#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 -5.49 -4.62 0.00 3.41 0.22 -4.91 113.62 102.22 2tmp n SER 2 Ca 0.00 0.07 -0.29 0.00 -0.26 0.00 0.00 58.87 58.39 2tmp n SER 2 Cb 0.00 -3.48 0.19 0.00 -0.26 0.00 0.00 64.21 60.66 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 -2.99 5.85 -0.08 0.00 1.04 -1.26 -4.74 113.70 111.53 2tmp s SER 4 Ca 0.66 -1.18 -0.30 0.00 0.48 0.00 0.00 55.95 55.61 2tmp s SER 4 Cb -0.21 -2.07 -0.03 0.00 0.10 0.00 0.00 66.02 63.81 2tmp s SER 4 CO 0.60 -0.49 1.23 -2.16 0.98 0.00 0.00 173.24 173.40 2tmp s PRO 5 N 1.56 4.32 0.00 4.02 0.04 -1.26 -4.85 135.00 138.83 2tmp s PRO 5 Ca 0.03 1.69 0.00 0.00 0.04 0.00 0.00 61.00 62.76 2tmp s PRO 5 Cb -0.21 -3.61 0.00 0.00 0.04 0.00 0.00 34.50 30.72 2tmp s PRO 5 CO 0.06 -0.52 0.00 1.55 0.04 0.00 0.00 177.00 178.13 2tmp n VAL 6 N 4.80 0.00 -3.29 -0.36 3.14 -1.26 -5.06 118.33 116.30 2tmp n VAL 6 Ca 0.12 0.00 -0.19 0.00 -2.96 0.00 0.00 64.34 61.31 2tmp n VAL 6 Cb 0.46 0.00 0.02 0.00 -1.06 0.00 0.00 33.84 33.26 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 -1.30 1.50 1.45 1.44 -1.26 -4.74 115.22 112.31 2tmp n HIS 7 Ca 0.00 0.54 0.11 0.00 -2.01 0.00 0.00 57.72 56.36 2tmp n HIS 7 Cb 0.00 -1.33 0.63 0.00 0.12 0.00 0.00 29.99 29.41 2tmp n HIS 7 CO 0.00 0.00 0.00 -0.35 -2.81 0.00 0.00 176.34 173.18 2tmp n PRO 8 N 0.56 0.75 0.00 -1.40 -0.04 -1.26 -2.76 135.00 130.85 2tmp n PRO 8 Ca -0.04 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.42 2tmp n PRO 8 Cb 0.58 -1.44 0.00 0.00 -0.04 0.00 0.00 33.50 32.59 2tmp n PRO 8 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2tmp n GLN 9 N -0.94 0.00 0.00 0.54 -0.06 -1.26 -2.91 117.38 112.74 2tmp n GLN 9 Ca 0.16 0.00 0.04 0.00 -2.00 0.00 0.00 57.00 55.20 2tmp n GLN 9 Cb 0.07 -0.39 0.19 0.00 -4.06 0.00 0.00 30.24 26.06 2tmp n GLN 9 CO 0.00 0.00 0.00 1.04 -0.20 0.00 0.00 177.06 177.90 2tmp n GLN 10 N -1.88 0.12 0.09 3.69 6.02 -1.25 -1.30 117.38 122.88 2tmp n GLN 10 Ca 0.00 0.20 -0.20 0.00 -0.01 0.00 0.00 57.00 56.99 2tmp n GLN 10 Cb 0.04 -1.50 -0.15 0.00 1.02 0.00 0.00 30.24 29.65 2tmp n GLN 10 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2tmp h ALA 11 N 2.36 0.10 -0.06 -1.58 0.00 -1.81 -2.38 119.26 115.89 2tmp h ALA 11 Ca 0.00 -1.02 0.00 0.00 0.00 0.00 0.00 54.91 53.89 2tmp h ALA 11 Cb 0.06 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2tmp h ALA 11 CO 0.00 0.97 0.00 1.19 0.00 0.00 0.00 179.25 181.41 2tmp n PHE 12 N -3.57 0.07 0.21 0.00 3.01 -0.42 -1.98 117.46 114.78 2tmp n PHE 12 Ca -0.17 -0.03 0.05 0.00 1.01 0.00 0.00 57.45 58.30 2tmp n PHE 12 Cb 1.07 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 40.47 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 -1.54 1.86 -4.28 0.00 2.85 -0.90 -4.60 115.26 108.65 2tmp n ASN 14 Ca -0.00 -0.02 -0.30 0.00 -0.11 0.00 0.00 54.58 54.15 2tmp n ASN 14 Cb 0.20 -0.43 0.23 0.00 1.24 0.00 0.00 39.78 41.02 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 -3.14 -3.63 -1.69 5.20 0.00 -0.84 -4.61 120.51 111.80 2tmp n ALA 15 Ca -0.41 -1.31 0.00 0.00 0.00 0.00 0.00 53.44 51.72 2tmp n ALA 15 Cb 1.02 -1.72 0.00 0.00 0.00 0.00 0.00 19.45 18.75 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 -3.54 0.00 -3.03 0.00 9.92 -1.25 -4.85 116.55 113.79 2tmp n ASP 16 Ca 0.02 -1.27 0.01 0.00 -0.53 0.00 0.00 54.79 53.02 2tmp n ASP 16 Cb 0.57 -0.05 -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 -0.71 -0.30 2.53 0.11 -1.17 -4.69 120.40 116.18 2tmp s VAL 17 Ca 0.00 -0.03 -0.11 0.00 -2.93 0.00 0.00 61.98 58.91 2tmp s VAL 17 Cb 0.00 0.00 -0.03 0.00 -1.53 0.00 0.00 36.38 34.82 2tmp s VAL 17 CO 0.00 0.00 0.18 -0.69 -3.33 0.00 0.00 175.10 171.26 2tmp s VAL 18 N 1.85 5.08 -0.08 2.04 1.01 0.27 -3.49 120.40 127.08 2tmp s VAL 18 Ca 0.16 -0.06 -0.03 0.00 0.00 0.00 0.00 61.98 62.04 2tmp s VAL 18 Cb -0.01 -3.49 0.04 0.00 0.00 0.00 0.00 36.38 32.92 2tmp s VAL 18 CO -0.10 0.16 0.16 0.27 0.00 0.00 0.00 175.10 175.60 2tmp s ILE 19 N 1.71 -0.16 0.00 2.22 -4.36 0.37 0.23 121.20 121.21 2tmp s ILE 19 Ca 0.06 0.26 0.00 0.00 -0.26 0.00 0.00 60.65 60.71 2tmp s ILE 19 Cb -0.16 -0.28 0.00 0.00 1.25 0.00 0.00 42.46 43.27 2tmp s ILE 19 CO 0.09 0.11 1.69 0.54 0.24 0.00 0.00 174.94 177.61 2tmp n ARG 20 N 4.74 0.86 -0.57 0.37 1.74 -0.88 -2.71 116.66 120.22 2tmp n ARG 20 Ca -0.16 0.00 -0.28 0.00 -0.77 0.00 0.00 57.85 56.64 2tmp n ARG 20 Cb 0.51 -1.07 0.26 0.00 -1.02 0.00 0.00 32.46 31.14 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 0.27 1.94 -0.14 0.55 -1.32 -0.13 -3.82 115.64 112.99 2tmp s THR 21 Ca 0.00 0.00 0.01 0.00 -1.21 0.00 0.00 61.69 60.49 2tmp s THR 21 Cb 0.00 -2.09 0.02 0.00 -1.51 0.00 0.00 72.50 68.92 2tmp s THR 21 CO 0.00 0.00 -0.15 -1.59 -2.21 0.00 0.00 174.62 170.67 2tmp s LYS 22 N -4.54 2.32 -0.53 7.08 -2.85 -1.26 -0.84 119.74 119.12 2tmp s LYS 22 Ca 0.68 -0.58 -0.19 0.00 -1.00 0.00 0.00 55.97 54.88 2tmp s LYS 22 Cb -0.24 -2.07 0.07 0.00 -2.06 0.00 0.00 37.83 33.53 2tmp s LYS 22 CO 0.64 -0.18 0.67 0.00 0.10 0.00 0.00 175.35 176.58 2tmp s ALA 23 N 1.32 3.37 -0.15 0.59 0.00 -1.26 0.27 121.76 125.89 2tmp s ALA 23 Ca 0.01 -1.81 0.05 0.00 0.00 0.00 0.00 51.96 50.21 2tmp s ALA 23 Cb -0.13 -3.43 -0.13 0.00 0.00 0.00 0.00 23.12 19.43 2tmp s ALA 23 CO -0.08 -2.12 -0.08 1.33 0.00 0.00 0.00 175.76 174.81 2tmp n VAL 24 N 5.65 0.93 -4.22 0.00 0.24 -1.25 -0.39 118.33 119.28 2tmp n VAL 24 Ca -0.07 -0.43 -0.24 0.00 -2.04 0.00 0.00 64.34 61.56 2tmp n VAL 24 Cb 0.45 -0.94 -0.08 0.00 -1.47 0.00 0.00 33.84 31.81 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 -5.26 4.37 0.36 -1.34 0.15 -1.03 -4.85 113.70 106.10 2tmp s SER 25 Ca -0.17 -0.98 -0.03 0.00 0.70 0.00 0.00 55.95 55.46 2tmp s SER 25 Cb 0.05 -0.56 0.01 0.00 -1.71 0.00 0.00 66.02 63.82 2tmp s SER 25 CO 0.44 -0.36 0.53 -0.62 1.20 0.00 0.00 173.24 174.43 2tmp n GLU 26 N -1.10 0.77 -3.51 5.44 4.71 -1.26 -0.02 120.64 125.67 2tmp n GLU 26 Ca -0.03 -2.78 -0.13 0.00 -0.01 0.00 0.00 57.16 54.22 2tmp n GLU 26 Cb 0.63 2.75 -0.11 0.00 -1.01 0.00 0.00 31.44 33.70 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 -2.73 0.24 -0.94 3.49 2.20 -1.24 -4.72 119.74 116.04 2tmp s LYS 27 Ca 0.28 0.56 -0.24 0.00 -0.36 0.00 0.00 55.97 56.21 2tmp s LYS 27 Cb -0.01 -0.47 0.00 0.00 -1.51 0.00 0.00 37.83 35.84 2tmp s LYS 27 CO 0.20 -0.50 1.67 -2.00 -0.36 0.00 0.00 175.35 174.36 2tmp s GLU 28 N 2.45 3.09 -0.72 4.03 2.12 -1.26 0.16 118.70 128.57 2tmp s GLU 28 Ca 0.06 -0.66 -0.16 0.00 0.36 0.00 0.00 54.97 54.57 2tmp s GLU 28 Cb -0.14 -5.15 0.16 0.00 0.26 0.00 0.00 34.13 29.26 2tmp s GLU 28 CO -0.12 -2.73 0.75 0.14 -0.54 0.00 0.00 175.26 172.75 2tmp s VAL 29 N 7.38 5.21 0.43 3.70 -7.23 -1.26 -4.96 120.40 123.67 2tmp s VAL 29 Ca 0.57 -1.78 -0.22 0.00 -1.81 0.00 0.00 61.98 58.74 2tmp s VAL 29 Cb -0.04 -4.49 -0.13 0.00 0.56 0.00 0.00 36.38 32.28 2tmp s VAL 29 CO -0.04 -1.09 0.44 0.47 -0.31 0.00 0.00 175.10 174.57 2tmp n ASP 30 N 5.19 -1.35 -0.19 4.85 9.92 -1.26 -2.38 116.55 131.32 2tmp n ASP 30 Ca 0.04 0.87 0.02 0.00 -0.53 0.00 0.00 54.79 55.19 2tmp n ASP 30 Cb 0.45 -1.07 0.03 0.00 -0.64 0.00 0.00 41.12 39.89 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 1.45 0.74 -0.59 -2.24 2.88 -1.26 -4.75 113.62 109.85 2tmp n SER 31 Ca 0.11 -1.91 0.04 0.00 -1.33 0.00 0.00 58.87 55.79 2tmp n SER 31 Cb 0.40 -0.15 -0.01 0.00 -0.75 0.00 0.00 64.21 63.70 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 -0.34 -1.78 3.91 0.46 0.00 -1.26 -4.59 105.19 101.59 2tmp n GLY 32 Ca 0.03 -1.27 -0.28 0.00 0.00 0.00 0.00 46.02 44.50 