#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gvg s SER 3 N 0.00 0.98 -0.00 8.00 1.04 -1.26 -0.12 113.70 122.34 1gvg s SER 3 Ca 0.00 -0.69 -0.01 0.00 0.48 0.00 0.00 55.95 55.74 1gvg s SER 3 Cb 0.00 0.05 -0.00 0.00 0.10 0.00 0.00 66.02 66.17 1gvg s SER 3 CO 0.00 -0.27 0.01 0.68 0.98 0.00 0.00 173.24 174.64 1gvg s VAL 4 N -2.03 0.01 -0.35 5.02 -7.23 -0.29 -4.94 120.40 110.60 1gvg s VAL 4 Ca -0.03 -0.12 -0.13 0.00 -1.81 0.00 0.00 61.98 59.88 1gvg s VAL 4 Cb -0.06 -0.07 -0.01 0.00 0.56 0.00 0.00 36.38 36.80 1gvg s VAL 4 CO -0.01 -0.07 0.26 -0.62 -0.31 0.00 0.00 175.10 174.35 1gvg s ASP 5 N -0.19 6.08 -0.05 4.85 2.15 -1.26 -0.82 116.67 127.42 1gvg s ASP 5 Ca -0.02 -0.47 0.21 0.00 0.43 0.00 0.00 52.55 52.70 1gvg s ASP 5 Cb -0.01 -2.15 0.69 0.00 -0.30 0.00 0.00 42.92 41.15 1gvg s ASP 5 CO -0.00 -0.27 1.59 0.00 -0.17 0.00 0.00 175.17 176.32 1gvg h THR 7 N 4.23 0.44 0.00 0.00 2.02 -1.69 0.27 112.91 118.18 1gvg h THR 7 Ca 0.00 -0.12 -0.00 0.00 0.77 0.00 0.00 66.41 67.06 1gvg h THR 7 Cb 1.21 0.07 -0.00 0.00 -1.74 0.00 0.00 68.15 67.69 1gvg h THR 7 CO 0.11 0.06 -0.01 0.00 0.37 0.00 0.00 175.52 176.05 1gvg h ALA 8 N 1.72 1.38 -0.51 6.16 0.00 -1.89 -2.01 119.26 124.10 1gvg h ALA 8 Ca 0.55 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.44 1gvg h ALA 8 Cb 1.05 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1gvg h ALA 8 CO -0.55 0.02 0.00 0.66 0.00 0.00 0.00 179.25 179.37 1gvg n TYR 9 N -3.65 1.10 -0.04 0.00 4.02 0.08 -4.53 117.16 114.15 1gvg n TYR 9 Ca -0.03 -0.45 -0.09 0.00 -0.01 0.00 0.00 57.90 57.32 1gvg n TYR 9 Cb 0.10 -0.18 -0.03 0.00 -0.02 0.00 0.00 39.34 39.22 1gvg n TYR 9 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 1gvg h GLY 10 N 4.57 -0.27 0.74 2.72 0.00 -1.43 0.30 103.07 109.69 1gvg h GLY 10 Ca 0.00 0.35 0.04 0.00 0.00 0.00 0.00 47.33 47.71 1gvg h GLY 10 CO 0.16 -0.21 0.17 -2.55 0.00 0.00 0.00 176.54 174.11 1gvg h PRO 11 N -0.30 0.34 -0.66 4.80 0.11 -1.85 0.08 132.00 134.51 1gvg h PRO 11 Ca 0.12 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.15 1gvg h PRO 11 Cb 0.50 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 31.50 1gvg h PRO 11 CO -0.39 0.23 0.17 0.93 -0.21 0.00 0.00 178.00 178.73 1gvg h GLU 12 N 0.35 1.05 -0.12 1.05 5.08 -1.78 -1.61 114.58 118.60 1gvg h GLU 12 Ca 0.17 -0.24 -0.15 0.00 -1.00 0.00 0.00 59.36 58.15 1gvg h GLU 12 Cb 0.12 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 1gvg h GLU 12 CO -0.15 0.92 -0.58 -0.07 -1.00 0.00 0.00 179.01 178.14 1gvg h LEU 13 N 1.00 0.41 -0.92 1.33 3.38 -0.57 -1.92 115.31 118.02 1gvg h LEU 13 Ca 0.21 -0.23 -0.10 0.00 0.09 0.00 0.00 57.88 57.85 1gvg h LEU 13 Cb 0.34 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1gvg h LEU 13 CO -0.00 0.90 -0.31 0.03 0.09 0.00 0.00 178.44 179.14 1gvg h ARG 14 N 0.28 0.42 -0.06 1.13 3.08 -0.76 -1.03 114.38 117.43 1gvg h ARG 14 Ca -0.00 -0.17 -0.01 0.00 0.07 0.00 0.00 59.98 59.87 1gvg h ARG 14 Cb 1.09 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 31.12 1gvg h ARG 14 CO 0.10 0.69 0.02 0.00 -1.07 0.00 0.00 179.97 179.70 1gvg h ALA 15 N 1.31 0.08 -0.87 0.04 0.00 -1.03 -1.77 119.26 117.01 1gvg h ALA 15 Ca 0.05 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.86 1gvg h ALA 15 Cb 0.73 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.45 1gvg h ALA 15 CO 0.06 -0.30 0.58 -0.07 0.00 0.00 0.00 179.25 179.52 1gvg h LEU 16 N -0.12 0.97 -1.18 0.00 3.38 -1.12 -1.27 115.31 115.97 1gvg h LEU 16 Ca 0.02 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1gvg h LEU 16 Cb 0.24 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 1gvg h LEU 16 CO 0.00 0.68 0.23 0.00 0.09 0.00 0.00 178.44 179.44 1gvg h ALA 17 N 1.48 1.35 0.00 1.53 0.00 -0.99 -1.79 119.26 120.84 1gvg h ALA 17 Ca 0.34 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 1gvg h ALA 17 Cb -0.04 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 1gvg h ALA 17 CO -0.09 0.49 -0.00 0.00 0.00 0.00 0.00 179.25 179.65 1gvg h ALA 18 N 1.46 1.00 0.00 0.00 0.00 -0.33 -2.35 119.26 119.04 1gvg h ALA 18 Ca 0.19 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 1gvg h ALA 18 Cb 0.14 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1gvg h ALA 18 CO -0.02 0.00 -0.23 0.00 0.00 0.00 0.00 179.25 179.00 1gvg h ARG 19 N 0.00 0.00 -6.93 0.00 3.08 -1.14 -3.46 114.38 105.93 1gvg h ARG 19 Ca -0.00 0.00 -0.46 0.00 0.07 0.00 0.00 59.98 59.59 1gvg h ARG 19 Cb 0.21 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.24 1gvg h ARG 19 CO 0.00 0.23 0.26 -0.51 -1.07 0.00 0.00 179.97 178.88 1gvg s LEU 20 N -6.71 4.03 0.28 3.04 1.43 -0.89 -5.00 118.68 114.87 1gvg s LEU 20 Ca 0.01 1.58 -0.30 0.00 -1.03 0.00 0.00 54.13 54.40 1gvg s LEU 20 Cb 0.10 -4.32 -0.13 0.00 0.03 0.00 0.00 46.19 41.87 1gvg s LEU 20 CO 0.64 -0.27 1.33 -2.65 0.23 0.00 0.00 176.35 175.63 1gvg n PRO 21 N -0.39 2.02 0.01 1.29 -0.02 -1.26 -4.89 135.00 131.76 1gvg n PRO 21 Ca 0.05 0.71 0.13 0.00 -2.02 0.00 0.00 63.50 62.37 1gvg n PRO 21 Cb 0.53 -2.32 0.55 0.00 -0.02 0.00 0.00 33.50 32.25 1gvg n PRO 21 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1gvg n ARG 22 N 1.37 0.02 -3.78 -0.52 1.74 -1.26 -4.04 116.66 110.20 1gvg n ARG 22 Ca 0.09 0.06 -0.28 0.00 -0.77 0.00 0.00 57.85 56.95 1gvg n ARG 22 Cb 0.33 -1.52 -0.11 0.00 -1.02 0.00 0.00 32.46 30.13 1gvg n ARG 22 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1gvg n THR 23 N -1.56 1.05 -0.24 0.55 -1.04 -1.26 -0.20 114.28 111.57 1gvg n THR 23 Ca 0.06 -4.57 0.04 0.00 -2.04 0.00 0.00 64.05 57.54 1gvg n THR 23 Cb 0.32 -2.07 0.16 0.00 -1.82 0.00 0.00 70.33 66.92 1gvg n THR 23 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 1gvg h PRO 24 N 5.39 0.43 0.00 -2.82 0.13 -1.77 -2.60 132.00 130.76 1gvg h PRO 24 Ca 0.18 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 1gvg h PRO 24 Cb 0.78 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 31.82 1gvg h PRO 24 CO 0.65 0.28 0.00 0.00 -0.23 0.00 0.00 178.00 178.70 1gvg h ARG 25 N 0.44 0.00 0.00 0.86 3.08 -1.86 -2.06 114.38 114.83 1gvg h ARG 25 Ca 0.38 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.40 1gvg h ARG 25 Cb 0.55 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.60 1gvg h ARG 25 CO -0.38 0.00 -0.15 0.00 -1.07 0.00 0.00 179.97 178.37 1gvg h ALA 26 N 2.17 1.09 -0.86 0.04 0.00 -1.50 -3.35 119.26 116.86 1gvg h ALA 26 Ca 0.00 -0.14 -0.18 0.00 0.00 0.00 0.00 54.91 54.59 1gvg h ALA 26 Cb 0.59 -0.02 -0.16 0.00 0.00 0.00 0.00 17.79 18.19 1gvg h ALA 26 CO 0.00 0.19 -0.51 -3.47 0.00 0.00 0.00 179.25 175.46 1gvg n ASP 27 N -3.41 -3.26 -0.17 0.00 4.64 -1.06 -5.03 116.55 108.27 1gvg n ASP 27 Ca -0.01 -2.97 -0.03 0.00 -1.38 0.00 0.00 54.79 50.40 1gvg n ASP 27 Cb 0.34 1.69 0.16 0.00 -1.04 0.00 0.00 41.12 42.28 1gvg n ASP 27 CO 0.00 0.00 0.00 0.25 -0.82 0.00 0.00 177.20 176.63 1gvg h LEU 28 N 4.83 0.85 -0.49 -2.67 5.85 -1.52 -0.62 115.31 121.54 1gvg h LEU 28 Ca 0.03 -0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.57 1gvg h LEU 28 Cb 1.09 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.88 1gvg h LEU 28 CO 0.08 0.81 0.18 1.88 -0.34 0.00 0.00 178.44 181.05 1gvg h TYR 29 N 0.88 0.75 -0.48 1.25 0.05 -1.86 -0.10 116.97 117.46 1gvg h TYR 29 Ca 0.20 -0.06 -0.10 0.00 0.05 0.00 0.00 58.73 58.81 1gvg h TYR 29 Cb 0.28 -0.22 -0.02 0.00 1.01 0.00 0.00 36.73 37.77 1gvg h TYR 29 CO 0.02 0.64 -0.11 0.00 -1.05 0.00 0.00 178.16 177.65 1gvg h ALA 30 N 1.03 0.90 -0.27 3.88 0.00 -1.85 -1.13 119.26 121.82 1gvg h ALA 30 Ca 0.16 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1gvg h ALA 30 Cb 0.21 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1gvg h ALA 30 CO -0.01 0.63 0.16 0.35 0.00 0.00 0.00 179.25 180.39 1gvg h PHE 31 N 0.79 0.35 0.00 0.00 3.04 -0.75 -0.89 116.94 119.49 1gvg h PHE 31 Ca 0.13 0.00 -0.10 0.00 3.98 0.00 0.00 57.97 61.98 1gvg h PHE 31 Cb 0.63 -0.12 -0.01 0.00 2.56 0.00 0.00 35.95 39.01 1gvg h PHE 31 CO 0.04 0.26 -0.47 -0.07 -2.02 0.00 0.00 178.31 176.04 1gvg h LEU 32 N 0.34 0.00 -0.40 0.59 3.38 -0.91 -0.46 115.31 117.85 1gvg h LEU 32 Ca 0.10 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.97 1gvg h LEU 32 Cb 0.01 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1gvg h LEU 32 CO -0.02 0.47 -0.14 -0.78 0.09 0.00 0.00 178.44 178.06 1gvg h ASP 33 N 0.00 0.82 -0.88 -0.43 1.82 -0.93 -0.33 116.42 116.50 1gvg h ASP 33 Ca -0.00 -0.38 0.00 0.00 -0.39 0.00 0.00 57.03 56.25 1gvg h ASP 33 Cb 0.96 -0.23 -0.04 0.00 0.68 0.00 0.00 39.33 40.70 1gvg h ASP 33 CO 0.06 1.02 0.55 0.00 -1.61 0.00 0.00 179.24 179.26 1gvg h ALA 34 N 0.83 1.11 -0.38 -0.78 0.00 -0.81 -1.29 119.26 117.94 1gvg h ALA 34 Ca 0.10 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 1gvg h ALA 34 Cb 0.68 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1gvg h ALA 34 CO 0.05 0.55 -0.01 0.00 0.00 0.00 0.00 179.25 179.83 1gvg h ALA 35 N 1.30 1.26 -0.19 0.00 0.00 -0.69 -1.46 119.26 119.49 1gvg h ALA 35 Ca 0.32 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1gvg h ALA 35 Cb -0.09 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1gvg h ALA 35 CO -0.06 0.49 0.04 1.25 0.00 0.00 0.00 179.25 180.97 1gvg h HIS 36 N 0.58 0.32 -0.65 0.00 6.17 -0.21 0.86 115.15 122.21 1gvg h HIS 36 Ca 0.12 -0.04 0.01 0.00 0.71 0.00 0.00 60.37 61.17 1gvg h HIS 36 Cb 0.39 -0.09 -0.03 0.00 2.52 0.00 0.00 27.41 30.20 1gvg h HIS 36 CO 0.02 0.43 0.43 1.15 0.71 0.00 0.00 177.93 180.67 1gvg h THR 37 N 0.11 1.16 -0.32 6.26 2.02 -1.04 -2.24 112.91 118.86 1gvg h THR 37 Ca 0.06 -0.30 -0.06 0.00 0.77 0.00 0.00 66.41 66.87 1gvg h THR 37 Cb 0.28 0.21 -0.02 0.00 -1.74 0.00 0.00 68.15 66.89 1gvg h THR 37 CO 0.00 0.16 -0.08 0.00 0.37 0.00 0.00 175.52 175.97 1gvg h ALA 38 N 1.24 1.27 0.00 6.16 0.00 -1.09 -2.65 119.26 124.19 1gvg h ALA 38 Ca 0.24 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1gvg h ALA 38 Cb -0.09 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.55 1gvg h ALA 38 CO -0.05 0.48 0.00 0.00 0.00 0.00 0.00 179.25 179.68 1gvg h ALA 39 N 1.43 1.00 0.00 0.00 0.00 -0.19 0.14 119.26 121.63 1gvg h ALA 39 