0.00 0.00 0.13 1.45 1.44 -1.26 -4.75 115.22 112.22 2tmp n HIS 7 Ca 0.00 0.00 -0.01 0.00 -2.01 0.00 0.00 57.72 55.70 2tmp n HIS 7 Cb 0.00 -0.97 0.11 0.00 0.12 0.00 0.00 29.99 29.25 2tmp n HIS 7 CO 0.00 0.00 0.00 -1.00 -2.81 0.00 0.00 176.34 172.53 2tmp h PRO 8 N 3.58 0.00 0.00 -1.40 0.13 -1.95 -2.99 132.00 129.37 2tmp h PRO 8 Ca 0.00 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.05 2tmp h PRO 8 Cb 0.92 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.04 2tmp h PRO 8 CO 0.00 0.66 -1.31 0.94 -0.23 0.00 0.00 178.00 178.06 2tmp n GLN 9 N -3.58 2.75 0.00 0.86 -0.06 -1.26 -3.72 117.38 112.37 2tmp n GLN 9 Ca -0.00 0.00 0.08 0.00 -2.00 0.00 0.00 57.00 55.08 2tmp n GLN 9 Cb 0.69 -1.12 0.38 0.00 -4.06 0.00 0.00 30.24 26.13 2tmp n GLN 9 CO 0.00 0.00 0.00 0.94 -0.20 0.00 0.00 177.06 177.80 2tmp n GLN 10 N -2.25 0.16 0.06 3.69 -0.06 -1.26 -2.03 117.38 115.70 2tmp n GLN 10 Ca -0.08 0.17 -0.18 0.00 -2.00 0.00 0.00 57.00 54.91 2tmp n GLN 10 Cb 0.64 -1.50 -0.14 0.00 -4.06 0.00 0.00 30.24 25.18 2tmp n GLN 10 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2tmp h ALA 11 N 2.68 0.25 -0.28 1.69 0.00 -1.75 -2.92 119.26 118.93 2tmp h ALA 11 Ca 0.00 -1.13 0.00 0.00 0.00 0.00 0.00 54.91 53.78 2tmp h ALA 11 Cb 0.18 0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2tmp h ALA 11 CO 0.00 1.12 0.00 1.19 0.00 0.00 0.00 179.25 181.56 2tmp n PHE 12 N -3.48 0.37 0.18 0.00 3.01 -0.86 -2.30 117.46 114.38 2tmp n PHE 12 Ca -0.19 -0.18 0.02 0.00 1.01 0.00 0.00 57.45 58.11 2tmp n PHE 12 Cb 1.05 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 40.51 2tmp n PHE 12 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2tmp n ASN 14 N -0.92 2.39 -4.10 0.00 2.85 -1.10 -4.58 115.26 109.80 2tmp n ASN 14 Ca 0.01 -0.09 -0.29 0.00 -0.11 0.00 0.00 54.58 54.10 2tmp n ASN 14 Cb 0.07 -0.17 0.20 0.00 1.24 0.00 0.00 39.78 41.11 2tmp n ASN 14 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2tmp n ALA 15 N -3.00 -3.56 -1.76 5.20 0.00 -0.97 -4.47 120.51 111.94 2tmp n ALA 15 Ca -0.33 -1.32 0.00 0.00 0.00 0.00 0.00 53.44 51.79 2tmp n ALA 15 Cb 0.87 -1.49 0.00 0.00 0.00 0.00 0.00 19.45 18.83 2tmp n ALA 15 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2tmp n ASP 16 N -2.57 0.00 -2.98 0.00 9.92 0.20 -4.76 116.55 116.36 2tmp n ASP 16 Ca 0.03 -1.22 0.00 0.00 -0.53 0.00 0.00 54.79 53.07 2tmp n ASP 16 Cb 0.57 -0.04 0.00 0.00 -0.64 0.00 0.00 41.12 41.00 2tmp n ASP 16 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2tmp s VAL 17 N 0.00 -0.72 -0.28 2.53 0.11 -1.02 -4.76 120.40 116.27 2tmp s VAL 17 Ca 0.00 -0.16 -0.12 0.00 -2.93 0.00 0.00 61.98 58.77 2tmp s VAL 17 Cb 0.00 0.00 -0.05 0.00 -1.53 0.00 0.00 36.38 34.80 2tmp s VAL 17 CO 0.00 0.00 0.24 -0.69 -3.33 0.00 0.00 175.10 171.32 2tmp s VAL 18 N 1.67 5.27 -0.10 2.04 1.01 0.30 -3.43 120.40 127.17 2tmp s VAL 18 Ca 0.18 0.28 -0.04 0.00 0.00 0.00 0.00 61.98 62.40 2tmp s VAL 18 Cb -0.00 -3.58 0.05 0.00 0.00 0.00 0.00 36.38 32.85 2tmp s VAL 18 CO -0.09 0.22 0.22 0.27 0.00 0.00 0.00 175.10 175.73 2tmp s ILE 19 N 1.84 -0.17 0.00 2.22 -4.36 0.34 0.21 121.20 121.27 2tmp s ILE 19 Ca 0.09 0.22 0.00 0.00 -0.26 0.00 0.00 60.65 60.70 2tmp s ILE 19 Cb -0.16 -0.36 0.00 0.00 1.25 0.00 0.00 42.46 43.19 2tmp s ILE 19 CO 0.11 0.09 1.68 0.54 0.24 0.00 0.00 174.94 177.59 2tmp n ARG 20 N 4.68 0.85 -0.84 0.37 1.74 -1.06 -2.59 116.66 119.80 2tmp n ARG 20 Ca -0.18 0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 56.60 2tmp n ARG 20 Cb 0.51 -1.08 0.17 0.00 -1.02 0.00 0.00 32.46 31.05 2tmp n ARG 20 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 2tmp s THR 21 N 0.30 2.34 -0.17 0.55 -1.32 -0.05 -3.87 115.64 113.43 2tmp s THR 21 Ca 0.00 0.11 0.01 0.00 -1.21 0.00 0.00 61.69 60.60 2tmp s THR 21 Cb 0.00 -2.30 0.01 0.00 -1.51 0.00 0.00 72.50 68.70 2tmp s THR 21 CO 0.00 -0.14 -0.18 -1.59 -2.21 0.00 0.00 174.62 170.49 2tmp s LYS 22 N -4.70 3.07 -0.58 7.08 -2.85 -1.26 -0.67 119.74 119.84 2tmp s