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 -4.25 5.43 0.03 1.61 -0.87 -1.26 0.27 114.94 115.91 2tmp s ASN 33 Ca 0.00 0.80 0.00 0.00 -1.57 0.00 0.00 52.86 52.09 2tmp s ASN 33 Cb 0.00 -1.69 0.00 0.00 -0.02 0.00 0.00 41.25 39.54 2tmp s ASN 33 CO 0.00 -1.22 0.00 -0.67 -2.57 0.00 0.00 177.10 172.64 2tmp n ASP 34 N -2.76 0.00 -0.08 -1.22 2.03 0.58 -4.62 116.55 110.49 2tmp n ASP 34 Ca 0.06 -0.15 0.14 0.00 0.52 0.00 0.00 54.79 55.36 2tmp n ASP 34 Cb 0.58 0.00 0.79 0.00 -0.72 0.00 0.00 41.12 41.76 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 -0.18 0.01 0.56 5.18 -0.00 -1.26 -2.68 119.36 120.99 2tmp n ILE 35 Ca 0.00 -0.04 0.07 0.00 -0.00 0.00 0.00 62.75 62.77 2tmp n ILE 35 Cb 0.00 -0.30 0.05 0.00 -0.00 0.00 0.00 39.64 39.39 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 -0.76 0.00 -0.07 1.39 9.36 -1.26 -4.95 117.16 120.86 2tmp n TYR 36 Ca 0.21 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.43 2tmp n TYR 36 Cb 0.14 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.85 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 0.79 1.69 3.83 2.98 0.00 -1.09 -5.03 105.19 108.36 2tmp n GLY 37 Ca 0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 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 -3.19 6.44 0.05 1.61 4.22 -1.26 -4.63 114.94 118.18 2tmp s ASN 38 Ca 0.00 1.66 -0.30 0.00 -2.14 0.00 0.00 52.86 52.07 2tmp s ASN 38 Cb 0.00 -2.52 -0.05 0.00 1.28 0.00 0.00 41.25 39.96 2tmp s ASN 38 CO 0.00 -0.71 1.17 -2.16 -2.04 0.00 0.00 177.10 173.36 2tmp s PRO 39 N -3.95 4.44 0.00 3.55 0.04 -1.26 0.22 135.00 138.04 2tmp s PRO 39 Ca 0.61 1.72 0.00 0.00 0.04 0.00 0.00 61.00 63.37 2tmp s PRO 39 Cb -0.12 -3.38 0.00 0.00 0.04 0.00 0.00 34.50 31.05 2tmp s PRO 39 CO 0.30 -0.25 0.13 -0.89 0.04 0.00 0.00 177.00 176.34 2tmp n ILE 40 N 3.97 0.00 -1.16 0.56 5.41 0.75 -4.80 119.36 124.10 2tmp n ILE 40 Ca 0.09 0.36 0.00 0.00 1.00 0.00 0.00 62.75 64.20 2tmp n ILE 40 Cb 0.47 -0.81 0.00 0.00 -0.71 0.00 0.00 39.64 38.58 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 -0.29 -2.83 -3.26 0.38 3.00 -1.25 -4.76 118.16 109.14 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 -2.20 -0.07 0.00 0.00 0.00 0.00 35.03 32.76 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 0.54 1.74 -1.35 1.64 1.85 -1.00 -4.19 116.66 115.90 2tmp n ARG 42 Ca 0.00 -4.00 -0.43 0.00 -1.00 0.00 0.00 57.85 52.42 2tmp n ARG 42 Cb 0.00 -1.79 -0.00 0.00 -1.05 0.00 0.00 32.46 29.61 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 0.90 1.10 -2.24 8.89 -0.00 -1.12 -4.18 119.36 122.71 2tmp n ILE 43 Ca 0.26 -0.50 -0.18 0.00 -0.00 0.00 0.00 62.75 62.33 2tmp n ILE 43 Cb 0.48 -0.13 0.11 0.00 -0.00 0.00 0.00 39.64 40.10 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 1.12 -0.26 -3.21 0.38 1.13 0.43 -2.03 117.38 114.94 2tmp n GLN 44 Ca 0.12 -1.84 -0.24 0.00 -1.94 0.00 0.00 57.00 53.11 2tmp n GLN 44 Cb 0.38 -0.66 -0.07 0.00 0.11 0.00 0.00 30.24 30.00 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 -2.75 0.21 -0.58 1.08 4.01 0.25 -3.73 117.16 115.65 2tmp n TYR 45 Ca 0.12 -3.66 -0.37 0.00 -0.16 0.00 0.00 57.90 53.83 2tmp n TYR 45 Cb 0.43 -0.38 -0.09 0.00 -0.31 0.00 0.00 39.34 38.99 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 0.41 -0.52 -0.72 2.13 0.98 -2.38 120.64 121.75 2tmp n GLU 46 Ca 0.23 -1.13 -0.20 0.00 0.66 0.00 0.00 57.16 56.71 2tmp n GLU 46 Cb 0.53 -2.52 0.18 0.00 0.27 0.00 0.00 31.44 29.90 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 6.39 0.00 0.07 6.31 -5.35 -0.30 -2.46 119.36 124.02 2tmp n ILE 47 Ca 0.41 -0.21 0.01 0.00 -0.27 0.00 0.00 62.75 62.68 2tmp n ILE 47 Cb 0.35 -0.99 -0.00 0.00 -1.74 0.00 0.00 39.64 37.26 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 -4.06 2.57 -2.15 