#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2tmv s TYR 2 N 0.00 3.26 -0.36 1.43 1.51 -1.17 -4.07 117.35 117.96 2tmv s TYR 2 Ca 0.00 1.40 0.04 0.00 -1.01 0.00 0.00 57.07 57.50 2tmv s TYR 2 Cb 0.00 -2.85 0.10 0.00 -0.11 0.00 0.00 41.96 39.11 2tmv s TYR 2 CO 0.00 -1.01 0.08 0.45 -1.11 0.00 0.00 175.55 173.95 2tmv s SER 3 N -3.72 4.68 -1.18 2.29 0.15 -1.24 -5.03 113.70 109.64 2tmv s SER 3 Ca 0.58 -2.23 -0.11 0.00 0.70 0.00 0.00 55.95 54.89 2tmv s SER 3 Cb -0.13 -1.59 0.22 0.00 -1.71 0.00 0.00 66.02 62.81 2tmv s SER 3 CO 0.51 -0.37 1.38 -0.38 1.20 0.00 0.00 173.24 175.58 2tmv n ILE 4 N 4.16 4.46 0.00 6.45 5.41 -1.26 -4.24 119.36 134.34 2tmv n ILE 4 Ca 0.04 -5.01 -0.03 0.00 1.00 0.00 0.00 62.75 58.74 2tmv n ILE 4 Cb 0.41 -2.47 -0.02 0.00 -0.71 0.00 0.00 39.64 36.85 2tmv n ILE 4 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 176.55 177.29 2tmv h THR 5 N 4.11 0.00 -1.99 1.39 2.02 -1.96 -3.44 112.91 113.04 2tmv h THR 5 Ca 0.27 0.00 -0.53 0.00 0.77 0.00 0.00 66.41 66.92 2tmv h THR 5 Cb 0.83 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 67.17 2tmv h THR 5 CO 1.21 0.00 -0.55 -0.89 0.37 0.00 0.00 175.52 175.67 2tmv s THR 6 N -3.55 3.42 0.19 3.16 2.01 -1.26 -5.04 115.64 114.55 2tmv s THR 6 Ca -0.03 -1.65 -0.10 0.00 0.31 0.00 0.00 61.69 60.22 2tmv s THR 6 Cb 0.01 -3.05 0.10 0.00 0.01 0.00 0.00 72.50 69.58 2tmv s THR 6 CO 0.12 -0.25 1.74 1.55 -0.69 0.00 0.00 174.62 177.10 2tmv h PRO 7 N 1.57 0.99 -2.22 4.92 0.13 -2.04 -3.15 132.00 132.19 2tmv h PRO 7 Ca -0.45 -0.19 -0.08 0.00 -0.87 0.00 0.00 66.00 64.42 2tmv h PRO 7 Cb 1.25 -0.16 -0.03 0.00 0.13 0.00 0.00 31.00 32.19 2tmv h PRO 7 CO 0.61 0.84 -0.05 0.43 -0.23 0.00 0.00 178.00 179.60 2tmv n SER 8 N -4.40 3.41 -0.03 1.44 7.64 -1.26 -3.04 113.62 117.38 2tmv n SER 8 Ca 0.05 -2.05 -0.04 0.00 1.01 0.00 0.00 58.87 57.84 2tmv n SER 8 Cb 0.18 -0.85 -0.03 0.00 -1.01 0.00 0.00 64.21 62.50 2tmv n SER 8 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 2tmv n GLN 9 N 2.31 0.33 0.08 1.43 7.27 -1.19 -4.61 117.38 122.99 2tmv n GLN 9 Ca 0.17 0.03 0.20 0.00 0.07 0.00 0.00 57.00 57.48 2tmv n GLN 9 Cb 0.49 -1.12 0.74 0.00 2.41 0.00 0.00 30.24 32.77 2tmv n GLN 9 CO 0.00 0.00 0.00 0.35 0.07 0.00 0.00 177.06 177.48 2tmv h PHE 10 N 0.00 0.00 -0.30 3.69 3.04 -1.81 1.09 116.94 122.65 2tmv h PHE 10 Ca -0.13 0.00 0.09 0.00 3.98 0.00 0.00 57.97 61.91 2tmv h PHE 10 Cb 1.21 0.00 -0.01 0.00 2.56 0.00 0.00 35.95 39.71 2tmv h PHE 10 CO 0.01 0.00 0.27 0.28 -2.02 0.00 0.00 178.31 176.85 2tmv h VAL 11 N 0.00 0.58 0.17 1.41 2.07 -1.82 -1.21 116.25 117.46 2tmv h VAL 11 Ca 0.20 0.00 -0.30 0.00 0.82 0.00 0.00 66.70 67.42 2tmv h VAL 11 Cb 0.96 0.79 0.02 0.00 -1.52 0.00 0.00 31.29 31.55 2tmv h VAL 11 CO -0.00 0.00 -1.33 -0.26 0.02 0.00 0.00 177.57 176.00 2tmv h PHE 12 N 0.00 0.81 -0.04 1.57 -1.00 0.94 -3.34 116.94 115.88 2tmv h PHE 12 Ca 0.14 -0.56 0.00 0.00 2.81 0.00 0.00 57.97 60.36 2tmv h PHE 12 Cb 0.69 -0.04 0.00 0.00 3.61 0.00 0.00 35.95 40.21 2tmv h PHE 12 CO 0.00 1.43 0.00 -0.11 -1.61 0.00 0.00 178.31 178.02 2tmv n LEU 13 N -3.67 0.23 0.00 1.54 7.94 -0.47 -4.80 117.00 117.77 2tmv n LEU 13 Ca -0.13 -0.11 -0.21 0.00 -1.11 0.00 0.00 56.01 54.45 2tmv n LEU 13 Cb 1.04 -0.03 0.16 0.00 0.53 0.00 0.00 43.42 45.12 2tmv n LEU 13 CO 0.57 0.06 0.56 -1.20 -1.11 0.00 0.00 177.39 176.27 2tmv n SER 14 N -0.44 -0.51 -3.39 1.96 7.64 -1.12 -4.61 113.62 113.16 2tmv n SER 14 Ca 0.04 -1.23 -0.39 0.00 1.01 0.00 0.00 58.87 58.31 2tmv n SER 14 Cb 0.05 -0.72 -0.00 0.00 -1.01 0.00 0.00 64.21 62.53 2tmv n SER 14 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2tmv n SER 15 N -3.83 7.69 0.00 6.43 7.64 -1.26 -3.88 113.62 126.40 2tmv n SER 15 Ca 0.11 -3.33 0.00 0.00 1.01 0.00 0.00 58.87 56.67 2tmv n SER 15 Cb 0.41 -1.28 0.00 0.00 -1.01 0.00 0.00 64.21 62.33 2tmv n SER 15 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2tmv n ALA 16 N 1.06 2.27 -2.47 -0.43 0.00 -1.26 -4.70 120.51 114.97 2tmv n ALA 16 Ca 0.57 -0.31 -0.39 0.00 0.00 0.00 0.00 53.44 53.30 2tmv n ALA 16 Cb 0.28 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.68 2tmv n ALA 16 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2tmv s TRP 17 N -0.36 3.70 0.20 0.00 0.52 -1.23 -2.39 118.94 119.37 2tmv s TRP 17 Ca 0.00 1.35 0.10 0.00 0.02 0.00 0.00 56.10 57.56 2tmv s TRP 17 Cb 0.00 -2.74 -0.04 0.00 -1.15 0.00 0.00 33.47 29.53 2tmv s TRP 17 CO 0.00 0.28 -0.20 0.00 0.02 0.00 0.00 176.95 177.05 2tmv s ALA 18 N 0.00 2.28 -0.14 0.98 0.00 -0.70 0.46 121.76 124.64 2tmv s ALA 18 Ca 0.36 -1.62 -0.06 0.00 0.00 0.00 0.00 51.96 50.64 2tmv s ALA 18 Cb -0.19 -0.23 -0.04 0.00 0.00 0.00 0.00 23.12 22.66 2tmv s ALA 18 CO 0.20 0.28 0.06 0.34 0.00 0.00 0.00 175.76 176.64 2tmv s ASP 19 N -2.89 5.64 0.08 0.00 2.15 -1.26 -1.67 116.67 118.72 2tmv s ASP 19 Ca 0.20 0.17 -0.35 0.00 0.43 0.00 0.00 52.55 53.00 2tmv s ASP 19 Cb -0.06 -1.83 -0.17 0.00 -0.30 0.00 0.00 42.92 40.56 2tmv s ASP 19 CO 0.09 0.28 1.55 1.55 -0.17 0.00 0.00 175.17 178.47 2tmv h PRO 20 N 5.88 -0.96 0.82 4.34 0.13 -1.96 -3.00 132.00 137.25 2tmv h PRO 20 Ca -0.45 0.07 -0.04 0.00 -0.87 0.00 0.00 66.00 64.71 2tmv h PRO 20 Cb 1.19 0.22 0.00 0.00 0.13 0.00 0.00 31.00 32.54 2tmv h PRO 20 CO 0.63 -0.64 -0.43 -0.84 -0.23 0.00 0.00 178.00 176.49 