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1gvg h ALA 39 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1gvg h ALA 39 CO 0.02 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.27 1gvg h ALA 40 N 2.02 1.00 -0.35 0.00 0.00 -1.42 -3.14 119.26 117.37 1gvg h ALA 40 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1gvg h ALA 40 Cb 0.10 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.84 1gvg h ALA 40 CO 0.00 0.00 0.02 0.43 0.00 0.00 0.00 179.25 179.70 1gvg n SER 41 N -2.45 3.51 -4.75 0.00 7.64 0.49 -5.02 113.62 113.05 1gvg n SER 41 Ca 0.04 -3.30 -0.33 0.00 1.01 0.00 0.00 58.87 56.29 1gvg n SER 41 Cb 0.36 -0.60 0.08 0.00 -1.01 0.00 0.00 64.21 63.04 1gvg n SER 41 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1gvg s LEU 42 N -2.99 3.23 0.46 -3.43 1.43 -1.19 -4.93 118.68 111.26 1gvg s LEU 42 Ca 0.45 2.07 -0.24 0.00 -1.03 0.00 0.00 54.13 55.38 1gvg s LEU 42 Cb 0.38 -4.56 -0.08 0.00 0.03 0.00 0.00 46.19 41.95 1gvg s LEU 42 CO 0.06 -2.06 1.22 -2.65 0.23 0.00 0.00 176.35 173.15 1gvg n PRO 43 N -2.96 1.69 -0.29 1.29 -0.02 -1.26 -4.70 135.00 128.76 1gvg n PRO 43 Ca 0.11 0.61 0.07 0.00 -2.02 0.00 0.00 63.50 62.27 1gvg n PRO 43 Cb 0.52 -2.35 0.22 0.00 -0.02 0.00 0.00 33.50 31.87 1gvg n PRO 43 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1gvg h GLY 44 N 1.72 1.32 0.90 -1.23 0.00 -1.99 -0.90 103.07 102.89 1gvg h GLY 44 Ca -0.48 -0.22 0.03 0.00 0.00 0.00 0.00 47.33 46.66 1gvg h GLY 44 CO 0.58 -0.06 0.54 0.00 0.00 0.00 0.00 176.54 177.60 1gvg h ALA 45 N 1.56 1.09 -0.09 3.60 0.00 -2.00 -1.16 119.26 122.26 1gvg h ALA 45 Ca 0.45 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.27 1gvg h ALA 45 Cb 0.66 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1gvg h ALA 45 CO -0.38 0.38 -0.17 1.25 0.00 0.00 0.00 179.25 180.33 1gvg h LEU 46 N 1.06 0.30 -0.58 0.00 5.85 -1.66 -1.55 115.31 118.72 1gvg h LEU 46 Ca 0.33 -0.56 0.06 0.00 0.84 0.00 0.00 57.88 58.55 1gvg h LEU 46 Cb -0.02 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 40.87 1gvg h LEU 46 CO -0.10 0.81 0.29 0.00 -0.34 0.00 0.00 178.44 179.09 1gvg h ALA 47 N 0.50 0.76 -0.27 1.25 0.00 -1.06 0.57 119.26 121.02 1gvg h ALA 47 Ca 0.00 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1gvg h ALA 47 Cb 0.76 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1gvg h ALA 47 CO 0.04 -0.07 0.11 1.15 0.00 0.00 0.00 179.25 180.48 1gvg h THR 48 N 0.53 1.17 -0.64 0.00 2.02 -1.18 -0.18 112.91 114.63 1gvg h THR 48 Ca 0.27 -0.50 0.00 0.00 0.77 0.00 0.00 66.41 66.95 1gvg h THR 48 Cb 0.22 1.00 -0.03 0.00 -1.74 0.00 0.00 68.15 67.59 1gvg h THR 48 CO -0.20 0.17 0.41 0.00 0.37 0.00 0.00 175.52 176.27 1gvg h ALA 49 N 0.96 0.82 -0.29 6.16 0.00 -0.80 -0.18 119.26 125.93 1gvg h ALA 49 Ca 0.09 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 1gvg h ALA 49 Cb 0.16 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1gvg h ALA 49 CO -0.01 0.27 -0.16 -0.07 0.00 0.00 0.00 179.25 179.29 1gvg h LEU 50 N 0.87 0.63 -0.95 0.00 3.38 -0.75 -1.89 115.31 116.61 1gvg h LEU 50 Ca 0.23 -0.42 -0.04 0.00 0.09 0.00 0.00 57.88 57.75 1gvg h LEU 50 Cb -0.06 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.48 1gvg h LEU 50 CO -0.05 0.92 0.31 0.44 0.09 0.00 0.00 178.44 180.15 1gvg h ASP 51 N 0.35 0.98 -0.19 -0.43 3.45 -0.84 0.10 116.42 119.83 1gvg h ASP 51 Ca 0.06 -0.13 -0.04 0.00 0.43 0.00 0.00 57.03 57.35 1gvg h ASP 51 Cb 0.69 -0.25 -0.01 0.00 -0.56 0.00 0.00 39.33 39.20 1gvg h ASP 51 CO 0.05 0.86 -0.02 0.74 -1.57 0.00 0.00 179.24 179.29 1gvg h THR 52 N 1.05 1.27 -0.59 0.35 2.02 -0.99 -1.30 112.91 114.72 1gvg h THR 52 Ca 0.25 -0.94 -0.06 0.00 0.77 0.00 0.00 66.41 66.42 1gvg h THR 52 Cb 0.17 1.50 -0.03 0.00 -1.74 0.00 0.00 68.15 68.06 1gvg h THR 52 CO -0.02 0.29 0.13 0.15 0.37 0.00 0.00 175.52 176.43 1gvg h PHE 53 N 0.10 0.96 -0.60 3.16 3.04 -1.16 -0.19 116.94 122.25 1gvg h PHE 53 Ca 0.05 -0.10 -0.03 0.00 3.98 0.00 0.00 57.97 61.87 1gvg h PHE 53 Cb 0.44 -0.27 -0.03 0.00 2.56 0.00 0.00 35.95 38.65 1gvg h PHE 53 CO 0.04 0.80 0.24 -0.97 -2.02 0.00 0.00 178.31 176.41 1gvg h ASN 54 N 0.88 0.82 0.58 0.41 -0.00 -0.62 0.24 115.58 117.89 1gvg h ASN 54 Ca 0.19 -0.17 -0.27 0.00 -0.00 0.00 0.00 56.30 56.05 1gvg h ASN 54 Cb 0.34 -0.21 0.01 0.00 -0.00 0.00 0.00 38.32 38.45 1gvg h ASN 54 CO 0.00 0.76 -1.22 0.00 -0.00 0.00 0.00 177.43 176.97 1gvg h ALA 55 N 1.09 0.11 0.00 1.57 0.00 -0.98 -3.39 119.26 117.66 1gvg h ALA 55 Ca 0.20 -0.86 0.00 0.00 0.00 0.00 0.00 54.91 54.25 1gvg h ALA 55 Cb 0.19 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1gvg h ALA 55 CO -0.02 0.94 -0.29 0.39 0.00 0.00 0.00 179.25 180.28 1gvg n GLU 56 N -3.57 5.11 0.00 0.00 1.02 -0.11 -5.11 120.64 117.99 1gvg n GLU 56 Ca -0.09 -0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.05 1gvg n GLU 56 Cb 1.01 -0.74 0.00 0.00 -0.02 0.00 0.00 31.44 31.69 1gvg n GLU 56 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1gvg n GLY 57 N 1.19 0.41 3.50 0.62 0.00 0.84 -4.93 105.19 106.82 1gvg n GLY 57 Ca 0.01 -0.93 -0.11 0.00 0.00 0.00 0.00 46.02 44.99 1gvg n GLY 57 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1gvg s SER 58 N -4.00 0.13 0.29 1.61 1.04 -1.26 -4.61 113.70 106.90 1gvg s SER 58 Ca 0.00 -1.12 0.02 0.00 0.48 0.00 0.00 55.95 55.33 1gvg s SER 58 Cb 0.00 0.56 0.46 0.00 0.10 0.00 0.00 66.02 67.14 1gvg s SER 58 CO 0.00 -1.11 1.79 -0.33 0.98 0.00 0.00 173.24 174.57 1gvg h GLU 59 N 2.30 0.59 -0.01 4.02 4.39 -1.96 -2.90 114.58 121.01 1gvg h GLU 59 Ca -0.28 -0.17 0.00 0.00 0.34 0.00 0.00 59.36 59.25 1gvg h GLU 59 Cb 1.25 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.83 1gvg h GLU 59 CO 0.40 0.67 -0.06 -0.40 -1.16 0.00 0.00 179.01 178.46 1gvg n ASP 60 N -4.21 1.43 -0.19 1.42 3.85 -1.26 -4.07 116.55 113.53 1gvg n ASP 60 Ca 0.01 -1.37 -0.02 0.00 -0.71 0.00 0.00 54.79 52.70 1gvg n ASP 60 Cb 0.31 0.03 -0.01 0.00 -1.35 0.00 0.00 41.12 40.11 1gvg n ASP 60 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1gvg n GLY 61 N 1.22 0.50 3.32 6.12 0.00 -1.10 -4.51 105.19 110.74 1gvg n GLY 61 Ca 0.17 -0.17 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 1gvg n GLY 61 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1gvg s HIS 62 N -1.78 -0.25 -0.13 1.61 -3.43 -1.26 -1.48 115.29 108.57 1gvg s HIS 62 Ca 0.00 0.16 -0.00 0.00 -0.80 0.00 0.00 55.06 54.42 1gvg s HIS 62 Cb 0.00 0.22 0.03 0.00 -1.43 0.00 0.00 32.58 31.40 1gvg s HIS 62 CO 0.00 -0.60 -0.08 -1.17 -2.00 0.00 0.00 174.74 170.89 1gvg s LEU 63 N -2.15 1.36 -0.26 5.38 2.96 -0.05 -1.88 118.68 124.04 1gvg s LEU 63 Ca -0.04 -0.40 -0.09 0.00 -0.22 0.00 0.00 54.13 53.38 1gvg s LEU 63 Cb -0.00 -0.92 -0.04 0.00 0.50 0.00 0.00 46.19 45.73 1gvg s LEU 63 CO -0.04 -0.12 0.11 -0.22 -1.32 0.00 0.00 176.35 174.76 1gvg s LEU 64 N 1.65 3.67 -0.36 -0.68 2.96 0.83 -0.33 118.68 126.42 1gvg s LEU 64 Ca 0.04 -0.12 -0.15 0.00 -0.22 0.00 0.00 54.13 53.68 1gvg s LEU 64 Cb -0.13 -2.00 -0.01 0.00 0.50 0.00 0.00 46.19 44.56 1gvg s LEU 64 CO -0.09 -0.03 0.33 -0.76 -1.32 0.00 0.00 176.35 174.48 1gvg s LEU 65 N 1.60 4.60 0.02 -0.68 1.43 0.33 -1.14 118.68 124.84 1gvg s LEU 65 Ca 0.06 -0.43 0.01 0.00 -1.03 0.00 0.00 54.13 52.75 1gvg s LEU 65 Cb -0.15 -2.26 -0.04 0.00 0.03 0.00 0.00 46.19 43.77 1gvg s LEU 65 CO 0.06 -0.35 0.07 -0.60 0.23 0.00 0.00 176.35 175.76 1gvg s ARG 66 N 1.90 2.97 -0.23 1.70 3.52 0.00 -0.66 118.95 128.16 1gvg s ARG 66 Ca 0.09 -0.56 0.00 0.00 -0.13 0.00 0.00 55.73 55.14 1gvg s ARG 66 Cb -0.17 -2.79 0.00 0.00 -1.56 0.00 0.00 34.95 30.42 1gvg s ARG 66 CO 0.11 0.62 0.00 0.41 -0.81 0.00 0.00 175.30 175.64 1gvg n GLY 67 N 1.05 0.49 3.77 8.12 0.00 -1.18 -0.64 105.19 116.80 1gvg n GLY 67 Ca -0.12 -0.94 -0.31 0.00 0.00 0.00 0.00 46.02 44.65 1gvg n GLY 67 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1gvg s LEU 68 N -0.56 2.95 0.52 0.99 1.43 0.00 -3.59 118.68 120.43 1gvg s LEU 68 Ca 0.00 1.72 -0.22 0.00 -1.03 0.00 0.00 54.13 54.61 1gvg s LEU 68 Cb 0.00 -4.43 -0.06 0.00 0.03 0.00 0.00 46.19 41.74 1gvg s LEU 68 CO 0.00 -1.98 1.28 -2.16 0.23 0.00 0.00 176.35 173.73 1gvg s PRO 69 N -4.95 3.32 -0.05 1.29 0.04 -1.26 -4.42 135.00 128.98 1gvg s PRO 69 Ca 0.61 2.05 -0.23 0.00 0.04 0.00 0.00 61.00 63.47 1gvg s PRO 69 Cb -0.16 -2.28 0.05 0.00 0.04 0.00 0.00 34.50 32.14 1gvg s PRO 69 CO 0.56 -0.99 0.50 0.54 0.04 0.00 0.00 177.00 177.66 1gvg s VAL 70 N -1.40 0.03 0.80 -0.36 0.11 -1.26 -4.39 120.40 113.92 1gvg s VAL 70 Ca 0.69 -0.21 -0.13 0.00 -2.93 0.00 0.00 61.98 59.40 1gvg s VAL 70 Cb -0.36 -0.81 0.08 0.00 -1.53 0.00 0.00 36.38 33.76 1gvg s VAL 70 CO 0.42 -0.12 1.19 -1.61 -3.33 0.00 0.00 175.10 171.66 1gvg s GLU 71 N -1.13 1.73 0.55 1.54 8.01 -1.26 -4.97 118.70 123.17 1gvg s GLU 71 Ca -0.11 1.69 -0.21 0.00 0.01 0.00 0.00 54.97 56.34 1gvg s GLU 71 Cb -0.03 -1.79 -0.05 0.00 -4.31 0.00 0.00 34.13 27.95 1gvg s GLU 71 CO 0.07 -2.13 1.27 0.00 0.01 0.00 0.00 175.26 174.47 1gvg s ALA 72 N -2.23 2.73 0.32 5.21 0.00 -1.26 -4.88 121.76 121.66 1gvg s ALA 72 Ca 0.72 1.14 0.05 0.00 0.00 0.00 0.00 51.96 53.86 1gvg s ALA 72 Cb -0.27 -3.49 0.68 0.00 0.00 0.00 0.00 23.12 20.04 1gvg s ALA 72 CO 0.50 -1.17 1.86 0.22 0.00 0.00 0.00 175.76 177.17 1gvg h ASP 73 N 1.34 0.80 0.67 0.00 3.58 -1.93 0.28 116.42 121.16 1gvg h ASP 73 Ca -0.50 0.04 0.00 0.00 0.42 0.00 0.00 57.03 56.99 1gvg h ASP 73 Cb 1.29 -0.12 0.00 0.00 1.72 0.00 0.00 39.33 42.22 1gvg h ASP 73 CO 0.57 0.42 0.00 0.00 -2.88 0.00 0.00 179.24 177.35 1gvg h ALA 74 N 1.57 1.00 -0.01 -0.78 0.00 -1.99 -2.63 119.26 116.42 1gvg h ALA 74 Ca 0.46 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.37 1gvg h ALA 74 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1gvg h ALA 74 CO -0.23 0.00 -0.52 -0.25 0.00 0.00 0.00 179.25 178.25 1gvg n ASP 75 N -2.90 1.26 -4.86 0.00 10.43 0.07 -4.91 116.55 115.65 1gvg n ASP 75 Ca -0.00 -1.01 -0.31 0.00 2.57 0.00 0.00 54.79 56.04 1gvg n ASP 75 Cb 0.22 0.44 -0.03 0.00 1.84 0.00 0.00 41.12 43.59 1gvg n ASP 75 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 1gvg s LEU 76 N -2.68 3.70 1.12 0.64 1.43 -0.99 -4.95 118.68 116.96 1gvg s LEU 