6.28 4.81 0.14 -4.78 118.16 120.97 2tmp n LYS 48 Ca 0.10 -0.33 0.00 0.00 -0.87 0.00 0.00 58.31 57.21 2tmp n LYS 48 Cb 0.40 -0.82 0.00 0.00 0.02 0.00 0.00 35.03 34.63 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 -0.42 -4.15 0.00 1.64 1.13 -1.26 -4.88 117.38 109.43 2tmp n GLN 49 Ca 0.01 2.97 0.00 0.00 -1.94 0.00 0.00 57.00 58.04 2tmp n GLN 49 Cb 0.04 -3.62 0.00 0.00 0.11 0.00 0.00 30.24 26.77 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 1.89 0.00 -3.92 5.09 -5.35 -1.26 -4.85 119.36 110.96 2tmp n ILE 50 Ca 0.00 0.00 -0.09 0.00 -0.27 0.00 0.00 62.75 62.39 2tmp n ILE 50 Cb 0.00 -0.65 -0.08 0.00 -1.74 0.00 0.00 39.64 37.17 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 -1.89 0.84 -0.39 6.28 2.20 -1.25 -4.96 119.74 120.57 2tmp s LYS 51 Ca 0.00 -1.05 0.09 0.00 -0.36 0.00 0.00 55.97 54.65 2tmp s LYS 51 Cb 0.00 0.32 0.27 0.00 -1.51 0.00 0.00 37.83 36.91 2tmp s LYS 51 CO 0.00 -0.26 0.56 0.00 -0.36 0.00 0.00 175.35 175.29 2tmp n MET 52 N -0.05 0.76 0.00 4.03 0.00 -1.26 -2.08 117.12 118.52 2tmp n MET 52 Ca -0.14 -3.23 0.00 0.00 0.00 0.00 0.00 57.70 54.33 2tmp n MET 52 Cb 0.62 -1.30 0.00 0.00 0.00 0.00 0.00 33.22 32.54 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 1.21 0.00 -3.34 3.17 3.72 0.11 -3.67 117.46 118.66 2tmp n PHE 53 Ca 0.22 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 57.36 2tmp n PHE 53 Cb 0.55 0.00 -0.08 0.00 -0.94 0.00 0.00 39.48 39.02 2tmp n PHE 53 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 2tmp n LYS 54 N -0.85 1.90 -0.59 -1.08 3.00 0.62 -4.92 118.16 116.24 2tmp n LYS 54 Ca 0.00 -4.17 0.00 0.00 -0.00 0.00 0.00 58.31 54.14 2tmp n LYS 54 Cb 0.00 -1.90 0.00 0.00 0.00 0.00 0.00 35.03 33.13 2tmp n LYS 54 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2tmp n GLY 55 N 1.05 6.29 0.22 3.14 0.00 -1.14 0.97 105.19 115.73 2tmp n GLY 55 Ca 0.27 -2.08 -0.02 0.00 0.00 0.00 0.00 46.02 44.19 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 -0.03 -0.59 -0.07 1.61 -0.04 -1.26 -4.93 135.00 129.69 2tmp n PRO 56 Ca 0.00 -0.11 -0.13 0.00 -0.04 0.00 0.00 63.50 63.22 2tmp n PRO 56 Cb 0.00 -0.09 -0.14 0.00 -0.04 0.00 0.00 33.50 33.23 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 -1.43 0.68 0.00 0.54 1.02 -1.26 -4.70 120.64 115.49 2tmp n GLU 57 Ca 0.01 0.13 0.00 0.00 -0.02 0.00 0.00 57.16 57.28 2tmp n GLU 57 Cb 0.03 -1.61 0.00 0.00 -0.02 0.00 0.00 31.44 29.84 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 -3.02 0.00 0.00 3.49 3.00 -1.26 -5.09 118.16 115.28 2tmp n LYS 58 Ca -0.31 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.00 2tmp n LYS 58 Cb 1.08 -0.61 0.00 0.00 0.00 0.00 0.00 35.03 35.50 2tmp n LYS 58 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 2tmp n ASP 59 N -0.45 0.00 0.00 3.14 -0.08 -1.26 -5.03 116.55 112.87 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 -1.44 0.00 -0.25 5.18 2.08 -1.26 0.16 119.36 123.82 2tmp n ILE 60 Ca 0.00 0.04 0.00 0.00 0.56 0.00 0.00 62.75 63.35 2tmp n ILE 60 Cb 0.00 -0.89 0.00 0.00 -0.75 0.00 0.00 39.64 38.00 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 -1.47 0.00 -3.41 0.38 1.02 -1.26 -4.33 120.64 111.57 2tmp n GLU 61 Ca 0.00 0.00 -0.19 0.00 -0.02 0.00 0.00 57.16 56.95 2tmp n GLU 61 Cb 0.00 -2.50 -0.10 0.00 -0.02 0.00 0.00 31.44 28.82 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 -2.61 -0.24 0.46 -0.32 0.08 -1.25 -1.14 117.98 112.97 2tmp s PHE 62 Ca 0.00 -0.56 0.08 0.00 0.12 0.00 0.00 56.93 56.57 2tmp s PHE 62 Cb 0.00 -0.53 0.03 0.00 -0.57 0.00 0.00 43.02 41.95 2tmp s PHE 62 CO 0.00 -0.92 0.61 0.42 -0.10 0.00 0.00 175.22 175.23 2tmp s ILE 63 N 1.95 2.72 0.15 0.64 -1.09 -1.00 -3.54 121.20 121.02 2tmp s ILE 63 Ca 0.12 -1.03 0.09 0.00 -2.23 0.00 0.00 60.65 57.60 2tmp s ILE 