LYS 22 Ca 0.66 -0.80 -0.19 0.00 -1.00 0.00 0.00 55.97 54.63 2tmp s LYS 22 Cb -0.22 -2.58 0.09 0.00 -2.06 0.00 0.00 37.83 33.06 2tmp s LYS 22 CO 0.59 -0.12 0.70 0.00 0.10 0.00 0.00 175.35 176.62 2tmp s ALA 23 N 1.10 3.40 -0.18 0.59 0.00 -1.26 0.12 121.76 125.52 2tmp s ALA 23 Ca 0.00 -2.13 0.08 0.00 0.00 0.00 0.00 51.96 49.91 2tmp s ALA 23 Cb -0.14 -3.50 -0.17 0.00 0.00 0.00 0.00 23.12 19.31 2tmp s ALA 23 CO -0.07 -2.30 -0.06 1.33 0.00 0.00 0.00 175.76 174.66 2tmp n VAL 24 N 5.57 1.13 -4.39 0.00 0.24 -1.25 -1.53 118.33 118.10 2tmp n VAL 24 Ca -0.09 -0.56 -0.24 0.00 -2.04 0.00 0.00 64.34 61.41 2tmp n VAL 24 Cb 0.43 -0.89 -0.09 0.00 -1.47 0.00 0.00 33.84 31.82 2tmp n VAL 24 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2tmp s SER 25 N -5.46 4.04 0.23 -1.34 0.15 -0.96 -4.84 113.70 105.53 2tmp s SER 25 Ca -0.17 -0.92 0.02 0.00 0.70 0.00 0.00 55.95 55.57 2tmp s SER 25 Cb 0.06 -0.53 -0.01 0.00 -1.71 0.00 0.00 66.02 63.84 2tmp s SER 25 CO 0.56 -0.07 0.26 -0.62 1.20 0.00 0.00 173.24 174.57 2tmp n GLU 26 N -0.80 0.37 -3.43 5.44 4.71 -1.26 0.96 120.64 126.62 2tmp n GLU 26 Ca -0.05 -2.02 -0.08 0.00 -0.01 0.00 0.00 57.16 55.00 2tmp n GLU 26 Cb 0.61 1.79 -0.08 0.00 -1.01 0.00 0.00 31.44 32.75 2tmp n GLU 26 CO 0.00 0.00 0.00 0.21 0.09 0.00 0.00 177.13 177.43 2tmp s LYS 27 N -2.71 0.35 -0.90 3.49 2.20 -1.24 -4.70 119.74 116.22 2tmp s LYS 27 Ca 0.23 0.72 -0.24 0.00 -0.36 0.00 0.00 55.97 56.31 2tmp s LYS 27 Cb 0.00 -0.16 0.00 0.00 -1.51 0.00 0.00 37.83 36.16 2tmp s LYS 27 CO 0.16 -0.52 1.67 -2.00 -0.36 0.00 0.00 175.35 174.30 2tmp s GLU 28 N 2.59 3.05 -0.68 4.03 2.12 -1.26 0.16 118.70 128.70 2tmp s GLU 28 Ca 0.09 -0.53 -0.15 0.00 0.36 0.00 0.00 54.97 54.73 2tmp s GLU 28 Cb -0.14 -5.02 0.17 0.00 0.26 0.00 0.00 34.13 29.39 2tmp s GLU 28 CO -0.15 -2.71 0.65 0.14 -0.54 0.00 0.00 175.26 172.65 2tmp s VAL 29 N 7.45 5.34 0.43 3.70 -7.23 -1.26 -4.96 120.40 123.87 2tmp s VAL 29 Ca 0.56 -1.88 -0.22 0.00 -1.81 0.00 0.00 61.98 58.64 2tmp s VAL 29 Cb -0.05 -4.42 -0.13 0.00 0.56 0.00 0.00 36.38 32.34 2tmp s VAL 29 CO -0.01 -0.98 0.42 0.47 -0.31 0.00 0.00 175.10 174.70 2tmp n ASP 30 N 4.83 -1.42 -0.31 4.85 9.92 -1.26 -2.50 116.55 130.66 2tmp n ASP 30 Ca -0.01 0.87 0.03 0.00 -0.53 0.00 0.00 54.79 55.15 2tmp n ASP 30 Cb 0.43 -1.06 0.04 0.00 -0.64 0.00 0.00 41.12 39.90 2tmp n ASP 30 CO 0.00 0.00 0.00 -0.24 0.13 0.00 0.00 177.20 177.09 2tmp n SER 31 N 1.49 0.80 -0.82 -2.24 2.88 -1.26 -4.76 113.62 109.71 2tmp n SER 31 Ca 0.11 -2.24 0.07 0.00 -1.33 0.00 0.00 58.87 55.48 2tmp n SER 31 Cb 0.40 -0.24 -0.02 0.00 -0.75 0.00 0.00 64.21 63.60 2tmp n SER 31 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2tmp n GLY 32 N -0.46 -1.69 3.91 0.46 0.00 -1.26 -4.56 105.19 101.59 2tmp n GLY 32 Ca 0.05 -1.22 -0.27 0.00 0.00 0.00 0.00 46.02 44.58 2tmp n GLY 32 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2tmp s ASN 33 N -4.76 5.53 0.07 1.61 -0.87 -1.25 0.23 114.94 115.50 2tmp s ASN 33 Ca 0.00 0.81 0.00 0.00 -1.57 0.00 0.00 52.86 52.10 2tmp s ASN 33 Cb 0.00 -1.74 0.00 0.00 -0.02 0.00 0.00 41.25 39.49 2tmp s ASN 33 CO 0.00 -1.15 0.00 -0.67 -2.57 0.00 0.00 177.10 172.71 2tmp n ASP 34 N -2.70 0.00 -0.00 -1.22 2.03 0.58 -4.65 116.55 110.58 2tmp n ASP 34 Ca 0.05 -0.26 0.15 0.00 0.52 0.00 0.00 54.79 55.25 2tmp n ASP 34 Cb 0.58 0.00 0.87 0.00 -0.72 0.00 0.00 41.12 41.84 2tmp n ASP 34 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 2tmp n ILE 35 N -0.33 0.00 0.60 5.18 -0.00 -1.26 -2.53 119.36 121.03 2tmp n ILE 35 Ca 0.00 -0.00 0.07 0.00 -0.00 0.00 0.00 62.75 62.82 2tmp n ILE 35 Cb 0.00 -0.45 0.05 0.00 -0.00 0.00 0.00 39.64 39.24 2tmp n ILE 35 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2tmp n TYR 36 N -0.95 0.00 -0.09 1.39 9.36 -1.26 -4.95 117.16 120.66 2tmp n TYR 36 Ca 0.22 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.44 2tmp n TYR 36 Cb 0.10 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.81 2tmp n TYR 36 