2tmv h ILE 21 N -1.00 0.00 -0.96 -3.56 3.07 -1.99 -2.63 117.51 110.44 2tmv h ILE 21 Ca -0.06 0.00 0.31 0.00 1.55 0.00 0.00 64.86 66.66 2tmv h ILE 21 Cb 0.87 0.00 -0.16 0.00 -0.27 0.00 0.00 36.82 37.26 2tmv h ILE 21 CO -0.07 0.00 0.38 -0.08 -1.05 0.00 0.00 178.15 177.33 2tmv h GLU 22 N -1.14 0.17 -0.04 0.16 4.81 -2.00 0.05 114.58 116.59 2tmv h GLU 22 Ca -0.11 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.05 2tmv h GLU 22 Cb 0.89 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.24 2tmv h GLU 22 CO 0.16 0.11 -0.20 1.25 -0.73 0.00 0.00 179.01 179.60 2tmv h LEU 23 N 0.18 0.24 0.15 1.64 5.85 -1.56 -3.04 115.31 118.77 2tmv h LEU 23 Ca 0.68 -0.67 0.01 0.00 0.84 0.00 0.00 57.88 58.75 2tmv h LEU 23 Cb 1.55 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 42.48 2tmv h LEU 23 CO -0.70 0.87 -0.26 0.40 -0.34 0.00 0.00 178.44 178.41 2tmv h ILE 24 N -0.36 0.43 -0.42 4.05 2.04 -0.69 0.77 117.51 123.32 2tmv h ILE 24 Ca -0.01 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.91 2tmv h ILE 24 Cb 0.87 0.43 -0.05 0.00 -0.74 0.00 0.00 36.82 37.33 2tmv h ILE 24 CO 0.04 0.00 0.11 0.78 0.00 0.00 0.00 178.15 179.08 2tmv h ASN 25 N -0.49 0.06 -0.20 1.72 4.21 -1.21 -0.60 115.58 119.08 2tmv h ASN 25 Ca 0.02 0.06 -0.00 0.00 1.21 0.00 0.00 56.30 57.59 2tmv h ASN 25 Cb 0.50 0.07 -0.01 0.00 -1.12 0.00 0.00 38.32 37.76 2tmv h ASN 25 CO -0.13 0.07 0.12 0.25 -1.29 0.00 0.00 177.43 176.45 2tmv h LEU 26 N 0.25 0.23 0.39 1.61 6.46 -1.29 0.26 115.31 123.22 2tmv h LEU 26 Ca 0.20 -0.04 -0.01 0.00 -0.12 0.00 0.00 57.88 57.91 2tmv h LEU 26 Cb 0.22 -0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 40.09 2tmv h LEU 26 CO -0.24 0.20 -0.33 0.00 -0.62 0.00 0.00 178.44 177.45 2tmv h THR 28 N -0.70 0.96 -0.64 0.00 2.02 -1.14 0.51 112.91 113.92 2tmv h THR 28 Ca -0.05 -0.12 -0.04 0.00 0.77 0.00 0.00 66.41 66.97 2tmv h THR 28 Cb 0.60 0.59 -0.03 0.00 -1.74 0.00 0.00 68.15 67.56 2tmv h THR 28 CO -0.01 0.06 0.24 0.78 0.37 0.00 0.00 175.52 176.96 2tmv h ASN 29 N 0.34 0.89 -0.36 4.18 2.35 0.21 -3.18 115.58 120.01 2tmv h ASN 29 Ca 0.19 -0.18 0.08 0.00 -0.55 0.00 0.00 56.30 55.84 2tmv h ASN 29 Cb 0.32 -0.23 -0.08 0.00 0.05 0.00 0.00 38.32 38.38 2tmv h ASN 29 CO -0.04 0.83 -0.21 0.00 -1.65 0.00 0.00 177.43 176.36 2tmv h ALA 30 N 1.09 0.03 0.00 -0.83 0.00 0.75 -2.25 119.26 118.05 2tmv h ALA 30 Ca 0.21 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.24 2tmv h ALA 30 Cb 0.23 0.48 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2tmv h ALA 30 CO -0.01 -0.59 0.13 1.28 0.00 0.00 0.00 179.25 180.06 2tmv n LEU 31 N -5.37 0.00 -4.14 0.00 4.77 -0.99 -3.30 117.00 107.96 2tmv n LEU 31 Ca 0.01 0.37 -0.38 0.00 -0.03 0.00 0.00 56.01 55.98 2tmv n LEU 31 Cb 0.29 -0.37 -0.06 0.00 -2.33 0.00 0.00 43.42 40.95 2tmv n LEU 31 CO 0.12 -0.37 0.38 -0.83 -1.33 0.00 0.00 177.39 175.36 2tmv s GLY 32 N -2.73 3.04 0.00 -0.72 0.00 -0.85 -4.94 107.32 101.11 2tmv s GLY 32 Ca 0.00 -3.78 0.00 0.00 0.00 0.00 0.00 44.72 40.94 2tmv s GLY 32 CO 0.00 1.21 0.00 0.70 0.00 0.00 0.00 173.10 175.01 2tmv n ASN 33 N 2.52 0.00 -3.61 1.64 5.03 -1.21 -5.04 115.26 114.60 2tmv n ASN 33 Ca 0.20 -0.19 -0.15 0.00 0.87 0.00 0.00 54.58 55.31 2tmv n ASN 33 Cb 0.38 0.00 -0.13 0.00 -1.02 0.00 0.00 39.78 39.00 2tmv n ASN 33 CO 0.00 0.00 0.00 -1.58 -1.83 0.00 0.00 177.26 173.85 2tmv s GLN 34 N 0.44 0.14 -0.08 3.52 2.00 -1.26 -4.99 119.66 119.44 2tmv s GLN 34 Ca 0.00 0.56 0.04 0.00 -2.00 0.00 0.00 55.36 53.95 2tmv s GLN 34 Cb 0.00 -0.42 0.24 0.00 0.80 0.00 0.00 33.01 33.63 2tmv s GLN 34 CO 0.00 -0.40 0.92 1.19 -0.50 0.00 0.00 175.29 176.50 2tmv n PHE 35 N 5.34 0.66 -0.31 1.67 3.01 -1.26 -2.23 117.46 124.34 2tmv n PHE 35 Ca -0.06 -0.30 0.00 0.00 1.01 0.00 0.00 57.45 58.11 2tmv n PHE 35 Cb 0.50 -0.25 0.00 0.00 -0.01 0.00 0.00 39.48 39.72 2tmv n PHE 35 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 2tmv n GLN 36 N 0.16 2.15 -3.73 -1.08 1.13 -1.26 -4.73 117.38 110.03 2tmv n GLN 36 Ca 0.09 -1.27 -0.38 0.00 -1.94 0.00 0.00 57.00 53.50 2tmv n GLN 36 Cb 0.57 -0.88 -0.11 0.00 0.11 0.00 0.00 30.24 29.93 2tmv n GLN 36 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 2tmv s THR 37 N -0.79 3.64 0.58 5.09 -4.23 -0.94 -4.92 115.64 114.05 2tmv s THR 37 Ca 0.01 -1.63 0.36 0.00 -1.18 0.00 0.00 61.69 59.25 2tmv s THR 37 Cb 0.01 -3.29 0.52 0.00 1.34 0.00 0.00 72.50 71.08 2tmv s THR 37 CO 0.00 -0.49 1.59 -0.61 -0.54 0.00 0.00 174.62 174.58 2tmv h GLN 38 N 8.19 0.00 0.00 3.99 -0.00 -1.87 0.00 115.11 125.42 2tmv h GLN 38 Ca -0.19 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.46 2tmv h GLN 38 Cb 1.07 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.55 2tmv h GLN 38 CO 0.69 0.00 0.00 0.94 0.00 0.00 0.00 178.83 180.46 2tmv n GLN 39 N -3.73 0.00 0.04 1.69 -0.06 -1.26 -3.37 117.38 110.69 2tmv n GLN 39 Ca 0.27 0.47 0.17 0.00 -2.00 0.00 0.00 57.00 55.91 2tmv n GLN 39 Cb 1.45 -1.23 0.33 0.00 -4.06 0.00 0.00 30.24 26.74 2tmv n GLN 39 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2tmv h ALA 40 N -2.00 2.47 0.00 1.69 0.00 -1.17 4.21 119.26 124.46 2tmv h ALA 40 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2tmv h ALA 40 Cb 0.00 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2tmv h ALA 40 CO 0.00 -1.32 -0.85 0.07 0.00 0.00 0.00 