63 Cb -0.15 -2.75 -0.04 0.00 -1.58 0.00 0.00 42.46 37.94 2tmp s ILE 63 CO -0.22 0.00 -0.20 -0.47 -1.23 0.00 0.00 174.94 172.82 2tmp s TYR 64 N -2.45 1.90 0.00 3.97 6.14 -1.19 0.85 117.35 126.56 2tmp s TYR 64 Ca 0.56 -0.44 0.00 0.00 0.64 0.00 0.00 57.07 57.83 2tmp s TYR 64 Cb -0.08 -0.97 0.00 0.00 0.42 0.00 0.00 41.96 41.33 2tmp s TYR 64 CO 0.34 0.32 0.00 -2.37 0.64 0.00 0.00 175.55 174.48 2tmp n THR 65 N 0.53 0.00 -4.07 4.34 5.66 -0.86 -3.22 114.28 116.65 2tmp n THR 65 Ca -0.15 0.00 -0.27 0.00 -3.05 0.00 0.00 64.05 60.58 2tmp n THR 65 Cb 0.56 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.28 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 3.57 1.00 1.79 0.00 -1.26 -2.80 121.76 123.06 2tmp s ALA 66 Ca 0.00 -1.16 0.00 0.00 0.00 0.00 0.00 51.96 50.80 2tmp s ALA 66 Cb 0.00 -1.38 0.00 0.00 0.00 0.00 0.00 23.12 21.74 2tmp s ALA 66 CO 0.00 0.57 0.00 -0.35 0.00 0.00 0.00 175.76 175.98 2tmp n PRO 67 N -0.12 0.90 0.00 0.00 -0.04 -1.26 -4.52 135.00 129.96 2tmp n PRO 67 Ca -0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.38 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 -0.20 -2.54 -1.24 3.54 7.64 -1.26 -2.74 113.62 116.83 2tmp n SER 68 Ca 0.00 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.86 2tmp n SER 68 Cb 0.00 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.21 2tmp n SER 68 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2tmp n SER 69 N -2.49 3.78 -1.26 6.43 3.41 -1.26 -4.79 113.62 117.43 2tmp n SER 69 Ca 0.00 -2.24 0.00 0.00 -0.26 0.00 0.00 58.87 56.37 2tmp n SER 69 Cb 0.00 -0.70 0.00 0.00 -0.26 0.00 0.00 64.21 63.25 2tmp n SER 69 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2tmp n ALA 70 N 0.64 -2.66 -0.07 7.33 0.00 -1.11 -4.75 120.51 119.90 2tmp n ALA 70 Ca 0.05 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.40 2tmp n ALA 70 Cb 0.57 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.96 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 0.15 0.76 -0.43 0.00 0.24 -1.23 -4.64 118.33 113.18 2tmp n VAL 71 Ca 0.00 -0.29 0.03 0.00 -2.04 0.00 0.00 64.34 62.04 2tmp n VAL 71 Cb 0.00 -0.98 0.04 0.00 -1.47 0.00 0.00 33.84 31.43 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 -0.75 4.09 0.25 0.00 0.00 -1.26 -0.68 105.19 106.83 2tmp n GLY 73 Ca 0.05 -0.80 0.03 0.00 0.00 0.00 0.00 46.02 45.29 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 -1.86 1.61 0.31 -1.26 -3.87 118.33 113.64 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 0.88 0.01 0.00 -0.91 0.00 0.00 33.84 33.82 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 0.17 -2.22 -4.79 4.52 3.41 -1.26 -4.76 113.62 108.69 2tmp n SER 75 Ca 0.04 -0.01 -0.35 0.00 -0.26 0.00 0.00 58.87 58.29 2tmp n SER 75 Cb 0.21 -0.61 -0.07 0.00 -0.26 0.00 0.00 64.21 63.47 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 -0.80 3.99 0.00 1.04 1.02 -1.26 -4.75 118.68 117.91 2tmp s LEU 76 Ca 0.11 0.28 0.00 0.00 0.02 0.00 0.00 54.13 54.54 2tmp s LEU 76 Cb -0.01 -2.04 0.00 0.00 0.02 0.00 0.00 46.19 44.16 2tmp s LEU 76 CO 0.25 0.36 0.38 -0.90 0.02 0.00 0.00 176.35 176.46 2tmp n ASP 77 N 1.84 0.74 0.00 2.29 5.75 -1.23 -4.78 116.55 121.16 2tmp n ASP 77 Ca -0.18 -1.04 0.00 0.00 -0.01 0.00 0.00 54.79 53.57 2tmp n ASP 77 Cb 0.54 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.63 2tmp n ASP 77 CO 0.00 0.00 0.00 0.52 -0.11 0.00 0.00 177.20 177.61 2tmp n VAL 78 N -0.02 0.00 0.06 2.12 0.31 0.47 -4.09 118.33 117.19 2tmp n VAL 78 Ca 0.00 0.00 0.03 0.00 -0.01 0.00 0.00 64.34 64.36 2tmp n VAL 78 Cb 0.09 0.00 0.17 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 0.00 -0.50 0.00 2.92 0.00 -1.26 0.15 105.19 106.50 2tmp n GLY 79 Ca 0.00 0.06 0.01 0.00 0.00 0.00 0.00 46.02 46.09 