76 Ca 0.17 1.38 -0.14 0.00 -1.03 0.00 0.00 54.13 54.51 1gvg s LEU 76 Cb 0.18 -4.30 0.25 0.00 0.03 0.00 0.00 46.19 42.35 1gvg s LEU 76 CO 0.64 -0.51 1.06 -2.84 0.23 0.00 0.00 176.35 174.93 1gvg s PRO 77 N -4.00 -0.56 0.46 1.29 0.02 -1.26 -4.95 135.00 126.00 1gvg s PRO 77 Ca 0.56 0.48 -0.24 0.00 0.02 0.00 0.00 61.00 61.81 1gvg s PRO 77 Cb -0.10 -1.63 -0.07 0.00 0.02 0.00 0.00 34.50 32.72 1gvg s PRO 77 CO 0.32 -3.39 1.35 0.99 -0.33 0.00 0.00 177.00 175.94 1gvg s THR 78 N -2.77 2.34 0.22 0.99 2.01 -1.26 -4.89 115.64 112.28 1gvg s THR 78 Ca 0.67 0.29 -0.32 0.00 0.31 0.00 0.00 61.69 62.64 1gvg s THR 78 Cb -0.19 -3.16 -0.13 0.00 0.01 0.00 0.00 72.50 69.03 1gvg s THR 78 CO 0.60 0.03 1.56 0.41 -0.69 0.00 0.00 174.62 176.53 1gvg n THR 79 N -0.32 0.46 -1.45 -0.82 -1.04 -0.40 -4.90 114.28 105.81 1gvg n THR 79 Ca 0.06 -0.11 -0.37 0.00 -2.04 0.00 0.00 64.05 61.59 1gvg n THR 79 Cb 0.44 -1.69 0.07 0.00 -1.82 0.00 0.00 70.33 67.32 1gvg n THR 79 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1gvg n PRO 80 N 2.90 0.62 0.00 -2.82 -0.02 -1.26 -4.89 135.00 129.52 1gvg n PRO 80 Ca 0.14 0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 1gvg n PRO 80 Cb 0.32 -2.11 0.00 0.00 -0.02 0.00 0.00 33.50 31.69 1gvg n PRO 80 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1gvg n SER 81 N -1.00 0.94 -3.88 2.55 3.41 -1.26 -4.89 113.62 109.48 1gvg n SER 81 Ca 0.13 -1.12 -0.09 0.00 -0.26 0.00 0.00 58.87 57.52 1gvg n SER 81 Cb 0.49 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.39 1gvg n SER 81 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1gvg s SER 82 N -0.12 -0.14 0.01 4.04 1.04 -1.26 -5.05 113.70 112.22 1gvg s SER 82 Ca 0.00 -0.72 -0.01 0.00 0.48 0.00 0.00 55.95 55.70 1gvg s SER 82 Cb 0.00 0.56 -0.01 0.00 0.10 0.00 0.00 66.02 66.67 1gvg s SER 82 CO 0.00 -1.06 0.01 0.28 0.98 0.00 0.00 173.24 173.45 1gvg s THR 83 N -3.94 0.07 0.90 2.02 -1.32 -1.26 -4.60 115.64 107.51 1gvg s THR 83 Ca 0.15 -0.60 -0.14 0.00 -1.21 0.00 0.00 61.69 59.90 1gvg s THR 83 Cb -0.00 -0.21 0.14 0.00 -1.51 0.00 0.00 72.50 70.92 1gvg s THR 83 CO 0.02 -0.33 1.20 -2.16 -2.21 0.00 0.00 174.62 171.14 1gvg s PRO 84 N -0.99 1.17 0.48 7.08 0.04 -1.26 -5.07 135.00 136.45 1gvg s PRO 84 Ca -0.11 0.01 -0.20 0.00 0.04 0.00 0.00 61.00 60.74 1gvg s PRO 84 Cb -0.07 -1.87 -0.09 0.00 0.04 0.00 0.00 34.50 32.52 1gvg s PRO 84 CO -0.00 -2.12 1.01 0.00 0.04 0.00 0.00 177.00 175.92 1gvg s ALA 85 N -3.54 2.93 0.30 8.56 0.00 -1.26 -4.98 121.76 123.76 1gvg s ALA 85 Ca 0.66 0.50 -0.30 0.00 0.00 0.00 0.00 51.96 52.82 1gvg s ALA 85 Cb -0.10 -3.21 -0.12 0.00 0.00 0.00 0.00 23.12 19.69 1gvg s ALA 85 CO 0.52 -0.20 1.55 -2.30 0.00 0.00 0.00 175.76 175.33 1gvg n PRO 86 N -0.98 2.60 0.27 0.00 -0.02 -1.26 -4.87 135.00 130.75 1gvg n PRO 86 Ca 0.08 0.92 0.13 0.00 -2.02 0.00 0.00 63.50 62.61 1gvg n PRO 86 Cb 0.53 -2.68 0.76 0.00 -0.02 0.00 0.00 33.50 32.09 1gvg n PRO 86 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1gvg h GLU 87 N 4.47 0.00 -0.02 -0.52 4.81 -1.94 -1.83 114.58 119.54 1gvg h GLU 87 Ca -0.47 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 1gvg h GLU 87 Cb 1.23 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.61 1gvg h GLU 87 CO 0.77 0.09 0.00 -0.40 -0.73 0.00 0.00 179.01 178.73 1gvg n ASP 88 N -3.78 0.78 -4.72 1.04 5.75 -1.26 -3.49 116.55 110.86 1gvg n ASP 88 Ca -0.02 -1.32 -0.42 0.00 -0.01 0.00 0.00 54.79 53.02 1gvg n ASP 88 Cb 0.19 -0.01 -0.03 0.00 -1.03 0.00 0.00 41.12 40.24 1gvg n ASP 88 CO 0.00 0.00 0.00 -0.60 -0.11 0.00 0.00 177.20 176.49 1gvg s ARG 89 N -1.98 4.12 0.47 0.11 3.52 -0.69 -4.91 118.95 119.59 1gvg s ARG 89 Ca 0.40 2.61 -0.24 0.00 -0.13 0.00 0.00 55.73 58.37 1gvg s ARG 89 Cb 0.20 -3.06 -0.07 0.00 -1.56 0.00 0.00 34.95 30.46 1gvg s ARG 89 CO 0.33 -0.74 1.27 0.45 -0.81 0.00 0.00 175.30 175.80 1gvg s SER 90 N 1.07 5.95 0.20 -2.12 0.15 -1.26 -4.41 113.70 113.28 1gvg s SER 90 Ca 0.73 2.56 -0.33 0.00 0.70 0.00 0.00 55.95 59.62 1gvg s SER 90 Cb -0.49 -2.62 -0.13 0.00 -1.71 0.00 0.00 66.02 61.06 1gvg s SER 90 CO 0.35 -1.09 1.60 -0.11 1.20 0.00 0.00 173.24 175.19 1gvg n LEU 91 N -0.44 3.48 -4.90 3.45 7.94 0.72 -4.98 117.00 122.26 1gvg n LEU 91 Ca 0.07 1.09 -0.33 0.00 -1.11 0.00 0.00 56.01 55.73 1gvg n LEU 91 Cb 0.46 -1.49 -0.05 0.00 0.53 0.00 0.00 43.42 42.87 1gvg n LEU 91 CO 0.52 -0.13 -0.11 -0.76 -1.11 0.00 0.00 177.39 175.80 1gvg s LEU 92 N 0.75 4.35 0.25 -1.96 1.43 -1.26 -5.01 118.68 117.23 1gvg s LEU 92 Ca 0.75 0.40 -0.04 0.00 -1.03 0.00 0.00 54.13 54.21 1gvg s LEU 92 Cb -0.61 -2.82 0.39 0.00 0.03 0.00 0.00 46.19 43.18 1gvg s LEU 92 CO 0.39 0.20 1.82 0.74 0.23 0.00 0.00 176.35 179.73 1gvg h THR 93 N 2.54 0.93 -0.07 5.49 2.02 -1.94 0.03 112.91 121.91 1gvg h THR 93 Ca -0.48 -0.29 -0.06 0.00 0.77 0.00 0.00 66.41 66.36 1gvg h THR 93 Cb 1.18 0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.60 1gvg h THR 93 CO 0.71 0.15 -0.25 0.24 0.37 0.00 0.00 175.52 176.74 1gvg h MET 94 N 0.84 0.11 -0.33 6.66 2.86 -1.95 -0.63 114.93 122.49 1gvg h MET 94 Ca 0.40 -0.03 -0.12 0.00 -2.06 0.00 0.00 59.70 57.89 1gvg h MET 94 Cb 0.34 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.97 1gvg h MET 94 CO -0.23 0.36 -0.28 0.93 1.06 0.00 0.00 176.91 178.75 1gvg h GLU 95 N 0.10 0.68 -0.68 1.72 5.08 -1.45 -1.21 114.58 118.82 1gvg h GLU 95 Ca 0.02 -0.29 -0.05 0.00 -1.00 0.00 0.00 59.36 58.04 1gvg h GLU 95 Cb 0.50 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.70 1gvg h GLU 95 CO 0.04 0.88 0.22 0.00 -1.00 0.00 0.00 179.01 179.15 1gvg h ALA 96 N 1.11 0.89 -0.68 3.43 0.00 -0.46 -0.54 119.26 123.00 1gvg h ALA 96 Ca 0.07 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 1gvg h ALA 96 Cb 0.77 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 1gvg h ALA 96 CO 0.06 0.56 0.32 0.52 0.00 0.00 0.00 179.25 180.71 1gvg h MET 97 N 0.99 0.99 0.00 0.00 2.86 -0.83 -0.73 114.93 118.21 1gvg h MET 97 Ca 0.22 -0.15 -0.03 0.00 -2.06 0.00 0.00 59.70 57.68 1gvg h MET 97 Cb 0.29 -0.17 -0.00 0.00 0.06 0.00 0.00 31.60 31.77 1gvg h MET 97 CO -0.01 0.79 -0.16 -0.07 1.06 0.00 0.00 176.91 178.52 1gvg h LEU 98 N 0.95 0.00 -0.07 1.22 3.38 -0.83 0.83 115.31 120.78 1gvg h LEU 98 Ca 0.23 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.16 1gvg h LEU 98 Cb 0.13 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 1gvg h LEU 98 CO -0.03 0.16 -0.12 1.23 0.09 0.00 0.00 178.44 179.78 1gvg h GLY 99 N 0.55 0.22 0.69 0.83 0.00 0.12 -0.71 103.07 104.78 1gvg h GLY 99 Ca -0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 47.33 47.06 1gvg h GLY 99 CO 0.02 0.23 -0.14 1.41 0.00 0.00 0.00 176.54 178.06 1gvg h LEU 100 N -0.27 -0.33 -0.48 3.11 3.38 -0.87 -1.16 115.31 118.71 1gvg h LEU 100 Ca 0.01 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 57.76 1gvg h LEU 100 Cb 0.68 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.49 1gvg h LEU 100 CO 0.03 0.02 0.15 0.58 0.09 0.00 0.00 178.44 179.30 1gvg h VAL 101 N -0.70 1.23 -0.47 1.22 2.07 -0.98 -2.15 116.25 116.47 1gvg h VAL 101 Ca -0.04 -0.75 0.02 0.00 0.82 0.00 0.00 66.70 66.75 1gvg h VAL 101 Cb 0.48 0.82 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 1gvg h VAL 101 CO 0.06 0.27 0.27 1.23 0.02 0.00 0.00 177.57 179.43 1gvg h GLY 102 N 0.63 0.66 2.00 2.17 0.00 -1.15 -2.36 103.07 105.02 1gvg h GLY 102 Ca 0.15 -0.21 -0.07 0.00 0.00 0.00 0.00 47.33 47.21 1gvg h GLY 102 CO -0.01 0.17 -0.32 3.21 0.00 0.00 0.00 176.54 179.60 1gvg h ARG 103 N 0.55 0.00 -0.36 4.80 2.47 -1.07 0.79 114.38 121.55 1gvg h ARG 103 Ca 0.19 0.00 -0.06 0.00 -1.26 0.00 0.00 59.98 58.85 1gvg h ARG 103 Cb 0.02 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.33 1gvg h ARG 103 CO -0.09 0.32 -0.02 -0.09 0.56 0.00 0.00 179.97 180.64 1gvg h ARG 104 N 0.00 0.58 0.13 0.04 9.65 -0.93 -3.21 114.38 120.64 1gvg h ARG 104 Ca -0.00 -0.14 -0.30 0.00 -1.10 0.00 0.00 59.98 58.43 1gvg h ARG 104 Cb 0.69 -0.08 -0.00 0.00 -1.39 0.00 0.00 29.97 29.19 1gvg h ARG 104 CO 0.04 0.62 -1.49 -0.07 2.80 0.00 0.00 179.97 181.88 1gvg h LEU 105 N 0.55 0.43 0.00 3.80 3.38 -0.80 -3.48 115.31 119.19 1gvg h LEU 105 Ca 0.11 -0.56 0.00 0.00 0.09 0.00 0.00 57.88 57.53 1gvg h LEU 105 Cb 0.39 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1gvg h LEU 105 CO 0.02 1.46 0.00 0.61 0.09 0.00 0.00 178.44 180.61 1gvg n GLY 106 N 1.65 -0.74 3.33 0.83 0.00 0.17 -4.79 105.19 105.64 1gvg n GLY 106 Ca -0.15 -0.32 -0.36 0.00 0.00 0.00 0.00 46.02 45.19 1gvg n GLY 106 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1gvg s LEU 107 N 0.00 3.35 0.34 0.99 1.43 0.06 -4.05 118.68 120.80 1gvg s LEU 107 Ca 0.00 -0.52 -0.28 0.00 -1.03 0.00 0.00 54.13 52.30 1gvg s LEU 107 Cb 0.00 -1.81 -0.12 0.00 0.03 0.00 0.00 46.19 44.29 1gvg s LEU 107 CO 0.00 -0.09 1.38 1.41 0.23 0.00 0.00 176.35 179.28 1gvg n HIS 108 N 4.83 2.53 -4.08 0.29 8.25 -1.26 -1.09 115.22 124.69 1gvg n HIS 108 Ca -0.16 0.49 -0.18 0.00 -0.26 0.00 0.00 57.72 57.61 1gvg n HIS 108 Cb 0.50 -2.47 -0.16 0.00 1.12 0.00 0.00 29.99 28.98 1gvg n HIS 108 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1gvg s THR 109 N -0.97 0.37 0.24 1.59 2.01 -0.34 -0.81 115.64 117.73 1gvg s THR 109 Ca 0.56 -0.07 0.04 0.00 0.31 0.00 0.00 61.69 62.53 1gvg s THR 109 Cb -0.54 -0.40 -0.03 0.00 0.01 0.00 0.00 72.50 71.54 1gvg s THR 109 CO 0.61 0.17 0.37 -0.83 -0.69 0.00 0.00 174.62 174.25 1gvg s GLY 110 N 0.69 1.32 -0.20 4.40 0.00 -0.15 -4.34 107.32 109.04 1gvg s GLY 110 Ca -0.08 -1.15 0.01 0.00 0.00 0.00 0.00 44.72 43.50 1gvg s GLY 110 CO -0.01 -1.16 -0.09 -0.19 0.00 0.00 0.00 173.10 171.66 1gvg s TYR 111 N -1.98 2.40 0.29 1.90 2.02 -1.26 -1.05 117.35 119.67 1gvg s TYR 111 Ca 0.35 -1.60 -0.02 0.00 -0.37 0.00 0.00 57.07 55.42 1gvg s TYR 111 Cb -0.09 -1.62 0.63 0.00 -0.40 0.00 0.00 41.96 40.47 1gvg s TYR 111 CO 0.30 -0.74 1.52 -2.13 -1.57 0.00 0.00 175.55 172.92 1gvg n ARG 112 N 4.69 -0.08 0.00 -0.62 3.00 0.03 -0.93 116.66 122.74 1gvg n ARG 112 Ca -0.14 1.48 0.13 0.00 -0.00 0.00 0.00 57.85 59.32 1gvg n ARG 112 Cb 0.46 -2.29 0.52 0.00 0.00 0.00 0.00 32.46 31.15 1gvg n ARG 112 