179.25 177.16 2tmv h ARG 41 N 0.00 0.00 0.00 0.00 0.11 -1.68 -3.15 114.38 109.66 2tmv h ARG 41 Ca 0.27 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.35 2tmv h ARG 41 Cb 2.32 0.00 0.00 0.00 1.11 0.00 0.00 29.97 33.40 2tmv h ARG 41 CO -0.00 0.00 -0.01 1.15 0.10 0.00 0.00 179.97 181.20 2tmv h THR 42 N 0.00 0.00 -0.86 0.08 2.02 0.82 -3.33 112.91 111.64 2tmv h THR 42 Ca 0.00 -0.04 0.19 0.00 0.77 0.00 0.00 66.41 67.34 2tmv h THR 42 Cb 0.99 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 67.28 2tmv h THR 42 CO 0.00 0.00 0.37 0.58 0.37 0.00 0.00 175.52 176.84 2tmv h VAL 43 N -0.04 0.54 -0.83 3.16 2.07 -1.53 0.35 116.25 119.97 2tmv h VAL 43 Ca 0.00 -0.15 0.03 0.00 0.82 0.00 0.00 66.70 67.40 2tmv h VAL 43 Cb 0.01 0.07 -0.05 0.00 -1.52 0.00 0.00 31.29 29.80 2tmv h VAL 43 CO 0.00 0.08 0.54 0.58 0.02 0.00 0.00 177.57 178.79 2tmv h VAL 44 N 0.43 1.16 -0.20 2.57 2.07 -1.77 0.43 116.25 120.94 2tmv h VAL 44 Ca 0.52 -0.37 0.04 0.00 0.82 0.00 0.00 66.70 67.71 2tmv h VAL 44 Cb 0.92 -0.01 -0.07 0.00 -1.52 0.00 0.00 31.29 30.61 2tmv h VAL 44 CO -0.49 0.19 -0.50 -0.61 0.02 0.00 0.00 177.57 176.19 2tmv h GLN 45 N 1.07 -0.49 0.00 1.57 4.15 -0.42 1.98 115.11 122.96 2tmv h GLN 45 Ca 0.33 0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.78 2tmv h GLN 45 Cb -0.03 0.11 0.00 0.00 0.21 0.00 0.00 27.48 27.77 2tmv h GLN 45 CO -0.10 -0.33 0.00 0.54 -1.93 0.00 0.00 178.83 177.01 2tmv n ARG 46 N -5.43 0.06 -0.00 1.69 1.74 -0.66 0.90 116.66 114.96 2tmv n ARG 46 Ca -0.05 0.32 -0.05 0.00 -0.77 0.00 0.00 57.85 57.30 2tmv n ARG 46 Cb 0.37 -1.62 -0.12 0.00 -1.02 0.00 0.00 32.46 30.07 2tmv n ARG 46 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2tmv n GLN 47 N -1.73 0.63 0.09 5.56 6.02 0.14 -3.13 117.38 124.97 2tmv n GLN 47 Ca 0.03 0.24 -0.17 0.00 -0.01 0.00 0.00 57.00 57.10 2tmv n GLN 47 Cb 0.18 -1.78 -0.10 0.00 1.02 0.00 0.00 30.24 29.55 2tmv n GLN 47 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.06 176.40 2tmv h PHE 48 N 0.00 0.66 0.00 1.08 3.57 0.58 -3.15 116.94 119.68 2tmv h PHE 48 Ca -0.25 -0.42 0.00 0.00 3.53 0.00 0.00 57.97 60.83 2tmv h PHE 48 Cb 1.84 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 40.53 2tmv h PHE 48 CO 0.00 1.29 0.00 0.45 -2.23 0.00 0.00 178.31 177.82 2tmv n SER 49 N -3.67 0.00 0.25 0.41 2.88 0.26 -4.12 113.62 109.63 2tmv n SER 49 Ca -0.09 0.56 0.12 0.00 -1.33 0.00 0.00 58.87 58.13 2tmv n SER 49 Cb 0.95 -0.35 0.63 0.00 -0.75 0.00 0.00 64.21 64.69 2tmv n SER 49 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 2tmv h GLU 50 N 0.00 0.00 -0.36 -1.46 5.08 -1.73 -1.51 114.58 114.60 2tmv h GLU 50 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2tmv h GLU 50 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2tmv h GLU 50 CO 0.00 0.00 0.00 1.55 -1.00 0.00 0.00 179.01 179.56 2tmv n VAL 51 N -2.49 0.00 -3.91 3.13 3.14 -1.19 -4.25 118.33 112.76 2tmv n VAL 51 Ca -0.02 0.00 -0.30 0.00 -2.96 0.00 0.00 64.34 61.06 2tmv n VAL 51 Cb 0.30 -0.26 -0.15 0.00 -1.06 0.00 0.00 33.84 32.67 2tmv n VAL 51 CO 0.00 0.00 0.00 0.26 -6.46 0.00 0.00 176.83 170.63 2tmv s TRP 52 N -1.40 2.84 -0.03 1.45 0.51 -0.57 -4.58 118.94 117.17 2tmv s TRP 52 Ca 0.00 -2.39 0.05 0.00 -2.12 0.00 0.00 56.10 51.64 2tmv s TRP 52 Cb 0.00 -2.32 -0.01 0.00 -0.81 0.00 0.00 33.47 30.33 2tmv s TRP 52 CO 0.00 -0.90 -0.18 0.15 -0.51 0.00 0.00 176.95 175.51 2tmv s LYS 53 N 1.22 1.66 0.16 4.98 1.02 0.17 -4.84 119.74 124.12 2tmv s LYS 53 Ca 0.08 -0.64 -0.32 0.00 0.02 0.00 0.00 55.97 55.12 2tmv s LYS 53 Cb -0.18 -1.52 -0.10 0.00 -0.52 0.00 0.00 37.83 35.51 2tmv s LYS 53 CO -0.14 0.32 1.66 -1.25 -0.92 0.00 0.00 175.35 175.02 2tmv s PRO 54 N -0.20 4.18 0.00 -1.68 0.04 -1.26 -3.56 135.00 132.52 2tmv s PRO 54 Ca 0.02 2.46 0.00 0.00 0.04 0.00 0.00 61.00 63.52 2tmv s PRO 54 Cb -0.09 -3.23 0.00 0.00 0.04 0.00 0.00 34.50 31.22 2tmv s PRO 54 CO 0.01 -0.69 0.00 0.45 0.04 0.00 0.00 177.00 176.80 2tmv n SER 55 N 4.34 0.00 -4.57 6.66 2.88 -1.25 -4.98 113.62 116.71 2tmv n SER 55 Ca 0.15 0.00 -0.41 0.00 -1.33 0.00 0.00 58.87 57.28 2tmv n SER 55 Cb 0.38 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.81 2tmv n SER 55 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 2tmv s PRO 56 N -0.76 3.62 0.14 -1.46 0.04 -1.26 -4.85 135.00 130.46 2tmv s PRO 56 Ca 0.00 -1.29 0.02 0.00 0.04 0.00 0.00 61.00 59.77 2tmv s PRO 56 Cb 0.00 -5.39 0.02 0.00 0.04 0.00 0.00 34.50 29.17 2tmv s PRO 56 CO 0.00 -2.30 0.16 1.04 0.04 0.00 0.00 177.00 175.94 2tmv n GLN 57 N 8.76 1.02 0.27 4.56 6.02 -1.26 -4.30 117.38 132.45 2tmv n GLN 57 Ca 0.37 -0.77 -0.11 0.00 -0.01 0.00 0.00 57.00 56.49 2tmv n GLN 57 Cb 0.50 -0.02 -0.06 0.00 1.02 0.00 0.00 30.24 31.68 2tmv n GLN 57 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 2tmv h VAL 58 N 0.17 0.00 0.00 5.09 2.07 -1.95 -2.72 116.25 118.91 2tmv h VAL 58 Ca -0.07 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.45 2tmv h VAL 58 Cb 0.30 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.07 2tmv h VAL 58 CO 0.10 0.00 0.18 0.41 0.02 0.00 0.00 177.57 178.29 2tmv n THR 59 N -4.04 0.76 -4.36 2.57 -1.04 -1.26 -3.02 114.28 103.89 2tmv n THR 59 Ca -0.09 0.75 -0.27 0.00 -2.04 0.00 0.00 64.05 62.41 2tmv n THR 59 Cb 0.29 -1.75 -0.04 0.00 -1.82 0.00 0.00 70.33 67.01 2tmv n THR 59 