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2tmp n GLY 37 N 0.85 1.76 3.83 2.98 0.00 -1.05 -5.03 105.19 108.53 2tmp n GLY 37 Ca 0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 2tmp n GLY 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2tmp s ASN 38 N -3.23 6.49 0.09 1.61 4.22 -1.26 -4.64 114.94 118.22 2tmp s ASN 38 Ca 0.00 1.63 -0.30 0.00 -2.14 0.00 0.00 52.86 52.05 2tmp s ASN 38 Cb 0.00 -2.52 -0.06 0.00 1.28 0.00 0.00 41.25 39.95 2tmp s ASN 38 CO 0.00 -0.68 1.16 -2.16 -2.04 0.00 0.00 177.10 173.38 2tmp s PRO 39 N -3.99 4.48 0.00 3.55 0.04 -1.26 0.21 135.00 138.03 2tmp s PRO 39 Ca 0.60 1.73 0.00 0.00 0.04 0.00 0.00 61.00 63.37 2tmp s PRO 39 Cb -0.11 -3.34 0.00 0.00 0.04 0.00 0.00 34.50 31.09 2tmp s PRO 39 CO 0.31 -0.16 0.10 -0.89 0.04 0.00 0.00 177.00 176.40 2tmp n ILE 40 N 3.51 0.00 -1.18 0.56 5.41 0.63 -4.80 119.36 123.49 2tmp n ILE 40 Ca 0.07 0.27 0.00 0.00 1.00 0.00 0.00 62.75 64.09 2tmp n ILE 40 Cb 0.47 -0.60 0.00 0.00 -0.71 0.00 0.00 39.64 38.79 2tmp n ILE 40 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72 2tmp n LYS 41 N -0.30 -2.78 -3.25 0.38 3.00 -1.25 -4.77 118.16 109.19 2tmp n LYS 41 Ca 0.00 2.15 -0.25 0.00 -0.00 0.00 0.00 58.31 60.21 2tmp n LYS 41 Cb 0.00 -2.14 -0.07 0.00 0.00 0.00 0.00 35.03 32.82 2tmp n LYS 41 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.40 180.29 2tmp n ARG 42 N 0.66 1.86 -1.35 1.64 1.85 -1.04 -4.17 116.66 116.11 2tmp n ARG 42 Ca 0.00 -4.08 -0.44 0.00 -1.00 0.00 0.00 57.85 52.33 2tmp n ARG 42 Cb 0.00 -1.85 -0.01 0.00 -1.05 0.00 0.00 32.46 29.55 2tmp n ARG 42 CO 0.00 0.00 0.00 -0.89 -0.01 0.00 0.00 177.63 176.73 2tmp n ILE 43 N 0.81 1.26 -2.16 8.89 -0.00 -1.14 -4.25 119.36 122.78 2tmp n ILE 43 Ca 0.27 -0.50 -0.21 0.00 -0.00 0.00 0.00 62.75 62.31 2tmp n ILE 43 Cb 0.47 -0.05 0.13 0.00 -0.00 0.00 0.00 39.64 40.19 2tmp n ILE 43 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2tmp n GLN 44 N 1.15 -0.48 -3.21 0.38 1.13 0.42 -2.06 117.38 114.71 2tmp n GLN 44 Ca 0.14 -1.92 -0.24 0.00 -1.94 0.00 0.00 57.00 53.04 2tmp n GLN 44 Cb 0.34 -0.80 -0.07 0.00 0.11 0.00 0.00 30.24 29.83 2tmp n GLN 44 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 2tmp n TYR 45 N -2.99 0.18 -0.73 1.08 4.01 0.21 -3.71 117.16 115.20 2tmp n TYR 45 Ca 0.13 -3.66 -0.42 0.00 -0.16 0.00 0.00 57.90 53.80 2tmp n TYR 45 Cb 0.47 -0.38 -0.11 0.00 -0.31 0.00 0.00 39.34 39.01 2tmp n TYR 45 CO 0.00 0.00 0.00 -1.91 -0.46 0.00 0.00 176.86 174.49 2tmp n GLU 46 N 1.20 0.30 -0.72 -0.72 2.13 0.27 -2.63 120.64 120.47 2tmp n GLU 46 Ca 0.23 -1.23 -0.19 0.00 0.66 0.00 0.00 57.16 56.62 2tmp n GLU 46 Cb 0.53 -2.72 0.16 0.00 0.27 0.00 0.00 31.44 29.68 2tmp n GLU 46 CO 0.00 0.00 0.00 0.44 -0.41 0.00 0.00 177.13 177.16 2tmp n ILE 47 N 7.02 0.00 -0.01 6.31 -5.35 -0.27 -2.25 119.36 124.80 2tmp n ILE 47 Ca 0.47 -0.34 0.00 0.00 -0.27 0.00 0.00 62.75 62.61 2tmp n ILE 47 Cb 0.42 -1.19 0.00 0.00 -1.74 0.00 0.00 39.64 37.13 2tmp n ILE 47 CO 0.00 0.00 0.00 1.17 -1.76 0.00 0.00 176.55 175.96 2tmp n LYS 48 N -3.60 2.98 -2.54 6.28 4.81 0.12 -4.81 118.16 121.40 2tmp n LYS 48 Ca 0.10 -1.51 0.00 0.00 -0.87 0.00 0.00 58.31 56.03 2tmp n LYS 48 Cb 0.38 -1.01 0.00 0.00 0.02 0.00 0.00 35.03 34.43 2tmp n LYS 48 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 2tmp n GLN 49 N -0.51 -1.03 -0.06 1.64 1.13 -1.26 -4.85 117.38 112.43 2tmp n GLN 49 Ca 0.00 0.99 -0.07 0.00 -1.94 0.00 0.00 57.00 55.98 2tmp n GLN 49 Cb 0.25 -0.67 -0.08 0.00 0.11 0.00 0.00 30.24 29.85 2tmp n GLN 49 CO 0.00 0.00 0.00 0.44 -1.44 0.00 0.00 177.06 176.06 2tmp n ILE 50 N 2.27 0.81 -4.01 5.09 -5.35 -1.26 -4.91 119.36 112.00 2tmp n ILE 50 Ca 0.00 -0.43 -0.09 0.00 -0.27 0.00 0.00 62.75 61.96 2tmp n ILE 50 Cb 0.00 -0.81 -0.08 0.00 -1.74 0.00 0.00 39.64 37.01 2tmp n ILE 50 CO 0.00 0.00 0.00 -0.75 -1.76 0.00 0.00 176.55 174.04 2tmp s LYS 51 N -2.28 0.90 -0.41 6.28 2.20 -1.25 -4.97 119.74 120.20 2tmp s LYS 51 Ca -0.11 -1.19 0.07 0.00 -0.36 0.00 0.00 55.97 54.38 2tmp s LYS 51 Cb 0.04 0.30 0.25 0.00 -1.51 0.00 0.00 37.83 36.90 2tmp s LYS 51 CO 0.43 -0.28 0.60 0.00 -0.36 0.00 0.00 175.35 175.74 2tmp n MET 52 N -0.08 0.71 0.00 4.03 0.00 -1.26 -2.58 117.12 117.94 2tmp n MET 52 Ca -0.10 -2.89 0.00 0.00 0.00 0.00 0.00 57.70 54.71 2tmp n MET 52 Cb 0.63 -1.28 0.00 0.00 0.00 0.00 0.00 33.22 32.57 2tmp n MET 52 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 175.97 177.16 2tmp n PHE 53 N 1.51 0.00 -3.60 3.17 3.72 0.96 -3.90 117.46 119.33 2tmp n PHE 53 Ca 0.19 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.31 2tmp n PHE 53 Cb 0.55 -0.10 -0.11 0.00 -0.94 0.00 0.00 39.48 38.88 2tmp n PHE 53 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 2tmp s LYS 54 N -1.47 1.49 0.00 -1.08 2.47 0.55 -4.93 119.74 116.78 2tmp s LYS 54 Ca 0.00 -2.54 0.00 0.00 -1.56 0.00 0.00 55.97 51.87 2tmp s LYS 54 Cb 0.00 -2.21 0.00 0.00 -1.46 0.00 0.00 37.83 34.16 2tmp s LYS 54 CO 0.00 -1.33 0.00 0.41 0.16 0.00 0.00 175.35 174.59 2tmp n GLY 55 N 2.59 6.57 0.54 5.54 0.00 -1.22 0.11 105.19 119.33 2tmp n GLY 55 Ca 0.24 -1.81 -0.04 0.00 0.00 0.00 0.00 46.02 44.42 2tmp n GLY 55 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2tmp n PRO 56 N 0.00 -0.75 -0.06 1.61 -0.04 -1.26 -4.97 135.00 129.53 2tmp n PRO 56 Ca 0.00 -0.28 -0.13 0.00 -0.04 0.00 0.00 63.50 63.05 2tmp n PRO 56 Cb 0.00 -0.22 -0.14 0.00 -0.04 0.00 0.00 33.50 33.10 2tmp n PRO 56 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2tmp n GLU 57 N -1.70 0.68 0.00 0.54 1.02 -1.26 -4.67 120.64 115.25 2tmp n GLU 57 Ca 0.02 0.18 0.00 0.00 -0.02 0.00 0.00 57.16 57.34 2tmp n GLU 57 Cb 0.09 -1.65 0.00 0.00 -0.02 0.00 0.00 31.44 29.85 2tmp n GLU 57 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 2tmp n LYS 58 N -3.08 0.00 0.00 3.49 4.81 -1.26 -5.09 118.16 117.03 2tmp n LYS 58 Ca -0.29 0.03 0.00 0.00 -0.87 0.00 0.00 58.31 57.18 2tmp n LYS 58 Cb 1.07 -0.71 0.00 0.00 0.02 0.00 0.00 35.03 35.41 2tmp n LYS 58 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 2tmp n ASP 59 N -0.59 0.00 0.00 3.14 -0.08 -1.26 -5.04 116.55 112.72 2tmp n ASP 59 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 2tmp n ASP 59 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 2tmp n ASP 59 CO 0.00 0.00 0.00 -0.38 0.12 0.00 0.00 177.20 176.94 2tmp n ILE 60 N -1.59 0.00 -0.02 5.18 2.08 -1.26 0.12 119.36 123.87 2tmp n ILE 60 Ca 0.00 0.05 0.00 0.00 0.56 0.00 0.00 62.75 63.36 2tmp n ILE 60 Cb 0.00 -0.90 0.00 0.00 -0.75 0.00 0.00 39.64 37.99 2tmp n ILE 60 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 2tmp n GLU 61 N -1.49 0.00 -3.47 0.38 1.02 -1.26 -4.34 120.64 111.47 2tmp n GLU 61 Ca 0.00 0.00 -0.25 0.00 -0.02 0.00 0.00 57.16 56.89 2tmp n GLU 61 Cb 0.00 -2.24 -0.12 0.00 -0.02 0.00 0.00 31.44 29.06 2tmp n GLU 61 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 2tmp s PHE 62 N -2.44 0.19 0.42 -0.32 0.08 -1.25 -1.12 117.98 113.54 2tmp s PHE 62 Ca 0.00 -0.92 0.07 0.00 0.12 0.00 0.00 56.93 56.21 2tmp s PHE 62 Cb 0.00 -0.76 0.01 0.00 -0.57 0.00 0.00 43.02 41.70 2tmp s PHE 62 CO 0.00 -0.86 0.57 0.42 -0.10 0.00 0.00 175.22 175.24 2tmp s ILE 63 N 1.82 3.13 0.11 0.64 -1.09 -1.08 -3.61 121.20 121.12 2tmp s ILE 63 Ca 0.12 -0.98 0.09 0.00 -2.23 0.00 0.00 60.65 57.65 2tmp s ILE 63 Cb -0.17 -3.06 -0.04 0.00 -1.58 0.00 0.00 42.46 37.61 2tmp s ILE 63 CO -0.23 -0.02 -0.23 -0.47 -1.23 0.00 0.00 174.94 172.76 2tmp s TYR 64 N -2.35 1.98 0.00 3.97 6.14 -1.20 0.64 117.35 126.54 2tmp s TYR 64 Ca 0.54 -0.40 0.00 0.00 0.64 0.00 0.00 57.07 57.84 2tmp s TYR 64 Cb -0.10 -1.08 0.00 0.00 0.42 0.00 0.00 41.96 41.20 2tmp s TYR 64 CO 0.33 0.25 0.00 -2.37 0.64 0.00 0.00 175.55 174.40 2tmp n THR 65 N 1.02 0.00 -4.12 4.34 5.66 -0.87 -2.96 114.28 117.34 2tmp n THR 65 Ca -0.19 0.00 -0.27 0.00 -3.05 0.00 0.00 64.05 60.54 2tmp n THR 65 Cb 0.53 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.25 2tmp n THR 65 