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1gvg n GLU 113 N -5.50 0.10 -4.03 -0.14 4.71 -1.26 -2.67 120.64 111.85 1gvg n GLU 113 Ca 0.20 -0.03 -0.35 0.00 -0.01 0.00 0.00 57.16 56.97 1gvg n GLU 113 Cb 0.64 -1.50 -0.12 0.00 -1.01 0.00 0.00 31.44 29.46 1gvg n GLU 113 CO 0.00 0.00 0.00 -1.17 0.09 0.00 0.00 177.13 176.05 1gvg s LEU 114 N -2.92 3.47 -1.50 -4.62 2.96 -0.11 -4.59 118.68 111.38 1gvg s LEU 114 Ca 0.16 -0.11 -0.07 0.00 -0.22 0.00 0.00 54.13 53.89 1gvg s LEU 114 Cb 0.19 -1.89 0.05 0.00 0.50 0.00 0.00 46.19 45.04 1gvg s LEU 114 CO 0.57 0.09 0.61 0.54 -1.32 0.00 0.00 176.35 176.84 1gvg n ARG 115 N 4.10 -3.67 -1.92 1.98 5.12 -1.26 -0.98 116.66 120.02 1gvg n ARG 115 Ca -0.17 0.44 -0.20 0.00 -1.93 0.00 0.00 57.85 55.99 1gvg n ARG 115 Cb 0.52 -4.85 -0.06 0.00 -1.16 0.00 0.00 32.46 26.91 1gvg n ARG 115 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13 1gvg n SER 116 N -2.89 -5.53 -0.10 0.55 7.64 -1.26 -1.58 113.62 110.45 1gvg n SER 116 Ca -0.16 0.30 -0.01 0.00 1.01 0.00 0.00 58.87 60.00 1gvg n SER 116 Cb 0.61 -4.77 -0.01 0.00 -1.01 0.00 0.00 64.21 59.03 1gvg n SER 116 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1gvg n GLY 117 N -0.63 0.49 3.82 0.23 0.00 -0.15 -4.99 105.19 103.95 1gvg n GLY 117 Ca -0.22 -0.23 -0.31 0.00 0.00 0.00 0.00 46.02 45.26 1gvg n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1gvg s THR 118 N -1.88 3.81 -0.22 2.61 -4.23 -0.61 -4.41 115.64 110.71 1gvg s THR 118 Ca 0.00 0.59 -0.09 0.00 -1.18 0.00 0.00 61.69 61.01 1gvg s THR 118 Cb 0.00 -3.37 -0.18 0.00 1.34 0.00 0.00 72.50 70.28 1gvg s THR 118 CO 0.00 -0.77 -0.03 0.52 -0.54 0.00 0.00 174.62 173.80 1gvg n VAL 119 N -3.16 1.58 -3.33 2.29 0.31 -1.26 -4.37 118.33 110.39 1gvg n VAL 119 Ca 0.07 -0.45 -0.40 0.00 -0.01 0.00 0.00 64.34 63.56 1gvg n VAL 119 Cb 0.54 -1.73 -0.08 0.00 -0.91 0.00 0.00 33.84 31.66 1gvg n VAL 119 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 1gvg s TYR 120 N -2.50 3.24 -0.16 3.52 2.02 -1.26 -4.46 117.35 117.75 1gvg s TYR 120 Ca -0.32 0.44 -0.03 0.00 -0.37 0.00 0.00 57.07 56.80 1gvg s TYR 120 Cb 0.09 -2.66 -0.02 0.00 -0.40 0.00 0.00 41.96 38.98 1gvg s TYR 120 CO 0.61 -0.28 -0.07 -1.01 -1.57 0.00 0.00 175.55 173.23 1gvg s HIS 121 N 2.18 2.93 0.00 2.71 3.76 -0.39 -4.86 115.29 121.62 1gvg s HIS 121 Ca 0.17 -0.58 -0.29 0.00 -0.15 0.00 0.00 55.06 54.20 1gvg s HIS 121 Cb -0.16 -1.96 -0.03 0.00 1.11 0.00 0.00 32.58 31.54 1gvg s HIS 121 CO 0.10 -0.23 0.96 -0.51 -0.85 0.00 0.00 174.74 174.20 1gvg s ASP 122 N 0.66 7.35 -0.38 1.40 1.01 -1.26 -0.50 116.67 124.95 1gvg s ASP 122 Ca -0.04 1.63 -0.05 0.00 0.71 0.00 0.00 52.55 54.81 1gvg s ASP 122 Cb -0.15 -2.56 0.08 0.00 1.01 0.00 0.00 42.92 41.30 1gvg s ASP 122 CO 0.02 -0.23 0.16 -0.69 0.21 0.00 0.00 175.17 174.64 1gvg s VAL 123 N 0.91 3.54 0.05 -1.27 1.01 0.59 -4.95 120.40 120.28 1gvg s VAL 123 Ca 0.50 -1.62 -0.02 0.00 0.00 0.00 0.00 61.98 60.85 1gvg s VAL 123 Cb -0.21 -3.22 -0.03 0.00 0.00 0.00 0.00 36.38 32.92 1gvg s VAL 123 CO 0.27 -0.45 -0.00 -0.72 0.00 0.00 0.00 175.10 174.20 1gvg s TYR 124 N 1.28 0.42 0.40 5.22 1.13 -1.26 -1.26 117.35 123.28 1gvg s TYR 124 Ca 0.03 -0.90 -0.24 0.00 -1.41 0.00 0.00 57.07 54.55 1gvg s TYR 124 Cb -0.22 -0.31 -0.09 0.00 -1.10 0.00 0.00 41.96 40.24 1gvg s TYR 124 CO -0.01 -0.36 1.01 -1.25 -2.51 0.00 0.00 175.55 172.43 1gvg s PRO 125 N -3.39 4.22 -0.01 -3.49 0.04 -1.26 -4.22 135.00 126.89 1gvg s PRO 125 Ca 0.02 1.39 0.00 0.00 0.04 0.00 0.00 61.00 62.46 1gvg s PRO 125 Cb 0.04 -2.49 0.01 0.00 0.04 0.00 0.00 34.50 32.10 1gvg s PRO 125 CO -0.08 -0.07 -0.01 0.45 0.04 0.00 0.00 177.00 177.34 1gvg s SER 126 N -1.72 0.21 0.36 6.66 0.15 -0.76 -4.98 113.70 113.61 1gvg s SER 126 Ca 0.58 -0.02 -0.28 0.00 0.70 0.00 0.00 55.95 56.93 1gvg s SER 126 Cb -0.19 -0.07 -0.12 0.00 -1.71 0.00 0.00 66.02 63.94 1gvg s SER 126 CO 0.24 -0.03 1.36 -2.65 1.20 0.00 0.00 173.24 173.36 1gvg n PRO 127 N 3.43 2.31 -1.70 5.44 -0.02 -1.26 -2.61 135.00 140.58 1gvg n PRO 127 Ca -0.18 0.81 -0.13 0.00 -2.02 0.00 0.00 63.50 61.98 1gvg n PRO 127 Cb 0.56 -2.46 -0.04 0.00 -0.02 0.00 0.00 33.50 31.54 1gvg n PRO 127 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1gvg n GLY 128 N 0.65 0.81 3.66 -1.23 0.00 -1.26 -4.96 105.19 102.86 1gvg n GLY 128 Ca 0.04 -0.38 -0.41 0.00 0.00 0.00 0.00 46.02 45.27 1gvg n GLY 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gvg n ALA 129 N 0.18 0.76 -1.77 4.61 0.00 -1.07 -4.95 120.51 118.27 1gvg n ALA 129 Ca -0.14 0.23 -0.39 0.00 0.00 0.00 0.00 53.44 53.14 1gvg n ALA 129 Cb 0.50 -2.18 -0.01 0.00 0.00 0.00 0.00 19.45 17.76 1gvg n ALA 129 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1gvg s HIS 130 N -1.25 2.90 0.58 0.00 2.46 -1.26 -4.90 115.29 113.81 1gvg s HIS 130 Ca 0.63 1.49 0.34 0.00 0.47 0.00 0.00 55.06 57.99 1gvg s HIS 130 Cb -0.52 -3.52 1.96 0.00 -0.13 0.00 0.00 32.58 30.36 1gvg s HIS 130 CO 0.56 -1.74 2.26 1.12 -2.47 0.00 0.00 174.74 174.48 1gvg h HIS 131 N 2.50 0.00 -2.17 3.88 2.07 -2.00 -2.92 115.15 116.51 1gvg h HIS 131 Ca -0.49 0.00 -0.74 0.00 -2.85 0.00 0.00 60.37 56.29 1gvg h HIS 131 Cb 1.24 0.00 -0.31 0.00 2.57 0.00 0.00 27.41 30.91 1gvg h HIS 131 CO 0.53 0.02 0.57 1.28 -3.07 0.00 0.00 177.93 177.26 1gvg n LEU 132 N -3.56 6.60 -3.83 6.12 4.77 -1.26 -4.86 117.00 120.97 1gvg n LEU 132 Ca -0.03 -5.36 -0.11 0.00 -0.03 0.00 0.00 56.01 50.49 1gvg n LEU 132 Cb 0.10 -0.98 -0.08 0.00 -2.33 0.00 0.00 43.42 40.14 1gvg n LEU 132 CO 0.25 2.08 -0.08 -0.94 -1.33 0.00 0.00 177.39 177.38 1gvg s SER 133 N -1.91 0.01 0.25 -1.43 1.04 -1.10 -4.78 113.70 105.78 1gvg s SER 133 Ca 0.44 -0.35 0.20 0.00 0.48 0.00 0.00 55.95 56.72 1gvg s SER 133 Cb 0.26 0.30 0.95 0.00 0.10 0.00 0.00 66.02 67.63 1gvg s SER 133 CO -0.18 -0.57 1.60 -1.54 0.98 0.00 0.00 173.24 173.53 1gvg n SER 134 N 0.66 0.50 -0.10 7.02 3.41 -1.26 -1.99 113.62 121.86 1gvg n SER 134 Ca -0.19 0.69 0.15 0.00 -0.26 0.00 0.00 58.87 59.26 1gvg n SER 134 Cb 0.59 -0.77 0.81 0.00 -0.26 0.00 0.00 64.21 64.58 1gvg n SER 134 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1gvg n GLU 135 N -2.12 1.03 -1.31 4.33 1.02 -1.26 -4.47 120.64 117.85 1gvg n GLU 135 Ca 0.00 -0.21 -0.31 0.00 -0.02 0.00 0.00 57.16 56.63 1gvg n GLU 135 Cb 0.10 -1.50 0.09 0.00 -0.02 0.00 0.00 31.44 30.11 1gvg n GLU 135 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1gvg s THR 136 N -2.11 3.44 0.00 2.62 -4.23 -0.84 -1.83 115.64 112.68 1gvg s THR 136 Ca 0.42 0.47 0.00 0.00 -1.18 0.00 0.00 61.69 61.40 1gvg s THR 136 Cb 0.21 -3.00 0.00 0.00 1.34 0.00 0.00 72.50 71.05 1gvg s THR 136 CO 0.38 -0.61 0.00 -1.54 -0.54 0.00 0.00 174.62 172.31 1gvg n SER 137 N -3.46 0.00 0.25 3.99 3.41 -1.26 -4.73 113.62 111.82 1gvg n SER 137 Ca 0.09 0.00 0.16 0.00 -0.26 0.00 0.00 58.87 58.86 1gvg n SER 137 Cb 0.53 0.10 0.63 0.00 -0.26 0.00 0.00 64.21 65.22 1gvg n SER 137 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1gvg h GLU 138 N 0.00 0.00 -5.33 4.33 5.08 -1.85 -1.10 114.58 115.72 1gvg h GLU 138 Ca 0.00 0.00 -0.60 0.00 -1.00 0.00 0.00 59.36 57.76 1gvg h GLU 138 Cb 0.00 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 29.13 1gvg h GLU 138 CO 0.00 0.00 -0.34 0.99 -1.00 0.00 0.00 179.01 178.66 1gvg s THR 139 N -3.59 5.28 0.19 1.13 2.01 -1.26 -4.69 115.64 114.72 1gvg s THR 139 Ca 0.02 0.48 -0.33 0.00 0.31 0.00 0.00 61.69 62.17 1gvg s THR 139 Cb 0.09 -3.62 -0.14 0.00 0.01 0.00 0.00 72.50 68.84 1gvg s THR 139 CO 0.53 0.32 1.47 -0.11 -0.69 0.00 0.00 174.62 176.14 1gvg n LEU 140 N 4.16 2.93 -4.39 4.42 7.94 -1.26 -4.72 117.00 126.08 1gvg n LEU 140 Ca -0.12 1.11 -0.45 0.00 -1.11 0.00 0.00 56.01 55.45 1gvg n LEU 140 Cb 0.52 -1.40 -0.06 0.00 0.53 0.00 0.00 43.42 43.00 1gvg n LEU 140 CO 0.38 -0.47 0.20 -0.22 -1.11 0.00 0.00 177.39 176.17 1gvg s LEU 141 N 0.52 5.51 0.88 -1.96 2.96 -0.40 -5.00 118.68 121.19 1gvg s LEU 141 Ca 0.75 -1.32 -0.11 0.00 -0.22 0.00 0.00 54.13 53.23 1gvg s LEU 141 Cb -0.69 -2.28 0.12 0.00 0.50 0.00 0.00 46.19 43.83 1gvg s LEU 141 CO 0.44 -0.84 1.09 -1.61 -1.32 0.00 0.00 176.35 174.12 1gvg s GLU 142 N 2.10 1.39 -0.03 1.98 2.02 -1.26 -1.36 118.70 123.53 1gvg s GLU 142 Ca 0.08 1.01 -0.38 0.00 0.02 0.00 0.00 54.97 55.71 1gvg s GLU 142 Cb -0.24 -1.81 -0.17 0.00 0.10 0.00 0.00 34.13 32.02 1gvg s GLU 142 CO 0.07 -2.21 1.45 1.19 0.02 0.00 0.00 175.26 175.79 1gvg n PHE 143 N -3.89 1.64 -3.78 1.61 3.72 -1.25 -4.64 117.46 110.88 1gvg n PHE 143 Ca 0.08 0.63 -0.13 0.00 -0.05 0.00 0.00 57.45 57.98 1gvg n PHE 143 Cb 0.54 -2.36 -0.10 0.00 -0.94 0.00 0.00 39.48 36.62 1gvg n PHE 143 CO 0.00 0.00 0.00 -3.38 -0.05 0.00 0.00 176.76 173.33 1gvg s HIS 144 N 1.38 -0.27 -0.24 1.38 -3.43 0.05 -0.86 115.29 113.30 1gvg s HIS 144 Ca 0.89 0.62 -0.16 0.00 -0.80 0.00 0.00 55.06 55.61 1gvg s HIS 144 Cb -1.01 0.10 -0.03 0.00 -1.43 0.00 0.00 32.58 30.21 1gvg s HIS 144 CO 0.53 -0.21 0.43 0.99 -2.00 0.00 0.00 174.74 174.47 1gvg s THR 145 N -0.26 5.15 0.05 -5.38 2.01 0.44 -0.79 115.64 116.86 1gvg s THR 145 Ca -0.04 0.72 -0.31 0.00 0.31 0.00 0.00 61.69 62.38 1gvg s THR 145 Cb -0.03 -3.75 -0.10 0.00 0.01 0.00 0.00 72.50 68.63 1gvg s THR 145 CO 0.01 0.17 1.94 1.21 -0.69 0.00 0.00 174.62 177.27 1gvg n GLU 146 N 5.04 2.83 -3.90 4.92 4.07 -1.26 -2.47 120.64 129.87 1gvg n GLU 146 Ca -0.07 1.04 -0.29 0.00 -0.06 0.00 0.00 57.16 57.78 1gvg n GLU 146 Cb 0.51 -2.97 0.02 0.00 -0.06 0.00 0.00 31.44 28.93 1gvg n GLU 146 CO 0.00 0.00 0.00 -1.33 -0.06 0.00 0.00 177.13 175.74 1gvg n MET 147 N 7.04 -5.09 0.26 5.31 2.81 -1.26 -4.65 117.12 121.55 1gvg n MET 147 Ca 0.20 0.57 0.14 0.00 -1.81 0.00 0.00 57.70 56.80 1gvg n MET 147 Cb 0.39 -5.34 0.82 0.00 -0.71 0.00 0.00 33.22 28.39 1gvg n MET 147 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1gvg h ALA 148 N 0.94 1.74 -0.04 3.04 0.00 -1.86 -1.20 119.26 121.88 1gvg h ALA 148 Ca -0.59 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.32 1gvg h ALA 148 Cb 1.