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2tmv n VAL 60 N -2.16 0.00 -3.46 12.58 0.31 -1.03 -4.67 118.33 119.90 2tmv n VAL 60 Ca -0.01 -2.04 -0.12 0.00 -0.01 0.00 0.00 64.34 62.16 2tmv n VAL 60 Cb 0.21 0.23 -0.03 0.00 -0.91 0.00 0.00 33.84 33.35 2tmv n VAL 60 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 2tmv s ARG 61 N -3.75 1.23 -0.03 5.55 3.52 -1.17 -4.53 118.95 119.78 2tmv s ARG 61 Ca 0.10 -0.47 -0.30 0.00 -0.13 0.00 0.00 55.73 54.93 2tmv s ARG 61 Cb -0.01 0.56 -0.06 0.00 -1.56 0.00 0.00 34.95 33.88 2tmv s ARG 61 CO 0.06 -0.52 1.72 0.12 -0.81 0.00 0.00 175.30 175.87 2tmv s PHE 62 N -3.62 1.86 0.50 5.12 5.36 -1.26 -4.75 117.98 121.19 2tmv s PHE 62 Ca 0.01 0.06 -0.21 0.00 -0.96 0.00 0.00 56.93 55.83 2tmv s PHE 62 Cb -0.00 -3.99 -0.09 0.00 -0.34 0.00 0.00 43.02 38.59 2tmv s PHE 62 CO -0.12 -4.22 0.79 -2.30 -1.46 0.00 0.00 175.22 167.92 2tmv n PRO 63 N 7.10 0.89 0.04 10.12 -0.02 -1.26 -4.64 135.00 147.24 2tmv n PRO 63 Ca 0.18 0.33 -0.02 0.00 -2.02 0.00 0.00 63.50 61.97 2tmv n PRO 63 Cb 0.42 -1.88 -0.01 0.00 -0.02 0.00 0.00 33.50 32.01 2tmv n PRO 63 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 2tmv h ASP 64 N 0.84 -0.09 0.00 2.55 2.03 -2.00 -3.36 116.42 116.39 2tmv h ASP 64 Ca -0.45 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.86 2tmv h ASP 64 Cb 1.37 0.02 0.00 0.00 -0.83 0.00 0.00 39.33 39.90 2tmv h ASP 64 CO 0.52 0.00 0.00 -1.20 -1.03 0.00 0.00 179.24 177.53 2tmv n SER 65 N -2.69 1.02 -3.79 4.15 7.64 -1.26 -4.81 113.62 113.88 2tmv n SER 65 Ca -0.01 -1.76 -0.09 0.00 1.01 0.00 0.00 58.87 58.01 2tmv n SER 65 Cb 0.04 -0.44 -0.04 0.00 -1.01 0.00 0.00 64.21 62.76 2tmv n SER 65 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2tmv s ASP 66 N -0.03 -0.22 0.07 6.43 1.01 -1.26 -5.18 116.67 117.50 2tmv s ASP 66 Ca 0.00 -0.56 0.00 0.00 0.71 0.00 0.00 52.55 52.70 2tmv s ASP 66 Cb 0.00 0.58 -0.00 0.00 1.01 0.00 0.00 42.92 44.51 2tmv s ASP 66 CO 0.00 -1.06 0.00 2.22 0.21 0.00 0.00 175.17 176.54 2tmv n PHE 67 N -0.34 0.16 -3.64 4.23 1.16 -1.26 -4.67 117.46 113.09 2tmv n PHE 67 Ca -0.09 -0.37 -0.09 0.00 -1.87 0.00 0.00 57.45 55.04 2tmv n PHE 67 Cb 0.62 -0.04 -0.07 0.00 -1.61 0.00 0.00 39.48 38.38 2tmv n PHE 67 CO 0.00 0.00 0.00 0.15 -1.87 0.00 0.00 176.76 175.04 2tmv s LYS 68 N -2.27 0.60 0.09 3.97 1.02 -0.67 -4.83 119.74 117.66 2tmv s LYS 68 Ca 0.00 0.83 -0.24 0.00 0.02 0.00 0.00 55.97 56.59 2tmv s LYS 68 Cb 0.00 0.23 -0.07 0.00 -0.52 0.00 0.00 37.83 37.48 2tmv s LYS 68 CO 0.00 -0.09 0.72 0.08 -0.92 0.00 0.00 175.35 175.15 2tmv s VAL 69 N 0.75 4.62 -0.25 3.17 1.01 -0.67 0.40 120.40 129.43 2tmv s VAL 69 Ca -0.03 1.56 0.02 0.00 0.00 0.00 0.00 61.98 63.54 2tmv s VAL 69 Cb -0.05 -4.07 0.05 0.00 0.00 0.00 0.00 36.38 32.31 2tmv s VAL 69 CO -0.09 0.45 -0.12 -0.47 0.00 0.00 0.00 175.10 174.88 2tmv s TYR 70 N -0.61 3.19 0.12 5.22 5.04 -1.26 -1.72 117.35 127.32 2tmv s TYR 70 Ca 0.35 -2.20 -0.23 0.00 -2.44 0.00 0.00 57.07 52.55 2tmv s TYR 70 Cb -0.21 -1.94 -0.05 0.00 0.35 0.00 0.00 41.96 40.11 2tmv s TYR 70 CO 0.23 -0.86 1.40 -0.09 -1.34 0.00 0.00 175.55 174.89 2tmv h ARG 71 N 7.81 -0.02 -4.63 4.97 2.43 -1.87 -2.85 114.38 120.21 2tmv h ARG 71 Ca -0.24 0.00 -0.71 0.00 -0.81 0.00 0.00 59.98 58.23 2tmv h ARG 71 Cb 1.06 0.00 -0.09 0.00 -0.42 0.00 0.00 29.97 30.53 2tmv h ARG 71 CO 0.49 -0.01 2.46 0.66 -1.51 0.00 0.00 179.97 182.06 2tmv n TYR 72 N -4.67 3.99 -3.79 2.20 4.01 -1.26 -2.44 117.16 115.19 2tmv n TYR 72 Ca 0.01 -2.95 -0.37 0.00 -0.16 0.00 0.00 57.90 54.43 2tmv n TYR 72 Cb 0.20 -2.45 -0.13 0.00 -0.31 0.00 0.00 39.34 36.64 2tmv n TYR 72 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 2tmv s ASN 73 N 3.16 5.04 0.60 7.72 3.84 -1.08 -4.90 114.94 129.32 2tmv s ASN 73 Ca 0.48 -0.85 0.11 0.00 0.21 0.00 0.00 52.86 52.81 2tmv s ASN 73 Cb 0.08 -1.84 0.39 0.00 -0.55 0.00 0.00 41.25 39.33 2tmv s ASN 73 CO -0.01 -0.21 1.08 0.00 -2.79 0.00 0.00 177.10 175.16 2tmv n ALA 74 N 4.82 0.43 -0.12 1.71 0.00 -1.26 0.19 120.51 126.28 2tmv n ALA 74 Ca -0.14 0.15 -0.20 0.00 0.00 0.00 0.00 53.44 53.24 2tmv n ALA 74 Cb 0.47 -0.26 -0.07 0.00 0.00 0.00 0.00 19.45 19.59 2tmv n ALA 74 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2tmv n VAL 75 N -2.74 1.51 -0.07 0.00 0.31 -1.26 -4.63 118.33 111.45 2tmv n VAL 75 Ca 0.10 -0.13 -0.11 0.00 -0.01 0.00 0.00 64.34 64.19 2tmv n VAL 75 Cb 1.18 -2.10 -0.04 0.00 -0.91 0.00 0.00 33.84 31.97 2tmv n VAL 75 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2tmv h LEU 76 N -1.00 0.37 0.00 7.52 3.38 -1.47 -3.34 115.31 120.77 2tmv h LEU 76 Ca -0.37 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.33 2tmv h LEU 76 Cb 1.32 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.97 2tmv h LEU 76 CO -0.23 0.54 0.00 -0.67 0.09 0.00 0.00 178.44 178.17 2tmv n ASP 77 N -4.71 0.00 0.18 -0.43 -0.08 0.52 0.20 116.55 112.22 2tmv n ASP 77 Ca -0.04 0.39 0.18 0.00 -1.51 0.00 0.00 54.79 53.81 2tmv n ASP 77 Cb 0.20 -0.07 0.80 0.00 2.34 0.00 0.00 41.12 44.39 2tmv n ASP 77 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2tmv h PRO 78 N 0.00 0.00 -0.53 -0.67 0.13 -1.78 -2.11 132.00 127.04 2tmv h PRO 78 Ca 0.00 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 65.16 2tmv h PRO 78 Cb 0.00 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.09 