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2tmp s ALA 66 N -1.00 3.42 1.00 1.79 0.00 -1.26 -2.87 121.76 122.84 2tmp s ALA 66 Ca 0.00 -1.22 0.00 0.00 0.00 0.00 0.00 51.96 50.74 2tmp s ALA 66 Cb 0.00 -1.24 0.00 0.00 0.00 0.00 0.00 23.12 21.88 2tmp s ALA 66 CO 0.00 0.56 0.00 -0.35 0.00 0.00 0.00 175.76 175.97 2tmp n PRO 67 N -0.05 1.13 0.00 0.00 -0.04 -1.26 -4.53 135.00 130.26 2tmp n PRO 67 Ca -0.09 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.37 2tmp n PRO 67 Cb 0.54 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.00 2tmp n PRO 67 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2tmp n SER 68 N 0.00 -5.09 -2.05 3.54 7.64 -1.26 -2.97 113.62 113.44 2tmp n SER 68 Ca 0.00 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.80 2tmp n SER 68 Cb 0.00 0.00 -0.12 0.00 -1.01 0.00 0.00 64.21 63.08 2tmp n SER 68 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2tmp n SER 69 N -3.06 4.17 -2.19 6.43 2.88 -1.26 -4.67 113.62 115.92 2tmp n SER 69 Ca 0.00 -2.26 -0.04 0.00 -1.33 0.00 0.00 58.87 55.24 2tmp n SER 69 Cb 0.00 -1.10 -0.03 0.00 -0.75 0.00 0.00 64.21 62.33 2tmp n SER 69 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2tmp n ALA 70 N 2.49 -3.47 -0.06 -1.46 0.00 -1.16 -4.86 120.51 111.99 2tmp n ALA 70 Ca 0.30 1.57 -0.07 0.00 0.00 0.00 0.00 53.44 55.24 2tmp n ALA 70 Cb 0.69 -3.07 -0.08 0.00 0.00 0.00 0.00 19.45 17.00 2tmp n ALA 70 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2tmp n VAL 71 N 1.08 0.77 -0.36 0.00 0.24 -1.22 -4.63 118.33 114.20 2tmp n VAL 71 Ca -0.27 -0.39 0.00 0.00 -2.04 0.00 0.00 64.34 61.64 2tmp n VAL 71 Cb 0.42 -0.84 0.00 0.00 -1.47 0.00 0.00 33.84 31.95 2tmp n VAL 71 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2tmp n GLY 73 N -0.27 4.44 0.13 0.00 0.00 -1.26 0.19 105.19 108.41 2tmp n GLY 73 Ca 0.00 -0.81 0.01 0.00 0.00 0.00 0.00 46.02 45.22 2tmp n GLY 73 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2tmp n VAL 74 N 0.00 0.38 -1.92 1.61 0.31 -1.26 -3.83 118.33 113.63 2tmp n VAL 74 Ca 0.00 -0.69 -0.11 0.00 -0.01 0.00 0.00 64.34 63.52 2tmp n VAL 74 Cb 0.00 0.84 0.01 0.00 -0.91 0.00 0.00 33.84 33.79 2tmp n VAL 74 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2tmp n SER 75 N 0.00 -2.42 -4.64 4.52 3.41 -1.26 -4.74 113.62 108.49 2tmp n SER 75 Ca 0.02 0.00 -0.35 0.00 -0.26 0.00 0.00 58.87 58.29 2tmp n SER 75 Cb 0.16 -0.66 -0.10 0.00 -0.26 0.00 0.00 64.21 63.35 2tmp n SER 75 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2tmp s LEU 76 N -0.83 3.84 0.00 1.04 1.02 -1.26 -4.76 118.68 117.73 2tmp s LEU 76 Ca 0.11 0.09 0.03 0.00 0.02 0.00 0.00 54.13 54.38 2tmp s LEU 76 Cb -0.01 -1.97 -0.02 0.00 0.02 0.00 0.00 46.19 44.20 2tmp s LEU 76 CO 0.25 0.17 0.21 -0.90 0.02 0.00 0.00 176.35 176.10 2tmp n ASP 77 N 3.57 0.34 0.00 2.29 5.68 -1.23 -4.72 116.55 122.47 2tmp n ASP 77 Ca -0.16 -0.67 0.00 0.00 -0.50 0.00 0.00 54.79 53.46 2tmp n ASP 77 Cb 0.52 0.84 0.00 0.00 -1.14 0.00 0.00 41.12 41.34 2tmp n ASP 77 CO 0.00 0.00 0.00 0.52 -1.33 0.00 0.00 177.20 176.39 2tmp n VAL 78 N -0.87 0.00 0.15 2.12 0.31 -0.58 -3.95 118.33 115.51 2tmp n VAL 78 Ca 0.01 0.00 0.04 0.00 -0.01 0.00 0.00 64.34 64.38 2tmp n VAL 78 Cb 0.06 0.00 0.20 0.00 -0.91 0.00 0.00 33.84 33.19 2tmp n VAL 78 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2tmp n GLY 79 N -0.23 -0.72 0.00 2.92 0.00 -1.26 -2.99 105.19 102.92 2tmp n GLY 79 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2tmp n GLY 79 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2tmp n GLY 80 N -1.07 0.00 0.00 -0.02 0.00 -1.26 -5.03 105.19 97.81 2tmp n GLY 80 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2tmp n GLY 80 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2tmp n LYS 81 N -1.66 0.00 0.00 1.61 0.00 -1.16 -5.10 118.16 111.86 2tmp n LYS 81 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 2tmp n LYS 81 Cb 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.32 2tmp n LYS 81 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 