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1gvg h ALA 148 CO 0.66 -0.08 0.00 2.48 0.00 0.00 0.00 179.25 182.31 1gvg n TYR 149 N -4.04 0.03 -3.69 0.00 0.18 -1.26 -4.87 117.16 103.52 1gvg n TYR 149 Ca -0.02 -0.02 -0.36 0.00 1.88 0.00 0.00 57.90 59.39 1gvg n TYR 149 Cb 0.14 0.00 -0.08 0.00 -0.38 0.00 0.00 39.34 39.03 1gvg n TYR 149 CO 0.00 0.00 0.00 -1.58 -2.08 0.00 0.00 176.86 173.20 1gvg s HIS 150 N -1.97 3.44 0.49 -3.48 2.46 -0.45 -1.05 115.29 114.74 1gvg s HIS 150 Ca 0.38 0.43 0.14 0.00 0.47 0.00 0.00 55.06 56.48 1gvg s HIS 150 Cb 0.20 -2.19 1.15 0.00 -0.13 0.00 0.00 32.58 31.61 1gvg s HIS 150 CO 0.32 0.31 2.10 0.00 -2.47 0.00 0.00 174.74 175.01 1gvg h ARG 151 N 6.52 0.08 -0.86 2.88 3.08 -1.46 -1.93 114.38 122.69 1gvg h ARG 151 Ca -0.42 -0.01 -0.42 0.00 0.07 0.00 0.00 59.98 59.20 1gvg h ARG 151 Cb 1.16 -0.02 -0.25 0.00 0.08 0.00 0.00 29.97 30.94 1gvg h ARG 151 CO 0.74 0.09 0.49 1.28 -1.07 0.00 0.00 179.97 181.50 1gvg n LEU 152 N -4.49 6.22 -4.55 3.04 4.77 -1.26 -4.73 117.00 116.01 1gvg n LEU 152 Ca -0.02 -3.59 -0.50 0.00 -0.03 0.00 0.00 56.01 51.88 1gvg n LEU 152 Cb 0.12 -0.79 -0.04 0.00 -2.33 0.00 0.00 43.42 40.37 1gvg n LEU 152 CO 0.35 1.05 0.63 1.67 -1.33 0.00 0.00 177.39 179.75 1gvg n GLN 153 N -1.02 0.91 -2.88 3.23 7.27 -0.73 -4.92 117.38 119.24 1gvg n GLN 153 Ca 0.53 0.33 -0.37 0.00 0.07 0.00 0.00 57.00 57.56 1gvg n GLN 153 Cb 1.53 -1.77 -0.06 0.00 2.41 0.00 0.00 30.24 32.35 1gvg n GLN 153 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 1gvg s PRO 154 N -0.42 4.47 0.28 3.69 0.04 -1.26 -4.88 135.00 136.93 1gvg s PRO 154 Ca 0.74 1.18 -0.02 0.00 0.04 0.00 0.00 61.00 62.94 1gvg s PRO 154 Cb -0.91 -2.81 0.41 0.00 0.04 0.00 0.00 34.50 31.23 1gvg s PRO 154 CO 0.53 0.31 1.88 -0.97 0.04 0.00 0.00 177.00 178.79 1gvg h ASN 155 N 3.21 0.87 -4.29 6.66 -0.00 -1.77 -3.43 115.58 116.83 1gvg h ASN 155 Ca -0.47 -0.10 -0.50 0.00 -0.00 0.00 0.00 56.30 55.24 1gvg h ASN 155 Cb 1.19 -0.22 -0.26 0.00 -0.00 0.00 0.00 38.32 39.03 1gvg h ASN 155 CO 0.65 0.74 -0.81 -0.31 -0.00 0.00 0.00 177.43 177.70 1gvg s TYR 156 N -5.53 1.43 -0.15 0.67 1.51 -0.80 0.10 117.35 114.58 1gvg s TYR 156 Ca -0.11 -0.34 -0.02 0.00 -1.01 0.00 0.00 57.07 55.60 1gvg s TYR 156 Cb 0.16 -0.86 -0.02 0.00 -0.11 0.00 0.00 41.96 41.13 1gvg s TYR 156 CO 0.80 0.04 -0.10 0.08 -1.11 0.00 0.00 175.55 175.27 1gvg s VAL 157 N -0.74 3.29 -0.08 0.71 1.01 -0.98 -1.26 120.40 122.33 1gvg s VAL 157 Ca 0.04 -0.57 0.03 0.00 0.00 0.00 0.00 61.98 61.48 1gvg s VAL 157 Cb -0.08 -2.41 -0.02 0.00 0.00 0.00 0.00 36.38 33.87 1gvg s VAL 157 CO 0.01 0.50 -0.16 -0.04 0.00 0.00 0.00 175.10 175.41 1gvg s MET 158 N 0.52 2.86 -0.16 2.72 -1.94 -0.20 -0.79 119.30 122.31 1gvg s MET 158 Ca -0.07 -0.74 0.00 0.00 -1.71 0.00 0.00 55.69 53.17 1gvg s MET 158 Cb -0.15 -2.42 0.03 0.00 2.01 0.00 0.00 34.83 34.30 1gvg s MET 158 CO 0.04 0.40 -0.11 -0.51 -0.01 0.00 0.00 175.02 174.83 1gvg s LEU 159 N -0.17 1.71 -0.06 -0.03 1.43 -0.09 -1.89 118.68 119.58 1gvg s LEU 159 Ca -0.01 -0.57 0.00 0.00 -1.03 0.00 0.00 54.13 52.52 1gvg s LEU 159 Cb -0.13 -1.08 -0.03 0.00 0.03 0.00 0.00 46.19 44.97 1gvg s LEU 159 CO 0.03 -0.11 -0.03 0.00 0.23 0.00 0.00 176.35 176.48 1gvg s ALA 160 N 1.53 3.16 -0.26 4.21 0.00 -0.08 -0.52 121.76 129.81 1gvg s ALA 160 Ca 0.03 -0.88 -0.08 0.00 0.00 0.00 0.00 51.96 51.03 1gvg s ALA 160 Cb -0.14 -1.34 -0.03 0.00 0.00 0.00 0.00 23.12 21.61 1gvg s ALA 160 CO -0.09 0.60 0.08 0.00 0.00 0.00 0.00 175.76 176.35 1gvg n SER 162 N 4.93 1.49 -3.86 0.00 7.64 -0.36 -1.58 113.62 121.88 1gvg n SER 162 Ca -0.16 0.17 -0.15 0.00 1.01 0.00 0.00 58.87 59.75 1gvg n SER 162 Cb 0.51 -0.32 -0.15 0.00 -1.01 0.00 0.00 64.21 63.24 1gvg n SER 162 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1gvg s ARG 163 N -2.55 0.19 0.54 1.43 0.52 -0.88 -4.62 118.95 113.58 1gvg s ARG 163 Ca -0.18 -0.00 -0.02 0.00 -0.52 0.00 0.00 55.73 55.01 1gvg s ARG 163 Cb 0.07 -0.27 0.02 0.00 0.52 0.00 0.00 34.95 35.29 1gvg s ARG 163 CO 0.76 -0.03 0.79 0.00 0.02 0.00 0.00 175.30 176.84 1gvg s ALA 164 N 0.40 3.61 0.68 2.13 0.00 -1.26 -1.05 121.76 126.27 1gvg s ALA 164 Ca -0.04 -1.01 -0.15 0.00 0.00 0.00 0.00 51.96 50.76 1gvg s ALA 164 Cb -0.06 -2.30 0.01 0.00 0.00 0.00 0.00 23.12 20.77 1gvg s ALA 164 CO -0.01 -0.68 1.13 0.16 0.00 0.00 0.00 175.76 176.36 1gvg s ASP 165 N -4.32 4.88 0.22 0.00 1.47 -1.26 -3.96 116.67 113.69 1gvg s ASP 165 Ca 0.53 2.07 -0.11 0.00 1.18 0.00 0.00 52.55 56.22 1gvg s ASP 165 Cb -0.10 -2.56 0.30 0.00 -0.34 0.00 0.00 42.92 40.22 1gvg s ASP 165 CO 0.41 -1.79 1.63 0.45 0.68 0.00 0.00 175.17 176.55 1gvg h HIS 166 N -0.09 -0.24 -0.09 2.11 3.86 -1.90 -1.23 115.15 117.57 1gvg h HIS 166 Ca -0.47 0.06 0.00 0.00 -1.16 0.00 0.00 60.37 58.80 1gvg h HIS 166 Cb 1.26 0.21 0.00 0.00 1.06 0.00 0.00 27.41 29.94 1gvg h HIS 166 CO 0.53 -0.26 0.00 0.39 0.86 0.00 0.00 177.93 179.45 1gvg n GLU 167 N -5.40 1.81 -3.75 2.45 1.02 -1.26 -4.95 120.64 110.56 1gvg n GLU 167 Ca 0.10 -1.20 -0.22 0.00 -0.02 0.00 0.00 57.16 55.81 1gvg n GLU 167 Cb 0.38 -1.45 0.03 0.00 -0.02 0.00 0.00 31.44 30.37 1gvg n GLU 167 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1gvg n ARG 168 N 0.44 -4.76 -0.01 3.49 1.74 -0.47 -4.92 116.66 112.18 1gvg n ARG 168 Ca 0.18 0.59 0.09 0.00 -0.77 0.00 0.00 57.85 57.94 1gvg n ARG 168 Cb 0.39 -5.12 -0.13 0.00 -1.02 0.00 0.00 32.46 26.58 1gvg n ARG 168 CO 0.00 0.00 0.00 -2.37 -1.52 0.00 0.00 177.63 173.74 1gvg n THR 169 N -4.32 0.00 -2.33 0.55 5.66 -1.26 -4.92 114.28 107.66 1gvg n THR 169 Ca -0.28 -0.32 -0.43 0.00 -3.05 0.00 0.00 64.05 59.98 1gvg n THR 169 Cb 0.67 0.35 -0.02 0.00 -1.55 0.00 0.00 70.33 69.78 1gvg n THR 169 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1gvg s ALA 170 N -3.07 3.31 -0.12 1.79 0.00 -1.26 -4.74 121.76 117.68 1gvg s ALA 170 Ca -0.03 0.18 -0.03 0.00 0.00 0.00 0.00 51.96 52.09 1gvg s ALA 170 Cb 0.12 -3.81 -0.03 0.00 0.00 0.00 0.00 23.12 19.40 1gvg s ALA 170 CO 0.74 -1.87 -0.00 0.00 0.00 0.00 0.00 175.76 174.63 1gvg s ALA 171 N 4.68 3.21 -0.34 0.00 0.00 -1.26 -4.45 121.76 123.61 1gvg s ALA 171 Ca 0.61 -0.80 -0.18 0.00 0.00 0.00 0.00 51.96 51.59 1gvg s ALA 171 Cb -0.19 -1.54 -0.01 0.00 0.00 0.00 0.00 23.12 21.38 1gvg s ALA 171 CO 0.25 0.44 0.49 0.99 0.00 0.00 0.00 175.76 177.93 1gvg s THR 172 N -0.39 5.05 -0.04 0.00 2.01 0.21 -1.08 115.64 121.39 1gvg s THR 172 Ca 0.07 0.37 -0.13 0.00 0.31 0.00 0.00 61.69 62.31 1gvg s THR 172 Cb -0.12 -3.92 -0.05 0.00 0.01 0.00 0.00 72.50 68.42 1gvg s THR 172 CO 0.02 -0.15 0.34 -0.76 -0.69 0.00 0.00 174.62 173.38 1gvg s LEU 173 N 2.32 4.44 -0.04 4.42 1.43 0.28 -0.76 118.68 130.77 1gvg s LEU 173 Ca 0.18 0.82 0.02 0.00 -1.03 0.00 0.00 54.13 54.12 1gvg s LEU 173 Cb -0.16 -2.46 0.02 0.00 0.03 0.00 0.00 46.19 43.62 1gvg s LEU 173 CO 0.13 0.32 -0.07 -0.69 0.23 0.00 0.00 176.35 176.26 1gvg s VAL 174 N -0.91 0.72 -0.07 -1.59 1.01 -0.21 -1.16 120.40 118.19 1gvg s VAL 174 Ca 0.21 -0.26 0.04 0.00 0.00 0.00 0.00 61.98 61.98 1gvg s VAL 174 Cb -0.15 -0.69 -0.00 0.00 0.00 0.00 0.00 36.38 35.53 1gvg s VAL 174 CO 0.11 0.26 -0.21 0.00 0.00 0.00 0.00 175.10 175.25 1gvg s ALA 175 N 0.68 1.88 -0.14 5.51 0.00 -0.53 -1.10 121.76 128.06 1gvg s ALA 175 Ca -0.11 -0.84 -0.04 0.00 0.00 0.00 0.00 51.96 50.97 1gvg s ALA 175 Cb -0.13 -0.66 -0.03 0.00 0.00 0.00 0.00 23.12 22.29 1gvg s ALA 175 CO 0.01 0.30 0.02 0.45 0.00 0.00 0.00 175.76 176.54 1gvg s SER 176 N 0.16 5.36 0.48 0.00 0.15 -1.26 -1.89 113.70 116.71 1gvg s SER 176 Ca -0.10 0.09 0.15 0.00 0.70 0.00 0.00 55.95 56.79 1gvg s SER 176 Cb -0.15 -1.75 1.14 0.00 -1.71 0.00 0.00 66.02 63.55 1gvg s SER 176 CO 0.05 0.27 2.08 1.62 1.20 0.00 0.00 173.24 178.46 1gvg h VAL 177 N 4.60 1.06 0.00 4.45 3.04 -1.20 -1.01 116.25 127.19 1gvg h VAL 177 Ca -0.42 -0.25 -0.04 0.00 -1.01 0.00 0.00 66.70 64.98 1gvg h VAL 177 Cb 1.19 1.10 -0.01 0.00 -2.01 0.00 0.00 31.29 31.56 1gvg h VAL 177 CO 0.62 0.08 -0.17 0.03 -1.01 0.00 0.00 177.57 177.12 1gvg h ARG 178 N 0.04 0.00 0.02 4.17 3.08 -1.79 -0.12 114.38 119.78 1gvg h ARG 178 Ca 0.01 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 59.74 1gvg h ARG 178 Cb 0.12 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.12 1gvg h ARG 178 CO 0.01 0.17 -1.90 1.63 -1.07 0.00 0.00 179.97 178.81 1gvg n LYS 179 N -3.45 0.66 0.09 0.04 5.02 -0.62 -4.44 118.16 115.46 1gvg n LYS 179 Ca -0.01 0.23 -0.16 0.00 -2.02 0.00 0.00 58.31 56.36 1gvg n LYS 179 Cb 0.35 -1.72 -0.10 0.00 -0.02 0.00 0.00 35.03 33.53 1gvg n LYS 179 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1gvg h ALA 180 N 0.83 0.18 -0.57 7.82 0.00 -1.05 -3.37 119.26 123.09 1gvg h ALA 180 Ca -0.36 -0.80 0.10 0.00 0.00 0.00 0.00 54.91 53.84 1gvg h ALA 180 Cb 2.05 0.02 -0.08 0.00 0.00 0.00 0.00 17.79 19.79 1gvg h ALA 180 CO 0.07 0.86 0.15 1.25 0.00 0.00 0.00 179.25 181.58 1gvg h LEU 181 N 0.16 0.08 -2.26 0.00 5.85 -1.23 -1.55 115.31 116.36 1gvg h LEU 181 Ca -0.12 0.09 0.04 0.00 0.84 0.00 0.00 57.88 58.73 1gvg h LEU 181 Cb 1.82 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 42.96 1gvg h LEU 181 CO 0.20 0.06 0.23 -0.65 -0.34 0.00 0.00 178.44 177.93 1gvg h PRO 182 N 0.30 0.00 0.00 5.25 0.11 -1.81 -1.27 132.00 134.58 1gvg h PRO 182 Ca 0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.40 1gvg h PRO 182 Cb 0.40 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.51 1gvg h PRO 182 CO -0.35 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 178.72 1gvg n LEU 183 N -3.47 0.44 -4.88 2.35 4.77 -0.58 -4.83 117.00 110.79 1gvg n LEU 183 Ca 0.01 0.54 -0.33 0.00 -0.03 0.00 0.00 56.01 56.20 1gvg n LEU 183 Cb 0.33 -0.40 -0.05 0.00 -2.33 0.00 0.00 43.42 40.97 1gvg n LEU 183 CO 0.23 -0.10 0.03 -0.76 -1.33 0.00 0.00 177.39 175.46 1gvg s LEU 184 N -3.82 4.32 0.82 2.23 1.43 -0.48 -5.04 118.68 118.13 1gvg s LEU 184 Ca 0.12 0.66 -0.12 0.00 -1.03 0.00 0.00 54.13 53.76 1gvg s LEU 184 Cb 0.15 -3.05 0.08 0.00 0.03 0.00 0.00 46.19 43.41 1gvg s LEU 184 CO 0.56 0.14 1.17 1.51 0.23 0.00 0.00 176.35 179.96 1gvg s ASP 185 N -2.03 4.42 0.26 2.29 1.47 -1.26 -4.85 116.67 116.96 1gvg s ASP 185 Ca 0.35 0.82 -0.04 0.00 1.18 0.00 0.00 52.55 54.85 1gvg s ASP 185 Cb -0.13 -1.33 0.30 0.00 -0.34 0.00 0.00 42.92 41.42 1gvg s ASP 185 CO 0.20 -1.96 1.85 -0.33 0.68 