2tmv h PRO 78 CO 0.00 0.00 0.32 -0.07 -0.23 0.00 0.00 178.00 178.02 2tmv h LEU 79 N 0.00 0.51 -0.08 1.56 3.38 -0.37 -3.10 115.31 117.21 2tmv h LEU 79 Ca 0.11 0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.13 2tmv h LEU 79 Cb 0.60 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 41.18 2tmv h LEU 79 CO -0.00 0.36 -0.35 0.58 0.09 0.00 0.00 178.44 179.12 2tmv h VAL 80 N 0.63 0.25 0.13 1.22 2.07 -0.70 -2.92 116.25 116.93 2tmv h VAL 80 Ca 0.22 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.75 2tmv h VAL 80 Cb 0.03 0.25 -0.03 0.00 -1.52 0.00 0.00 31.29 30.02 2tmv h VAL 80 CO -0.10 0.00 -0.20 0.74 0.02 0.00 0.00 177.57 178.03 2tmv h THR 81 N -0.45 0.54 -1.36 2.57 2.02 -1.63 0.58 112.91 115.18 2tmv h THR 81 Ca 0.08 0.00 0.44 0.00 0.77 0.00 0.00 66.41 67.70 2tmv h THR 81 Cb 0.58 0.54 -0.11 0.00 -1.74 0.00 0.00 68.15 67.42 2tmv h THR 81 CO -0.33 0.00 0.91 0.00 0.37 0.00 0.00 175.52 176.47 2tmv n ALA 82 N -2.50 1.33 -0.06 6.16 0.00 -1.14 0.53 120.51 124.82 2tmv n ALA 82 Ca -0.07 0.70 -0.05 0.00 0.00 0.00 0.00 53.44 54.03 2tmv n ALA 82 Cb 0.24 -0.95 -0.03 0.00 0.00 0.00 0.00 19.45 18.72 2tmv n ALA 82 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2tmv h LEU 83 N 0.00 0.00 -1.90 0.00 3.38 -0.20 -3.36 115.31 113.22 2tmv h LEU 83 Ca 0.78 -0.12 0.03 0.00 0.09 0.00 0.00 57.88 58.66 2tmv h LEU 83 Cb 2.72 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 43.46 2tmv h LEU 83 CO -0.29 0.73 0.40 -0.07 0.09 0.00 0.00 178.44 179.30 2tmv h LEU 84 N -1.00 0.00 -3.16 1.67 3.38 0.50 -3.11 115.31 113.59 2tmv h LEU 84 Ca -0.03 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.80 2tmv h LEU 84 Cb 0.41 0.00 -0.27 0.00 0.09 0.00 0.00 40.66 40.88 2tmv h LEU 84 CO -0.02 0.00 -0.87 0.61 0.09 0.00 0.00 178.44 178.25 2tmv n GLY 85 N -1.30 2.46 0.01 0.83 0.00 0.59 -4.70 105.19 103.08 2tmv n GLY 85 Ca 0.01 -1.05 0.09 0.00 0.00 0.00 0.00 46.02 45.06 2tmv n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2tmv n ALA 86 N -0.09 2.81 0.17 4.61 0.00 -1.17 -4.37 120.51 122.47 2tmv n ALA 86 Ca 0.11 -0.41 0.11 0.00 0.00 0.00 0.00 53.44 53.24 2tmv n ALA 86 Cb 0.98 -0.59 0.10 0.00 0.00 0.00 0.00 19.45 19.95 2tmv n ALA 86 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 2tmv h PHE 87 N 0.00 0.00 -0.27 0.00 0.05 -1.84 -3.37 116.94 111.51 2tmv h PHE 87 Ca 0.00 0.00 0.06 0.00 3.82 0.00 0.00 57.97 61.85 2tmv h PHE 87 Cb 0.74 0.00 -0.06 0.00 2.00 0.00 0.00 35.95 38.63 2tmv h PHE 87 CO 0.00 0.06 -0.11 -0.44 -0.18 0.00 0.00 178.31 177.63 2tmv h ASP 88 N 0.00 -0.39 -5.21 2.17 5.19 -1.84 -3.46 116.42 112.88 2tmv h ASP 88 Ca -0.01 0.10 -0.08 0.00 -0.62 0.00 0.00 57.03 56.43 2tmv h ASP 88 Cb 1.05 0.22 -0.12 0.00 0.18 0.00 0.00 39.33 40.67 2tmv h ASP 88 CO 0.01 -0.15 -0.20 0.42 -3.12 0.00 0.00 179.24 176.20 2tmv s THR 89 N -6.18 0.05 0.15 0.35 -4.23 -1.26 -5.01 115.64 99.51 2tmv s THR 89 Ca -0.14 -1.21 0.00 0.00 -1.18 0.00 0.00 61.69 59.16 2tmv s THR 89 Cb 0.12 -1.80 0.00 0.00 1.34 0.00 0.00 72.50 72.17 2tmv s THR 89 CO 0.69 -0.22 0.00 -2.11 -0.54 0.00 0.00 174.62 172.44 2tmv n ARG 90 N -0.26 0.00 0.04 3.99 1.85 -1.26 -4.87 116.66 116.14 2tmv n ARG 90 Ca -0.08 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.77 2tmv n ARG 90 Cb 0.63 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 32.04 2tmv n ARG 90 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 2tmv n ASN 91 N -2.85 -0.66 -2.79 2.89 5.03 -1.26 -4.33 115.26 111.29 2tmv n ASN 91 Ca 0.00 0.21 -0.02 0.00 0.87 0.00 0.00 54.58 55.64 2tmv n ASN 91 Cb 0.00 0.86 0.00 0.00 -1.02 0.00 0.00 39.78 39.63 2tmv n ASN 91 CO 0.00 0.00 0.00 -2.11 -1.83 0.00 0.00 177.26 173.32 2tmv n ARG 92 N -2.37 -3.09 -2.70 3.52 1.85 -1.26 -5.05 116.66 107.56 2tmv n ARG 92 Ca 0.00 2.54 -0.05 0.00 -1.00 0.00 0.00 57.85 59.34 2tmv n ARG 92 Cb 0.00 -5.12 0.05 0.00 -1.05 0.00 0.00 32.46 26.34 2tmv n ARG 92 CO 0.00 0.00 0.00 1.51 -0.01 0.00 0.00 177.63 179.13 2tmv n ILE 93 N 0.56 0.00 -1.36 8.89 3.06 -1.26 -5.05 119.36 124.19 2tmv n ILE 93 Ca 0.02 -0.77 -0.39 0.00 -2.50 0.00 0.00 62.75 59.11 2tmv n ILE 93 Cb 0.12 1.04 -0.02 0.00 0.54 0.00 0.00 39.64 41.33 2tmv n ILE 93 CO 0.00 0.00 0.00 -0.38 -2.50 0.00 0.00 176.55 173.67 2tmv n ILE 94 N 1.99 3.15 -2.59 9.51 5.41 -1.26 -4.83 119.36 130.74 2tmv n ILE 94 Ca 0.08 -2.37 -0.43 0.00 1.00 0.00 0.00 62.75 61.02 2tmv n ILE 94 Cb 0.66 -2.48 0.00 0.00 -0.71 0.00 0.00 39.64 37.11 2tmv n ILE 94 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 176.55 174.71 2tmv n GLU 95 N 5.44 3.26 -2.52 0.38 0.28 -1.26 -4.96 120.64 121.26 2tmv n GLU 95 Ca 0.57 -3.42 -0.28 0.00 -0.16 0.00 0.00 57.16 53.86 2tmv n GLU 95 Cb 0.32 -3.27 -0.00 0.00 1.43 0.00 0.00 31.44 29.92 2tmv n GLU 95 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 2tmv s VAL 96 N 2.85 4.86 0.69 3.84 1.01 -1.26 -4.42 120.40 127.97 2tmv s VAL 96 Ca 0.48 0.36 0.02 0.00 0.00 0.00 0.00 61.98 62.84 2tmv s VAL 96 Cb 0.03 -3.85 0.12 0.00 0.00 0.00 0.00 36.38 32.68 2tmv s VAL 96 CO 0.03 -0.87 0.95 -0.70 0.00 0.00 0.00 175.10 174.50 2tmv s GLU 97 N -4.74 1.82 0.26 2.72 -6.30 0.68 -4.79 118.70 108.35 2tmv s GLU 97 Ca 0.49 -1.25 -0.08 0.00 -2.50 0.00 0.00 54.97 51.63 2tmv s GLU 97 Cb -0.10 -2.41 0.42 0.00 0.00 0.00 0.00 34.13 32.04 2tmv