2tmp n LYS 82 N 0.00 0.00 -3.68 -1.58 2.85 -1.23 -4.90 118.16 109.61 2tmp n LYS 82 Ca 0.00 0.00 -0.08 0.00 -1.05 0.00 0.00 58.31 57.18 2tmp n LYS 82 Cb 0.00 0.00 -0.02 0.00 -0.65 0.00 0.00 35.03 34.36 2tmp n LYS 82 CO 0.00 0.00 0.00 -1.83 -0.05 0.00 0.00 177.40 175.52 2tmp s GLU 83 N 0.00 1.46 0.01 -1.58 -1.05 -1.26 -4.43 118.70 111.85 2tmp s GLU 83 Ca 0.00 -0.72 -0.14 0.00 -0.15 0.00 0.00 54.97 53.95 2tmp s GLU 83 Cb 0.00 0.55 0.02 0.00 -0.44 0.00 0.00 34.13 34.26 2tmp s GLU 83 CO 0.00 -0.66 0.31 1.52 0.95 0.00 0.00 175.26 177.38 2tmp s TYR 84 N -3.70 -0.14 -2.09 4.83 -0.85 0.16 -3.32 117.35 112.24 2tmp s TYR 84 Ca 0.08 0.12 0.18 0.00 -0.52 0.00 0.00 57.07 56.92 2tmp s TYR 84 Cb -0.03 0.10 0.88 0.00 0.38 0.00 0.00 41.96 43.29 2tmp s TYR 84 CO -0.01 -0.45 1.59 1.47 -1.52 0.00 0.00 175.55 176.64 2tmp n LEU 85 N 0.94 0.58 0.00 -3.49 -0.00 -1.07 -0.87 117.00 113.09 2tmp n LEU 85 Ca -0.20 -0.25 0.00 0.00 -0.00 0.00 0.00 56.01 55.56 2tmp n LEU 85 Cb 0.58 -0.04 0.00 0.00 -0.00 0.00 0.00 43.42 43.96 2tmp n LEU 85 CO 0.22 0.12 0.00 -0.38 -0.00 0.00 0.00 177.39 177.35 2tmp n ILE 86 N -0.38 0.00 -3.84 1.47 -0.00 -1.07 0.12 119.36 115.67 2tmp n ILE 86 Ca 0.13 0.00 -0.29 0.00 -0.00 0.00 0.00 62.75 62.59 2tmp n ILE 86 Cb 0.15 0.00 -0.16 0.00 -0.00 0.00 0.00 39.64 39.63 2tmp n ILE 86 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2tmp s ALA 87 N 0.00 1.53 0.33 -1.39 0.00 -0.80 -2.46 121.76 118.97 2tmp s ALA 87 Ca 0.00 -1.09 0.01 0.00 0.00 0.00 0.00 51.96 50.88 2tmp s ALA 87 Cb 0.00 -1.33 -0.01 0.00 0.00 0.00 0.00 23.12 21.78 2tmp s ALA 87 CO 0.00 -1.21 0.39 0.20 0.00 0.00 0.00 175.76 175.14 2tmp s GLY 88 N 1.60 1.77 0.36 0.00 0.00 -1.23 -3.26 107.32 106.55 2tmp s GLY 88 Ca -0.03 -1.71 0.15 0.00 0.00 0.00 0.00 44.72 43.13 2tmp s GLY 88 CO -0.08 -1.18 1.71 0.07 0.00 0.00 0.00 173.10 173.63 2tmp h LYS 89 N 2.15 0.41 0.00 2.90 2.10 -1.78 0.59 116.57 122.93 2tmp h LYS 89 Ca -0.27 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.35 2tmp h LYS 89 Cb 1.24 -0.09 0.00 0.00 -0.90 0.00 0.00 32.23 32.48 2tmp h LYS 89 CO 0.39 0.27 0.00 0.00 -2.00 0.00 0.00 179.45 178.10 2tmp n ALA 90 N -2.37 0.00 -0.73 0.07 0.00 -1.23 -4.43 120.51 111.83 2tmp n ALA 90 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.73 2tmp n ALA 90 Cb 0.91 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.36 2tmp n ALA 90 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2tmp n GLU 91 N -0.93 0.38 0.00 0.00 4.07 -1.23 -4.05 120.64 118.88 2tmp n GLU 91 Ca 0.00 -0.52 0.00 0.00 -0.06 0.00 0.00 57.16 56.58 2tmp n GLU 91 Cb 0.00 -0.64 0.00 0.00 -0.06 0.00 0.00 31.44 30.74 2tmp n GLU 91 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2tmp n GLY 92 N -0.08 0.36 3.13 8.31 0.00 -1.15 -4.83 105.19 110.93 2tmp n GLY 92 Ca 0.00 -1.07 -0.20 0.00 0.00 0.00 0.00 46.02 44.75 2tmp n GLY 92 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2tmp s ASP 93 N -4.00 1.62 0.00 1.61 1.11 -1.26 -4.69 116.67 111.05 2tmp s ASP 93 Ca 0.00 -0.41 0.00 0.00 0.18 0.00 0.00 52.55 52.32 2tmp s ASP 93 Cb 0.00 -0.12 0.00 0.00 1.07 0.00 0.00 42.92 43.87 2tmp s ASP 93 CO 0.00 0.06 0.00 0.61 1.18 0.00 0.00 175.17 177.02 2tmp n GLY 94 N 2.10 1.76 3.63 0.21 0.00 0.32 -4.90 105.19 108.31 2tmp n GLY 94 Ca -0.17 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.80 2tmp n GLY 94 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2tmp s LYS 95 N -0.04 0.22 0.00 1.61 0.00 -1.25 -3.98 119.74 116.30 2tmp s LYS 95 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 55.97 56.14 2tmp s LYS 95 Cb 0.00 0.11 0.00 0.00 0.00 0.00 0.00 37.83 37.94 2tmp s LYS 95 CO 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 175.35 175.30 2tmp n MET 96 N 1.31 0.00 -4.39 1.78 0.00 -1.24 -2.94 117.12 111.64 2tmp n MET 96 Ca -0.08 0.00 -0.24 0.00 0.00 0.00 0.00 57.70 57.38 2tmp n MET 96 Cb 0.57 0.00 -0.17 0.00 0.00 0.00 0.00 33.22 33.63 2tmp n MET 96 