0.00 0.00 175.17 175.61 1gvg h GLU 186 N -1.10 1.08 -0.62 2.11 4.39 -1.98 -1.99 114.58 116.48 1gvg h GLU 186 Ca -0.46 -0.16 -0.08 0.00 0.34 0.00 0.00 59.36 59.00 1gvg h GLU 186 Cb 1.33 -0.19 -0.03 0.00 -0.10 0.00 0.00 28.75 29.76 1gvg h GLU 186 CO 0.65 0.84 0.08 0.07 -1.16 0.00 0.00 179.01 179.50 1gvg h ARG 187 N 1.07 1.02 -0.23 2.33 0.11 -1.99 -0.06 114.38 116.63 1gvg h ARG 187 Ca 0.26 -0.27 -0.03 0.00 0.10 0.00 0.00 59.98 60.03 1gvg h ARG 187 Cb 0.13 -0.12 -0.01 0.00 1.11 0.00 0.00 29.97 31.08 1gvg h ARG 187 CO -0.03 0.95 0.01 1.15 0.10 0.00 0.00 179.97 182.15 1gvg h THR 188 N 0.96 1.25 -0.40 0.08 2.02 -1.86 -0.57 112.91 114.38 1gvg h THR 188 Ca 0.19 -0.86 0.03 0.00 0.77 0.00 0.00 66.41 66.54 1gvg h THR 188 Cb 0.44 1.36 -0.03 0.00 -1.74 0.00 0.00 68.15 68.18 1gvg h THR 188 CO 0.01 0.27 0.21 0.03 0.37 0.00 0.00 175.52 176.41 1gvg h ARG 189 N 0.18 0.42 -0.84 6.66 3.08 -1.19 -1.89 114.38 120.80 1gvg h ARG 189 Ca 0.07 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.10 1gvg h ARG 189 Cb 0.39 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 30.30 1gvg h ARG 189 CO 0.01 0.28 0.54 0.00 -1.07 0.00 0.00 179.97 179.73 1gvg h ALA 190 N 1.20 1.07 -0.78 0.04 0.00 -0.82 -0.23 119.26 119.74 1gvg h ALA 190 Ca 0.17 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 1gvg h ALA 190 Cb 0.06 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 1gvg h ALA 190 CO -0.11 0.49 0.29 -0.09 0.00 0.00 0.00 179.25 179.84 1gvg h ARG 191 N 1.14 1.17 0.00 0.00 9.65 -0.71 -3.18 114.38 122.47 1gvg h ARG 191 Ca 0.31 -0.22 -0.24 0.00 -1.10 0.00 0.00 59.98 58.73 1gvg h ARG 191 Cb -0.10 -0.19 0.01 0.00 -1.39 0.00 0.00 29.97 28.30 1gvg h ARG 191 CO -0.06 0.96 -0.97 -0.07 2.80 0.00 0.00 179.97 182.63 1gvg h LEU 192 N 1.14 0.62 -9.23 3.80 3.38 -0.99 -3.41 115.31 110.61 1gvg h LEU 192 Ca 0.26 -0.50 -0.55 0.00 0.09 0.00 0.00 57.88 57.18 1gvg h LEU 192 Cb 0.24 -0.19 0.01 0.00 0.09 0.00 0.00 40.66 40.81 1gvg h LEU 192 CO -0.02 1.30 1.32 -0.11 0.09 0.00 0.00 178.44 181.02 1gvg n LEU 193 N -3.77 3.88 -1.23 1.67 7.94 -0.13 -2.06 117.00 123.31 1gvg n LEU 193 Ca -0.08 0.67 -0.16 0.00 -1.11 0.00 0.00 56.01 55.33 1gvg n LEU 193 Cb 0.85 -1.54 -0.07 0.00 0.53 0.00 0.00 43.42 43.19 1gvg n LEU 193 CO 0.52 -0.09 -0.15 0.47 -1.11 0.00 0.00 177.39 177.03 1gvg n ASP 194 N 8.92 -5.16 -4.52 1.96 10.43 0.35 -4.97 116.55 123.57 1gvg n ASP 194 Ca 0.23 0.40 -0.41 0.00 2.57 0.00 0.00 54.79 57.58 1gvg n ASP 194 Cb 0.42 -4.07 -0.10 0.00 1.84 0.00 0.00 41.12 39.21 1gvg n ASP 194 CO 0.00 0.00 0.00 -0.60 -1.07 0.00 0.00 177.20 175.53 1gvg s ARG 195 N -3.33 3.40 0.16 -1.24 3.52 -0.87 -4.98 118.95 115.61 1gvg s ARG 195 Ca 0.00 -0.70 -0.31 0.00 -0.13 0.00 0.00 55.73 54.60 1gvg s ARG 195 Cb 0.00 -3.84 -0.09 0.00 -1.56 0.00 0.00 34.95 29.46 1gvg s ARG 195 CO 0.00 -0.51 1.38 1.03 -0.81 0.00 0.00 175.30 176.39 1gvg s ARG 196 N 1.75 4.33 0.04 5.12 0.52 -1.26 -4.07 118.95 125.38 1gvg s ARG 196 Ca 0.06 2.11 0.03 0.00 -0.52 0.00 0.00 55.73 57.42 1gvg s ARG 196 Cb -0.18 -3.21 -0.02 0.00 0.52 0.00 0.00 34.95 32.07 1gvg s ARG 196 CO 0.11 -0.39 -0.10 -1.64 0.02 0.00 0.00 175.30 173.30 1gvg s MET 197 N 0.53 0.66 0.33 3.54 -1.94 0.03 -4.86 119.30 117.59 1gvg s MET 197 Ca 0.62 -0.69 -0.29 0.00 -1.71 0.00 0.00 55.69 53.62 1gvg s MET 197 Cb -0.38 -0.56 -0.12 0.00 2.01 0.00 0.00 34.83 35.78 1gvg s MET 197 CO 0.34 0.13 1.37 -2.30 -0.01 0.00 0.00 175.02 174.55 1gvg n PRO 198 N 1.80 2.26 -3.74 2.03 -0.02 -1.26 -0.18 135.00 135.90 1gvg n PRO 198 Ca -0.20 0.79 -0.14 0.00 -2.02 0.00 0.00 63.50 61.94 1gvg n PRO 198 Cb 0.55 -2.43 -0.14 0.00 -0.02 0.00 0.00 33.50 31.46 1gvg n PRO 198 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1gvg s VAL 201 N -3.59 2.21 0.75 0.00 -7.23 -1.26 -4.81 120.40 106.47 1gvg s VAL 201 Ca 0.69 -2.18 -0.12 0.00 -1.81 0.00 0.00 61.98 58.55 1gvg s VAL 201 Cb -0.08 -2.68 0.05 0.00 0.56 0.00 0.00 36.38 34.23 1gvg s VAL 201 CO 0.53 -0.18 1.12 -1.81 -0.31 0.00 0.00 175.10 174.44 1gvg s ASP 202 N -3.62 4.41 0.28 4.85 1.11 -1.26 -4.86 116.67 117.58 1gvg s ASP 202 Ca 0.33 2.00 0.01 0.00 0.18 0.00 0.00 52.55 55.07 1gvg s ASP 202 Cb 0.03 -2.55 0.65 0.00 1.07 0.00 0.00 42.92 42.13 1gvg s ASP 202 CO 0.17 -2.10 1.68 0.58 1.18 0.00 0.00 175.17 176.67 1gvg h VAL 203 N -0.77 0.43 -0.21 -1.27 2.07 -2.00 -0.55 116.25 113.96 1gvg h VAL 203 Ca -0.45 -0.11 0.06 0.00 0.82 0.00 0.00 66.70 67.03 1gvg h VAL 203 Cb 1.25 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 31.11 1gvg h VAL 203 CO 0.50 0.06 0.17 0.00 0.02 0.00 0.00 177.57 178.33 1gvg h ALA 204 N 1.71 2.02 -0.56 1.67 0.00 -1.91 -2.46 119.26 119.73 1gvg h ALA 204 Ca 0.52 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.42 1gvg h ALA 204 Cb 0.98 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1gvg h ALA 204 CO -0.56 -0.28 0.00 1.19 0.00 0.00 0.00 179.25 179.59 1gvg n PHE 205 N -4.17 0.74 -2.83 0.00 3.01 -0.22 -4.68 117.46 109.31 1gvg n PHE 205 Ca 0.02 -0.37 -0.41 0.00 1.01 0.00 0.00 57.45 57.69 1gvg n PHE 205 Cb 0.31 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.75 1gvg n PHE 205 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1gvg s ARG 206 N -1.26 4.42 0.00 -1.08 0.52 -0.93 -4.96 118.95 115.66 1gvg s ARG 206 Ca 0.44 1.17 0.00 0.00 -0.52 0.00 0.00 55.73 56.81 1gvg s ARG 206 Cb 0.24 -3.51 0.00 0.00 0.52 0.00 0.00 34.95 32.20 1gvg s ARG 206 CO 0.32 -0.17 0.00 0.44 0.02 0.00 0.00 175.30 175.90 1gvg n ILE 215 N 4.29 0.00 -4.51 1.52 -5.35 -1.26 -5.11 119.36 108.94 1gvg n ILE 215 Ca 0.05 0.00 -0.25 0.00 -0.27 0.00 0.00 62.75 62.28 1gvg n ILE 215 Cb 0.50 0.00 -0.10 0.00 -1.74 0.00 0.00 39.64 38.30 1gvg n ILE 215 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1gvg s ALA 216 N -2.00 2.84 -0.13 -1.28 0.00 -0.93 -4.87 121.76 115.39 1gvg s ALA 216 Ca 0.00 -2.00 0.02 0.00 0.00 0.00 0.00 51.96 49.98 1gvg s ALA 216 Cb 0.00 -0.12 0.01 0.00 0.00 0.00 0.00 23.12 23.01 1gvg s ALA 216 CO 0.00 0.15 -0.19 -0.65 0.00 0.00 0.00 175.76 175.07 1gvg s GLN 217 N -3.58 2.68 -0.04 0.00 -1.52 -0.23 -0.85 119.66 116.12 1gvg s GLN 217 Ca 0.31 -0.72 0.05 0.00 -1.95 0.00 0.00 55.36 53.05 1gvg s GLN 217 Cb -0.00 -2.23 -0.01 0.00 -0.22 0.00 0.00 33.01 30.54 1gvg s GLN 217 CO 0.16 -0.07 -0.20 0.08 -0.25 0.00 0.00 175.29 175.00 1gvg s VAL 218 N 0.99 1.67 -0.38 1.09 1.01 0.75 -4.03 120.40 121.50 1gvg s VAL 218 Ca -0.05 -0.87 -0.19 0.00 0.00 0.00 0.00 61.98 60.87 1gvg s VAL 218 Cb -0.15 -1.42 0.01 0.00 0.00 0.00 0.00 36.38 34.82 1gvg s VAL 218 CO -0.04 0.47 0.58 -0.54 0.00 0.00 0.00 175.10 175.58 1gvg s LYS 219 N -0.16 3.51 0.35 2.72 1.02 -1.26 -0.79 119.74 125.12 1gvg s LYS 219 Ca -0.01 -0.19 0.02 0.00 0.02 0.00 0.00 55.97 55.82 1gvg s LYS 219 Cb -0.11 -3.86 0.63 0.00 -0.52 0.00 0.00 37.83 33.97 1gvg s LYS 219 CO 0.02 -0.79 2.00 -1.35 -0.92 0.00 0.00 175.35 174.31 1gvg h PRO 220 N 8.59 0.84 -5.81 -1.68 0.11 -1.72 -3.36 132.00 128.99 1gvg h PRO 220 Ca -0.27 -0.05 -0.53 0.00 0.11 0.00 0.00 66.00 65.26 1gvg h PRO 220 Cb 1.11 -0.19 -0.26 0.00 0.11 0.00 0.00 31.00 31.77 1gvg h PRO 220 CO 0.83 0.56 -0.83 -0.51 -0.21 0.00 0.00 178.00 177.84 1gvg s LEU 221 N -9.75 2.16 0.20 2.35 1.43 -1.24 -0.63 118.68 113.21 1gvg s LEU 221 Ca -0.10 -0.48 -0.20 0.00 -1.03 0.00 0.00 54.13 52.31 1gvg s LEU 221 Cb 0.18 -0.85 0.04 0.00 0.03 0.00 0.00 46.19 45.59 1gvg s LEU 221 CO 0.77 0.12 0.60 -0.72 0.23 0.00 0.00 176.35 177.35 1gvg s TYR 222 N -0.78 -0.29 0.00 0.29 -0.85 -0.79 -0.49 117.35 114.43 1gvg s TYR 222 Ca 0.06 -0.03 0.00 0.00 -0.52 0.00 0.00 57.07 56.58 1gvg s TYR 222 Cb -0.08 0.53 0.00 0.00 0.38 0.00 0.00 41.96 42.79 1gvg s TYR 222 CO 0.01 -0.97 0.00 0.41 -1.52 0.00 0.00 175.55 173.49 1gvg n GLY 223 N -0.38 -1.46 3.68 5.49 0.00 -1.26 0.16 105.19 111.42 1gvg n GLY 223 Ca -0.11 -1.55 -0.53 0.00 0.00 0.00 0.00 46.02 43.83 1gvg n GLY 223 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1gvg n ASP 224 N 0.09 2.73 0.19 1.61 -0.08 -1.26 -4.81 116.55 115.01 1gvg n ASP 224 Ca 0.00 1.05 0.14 0.00 -1.51 0.00 0.00 54.79 54.47 1gvg n ASP 224 Cb 0.00 -1.25 0.74 0.00 2.34 0.00 0.00 41.12 42.95 1gvg n ASP 224 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1gvg h ALA 225 N 7.49 2.00 0.00 -1.67 0.00 -1.99 -0.32 119.26 124.76 1gvg h ALA 225 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1gvg h ALA 225 Cb 1.30 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1gvg h ALA 225 CO 0.93 -0.24 -0.18 -0.25 0.00 0.00 0.00 179.25 179.51 1gvg n ASP 226 N -4.20 0.44 -2.78 0.00 8.00 -1.26 -4.37 116.55 112.38 1gvg n ASP 226 Ca 0.01 0.34 -0.10 0.00 0.71 0.00 0.00 54.79 55.76 1gvg n ASP 226 Cb 0.28 -0.36 0.07 0.00 -0.02 0.00 0.00 41.12 41.08 1gvg n ASP 226 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1gvg n ASP 227 N -1.83 -2.19 -4.77 -2.24 4.64 -0.56 -5.15 116.55 104.45 1gvg n ASP 227 Ca 0.06 -3.52 -0.31 0.00 -1.38 0.00 0.00 54.79 49.64 1gvg n ASP 227 Cb 0.38 1.64 0.09 0.00 -1.04 0.00 0.00 41.12 42.20 1gvg n ASP 227 CO 0.00 0.00 0.00 -2.16 -0.82 0.00 0.00 177.20 174.22 1gvg s PRO 228 N 0.14 2.25 0.59 -0.67 0.04 -0.24 -4.51 135.00 132.60 1gvg s PRO 228 Ca 0.26 1.18 -0.06 0.00 0.04 0.00 0.00 61.00 62.43 1gvg s PRO 228 Cb 0.27 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.92 1gvg s PRO 228 CO -0.11 -1.65 0.91 -0.06 0.04 0.00 0.00 177.00 176.13 1gvg s PHE 229 N -2.88 3.29 -0.03 0.56 0.08 0.12 -4.86 117.98 114.27 1gvg s PHE 229 Ca 0.61 0.70 0.05 0.00 0.12 0.00 0.00 56.93 58.41 1gvg s PHE 229 Cb -0.17 -2.72 -0.01 0.00 -0.57 0.00 0.00 43.02 39.55 1gvg s PHE 229 CO 0.56 -0.80 -0.16 -1.17 -0.10 0.00 0.00 175.22 173.55 1gvg s LEU 230 N -5.00 1.96 -0.28 -0.37 2.96 0.39 -1.89 118.68 116.46 1gvg s LEU 230 Ca 0.54 -0.31 -0.02 0.00 -0.22 0.00 0.00 54.13 54.12 1gvg s LEU 230 Cb -0.11 -0.87 0.09 0.00 0.50 0.00 0.00 46.19 45.80 1gvg s LEU 230 CO 0.46 0.17 0.09 -0.83 -1.32 0.00 0.00 176.35 174.92 1gvg s GLY 231 N -0.16 0.87 -0.00 7.98 0.00 0.20 -4.40 107.32 111.81 1gvg s GLY 231 Ca 0.01 -1.35 0.01 0.00 0.00 0.00 0.00 44.72 43.40 1gvg s GLY 231 CO 0.01 1.67 -0.05 -0.47 0.00 0.00 