s GLU 97 CO 0.45 -1.31 1.47 -1.71 0.02 0.00 0.00 175.26 174.18 2tmv n ASN 98 N -2.69 -0.35 0.11 -1.70 2.85 -1.26 -2.57 115.26 109.64 2tmv n ASN 98 Ca 0.15 1.62 -0.05 0.00 -0.11 0.00 0.00 54.58 56.20 2tmv n ASN 98 Cb 0.61 -0.48 -0.02 0.00 1.24 0.00 0.00 39.78 41.12 2tmv n ASN 98 CO 0.00 0.00 0.00 0.06 -2.11 0.00 0.00 177.26 175.21 2tmv h GLN 99 N 0.00 -0.29 0.00 1.20 3.07 -2.03 -3.50 115.11 113.56 2tmv h GLN 99 Ca 0.44 0.02 0.00 0.00 0.09 0.00 0.00 58.65 59.20 2tmv h GLN 99 Cb 0.68 0.07 0.00 0.00 0.08 0.00 0.00 27.48 28.31 2tmv h GLN 99 CO -0.97 -0.19 0.00 0.00 0.09 0.00 0.00 178.83 177.76 2tmv n ALA 100 N -2.33 0.00 -2.65 0.06 0.00 -1.06 -5.04 120.51 109.49 2tmv n ALA 100 Ca -0.04 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.21 2tmv n ALA 100 Cb 0.12 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.42 2tmv n ALA 100 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2tmv s ASN 101 N 0.57 1.32 0.00 0.00 2.47 -1.26 0.25 114.94 118.28 2tmv s ASN 101 Ca 0.00 -0.25 0.00 0.00 0.42 0.00 0.00 52.86 53.03 2tmv s ASN 101 Cb 0.00 -0.13 0.00 0.00 -1.45 0.00 0.00 41.25 39.67 2tmv s ASN 101 CO 0.00 0.11 0.65 -0.81 -3.72 0.00 0.00 177.10 173.33 2tmv n PRO 102 N 2.62 0.00 0.00 0.43 -0.04 -1.26 -4.17 135.00 132.58 2tmv n PRO 102 Ca -0.15 0.48 0.06 0.00 -0.04 0.00 0.00 63.50 63.86 2tmv n PRO 102 Cb 0.56 -1.32 0.37 0.00 -0.04 0.00 0.00 33.50 33.08 2tmv n PRO 102 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2tmv n THR 103 N -1.95 0.00 0.00 0.52 -1.04 -1.26 -4.68 114.28 105.88 2tmv n THR 103 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2tmv n THR 103 Cb 0.00 -0.53 0.00 0.00 -1.82 0.00 0.00 70.33 67.98 2tmv n THR 103 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 2tmv n THR 104 N -0.83 0.00 -1.20 12.58 -1.04 -1.26 -2.67 114.28 119.86 2tmv n THR 104 Ca 0.09 0.46 0.05 0.00 -2.04 0.00 0.00 64.05 62.62 2tmv n THR 104 Cb 0.04 -0.65 0.20 0.00 -1.82 0.00 0.00 70.33 68.11 2tmv n THR 104 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2tmv n ALA 105 N -1.39 3.19 -0.35 2.41 0.00 -1.26 -4.03 120.51 119.08 2tmv n ALA 105 Ca 0.00 -2.72 0.00 0.00 0.00 0.00 0.00 53.44 50.72 2tmv n ALA 105 Cb 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 19.45 18.87 2tmv n ALA 105 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2tmv n GLU 106 N -1.00 0.00 0.00 0.00 -0.58 -1.09 -4.64 120.64 113.33 2tmv n GLU 106 Ca 0.23 0.32 0.00 0.00 -0.42 0.00 0.00 57.16 57.29 2tmv n GLU 106 Cb 0.83 -1.17 0.00 0.00 -0.57 0.00 0.00 31.44 30.53 2tmv n GLU 106 CO 0.00 0.00 0.00 -2.37 -0.48 0.00 0.00 177.13 174.28 2tmv n THR 107 N -1.47 0.00 0.00 2.62 5.66 -1.26 -4.90 114.28 114.93 2tmv n THR 107 Ca 0.00 -0.36 0.00 0.00 -3.05 0.00 0.00 64.05 60.64 2tmv n THR 107 Cb 0.00 0.87 0.00 0.00 -1.55 0.00 0.00 70.33 69.65 2tmv n THR 107 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 175.07 171.91 2tmv n LEU 108 N -1.09 0.49 0.00 1.09 -0.00 -1.26 -5.01 117.00 111.22 2tmv n LEU 108 Ca 0.00 0.52 0.00 0.00 -0.00 0.00 0.00 56.01 56.53 2tmv n LEU 108 Cb 0.00 -0.14 0.00 0.00 -0.00 0.00 0.00 43.42 43.28 2tmv n LEU 108 CO 0.00 -0.14 0.00 0.47 -0.00 0.00 0.00 177.39 177.72 2tmv n ASP 109 N -0.91 0.03 -3.78 1.96 9.92 -1.26 -5.06 116.55 117.46 2tmv n ASP 109 Ca 0.00 0.00 -0.13 0.00 -0.53 0.00 0.00 54.79 54.13 2tmv n ASP 109 Cb 0.00 0.00 -0.13 0.00 -0.64 0.00 0.00 41.12 40.35 2tmv n ASP 109 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2tmv s ALA 110 N -2.23 -0.39 -0.16 2.24 0.00 -1.26 -4.81 121.76 115.14 2tmv s ALA 110 Ca 0.00 0.62 0.12 0.00 0.00 0.00 0.00 51.96 52.70 2tmv s ALA 110 Cb 0.00 -0.39 -0.23 0.00 0.00 0.00 0.00 23.12 22.50 2tmv s ALA 110 CO 0.00 -0.12 0.19 -2.37 0.00 0.00 0.00 175.76 173.46 2tmv n THR 111 N 3.55 1.49 0.17 0.00 5.66 -1.26 -4.01 114.28 119.88 2tmv n THR 111 Ca -0.19 -0.79 0.19 0.00 -3.05 0.00 0.00 64.05 60.21 2tmv n THR 111 Cb 0.56 -0.84 0.78 0.00 -1.55 0.00 0.00 70.33 69.28 2tmv n THR 111 CO 0.00 0.00 0.00 -0.09 -3.05 0.00 0.00 175.07 171.93 2tmv h ARG 112 N 0.01 0.00 0.00 1.09 2.43 -1.98 -2.36 114.38 113.57 2tmv h ARG 112 Ca -0.48 0.00 -0.30 0.00 -0.81 0.00 0.00 59.98 58.39 2tmv h ARG 112 Cb 2.12 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 31.62 2tmv h ARG 112 CO 0.03 0.00 -2.12 0.54 -1.51 0.00 0.00 179.97 176.91 2tmv n ARG 113 N -3.52 1.19 0.14 0.20 1.74 -1.26 -4.43 116.66 110.72 2tmv n ARG 113 Ca 0.04 0.02 -0.07 0.00 -0.77 0.00 0.00 57.85 57.07 2tmv n ARG 113 Cb 0.51 -1.41 -0.03 0.00 -1.02 0.00 0.00 32.46 30.50 2tmv n ARG 113 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2tmv h VAL 114 N 0.00 0.00 -1.11 1.55 2.07 -1.56 -1.44 116.25 115.77 2tmv h VAL 114 Ca -0.44 0.00 0.31 0.00 0.82 0.00 0.00 66.70 67.39 2tmv h VAL 114 Cb 1.93 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 31.63 2tmv h VAL 114 CO 0.00 0.00 0.76 0.44 0.02 0.00 0.00 177.57 178.79 2tmv h ASP 115 N -0.40 0.22 -0.61 0.57 3.45 -1.84 2.22 116.42 120.02 2tmv h ASP 115 Ca -0.03 0.05 -0.02 0.00 0.43 0.00 0.00 57.03 57.45 2tmv h ASP 115 Cb 0.33 0.01 -0.03 0.00 -0.56 0.00 0.00 39.33 39.08 2tmv h ASP 115 CO 0.03 0.03 0.32 0.44 -1.57 0.00 0.00 179.24 178.49 2tmv h ASP 116 N 0.19 0.78 -0.75 6.45 5.19 -1.74 -2.25 116.42 124.29 2tmv h ASP 116 Ca 0.58 -0.11 0.17 0.00 -0.62 