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 175.97 174.96 2tmp s HIS 97 N -3.62 1.29 0.00 3.17 3.76 -1.26 -3.21 115.29 115.43 2tmp s HIS 97 Ca 0.00 -0.48 -0.00 0.00 -0.15 0.00 0.00 55.06 54.42 2tmp s HIS 97 Cb 0.00 -1.00 -0.00 0.00 1.11 0.00 0.00 32.58 32.69 2tmp s HIS 97 CO 0.00 -0.29 0.00 0.96 -0.85 0.00 0.00 174.74 174.56 2tmp s ILE 98 N 0.87 0.02 0.14 0.60 -4.36 -1.16 -3.47 121.20 113.84 2tmp s ILE 98 Ca -0.11 -0.13 0.00 0.00 -0.26 0.00 0.00 60.65 60.15 2tmp s ILE 98 Cb -0.15 -0.05 -0.04 0.00 1.25 0.00 0.00 42.46 43.47 2tmp s ILE 98 CO 0.01 -0.07 0.03 0.42 0.24 0.00 0.00 174.94 175.57 2tmp s THR 99 N -0.21 0.33 0.13 8.37 -4.23 -1.25 -4.36 115.64 114.42 2tmp s THR 99 Ca -0.02 -1.93 -0.19 0.00 -1.18 0.00 0.00 61.69 58.37 2tmp s THR 99 Cb -0.01 -2.03 -0.04 0.00 1.34 0.00 0.00 72.50 71.76 2tmp s THR 99 CO -0.00 -0.52 1.76 0.17 -0.54 0.00 0.00 174.62 175.50 2tmp h LEU 100 N 2.83 0.17 -2.09 4.79 -0.00 -0.36 0.34 115.31 120.99 2tmp h LEU 100 Ca -0.36 0.01 -0.01 0.00 -0.00 0.00 0.00 57.88 57.52 2tmp h LEU 100 Cb 1.20 -0.02 -0.00 0.00 -0.00 0.00 0.00 40.66 41.83 2tmp h LEU 100 CO 0.61 0.13 -0.05 0.00 -0.00 0.00 0.00 178.44 179.13 2tmp s ASP 102 N -6.61 4.84 -0.16 0.00 -1.08 0.11 -4.68 116.67 109.08 2tmp s ASP 102 Ca -0.05 1.13 -0.29 0.00 -0.52 0.00 0.00 52.55 52.82 2tmp s ASP 102 Cb 0.16 -1.85 -0.03 0.00 -1.46 0.00 0.00 42.92 39.73 2tmp s ASP 102 CO 0.62 -1.73 1.54 0.12 0.52 0.00 0.00 175.17 176.24 2tmp s PHE 103 N -3.31 2.24 -0.28 -5.34 5.36 -1.20 -4.73 117.98 110.72 2tmp s PHE 103 Ca 0.60 0.54 -0.21 0.00 -0.96 0.00 0.00 56.93 56.91 2tmp s PHE 103 Cb -0.12 -3.86 0.11 0.00 -0.34 0.00 0.00 43.02 38.81 2tmp s PHE 103 CO 0.52 -2.92 0.88 0.96 -1.46 0.00 0.00 175.22 173.20 2tmp s ILE 104 N 4.43 0.00 0.10 3.12 -4.36 -1.26 -1.91 121.20 121.32 2tmp s ILE 104 Ca 0.68 0.00 -0.17 0.00 -0.26 0.00 0.00 60.65 60.90 2tmp s ILE 104 Cb -0.27 -1.00 0.04 0.00 1.25 0.00 0.00 42.46 42.48 2tmp s ILE 104 CO 0.26 0.00 0.41 0.68 0.24 0.00 0.00 174.94 176.52 2tmp s VAL 105 N 0.87 0.07 -1.88 8.37 -7.23 -1.26 -5.00 120.40 114.34 2tmp s VAL 105 Ca -0.04 -0.54 0.00 0.00 -1.81 0.00 0.00 61.98 59.59 2tmp s VAL 105 Cb -0.05 -1.11 0.00 0.00 0.56 0.00 0.00 36.38 35.78 2tmp s VAL 105 CO -0.10 -0.30 0.70 -0.81 -0.31 0.00 0.00 175.10 174.28 2tmp n PRO 106 N -0.03 0.75 0.00 4.82 -0.04 -1.26 -2.58 135.00 136.66 2tmp n PRO 106 Ca -0.17 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.29 2tmp n PRO 106 Cb 0.63 -1.04 0.00 0.00 -0.04 0.00 0.00 33.50 33.04 2tmp n PRO 106 CO 0.00 0.00 0.00 1.87 -0.04 0.00 0.00 175.50 177.33 2tmp n TRP 107 N -0.43 0.00 -0.54 0.54 -0.00 -1.21 -4.17 117.44 111.64 2tmp n TRP 107 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 57.50 57.39 2tmp n TRP 107 Cb 0.02 0.00 -0.06 0.00 -0.00 0.00 0.00 31.31 31.28 2tmp n TRP 107 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 177.69 174.22 2tmp n ASP 108 N 2.31 3.15 0.09 5.87 2.03 -1.26 -2.57 116.55 126.17 2tmp n ASP 108 Ca 0.00 -2.08 0.00 0.00 0.52 0.00 0.00 54.79 53.23 2tmp n ASP 108 Cb 0.00 -0.80 0.00 0.00 -0.72 0.00 0.00 41.12 39.60 2tmp n ASP 108 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 2tmp n THR 109 N 3.34 0.00 0.00 5.18 -2.24 -1.26 -5.07 114.28 114.22 2tmp n THR 109 Ca 0.27 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.05 2tmp n THR 109 Cb 0.32 -0.03 0.00 0.00 -2.10 0.00 0.00 70.33 68.52 2tmp n THR 109 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2tmp n LEU 110 N -2.87 0.00 0.00 3.22 4.77 -1.06 -4.79 117.00 116.27 2tmp n LEU 110 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2tmp n LEU 110 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2tmp n LEU 110 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.39 174.86 2tmp n SER 111 N 0.00 0.00 0.00 -1.43 7.64 -1.26 -4.89 113.62 113.68 2tmp n SER 111 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2tmp n SER 111 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2tmp