0.00 173.10 174.26 1gvg s TYR 232 N 1.77 0.43 -0.17 1.90 6.14 -1.26 -4.12 117.35 122.04 1gvg s TYR 232 Ca 0.07 -0.08 -0.04 0.00 0.64 0.00 0.00 57.07 57.66 1gvg s TYR 232 Cb -0.17 -0.28 0.08 0.00 0.42 0.00 0.00 41.96 42.02 1gvg s TYR 232 CO -0.24 -0.01 0.25 0.34 0.64 0.00 0.00 175.55 176.53 1gvg s ASP 233 N -0.12 0.81 0.58 4.32 3.68 -1.26 -0.42 116.67 124.26 1gvg s ASP 233 Ca 0.02 0.19 0.36 0.00 2.13 0.00 0.00 52.55 55.24 1gvg s ASP 233 Cb -0.02 0.58 1.76 0.00 -1.45 0.00 0.00 42.92 43.78 1gvg s ASP 233 CO -0.00 -0.28 2.14 -0.09 0.13 0.00 0.00 175.17 177.07 1gvg h ARG 234 N 8.29 0.00 0.00 4.34 2.43 -1.33 -1.84 114.38 126.28 1gvg h ARG 234 Ca -0.16 0.00 -0.32 0.00 -0.81 0.00 0.00 59.98 58.69 1gvg h ARG 234 Cb 1.13 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 30.63 1gvg h ARG 234 CO 0.21 0.04 -2.20 0.39 -1.51 0.00 0.00 179.97 176.90 1gvg n GLU 235 N -3.24 0.89 -0.06 0.20 -0.58 -1.26 -4.79 120.64 111.80 1gvg n GLU 235 Ca -0.01 0.06 -0.02 0.00 -0.42 0.00 0.00 57.16 56.76 1gvg n GLU 235 Cb 0.21 -1.44 -0.16 0.00 -0.57 0.00 0.00 31.44 29.49 1gvg n GLU 235 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1gvg n LEU 236 N -2.88 0.07 -4.72 -4.62 4.77 -1.17 -4.92 117.00 103.54 1gvg n LEU 236 Ca -0.33 0.03 -0.42 0.00 -0.03 0.00 0.00 56.01 55.26 1gvg n LEU 236 Cb 0.98 0.30 -0.03 0.00 -2.33 0.00 0.00 43.42 42.34 1gvg n LEU 236 CO 0.29 0.31 0.95 -0.22 -1.33 0.00 0.00 177.39 177.39 1gvg s LEU 237 N -5.20 4.39 -0.46 2.23 2.96 -0.70 -1.07 118.68 120.82 1gvg s LEU 237 Ca -0.09 2.19 0.06 0.00 -0.22 0.00 0.00 54.13 56.07 1gvg s LEU 237 Cb 0.09 -3.59 0.22 0.00 0.50 0.00 0.00 46.19 43.41 1gvg s LEU 237 CO 0.85 -0.52 0.50 0.00 -1.32 0.00 0.00 176.35 175.86 1gvg n ALA 238 N 3.62 2.89 -1.75 5.97 0.00 0.45 -4.94 120.51 126.73 1gvg n ALA 238 Ca 0.09 -3.62 -0.38 0.00 0.00 0.00 0.00 53.44 49.53 1gvg n ALA 238 Cb 0.44 -0.83 0.03 0.00 0.00 0.00 0.00 19.45 19.10 1gvg n ALA 238 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1gvg s PRO 239 N -1.03 3.28 -0.11 0.00 0.04 -1.26 -4.22 135.00 131.70 1gvg s PRO 239 Ca 0.34 2.10 -0.04 0.00 0.04 0.00 0.00 61.00 63.44 1gvg s PRO 239 Cb 0.11 -2.28 -0.06 0.00 0.04 0.00 0.00 34.50 32.32 1gvg s PRO 239 CO -0.13 -1.03 -0.13 0.39 0.04 0.00 0.00 177.00 176.14 1gvg n GLU 240 N -0.92 0.26 -1.72 4.56 1.02 -1.26 -4.76 120.64 117.80 1gvg n GLU 240 Ca 0.10 0.09 -0.43 0.00 -0.02 0.00 0.00 57.16 56.91 1gvg n GLU 240 Cb 0.46 -1.02 -0.02 0.00 -0.02 0.00 0.00 31.44 30.84 1gvg n GLU 240 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1gvg n ASP 241 N -3.28 3.52 0.01 1.62 2.03 -1.26 -4.82 116.55 114.37 1gvg n ASP 241 Ca -0.22 1.15 0.05 0.00 0.52 0.00 0.00 54.79 56.29 1gvg n ASP 241 Cb 0.68 -1.55 0.44 0.00 -0.72 0.00 0.00 41.12 39.98 1gvg n ASP 241 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1gvg h PRO 242 N 4.55 0.49 -0.35 -0.67 0.11 -1.99 -0.61 132.00 133.53 1gvg h PRO 242 Ca -0.46 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 65.48 1gvg h PRO 242 Cb 1.24 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 1gvg h PRO 242 CO 0.78 0.33 -0.31 0.00 -0.21 0.00 0.00 178.00 178.58 1gvg h ALA 243 N 1.75 0.78 -0.32 -0.75 0.00 -1.99 -1.20 119.26 117.53 1gvg h ALA 243 Ca 0.16 -0.41 -0.07 0.00 0.00 0.00 0.00 54.91 54.58 1gvg h ALA 243 Cb 0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1gvg h ALA 243 CO -0.04 0.65 -0.08 -0.44 0.00 0.00 0.00 179.25 179.34 1gvg h ASP 244 N 0.65 0.63 -0.82 0.00 3.45 -1.69 -1.92 116.42 116.71 1gvg h ASP 244 Ca 0.07 -0.37 0.01 0.00 0.43 0.00 0.00 57.03 57.17 1gvg h ASP 244 Cb 0.85 -0.17 -0.04 0.00 -0.56 0.00 0.00 39.33 39.40 1gvg h ASP 244 CO 0.07 0.85 0.54 0.11 -1.57 0.00 0.00 179.24 179.25 1gvg h LYS 245 N 0.40 1.09 -0.51 3.56 1.57 -0.97 -0.47 116.57 121.24 1gvg h LYS 245 Ca 0.08 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 1gvg h LYS 245 Cb 0.58 -0.24 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 1gvg h LYS 245 CO 0.03 0.73 0.25 1.49 -0.57 0.00 0.00 179.45 181.38 1gvg h GLU 246 N 1.12 0.72 -0.47 3.15 4.81 -1.11 -0.01 114.58 122.79 1gvg h GLU 246 Ca 0.30 -0.10 -0.12 0.00 -0.13 0.00 0.00 59.36 59.31 1gvg h GLU 246 Cb -0.12 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.12 1gvg h GLU 246 CO -0.06 0.59 -0.19 0.00 -0.73 0.00 0.00 179.01 178.62 1gvg h ALA 247 N 1.09 0.77 -0.33 2.92 0.00 -0.95 -1.72 119.26 121.05 1gvg h ALA 247 Ca 0.17 -0.37 -0.12 0.00 0.00 0.00 0.00 54.91 54.59 1gvg h ALA 247 Cb 0.10 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1gvg h ALA 247 CO -0.02 0.66 -0.27 0.28 0.00 0.00 0.00 179.25 179.90 1gvg h VAL 248 N 0.82 1.28 -0.50 0.00 2.07 -0.90 -1.57 116.25 117.45 1gvg h VAL 248 Ca 0.11 -1.38 -0.06 0.00 0.82 0.00 0.00 66.70 66.20 1gvg h VAL 248 Cb 0.74 1.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.80 1gvg h VAL 248 CO 0.06 0.45 0.08 0.00 0.02 0.00 0.00 177.57 178.18 1gvg h ALA 249 N 1.11 1.21 -0.44 1.67 0.00 -0.72 0.21 119.26 122.30 1gvg h ALA 249 Ca 0.08 -0.22 -0.12 0.00 0.00 0.00 0.00 54.91 54.65 1gvg h ALA 249 Cb 0.77 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1gvg h ALA 249 CO 0.06 0.54 -0.19 0.00 0.00 0.00 0.00 179.25 179.66 1gvg h ALA 250 N 1.34 0.62 -0.49 0.00 0.00 -1.06 -1.78 119.26 117.89 1gvg h ALA 250 Ca 0.16 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 1gvg h ALA 250 Cb 0.34 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1gvg h ALA 250 CO 0.01 0.58 0.23 1.25 0.00 0.00 0.00 179.25 181.32 1gvg h LEU 251 N 0.74 0.65 -0.43 0.00 5.85 -0.80 -1.80 115.31 119.51 1gvg h LEU 251 Ca 0.10 -0.13 0.02 0.00 0.84 0.00 0.00 57.88 58.71 1gvg h LEU 251 Cb 0.76 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.59 1gvg h LEU 251 CO 0.06 0.60 0.25 -1.28 -0.34 0.00 0.00 178.44 177.73 1gvg h SER 252 N 0.65 0.39 -0.44 1.25 0.87 -0.40 -0.49 113.55 115.38 1gvg h SER 252 Ca 0.17 0.01 -0.03 0.00 -1.23 0.00 0.00 61.79 60.71 1gvg h SER 252 Cb 0.13 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 61.99 1gvg h SER 252 CO -0.02 0.28 0.17 0.50 -0.53 0.00 0.00 176.83 177.23 1gvg h LYS 253 N 0.50 0.66 -0.63 2.24 3.64 -1.17 -1.58 116.57 120.23 1gvg h LYS 253 Ca 0.17 -0.12 -0.05 0.00 -1.27 0.00 0.00 60.65 59.38 1gvg h LYS 253 Cb 0.03 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.71 1gvg h LYS 253 CO -0.09 0.62 0.19 0.00 -2.27 0.00 0.00 179.45 177.89 1gvg h ALA 254 N 1.01 1.15 -0.49 5.00 0.00 -1.01 -0.58 119.26 124.35 1gvg h ALA 254 Ca 0.15 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 1gvg h ALA 254 Cb 0.21 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1gvg h ALA 254 CO -0.01 0.59 0.19 -0.07 0.00 0.00 0.00 179.25 179.95 1gvg h LEU 255 N 0.92 0.68 -0.57 0.00 3.38 -0.84 -2.23 115.31 116.65 1gvg h LEU 255 Ca 0.21 -0.17 0.04 0.00 0.09 0.00 0.00 57.88 58.04 1gvg h LEU 255 Cb 0.28 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 40.80 1gvg h LEU 255 CO -0.01 0.67 0.32 0.44 0.09 0.00 0.00 178.44 179.95 1gvg h ASP 256 N 0.65 0.48 0.33 -0.43 3.45 -0.76 -2.38 116.42 117.76 1gvg h ASP 256 Ca 0.16 0.02 0.00 0.00 0.43 0.00 0.00 57.03 57.64 1gvg h ASP 256 Cb 0.21 -0.07 0.00 0.00 -0.56 0.00 0.00 39.33 38.90 1gvg h ASP 256 CO -0.01 0.33 0.00 -0.33 -1.57 0.00 0.00 179.24 177.65 1gvg h GLU 257 N 0.61 0.00 -0.09 3.56 5.08 -0.55 -2.09 114.58 121.10 1gvg h GLU 257 Ca 0.25 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 1gvg h GLU 257 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1gvg h GLU 257 CO -0.15 0.00 0.00 1.33 -1.00 0.00 0.00 179.01 179.19 1gvg n VAL 258 N -2.40 1.72 -1.71 3.13 0.24 -0.92 -5.05 118.33 113.35 1gvg n VAL 258 Ca -0.00 -1.80 -0.43 0.00 -2.04 0.00 0.00 64.34 60.06 1gvg n VAL 258 Cb 0.13 -0.03 -0.03 0.00 -1.47 0.00 0.00 33.84 32.44 1gvg n VAL 258 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 1gvg n THR 259 N -0.85 0.42 -4.40 3.34 -1.04 -0.79 -4.58 114.28 106.37 1gvg n THR 259 Ca 0.14 -0.10 -0.26 0.00 -2.04 0.00 0.00 64.05 61.78 1gvg n THR 259 Cb 0.60 -1.79 -0.11 0.00 -1.82 0.00 0.00 70.33 67.21 1gvg n THR 259 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1gvg s GLU 260 N 0.42 1.69 -0.01 -2.82 2.02 -0.26 -4.97 118.70 114.77 1gvg s GLU 260 Ca 0.72 -1.52 0.05 0.00 0.02 0.00 0.00 54.97 54.24 1gvg s GLU 260 Cb -0.57 -1.90 -0.01 0.00 0.10 0.00 0.00 34.13 31.74 1gvg s GLU 260 CO 0.41 0.39 -0.16 0.00 0.02 0.00 0.00 175.26 175.91 1gvg s ALA 261 N -1.88 1.36 -0.13 5.21 0.00 -1.26 -1.05 121.76 124.01 1gvg s ALA 261 Ca 0.24 -0.73 0.01 0.00 0.00 0.00 0.00 51.96 51.48 1gvg s ALA 261 Cb -0.07 -0.33 0.02 0.00 0.00 0.00 0.00 23.12 22.73 1gvg s ALA 261 CO 0.12 0.33 -0.14 0.08 0.00 0.00 0.00 175.76 176.15 1gvg s VAL 262 N -0.44 1.53 -0.58 0.00 1.01 0.06 -4.96 120.40 117.02 1gvg s VAL 262 Ca 0.06 -0.62 -0.18 0.00 0.00 0.00 0.00 61.98 61.24 1gvg s VAL 262 Cb -0.06 -1.42 0.11 0.00 0.00 0.00 0.00 36.38 35.00 1gvg s VAL 262 CO -0.00 0.45 0.65 -0.31 0.00 0.00 0.00 175.10 175.88 1gvg s TYR 263 N 1.32 3.07 0.15 5.22 1.51 -1.26 -0.62 117.35 126.74 1gvg s TYR 263 Ca 0.01 -1.06 -0.31 0.00 -1.01 0.00 0.00 57.07 54.70 1gvg s TYR 263 Cb -0.14 -3.95 -0.09 0.00 -0.11 0.00 0.00 41.96 37.67 1gvg s TYR 263 CO -0.07 -1.22 1.46 -0.51 -1.11 0.00 0.00 175.55 174.10 1gvg s LEU 264 N 2.37 4.37 0.26 -1.29 1.43 -1.26 -5.01 118.68 119.56 1gvg s LEU 264 Ca 0.09 2.49 0.08 0.00 -1.03 0.00 0.00 54.13 55.75 1gvg s LEU 264 Cb -0.26 -3.59 -0.05 0.00 0.03 0.00 0.00 46.19 42.31 1gvg s LEU 264 CO 0.05 -0.72 -0.10 -1.83 0.23 0.00 0.00 176.35 173.98 1gvg s GLU 265 N 0.88 1.53 0.16 1.70 -1.05 -1.26 -4.59 118.70 116.07 1gvg s GLU 265 Ca 0.66 -1.74 -0.34 0.00 -0.15 0.00 0.00 54.97 53.40 1gvg s GLU 265 Cb -0.40 -1.27 -0.16 0.00 -0.44 0.00 0.00 34.13 31.86 1gvg s GLU 265 CO 0.33 0.12 1.20 -2.30 0.95 0.00 0.00 175.26 175.56 1gvg n PRO 266 N -0.55 1.17 -0.00 -4.83 -0.02 -1.26 -1.18 135.00 128.32 1gvg n PRO 266 Ca -0.06 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 1gvg n PRO 266 Cb 0.62 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 32.16 1gvg n PRO 266 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1gvg