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 -1.34 0.21 0.00 -0.02 0.00 -1.26 -4.96 105.19 97.82 2tmp n GLY 80 Ca -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 -1.39 0.00 0.00 1.61 0.00 0.12 -5.03 118.16 113.47 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 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.09 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 -0.10 0.00 -3.69 -1.58 2.85 -0.63 -4.93 118.16 110.09 2tmp n LYS 82 Ca 0.00 0.00 -0.03 0.00 -1.05 0.00 0.00 58.31 57.23 2tmp n LYS 82 Cb 0.00 0.00 -0.01 0.00 -0.65 0.00 0.00 35.03 34.37 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 0.92 0.01 -1.58 -1.05 -1.26 -4.59 118.70 111.16 2tmp s GLU 83 Ca 0.00 -0.49 -0.18 0.00 -0.15 0.00 0.00 54.97 54.15 2tmp s GLU 83 Cb 0.00 0.33 0.03 0.00 -0.44 0.00 0.00 34.13 34.05 2tmp s GLU 83 CO 0.00 -0.42 0.39 1.52 0.95 0.00 0.00 175.26 177.70 2tmp s TYR 84 N -3.02 -0.25 -2.12 4.83 -0.85 -0.02 -3.41 117.35 112.51 2tmp s TYR 84 Ca 0.12 0.29 0.23 0.00 -0.52 0.00 0.00 57.07 57.19 2tmp s TYR 84 Cb 0.00 0.18 1.22 0.00 0.38 0.00 0.00 41.96 43.74 2tmp s TYR 84 CO -0.01 -0.50 1.81 1.47 -1.52 0.00 0.00 175.55 176.79 2tmp n LEU 85 N 0.82 0.53 0.00 -3.49 -0.00 -1.06 -0.95 117.00 112.84 2tmp n LEU 85 Ca -0.20 -0.21 0.00 0.00 -0.00 0.00 0.00 56.01 55.61 2tmp n LEU 85 Cb 0.58 -0.02 0.00 0.00 -0.00 0.00 0.00 43.42 43.98 2tmp n LEU 85 CO 0.21 0.10 0.00 -0.38 -0.00 0.00 0.00 177.39 177.33 2tmp n ILE 86 N -0.49 0.00 -3.79 1.47 -0.00 -1.10 0.14 119.36 115.59 2tmp n ILE 86 Ca 0.17 0.00 -0.30 0.00 -0.00 0.00 0.00 62.75 62.63 2tmp n ILE 86 Cb 0.17 0.00 -0.15 0.00 -0.00 0.00 0.00 39.64 39.65 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 1.72 0.18 -1.39 0.00 -0.65 -2.77 121.76 118.85 2tmp s ALA 87 Ca 0.00 -1.67 -0.19 0.00 0.00 0.00 0.00 51.96 50.10 2tmp s ALA 87 Cb 0.00 -1.61 0.04 0.00 0.00 0.00 0.00 23.12 21.55 2tmp s ALA 87 CO 0.00 -1.58 0.54 0.20 0.00 0.00 0.00 175.76 174.92 2tmp s GLY 88 N 1.52 -0.28 -0.82 0.00 0.00 -1.25 -2.96 107.32 103.53 2tmp s GLY 88 Ca 0.07 0.02 -0.20 0.00 0.00 0.00 0.00 44.72 44.61 2tmp s GLY 88 CO -0.19 -0.13 2.07 1.17 0.00 0.00 0.00 173.10 176.01 2tmp n LYS 89 N -0.34 0.00 -0.35 2.90 4.81 -1.24 -3.84 118.16 120.10 2tmp n LYS 89 Ca -0.13 0.00 -0.30 0.00 -0.87 0.00 0.00 58.31 57.01 2tmp n LYS 89 Cb 0.63 -1.10 0.29 0.00 0.02 0.00 0.00 35.03 34.87 2tmp n LYS 89 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2tmp s ALA 90 N 5.12 -0.84 0.00 3.14 0.00 -1.26 -2.63 121.76 125.29 2tmp s ALA 90 Ca 1.10 -0.62 0.00 0.00 0.00 0.00 0.00 51.96 52.44 2tmp s ALA 90 Cb -0.93 -3.03 0.00 0.00 0.00 0.00 0.00 23.12 19.16 2tmp s ALA 90 CO 0.42 -4.52 0.60 -1.91 0.00 0.00 0.00 175.76 170.35 2tmp n GLU 91 N -5.54 0.56 0.00 0.00 4.07 -1.22 -4.38 120.64 114.13 2tmp n GLU 91 Ca 0.10 -0.76 0.00 0.00 -0.06 0.00 0.00 57.16 56.44 2tmp n GLU 91 Cb 0.58 -0.88 0.00 0.00 -0.06 0.00 0.00 31.44 31.09 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 -0.16 0.72 2.91 8.31 0.00 -1.18 -4.86 105.19 110.93 2tmp n GLY 92 Ca 0.00 -0.81 -0.14 0.00 0.00 0.00 0.00 46.02 45.07 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 0.33 0.00 1.61 1.11 -1.26 -4.76 116.67 109.70 2tmp s ASP 93 Ca 0.00 -0.05 0.00 0.00 0.18 0.00 0.00 52.55 52.68 2tmp s ASP 93 Cb 0.00 -0.04 0.00 0.00 1.07 0.00 0.00 42.92 43.95 2tmp s ASP 93 CO 0.00 0.03 0.00 0.61 1.18 0.00 0.00 175.17 176.99 2tmp n GLY 94 N 3.05 1.33 3.64 0.21 0.00 0.42 -4.93 105.19 108.90 2tmp n GLY 94 Ca -0.13 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.10 0.16 0.00 1.61 0.00 -1.25 -3.95 119.74 116.22 2tmp s LYS 95 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 55.97 56.11 2tmp s LYS 95 Cb 0.00 0.08 0.00 0.00 0.00 0.00 0.00 37.83 37.91 2tmp s LYS 95 CO 