n SER 111 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2tmp n THR 112 N 0.00 0.00 -0.02 0.44 -1.04 -1.26 -4.93 114.28 107.46 2tmp n THR 112 Ca 0.00 0.00 0.24 0.00 -2.04 0.00 0.00 64.05 62.25 2tmp n THR 112 Cb 0.00 0.00 0.68 0.00 -1.82 0.00 0.00 70.33 69.19 2tmp n THR 112 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 2tmp h THR 113 N 0.00 0.29 0.13 12.58 2.02 -1.92 0.90 112.91 126.91 2tmp h THR 113 Ca 0.00 0.00 -0.31 0.00 0.77 0.00 0.00 66.41 66.87 2tmp h THR 113 Cb 0.00 0.48 -0.00 0.00 -1.74 0.00 0.00 68.15 66.88 2tmp h THR 113 CO 0.00 0.00 -1.54 1.56 0.37 0.00 0.00 175.52 175.91 2tmp h GLN 114 N 0.00 0.28 -0.33 6.66 7.50 -1.91 -3.24 115.11 124.07 2tmp h GLN 114 Ca 0.30 -0.47 -0.12 0.00 0.50 0.00 0.00 58.65 58.86 2tmp h GLN 114 Cb 1.62 0.18 -0.01 0.00 0.05 0.00 0.00 27.48 29.32 2tmp h GLN 114 CO -0.00 1.15 -0.25 0.87 -1.50 0.00 0.00 178.83 179.10 2tmp h LYS 115 N 0.08 0.75 0.00 1.46 1.57 0.22 -1.80 116.57 118.84 2tmp h LYS 115 Ca -0.25 -0.37 0.00 0.00 -1.87 0.00 0.00 60.65 58.16 2tmp h LYS 115 Cb 2.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.34 2tmp h LYS 115 CO 0.17 0.99 0.00 1.57 -0.57 0.00 0.00 179.45 181.61 2tmp h LYS 116 N 0.52 0.00 0.00 3.15 5.09 -0.33 0.22 116.57 125.21 2tmp h LYS 116 Ca 0.06 0.00 -0.05 0.00 0.09 0.00 0.00 60.65 60.75 2tmp h LYS 116 Cb 0.82 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 33.14 2tmp h LYS 116 CO 0.07 0.00 -1.58 0.45 -2.09 0.00 0.00 179.45 176.29 2tmp n SER 117 N -2.30 0.43 0.23 7.07 2.88 -0.80 -3.92 113.62 117.21 2tmp n SER 117 Ca -0.01 0.17 0.06 0.00 -1.33 0.00 0.00 58.87 57.77 2tmp n SER 117 Cb 0.08 1.09 0.53 0.00 -0.75 0.00 0.00 64.21 65.16 2tmp n SER 117 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 2tmp h LEU 118 N 0.00 0.00 -0.09 2.46 3.38 0.24 0.74 115.31 122.05 2tmp h LEU 118 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2tmp h LEU 118 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 2tmp h LEU 118 CO 0.01 0.18 -0.36 -0.46 0.09 0.00 0.00 178.44 177.90 2tmp n ASN 119 N -4.22 0.50 -0.11 -0.43 6.94 -1.18 -3.41 115.26 113.34 2tmp n ASN 119 Ca -0.02 -0.25 0.06 0.00 -0.02 0.00 0.00 54.58 54.34 2tmp n ASN 119 Cb 0.25 0.09 0.30 0.00 -2.36 0.00 0.00 39.78 38.06 2tmp n ASN 119 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 2tmp n HIS 120 N -1.33 0.06 0.00 -2.53 8.25 0.25 -4.92 115.22 115.00 2tmp n HIS 120 Ca 0.07 -0.03 0.00 0.00 -0.26 0.00 0.00 57.72 57.50 2tmp n HIS 120 Cb 0.33 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.44 2tmp n HIS 120 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2tmp n ARG 121 N -0.46 0.00 -3.32 -0.41 5.12 -1.22 -2.98 116.66 113.39 2tmp n ARG 121 Ca 0.09 0.00 -0.12 0.00 -1.93 0.00 0.00 57.85 55.89 2tmp n ARG 121 Cb 0.09 0.00 -0.06 0.00 -1.16 0.00 0.00 32.46 31.33 2tmp n ARG 121 CO 0.00 0.00 0.00 -0.47 -1.93 0.00 0.00 177.63 175.23 2tmp s TYR 122 N 0.00 -0.73 -0.84 -1.55 5.04 -1.26 -4.50 117.35 113.51 2tmp s TYR 122 Ca 0.00 -0.43 -0.03 0.00 -2.44 0.00 0.00 57.07 54.16 2tmp s TYR 122 Cb 0.00 -0.20 -0.01 0.00 0.35 0.00 0.00 41.96 42.10 2tmp s TYR 122 CO 0.00 -1.02 0.72 0.94 -1.34 0.00 0.00 175.55 174.85 2tmp n GLN 123 N 4.41 -1.47 -0.53 4.97 7.27 -1.05 -4.74 117.38 126.23 2tmp n GLN 123 Ca 0.10 1.16 -0.14 0.00 0.07 0.00 0.00 57.00 58.19 2tmp n GLN 123 Cb 0.49 -4.97 -0.03 0.00 2.41 0.00 0.00 30.24 28.13 2tmp n GLN 123 CO 0.00 0.00 0.00 -1.33 0.07 0.00 0.00 177.06 175.80 2tmp n MET 124 N -2.40 1.41 -1.96 3.69 2.81 -1.16 -4.33 117.12 115.18 2tmp n MET 124 Ca -0.08 -1.03 -0.10 0.00 -1.81 0.00 0.00 57.70 54.68 2tmp n MET 124 Cb 0.56 -2.18 -0.02 0.00 -0.71 0.00 0.00 33.22 30.87 2tmp n MET 124 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2tmp n GLY 125 N 3.55 0.13 0.42 3.03 0.00 -1.26 -4.90 105.19 106.16 2tmp n GLY 125 Ca 0.30 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.29 2tmp n GLY 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32