0.00 0.00 57.03 57.05 2tmv h ASP 116 Cb 1.90 -0.20 -0.13 0.00 0.18 0.00 0.00 39.33 41.08 2tmv h ASP 116 CO -0.16 0.66 -0.05 0.00 -3.12 0.00 0.00 179.24 176.57 2tmv h ALA 117 N 1.14 0.70 0.60 3.45 0.00 0.48 0.59 119.26 126.22 2tmv h ALA 117 Ca 0.21 0.25 -0.02 0.00 0.00 0.00 0.00 54.91 55.35 2tmv h ALA 117 Cb 0.07 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2tmv h ALA 117 CO -0.03 -0.42 -0.40 1.15 0.00 0.00 0.00 179.25 179.54 2tmv h THR 118 N 0.07 0.00 -0.72 0.00 2.02 -1.30 -0.98 112.91 112.00 2tmv h THR 118 Ca 0.40 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.72 2tmv h THR 118 Cb 0.68 0.00 -0.13 0.00 -1.74 0.00 0.00 68.15 66.95 2tmv h THR 118 CO -0.69 0.00 -0.19 0.52 0.37 0.00 0.00 175.52 175.54 2tmv n VAL 119 N -4.90 -0.31 -0.01 3.16 0.31 0.15 0.40 118.33 117.13 2tmv n VAL 119 Ca -0.11 1.64 -0.06 0.00 -0.01 0.00 0.00 64.34 65.80 2tmv n VAL 119 Cb 0.40 -2.26 0.13 0.00 -0.91 0.00 0.00 33.84 31.20 2tmv n VAL 119 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2tmv h ALA 120 N 1.40 0.93 -3.00 3.52 0.00 -1.25 -2.33 119.26 118.54 2tmv h ALA 120 Ca 0.34 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2tmv h ALA 120 Cb 0.52 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2tmv h ALA 120 CO -0.74 0.62 0.00 -0.89 0.00 0.00 0.00 179.25 178.24 2tmv n ILE 121 N -4.07 0.00 -0.64 0.00 5.41 1.33 0.61 119.36 122.00 2tmv n ILE 121 Ca -0.01 0.82 0.50 0.00 1.00 0.00 0.00 62.75 65.07 2tmv n ILE 121 Cb 0.47 -1.66 0.77 0.00 -0.71 0.00 0.00 39.64 38.51 2tmv n ILE 121 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 176.55 176.46 2tmv h ARG 122 N 0.00 0.00 0.08 0.38 2.43 -1.33 -1.41 114.38 114.53 2tmv h ARG 122 Ca 0.00 0.00 -0.17 0.00 -0.81 0.00 0.00 59.98 59.00 2tmv h ARG 122 Cb 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 2tmv h ARG 122 CO 0.00 0.00 -0.87 1.03 -1.51 0.00 0.00 179.97 178.62 2tmv h SER 123 N 0.00 0.26 0.87 -3.80 0.87 -1.11 -3.24 113.55 107.40 2tmv h SER 123 Ca 0.88 -0.87 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 2tmv h SER 123 Cb 3.67 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 65.55 2tmv h SER 123 CO -0.01 1.38 0.00 0.00 -0.53 0.00 0.00 176.83 177.67 2tmv n ALA 124 N -2.85 2.10 -0.26 6.23 0.00 0.20 -3.05 120.51 122.87 2tmv n ALA 124 Ca -0.19 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.18 2tmv n ALA 124 Cb 0.74 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.80 2tmv n ALA 124 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2tmv n ILE 125 N -1.57 0.00 -0.20 0.00 5.41 -0.86 -3.73 119.36 118.40 2tmv n ILE 125 Ca 0.06 1.26 -0.02 0.00 1.00 0.00 0.00 62.75 65.05 2tmv n ILE 125 Cb 0.29 -2.23 0.09 0.00 -0.71 0.00 0.00 39.64 37.08 2tmv n ILE 125 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 176.55 175.42 2tmv h ASN 126 N 0.00 0.41 -0.93 4.38 -0.73 -1.58 -1.27 115.58 115.86 2tmv h ASN 126 Ca 0.00 0.04 0.27 0.00 1.87 0.00 0.00 56.30 58.49 2tmv h ASN 126 Cb 0.00 -0.03 -0.15 0.00 0.27 0.00 0.00 38.32 38.41 2tmv h ASN 126 CO 0.00 0.26 0.30 0.78 -0.37 0.00 0.00 177.43 178.40 2tmv h ASN 127 N 0.55 0.06 0.55 1.15 2.35 -1.69 1.66 115.58 120.21 2tmv h ASN 127 Ca 0.28 0.21 -0.03 0.00 -0.55 0.00 0.00 56.30 56.22 2tmv h ASN 127 Cb 0.24 0.27 0.01 0.00 0.05 0.00 0.00 38.32 38.88 2tmv h ASN 127 CO -0.21 -0.20 -0.26 0.25 -1.65 0.00 0.00 177.43 175.35 2tmv h LEU 128 N 0.19 -0.62 -0.72 1.61 6.46 -1.54 -2.26 115.31 118.44 2tmv h LEU 128 Ca 0.62 0.02 0.16 0.00 -0.12 0.00 0.00 57.88 58.56 2tmv h LEU 128 Cb 1.34 0.16 -0.14 0.00 -0.73 0.00 0.00 40.66 41.29 2tmv h LEU 128 CO -0.69 -0.37 -0.13 -0.38 -0.62 0.00 0.00 178.44 176.25 2tmv n ILE 129 N -4.37 -0.30 -0.20 4.05 5.41 0.39 0.28 119.36 124.63 2tmv n ILE 129 Ca -0.09 1.62 0.01 0.00 1.00 0.00 0.00 62.75 65.29 2tmv n ILE 129 Cb 0.29 -2.28 0.11 0.00 -0.71 0.00 0.00 39.64 37.06 2tmv n ILE 129 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 2tmv h VAL 130 N 0.00 0.57 0.40 1.39 2.07 0.20 0.98 116.25 121.87 2tmv h VAL 130 Ca 0.37 -0.07 -0.02 0.00 0.82 0.00 0.00 66.70 67.80 2tmv h VAL 130 Cb 0.62 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 30.75 2tmv h VAL 130 CO -0.72 0.04 -0.19 -0.33 0.02 0.00 0.00 177.57 176.38 2tmv h GLU 131 N 0.20 -0.52 -0.97 1.57 4.39 0.46 -2.96 114.58 116.75 2tmv h GLU 131 Ca 0.32 0.04 0.22 0.00 0.34 0.00 0.00 59.36 60.28 2tmv h GLU 131 Cb 0.51 0.12 -0.12 0.00 -0.10 0.00 0.00 28.75 29.16 2tmv h GLU 131 CO -0.46 -0.35 0.55 -0.07 -1.16 0.00 0.00 179.01 177.52 2tmv h LEU 132 N -0.96 0.63 -0.71 1.33 3.38 0.14 0.39 115.31 119.51 2tmv h LEU 132 Ca -0.06 0.12 0.08 0.00 0.09 0.00 0.00 57.88 58.12 2tmv h LEU 132 Cb 0.42 0.03 -0.07 0.00 0.09 0.00 0.00 40.66 41.13 2tmv h LEU 132 CO 0.09 0.15 0.38 0.40 0.09 0.00 0.00 178.44 179.55 2tmv h ILE 133 N 0.61 0.90 0.00 1.22 2.04 -0.86 -0.52 117.51 120.89 2tmv h ILE 133 Ca 0.59 -0.23 -0.03 0.00 1.00 0.00 0.00 64.86 66.20 2tmv h ILE 133 Cb 1.05 0.18 -0.00 0.00 -0.74 0.00 0.00 36.82 37.31 2tmv h ILE 133 CO -0.45 0.12 -0.13 0.03 0.00 0.00 0.00 178.15 177.73 2tmv h ARG 134 N 0.66 0.00 -0.07 2.37 3.08 -0.07 -3.46 114.38 116.89 2tmv h ARG 134 Ca 0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.39 2tmv h ARG 134 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.35 2tmv h ARG 134 CO -0.23 0.13 0.00 0.41 -1.07 0.00 0.00 179.97 179.20 2tmv n GLY 135 N -1.14 0.62 3.57 0.04 0.00 -0.20 -4.98 105.19 103.11 2tmv n GLY 135 Ca -0.03 -0.75 -0.48 0.00 0.00 0.00 0.00 46.02 44.76 2tmv n GLY 135 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2tmv n THR 136 N -3.48 1.11 -0.76 2.61 -1.04 -1.23 -3.79 114.28 107.70 2tmv n THR 136 Ca 0.00 -0.28 0.00 0.00 -2.04 0.00 0.00 64.05 61.73 2tmv n THR 136 Cb 0.43 -0.84 0.00 0.00 -1.82 0.00 0.00 70.33 68.10 2tmv n THR 136 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2tmv n GLY 137 N 1.88 0.00 3.52 3.41 0.00 -1.26 -4.84 105.19 107.90 2tmv n GLY 137 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 2tmv n GLY 137 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2tmv s SER 138 N -0.97 6.18 0.63 1.61 0.01 -1.25 -4.14 113.70 115.76 2tmv s SER 138 Ca 0.00 -0.39 0.00 0.00 1.31 0.00 0.00 55.95 56.87 2tmv s SER 138 Cb 0.00 -2.20 0.00 0.00 0.21 0.00 0.00 66.02 64.03 2tmv s SER 138 CO 0.00 -0.42 0.00 -1.22 0.41 0.00 0.00 173.24 172.01 2tmv n TYR 139 N 5.44 -2.60 -3.52 2.43 4.01 1.30 -4.71 117.16 119.50 2tmv n TYR 139 Ca -0.09 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.52 2tmv n TYR 139 Cb 0.49 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.47 2tmv n TYR 139 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 2tmv s ASN 140 N -1.00 -0.50 0.16 7.72 3.84 -1.26 -1.66 114.94 122.24 2tmv s ASN 140 Ca 0.00 0.17 -0.30 0.00 0.21 0.00 0.00 52.86 52.94 2tmv s ASN 140 Cb 0.00 0.53 -0.05 0.00 -0.55 0.00 0.00 41.25 41.18 2tmv s ASN 140 CO 0.00 -0.79 1.54 0.08 -2.79 0.00 0.00 177.10 175.15 2tmv h ARG 141 N 2.55 -0.03 0.00 0.43 0.11 -1.82 3.16 114.38 118.78 2tmv h ARG 141 Ca -0.31 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.77 2tmv h ARG 141 Cb 1.23 0.01 0.00 0.00 1.11 0.00 0.00 29.97 32.32 2tmv h ARG 141 CO 0.40 -0.02 0.30 0.77 0.10 0.00 0.00 179.97 181.52 2tmv h SER 142 N -0.03 0.00 0.00 0.08 0.02 -1.93 -2.28 113.55 109.41 2tmv h SER 142 Ca 0.17 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 2tmv h SER 142 Cb 0.44 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.98 2tmv h SER 142 CO -0.92 0.00 0.00 -0.24 -1.14 0.00 0.00 176.83 174.53 2tmv n SER 143 N -2.67 0.00 -0.38 3.07 2.88 1.01 -3.46 113.62 114.06 2tmv n SER 143 Ca -0.02 0.20 0.37 0.00 -1.33 0.00 0.00 58.87 58.09 2tmv n SER 143 Cb 0.34 -0.42 0.73 0.00 -0.75 0.00 0.00 64.21 64.12 2tmv n SER 143 CO 0.00 0.00 0.00 0.15 -1.23 0.00 0.00 175.04 173.96 2tmv h PHE 144 N 0.00 0.09 0.00 0.66 -0.00 -0.06 0.57 116.94 118.19 2tmv h PHE 144 Ca 0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 57.97 57.78 2tmv h PHE 144 Cb 0.00 -0.02 -0.03 0.00 -0.00 0.00 0.00 35.95 35.90 2tmv h PHE 144 CO 0.00 -0.00 -0.91 0.93 -0.00 0.00 0.00 178.31 178.32 2tmv h GLU 145 N 0.04 0.00 -0.34 1.11 5.08 -1.63 0.68 114.58 119.51 2tmv h GLU 145 Ca 0.63 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.99 2tmv h GLU 145 Cb 2.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.67 2tmv h GLU 145 CO -0.05 0.91 0.00 0.43 -1.00 0.00 0.00 179.01 179.30 2tmv n SER 146 N -3.37 2.64 -0.04 1.42 7.64 0.15 -2.47 113.62 119.60 2tmv n SER 146 Ca 0.00 -1.90 -0.06 0.00 1.01 0.00 0.00 58.87 57.93 2tmv n SER 146 Cb 0.89 -0.22 -0.02 0.00 -1.01 0.00 0.00 64.21 63.85 2tmv n SER 146 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2tmv n SER 147 N 0.95 1.56 0.17 6.43 7.64 0.12 -4.84 113.62 125.65 2tmv n SER 147 Ca 0.18 0.25 -0.07 0.00 1.01 0.00 0.00 58.87 60.23 2tmv n SER 147 Cb 0.46 -0.59 -0.03 0.00 -1.01 0.00 0.00 64.21 63.04 2tmv n SER 147 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2tmv h SER 148 N -0.62 -0.40 0.00 6.43 4.64 0.26 -3.48 113.55 120.37 2tmv h SER 148 Ca 0.00 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2tmv h SER 148 Cb 0.62 0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.82 2tmv h SER 148 CO 0.00 -0.08 0.00 0.61 -0.87 0.00 0.00 176.83 176.49 2tmv n GLY 149 N 0.32 1.16 3.72 -0.77 0.00 -1.03 -5.00 105.19 103.59 2tmv n GLY 149 Ca -0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 2tmv n GLY 149 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2tmv s LEU 150 N 0.00 4.40 0.05 0.99 0.05 -1.26 -4.95 118.68 117.95 2tmv s LEU 150 Ca 0.00 1.63 0.07 0.00 0.05 0.00 0.00 54.13 55.88 2tmv s LEU 150 Cb 0.00 -3.51 -0.03 0.00 -2.05 0.00 0.00 46.19 40.60 2tmv s LEU 150 CO 0.00 -0.19 -0.19 -0.69 -0.55 0.00 0.00 176.35 174.73 2tmv s VAL 151 N 0.72 2.72 -0.09 1.48 1.01 -1.26 -4.81 120.40 120.17 2tmv s VAL 151 Ca 0.49 -1.23 -0.03 0.00 0.00 0.00 0.00 61.98 61.21 2tmv s VAL 151 Cb -0.21 -2.15 -0.04 0.00 0.00 0.00 0.00 36.38 33.99 2tmv s VAL 151 CO 0.27 0.32 0.04 0.86 0.00 0.00 0.00 175.10 176.59 2tmv s TRP 152 N -0.93 3.27 -0.05 5.22 -0.00 -1.26 -3.63 118.94 121.57 2tmv s TRP 152 Ca 0.14 0.28 -0.00 0.00 -0.00 0.00 0.00 56.10 56.52 2tmv s TRP 152 Cb -0.10 -1.82 0.03 0.00 -0.00 0.00 0.00 33.47 31.57 2tmv s TRP 152 CO 0.05 0.54 -0.02 0.95 -0.00 0.00 0.00 176.95 178.48 2tmv s THR 153 N -0.93 0.38 -2.64 5.86 -4.23 -1.26 -5.10 115.64 107.72 2tmv s THR 153 Ca 0.14 0.03 0.21 0.00 -1.18 0.00 0.00 61.69 60.89 2tmv s THR 153 Cb -0.12 -0.47 0.17 0.00 1.34 0.00 0.00 72.50 73.42 2tmv s THR 153 CO 0.03 0.22 1.17 -1.20 -0.54 0.00 0.00 174.62 174.30