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 175.35 175.32 2tmp n MET 96 N 1.39 0.00 -4.78 1.78 0.00 -1.23 -3.10 117.12 111.18 2tmp n MET 96 Ca -0.08 0.00 -0.26 0.00 0.00 0.00 0.00 57.70 57.36 2tmp n MET 96 Cb 0.57 0.00 -0.16 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 -3.83 1.68 -0.05 3.17 3.76 -1.08 -3.18 115.29 115.77 2tmp s HIS 97 Ca 0.00 -0.54 -0.06 0.00 -0.15 0.00 0.00 55.06 54.31 2tmp s HIS 97 Cb 0.00 -1.16 0.01 0.00 1.11 0.00 0.00 32.58 32.55 2tmp s HIS 97 CO 0.00 -0.21 0.15 0.96 -0.85 0.00 0.00 174.74 174.79 2tmp s ILE 98 N 0.23 0.02 0.07 0.60 -4.36 -1.20 -3.60 121.20 112.96 2tmp s ILE 98 Ca -0.08 -0.15 -0.01 0.00 -0.26 0.00 0.00 60.65 60.15 2tmp s ILE 98 Cb -0.13 -0.27 -0.04 0.00 1.25 0.00 0.00 42.46 43.27 2tmp s ILE 98 CO 0.03 -0.08 -0.00 0.42 0.24 0.00 0.00 174.94 175.55 2tmp s THR 99 N -0.22 0.19 0.21 8.37 -4.23 -1.26 -4.35 115.64 114.36 2tmp s THR 99 Ca -0.03 -1.80 -0.09 0.00 -1.18 0.00 0.00 61.69 58.59 2tmp s THR 99 Cb -0.02 -1.61 0.15 0.00 1.34 0.00 0.00 72.50 72.36 2tmp s THR 99 CO 0.00 -0.89 1.82 0.17 -0.54 0.00 0.00 174.62 175.19 2tmp h LEU 100 N 3.08 0.60 -1.36 4.79 -0.00 -1.01 0.11 115.31 121.52 2tmp h LEU 100 Ca -0.34 0.02 -0.04 0.00 -0.00 0.00 0.00 57.88 57.52 2tmp h LEU 100 Cb 1.15 -0.10 -0.02 0.00 -0.00 0.00 0.00 40.66 41.70 2tmp h LEU 100 CO 0.64 0.39 0.01 0.00 -0.00 0.00 0.00 178.44 179.49 2tmp s ASP 102 N -6.78 3.74 -0.13 0.00 -1.08 0.38 -4.67 116.67 108.14 2tmp s ASP 102 Ca -0.07 1.17 -0.29 0.00 -0.52 0.00 0.00 52.55 52.83 2tmp s ASP 102 Cb 0.16 -1.82 -0.03 0.00 -1.46 0.00 0.00 42.92 39.76 2tmp s ASP 102 CO 0.75 -2.43 1.50 0.12 0.52 0.00 0.00 175.17 175.63 2tmp s PHE 103 N -3.16 2.33 -0.28 -5.34 5.36 -1.16 -4.73 117.98 111.01 2tmp s PHE 103 Ca 0.63 0.56 -0.21 0.00 -0.96 0.00 0.00 56.93 56.95 2tmp s PHE 103 Cb -0.15 -3.78 0.11 0.00 -0.34 0.00 0.00 43.02 38.86 2tmp s PHE 103 CO 0.54 -2.87 0.91 0.96 -1.46 0.00 0.00 175.22 173.31 2tmp s ILE 104 N 4.03 0.00 0.11 3.12 -4.36 -1.26 -1.63 121.20 121.20 2tmp s ILE 104 Ca 0.66 0.00 -0.18 0.00 -0.26 0.00 0.00 60.65 60.87 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 0.24 0.00 0.44 0.68 0.24 0.00 0.00 174.94 176.54 2tmp s VAL 105 N 0.76 0.05 -1.99 8.37 -7.23 -1.26 -5.00 120.40 114.10 2tmp s VAL 105 Ca -0.02 -0.44 0.00 0.00 -1.81 0.00 0.00 61.98 59.71 2tmp s VAL 105 Cb -0.05 -1.10 0.00 0.00 0.56 0.00 0.00 36.38 35.80 2tmp s VAL 105 CO -0.09 -0.24 0.75 -0.81 -0.31 0.00 0.00 175.10 174.39 2tmp n PRO 106 N -0.09 0.75 0.00 4.82 -0.04 -1.26 -2.56 135.00 136.62 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 -1.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.09 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 -0.49 0.00 -0.55 0.54 -0.00 -1.22 -4.15 117.44 111.57 2tmp n TRP 107 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 57.50 57.41 2tmp n TRP 107 Cb 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 31.31 31.24 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 2.36 3.10 0.23 5.87 -0.08 -1.26 -2.89 116.55 123.88 2tmp n ASP 108 Ca 0.00 -2.07 0.00 0.00 -1.51 0.00 0.00 54.79 51.21 2tmp n ASP 108 Cb 0.00 -0.80 0.00 0.00 2.34 0.00 0.00 41.12 42.66 2tmp n ASP 108 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 2tmp n THR 109 N 3.06 0.00 0.00 5.18 -2.24 -1.26 -5.07 114.28 113.95 2tmp n THR 109 Ca 0.26 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.04 2tmp n THR 109 Cb 0.40 -0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.59 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 -3.45 0.00 0.00 3.22 4.77 -1.14 -4.76 117.00 115.64 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 -4.90 113.62 113.67 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 -0.11 0.44 -1.04 -1.26 -4.94 114.28 107.38 2tmp n THR 112 Ca 0.00 0.00 0.27 0.00 -2.04 0.00 0.00 64.05 62.28 2tmp n THR 112 Cb 0.00 0.00 0.70 0.00 -1.82 0.00 0.00 70.33 69.21 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 0.35 0.06 12.58 2.02 -1.93 1.16 112.91 127.16 2tmp h THR 113 Ca 0.00 0.00 -0.26 0.00 0.77 0.00 0.00 66.41 66.92 2tmp h THR 113 Cb 0.00 0.47 -0.02 0.00 -1.74 0.00 0.00 68.15 66.87 2tmp h THR 113 CO 0.00 0.00 -1.30 1.56 0.37 0.00 0.00 175.52 176.15 2tmp h GLN 114 N 0.00 0.14 -0.13 6.66 7.50 -1.87 -3.17 115.11 124.24 2tmp h GLN 114 Ca 0.37 -0.23 -0.16 0.00 0.50 0.00 0.00 58.65 59.13 2tmp h GLN 114 Cb 1.77 0.09 0.01 0.00 0.05 0.00 0.00 27.48 29.39 2tmp h GLN 114 CO -0.00 1.02 -0.56 0.87 -1.50 0.00 0.00 178.83 178.66 2tmp h LYS 115 N 0.04 0.60 0.00 1.46 1.57 0.76 -2.51 116.57 118.49 2tmp h LYS 115 Ca -0.14 -0.48 -0.00 0.00 -1.87 0.00 0.00 60.65 58.16 2tmp h LYS 115 Cb 1.92 0.09 -0.00 0.00 0.08 0.00 0.00 32.23 34.33 2tmp h LYS 115 CO 0.15 1.10 -0.00 1.57 -0.57 0.00 0.00 179.45 181.70 2tmp h LYS 116 N 0.25 0.00 0.00 3.15 5.09 -0.22 0.41 116.57 125.24 2tmp h LYS 116 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.71 2tmp h LYS 116 Cb 1.19 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.52 2tmp h LYS 116 CO 0.12 0.00 -0.73 1.03 -2.09 0.00 0.00 179.45 177.78 2tmp h SER 117 N 0.00 0.00 1.17 7.07 0.87 -1.46 -3.28 113.55 117.92 2tmp h SER 117 Ca -0.00 -0.23 -0.00 0.00 -1.23 0.00 0.00 61.79 60.32 2tmp h SER 117 Cb 0.05 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.01 2tmp h SER 117 CO 0.00 0.12 -0.01 -0.07 -0.53 0.00 0.00 176.83 176.34 2tmp h LEU 118 N 0.00 0.00 0.18 2.23 3.38 0.25 -3.15 115.31 118.20 2tmp h LEU 118 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2tmp h LEU 118 Cb 0.76 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.51 2tmp h LEU 118 CO 0.00 0.01 -0.09 -1.13 0.09 0.00 0.00 178.44 177.32 2tmp h ASN 119 N 0.00 -0.21 -1.72 -0.43 -1.24 -1.60 -3.45 115.58 106.93 2tmp h ASN 119 Ca -0.00 -0.26 -0.67 0.00 0.71 0.00 0.00 56.30 56.09 2tmp h ASN 119 Cb 0.59 0.05 0.08 0.00 0.73 0.00 0.00 38.32 39.78 2tmp h ASN 119 CO 0.00 0.34 0.15 0.00 -1.29 0.00 0.00 177.43 176.64 2tmp n HIS 120 N -4.93 1.02 -0.16 0.67 1.44 -1.19 -4.83 115.22 107.24 2tmp n HIS 120 Ca -0.06 0.76 -0.03 0.00 -2.01 0.00 0.00 57.72 56.38 2tmp n HIS 120 Cb 0.22 -2.22 0.04 0.00 0.12 0.00 0.00 29.99 28.15 2tmp n HIS 120 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2tmp h ARG 121 N 3.05 0.00 0.00 -1.40 2.47 -1.87 -3.42 114.38 113.21 2tmp h ARG 121 Ca -0.43 -0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.29 2tmp h ARG 121 Cb 1.36 -0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.68 2tmp h ARG 121 CO 0.68 0.00 0.00 2.48 0.56 0.00 0.00 179.97 183.69 2tmp n TYR 122 N -5.36 0.00 -2.97 3.04 4.11 -1.26 -4.70 117.16 110.02 2tmp n TYR 122 Ca 0.05 0.00 -0.04 0.00 -0.00 0.00 0.00 57.90 57.91 2tmp n TYR 122 Cb 0.27 0.00 0.02 0.00 -0.00 0.00 0.00 39.34 39.63 2tmp n TYR 122 CO 0.00 0.00 0.00 0.94 -0.00 0.00 0.00 176.86 177.80 2tmp n GLN 123 N 0.00 -1.44 -0.57 -3.48 7.27 -1.17 -4.78 117.38 113.20 2tmp n GLN 123 Ca 0.00 1.24 -0.13 0.00 0.07 0.00 0.00 57.00 58.18 2tmp n GLN 123 Cb 0.00 -5.41 -0.04 0.00 2.41 0.00 0.00 30.24 27.20 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 -2.09 1.44 -1.53 3.69 2.81 -1.26 -4.40 117.12 115.79 2tmp n MET 124 Ca -0.02 -0.96 -0.09 0.00 -1.81 0.00 0.00 57.70 54.82 2tmp n MET 124 Cb 0.53 -2.11 -0.03 0.00 -0.71 0.00 0.00 33.22 30.90 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 3.35 0.55 0.00 3.03 0.00 -1.26 -4.89 105.19 105.97 2tmp n GLY 125 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.33 2tmp n GLY 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32