n GLY 267 N 2.11 0.80 3.79 -1.23 0.00 -0.61 -4.71 105.19 105.34 1gvg n GLY 267 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 1gvg n GLY 267 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1gvg s ASP 268 N -2.54 7.23 -0.16 1.61 -0.00 -0.33 -0.82 116.67 121.66 1gvg s ASP 268 Ca 0.00 1.56 -0.03 0.00 -0.00 0.00 0.00 52.55 54.09 1gvg s ASP 268 Cb 0.00 -2.47 0.05 0.00 -0.00 0.00 0.00 42.92 40.50 1gvg s ASP 268 CO 0.00 0.10 0.03 -0.22 -0.00 0.00 0.00 175.17 175.08 1gvg s LEU 269 N -1.62 0.99 -0.24 1.23 0.20 0.17 -0.93 118.68 118.48 1gvg s LEU 269 Ca 0.41 -0.62 -0.10 0.00 0.69 0.00 0.00 54.13 54.51 1gvg s LEU 269 Cb -0.20 -0.54 -0.05 0.00 -0.43 0.00 0.00 46.19 44.97 1gvg s LEU 269 CO 0.23 -0.28 0.15 -0.22 -0.29 0.00 0.00 176.35 175.95 1gvg s LEU 270 N 1.90 4.08 -0.29 -0.68 2.96 0.33 -0.52 118.68 126.46 1gvg s LEU 270 Ca 0.01 0.10 -0.08 0.00 -0.22 0.00 0.00 54.13 53.94 1gvg s LEU 270 Cb -0.16 -2.09 -0.00 0.00 0.50 0.00 0.00 46.19 44.44 1gvg s LEU 270 CO -0.07 0.07 0.09 -0.63 -1.32 0.00 0.00 176.35 174.49 1gvg s ILE 271 N 1.02 4.19 -0.23 6.68 1.01 0.55 -0.91 121.20 133.51 1gvg s ILE 271 Ca 0.07 -0.51 -0.09 0.00 0.00 0.00 0.00 60.65 60.13 1gvg s ILE 271 Cb -0.13 -3.11 -0.04 0.00 0.01 0.00 0.00 42.46 39.19 1gvg s ILE 271 CO 0.04 0.14 0.11 -0.69 0.00 0.00 0.00 174.94 174.53 1gvg s VAL 272 N 1.55 4.86 -0.72 2.92 1.01 0.03 -0.87 120.40 129.17 1gvg s VAL 272 Ca 0.04 0.01 -0.26 0.00 0.00 0.00 0.00 61.98 61.76 1gvg s VAL 272 Cb -0.17 -3.25 0.01 0.00 0.00 0.00 0.00 36.38 32.97 1gvg s VAL 272 CO 0.04 0.37 1.53 -0.62 0.00 0.00 0.00 175.10 176.42 1gvg s ASP 273 N 1.08 5.82 0.00 3.32 3.68 -0.55 -2.33 116.67 127.69 1gvg s ASP 273 Ca 0.05 -0.26 0.23 0.00 2.13 0.00 0.00 52.55 54.71 1gvg s ASP 273 Cb -0.14 -2.55 1.40 0.00 -1.45 0.00 0.00 42.92 40.18 1gvg s ASP 273 CO 0.04 -2.05 1.79 -3.20 0.13 0.00 0.00 175.17 171.87 1gvg n ASN 274 N 10.78 0.00 -0.64 -0.34 5.15 0.12 -1.90 115.26 128.42 1gvg n ASN 274 Ca 0.13 -0.85 0.09 0.00 -0.60 0.00 0.00 54.58 53.35 1gvg n ASN 274 Cb 0.50 0.00 0.06 0.00 -0.53 0.00 0.00 39.78 39.81 1gvg n ASN 274 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1gvg n PHE 275 N -0.96 0.00 -0.74 1.20 3.72 -1.24 -4.60 117.46 114.83 1gvg n PHE 275 Ca 0.18 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.58 1gvg n PHE 275 Cb 0.08 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.62 1gvg n PHE 275 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1gvg n ARG 276 N 0.80 0.62 -4.20 -1.08 1.74 -0.80 -0.46 116.66 113.28 1gvg n ARG 276 Ca 0.10 -0.66 -0.16 0.00 -0.77 0.00 0.00 57.85 56.35 1gvg n ARG 276 Cb 0.42 -0.63 -0.07 0.00 -1.02 0.00 0.00 32.46 31.16 1gvg n ARG 276 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1gvg s THR 277 N -0.22 0.00 0.01 0.55 -4.23 -0.88 -0.65 115.64 110.23 1gvg s THR 277 Ca 0.00 -1.87 0.00 0.00 -1.18 0.00 0.00 61.69 58.64 1gvg s THR 277 Cb 0.00 -2.52 -0.01 0.00 1.34 0.00 0.00 72.50 71.31 1gvg s THR 277 CO 0.00 0.00 -0.02 0.28 -0.54 0.00 0.00 174.62 174.34 1gvg s THR 278 N -3.54 0.08 0.15 3.99 -1.32 -0.79 -4.53 115.64 109.67 1gvg s THR 278 Ca 0.37 -0.56 0.01 0.00 -1.21 0.00 0.00 61.69 60.30 1gvg s THR 278 Cb 0.03 -0.17 -0.04 0.00 -1.51 0.00 0.00 72.50 70.80 1gvg s THR 278 CO 0.22 -0.31 0.00 -1.38 -2.21 0.00 0.00 174.62 170.94 1gvg s HIS 279 N -0.90 1.06 0.30 9.09 -3.43 0.03 -1.46 115.29 119.99 1gvg s HIS 279 Ca -0.10 -1.05 -0.10 0.00 -0.80 0.00 0.00 55.06 53.01 1gvg s HIS 279 Cb -0.06 -0.61 0.01 0.00 -1.43 0.00 0.00 32.58 30.49 1gvg s HIS 279 CO -0.01 -0.27 0.54 0.00 -2.00 0.00 0.00 174.74 173.01 1gvg s ALA 280 N -3.74 -0.04 -0.02 -1.38 0.00 -0.31 -0.77 121.76 115.49 1gvg s ALA 280 Ca 0.21 -1.04 -0.00 0.00 0.00 0.00 0.00 51.96 51.13 1gvg s ALA 280 Cb 0.06 1.02 0.03 0.00 0.00 0.00 0.00 23.12 24.23 1gvg s ALA 280 CO 0.02 -0.87 0.02 0.50 0.00 0.00 0.00 175.76 175.43 1gvg s ARG 281 N -3.40 0.07 0.77 0.00 3.52 -0.46 -0.56 118.95 118.89 1gvg s ARG 281 Ca 0.23 0.17 -0.12 0.00 -0.13 0.00 0.00 55.73 55.88 1gvg s ARG 281 Cb -0.02 -0.35 0.05 0.00 -1.56 0.00 0.00 34.95 33.08 1gvg s ARG 281 CO 0.13 -0.17 1.13 0.95 -0.81 0.00 0.00 175.30 176.53 1gvg s THR 282 N 1.15 2.85 0.62 4.11 -4.23 -0.24 -1.27 115.64 118.61 1gvg s THR 282 Ca -0.08 0.27 -0.18 0.00 -1.18 0.00 0.00 61.69 60.52 1gvg s THR 282 Cb -0.13 -3.22 -0.02 0.00 1.34 0.00 0.00 72.50 70.46 1gvg s THR 282 CO -0.03 -0.36 1.24 -2.84 -0.54 0.00 0.00 174.62 172.09 1gvg s PRO 283 N -5.40 2.79 0.07 3.99 0.02 -1.26 -4.35 135.00 130.86 1gvg s PRO 283 Ca 0.60 1.90 -0.16 0.00 0.02 0.00 0.00 61.00 63.36 1gvg s PRO 283 Cb -0.12 -1.90 0.03 0.00 0.02 0.00 0.00 34.50 32.54 1gvg s PRO 283 CO 0.51 -1.37 0.38 -0.59 -0.33 0.00 0.00 177.00 175.60 1gvg s PHE 284 N -1.55 -0.20 -0.34 6.54 -0.12 -0.42 -4.06 117.98 117.83 1gvg s PHE 284 Ca 0.79 0.05 -0.08 0.00 -0.05 0.00 0.00 56.93 57.64 1gvg s PHE 284 Cb -0.33 0.20 0.03 0.00 -0.63 0.00 0.00 43.02 42.29 1gvg s PHE 284 CO 0.36 -0.59 0.14 -1.12 -0.05 0.00 0.00 175.22 173.95 1gvg s SER 285 N -2.27 5.44 0.85 1.98 0.01 -1.26 -2.39 113.70 116.06 1gvg s SER 285 Ca -0.02 -1.02 -0.11 0.00 1.31 0.00 0.00 55.95 56.10 1gvg s SER 285 Cb 0.00 -1.92 0.10 0.00 0.21 0.00 0.00 66.02 64.41 1gvg s SER 285 CO -0.06 -0.33 1.09 -2.84 0.41 0.00 0.00 173.24 171.52 1gvg s PRO 286 N 1.47 1.60 0.00 12.44 0.02 -1.26 -4.88 135.00 144.39 1gvg s PRO 286 Ca 0.00 1.03 0.05 0.00 0.02 0.00 0.00 61.00 62.10 1gvg s PRO 286 Cb -0.19 -1.83 -0.05 0.00 0.02 0.00 0.00 34.50 32.45 1gvg s PRO 286 CO 0.04 -2.06 0.21 0.54 -0.33 0.00 0.00 177.00 175.40 1gvg n ARG 287 N -3.79 5.31 -3.93 5.54 1.74 -1.26 -5.01 116.66 115.25 1gvg n ARG 287 Ca 0.08 -0.02 -0.27 0.00 -0.77 0.00 0.00 57.85 56.88 1gvg n ARG 287 Cb 0.54 -0.73 -0.00 0.00 -1.02 0.00 0.00 32.46 31.24 1gvg n ARG 287 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 1gvg n TRP 288 N -1.08 -1.83 -0.02 -1.55 7.02 -1.26 -4.88 117.44 113.84 1gvg n TRP 288 Ca 0.01 0.80 0.02 0.00 -1.02 0.00 0.00 57.50 57.31 1gvg n TRP 288 Cb 0.08 -3.81 0.05 0.00 -2.42 0.00 0.00 31.31 25.21 1gvg n TRP 288 CO 0.00 0.00 0.00 -0.40 -2.02 0.00 0.00 177.69 175.27 1gvg n ASP 289 N -2.93 2.19 0.00 -0.99 5.75 -1.26 -4.97 116.55 114.34 1gvg n ASP 289 Ca -0.20 -1.84 0.00 0.00 -0.01 0.00 0.00 54.79 52.74 1gvg n ASP 289 Cb 0.63 -0.08 0.00 0.00 -1.03 0.00 0.00 41.12 40.64 1gvg n ASP 289 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1gvg n GLY 290 N -0.02 0.91 0.32 6.12 0.00 -1.26 -4.88 105.19 106.38 1gvg n GLY 290 Ca 0.04 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.14 1gvg n GLY 290 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1gvg n LYS 291 N -2.00 1.09 -1.01 1.61 4.76 -1.26 -1.28 118.16 120.08 1gvg n LYS 291 Ca 0.00 -2.47 -0.30 0.00 -2.87 0.00 0.00 58.31 52.66 1gvg n LYS 291 Cb 0.00 -1.30 0.14 0.00 -1.84 0.00 0.00 35.03 32.04 1gvg n LYS 291 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1gvg s ASP 292 N -2.63 3.36 0.24 4.39 -0.00 -1.26 -4.73 116.67 116.03 1gvg s ASP 292 Ca 0.29 1.80 -0.29 0.00 -0.00 0.00 0.00 52.55 54.35 1gvg s ASP 292 Cb 0.26 -2.41 -0.16 0.00 -0.00 0.00 0.00 42.92 40.62 1gvg s ASP 292 CO -0.01 -2.76 0.83 -1.14 -0.00 0.00 0.00 175.17 172.09 1gvg n ARG 293 N -3.99 0.76 -3.39 8.23 0.63 -1.25 -4.82 116.66 112.83 1gvg n ARG 293 Ca 0.09 0.27 -0.12 0.00 -0.92 0.00 0.00 57.85 57.16 1gvg n ARG 293 Cb 0.54 -1.50 -0.09 0.00 0.45 0.00 0.00 32.46 31.85 1gvg n ARG 293 CO 0.00 0.00 0.00 -0.46 -2.51 0.00 0.00 177.63 174.66 1gvg s TRP 294 N -0.94 -0.66 0.34 -0.14 -0.00 -0.21 -4.29 118.94 113.05 1gvg s TRP 294 Ca 0.63 0.53 0.08 0.00 -0.00 0.00 0.00 56.10 57.34 1gvg s TRP 294 Cb -0.82 -0.14 -0.04 0.00 -0.00 0.00 0.00 33.47 32.47 1gvg s TRP 294 CO 0.58 -0.73 0.18 -0.51 -0.00 0.00 0.00 176.95 176.46 1gvg s LEU 295 N 2.47 3.32 -0.13 5.86 1.43 -0.39 -1.23 118.68 130.02 1gvg s LEU 295 Ca 0.11 -0.73 0.02 0.00 -1.03 0.00 0.00 54.13 52.50 1gvg s LEU 295 Cb -0.15 -1.83 0.01 0.00 0.03 0.00 0.00 46.19 44.25 1gvg s LEU 295 CO -0.18 -0.33 -0.20 -1.00 0.23 0.00 0.00 176.35 174.87 1gvg s HIS 296 N -2.41 2.46 -0.08 0.29 3.76 0.30 -0.30 115.29 119.30 1gvg s HIS 296 Ca 0.39 -1.22 0.02 0.00 -0.15 0.00 0.00 55.06 54.10 1gvg s HIS 296 Cb -0.03 -1.69 -0.02 0.00 1.11 0.00 0.00 32.58 31.94 1gvg s HIS 296 CO 0.24 -0.57 -0.13 0.50 -0.85 0.00 0.00 174.74 173.92 1gvg s ARG 297 N 0.86 2.85 0.05 1.40 3.52 0.34 -0.90 118.95 127.07 1gvg s ARG 297 Ca -0.07 -0.68 0.00 0.00 -0.13 0.00 0.00 55.73 54.85 1gvg s ARG 297 Cb -0.15 -2.48 -0.03 0.00 -1.56 0.00 0.00 34.95 30.72 1gvg s ARG 297 CO -0.02 0.47 -0.04 0.14 -0.81 0.00 0.00 175.30 175.04 1gvg s VAL 298 N -0.32 0.31 -0.08 7.11 -7.23 -0.79 -1.26 120.40 118.14 1gvg s VAL 298 Ca 0.03 -1.56 0.02 0.00 -1.81 0.00 0.00 61.98 58.67 1gvg s VAL 298 Cb -0.13 -1.18 -0.02 0.00 0.56 0.00 0.00 36.38 35.62 1gvg s VAL 298 CO 0.02 -0.80 -0.15 -0.31 -0.31 0.00 0.00 175.10 173.55 1gvg s TYR 299 N -3.06 2.72 -0.12 2.82 2.02 -1.26 -1.03 117.35 119.44 1gvg s TYR 299 Ca 0.01 -0.40 0.03 0.00 -0.37 0.00 0.00 57.07 56.34 1gvg s TYR 299 Cb 0.02 -1.71 0.01 0.00 -0.40 0.00 0.00 41.96 39.87 1gvg s TYR 299 CO -0.06 -0.01 -0.22 0.42 -1.57 0.00 0.00 175.55 174.11 1gvg s ILE 300 N -0.25 2.01 -0.00 2.71 -1.09 -0.39 -1.20 121.20 122.99 1gvg s ILE 300 Ca 0.01 -0.97 -0.04 0.00 -2.23 0.00 0.00 60.65 57.42 1gvg s ILE 300 Cb -0.13 -1.77 -0.04 0.00 -1.58 0.00 0.00 42.46 38.94 1gvg s ILE 300 CO 0.03 0.54 0.22 -0.13 -1.23 0.00 0.00 174.94 174.37 1gvg s ARG 301 N 0.63 3.50 0.18 2.79 0.52 -0.25 -1.90 118.95 124.42 1gvg s ARG 301 Ca -0.12 -0.21 0.01 0.00 -0.52 0.00 0.00 55.73 54.90 1gvg s ARG 301 Cb -0.16 -3.09 -0.01 0.00 0.52 0.00 0.00 34.95 32.22 1gvg s ARG 301 CO 0.02 0.66 0.05 0.25 0.02 0.00 0.00 175.30 176.31 1gvg n THR 302 N 1.02 0.00 1.29 0.02 -2.24 -1.26 -0.76 114.28 112.35 1gvg n THR 302 Ca -0.11 -0.99 0.13 0.00 -2.27 0.00 0.00 64.05 60.81 1gvg n THR 302 Cb 0.53 0.33 0.69 0.00 -2.10 0.00 0.00 70.33 69.77 1gvg n THR 302 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1gvg n ASP 303 N -1.71 0.00 -4.67 3.42 10.43 -1.26 -4.38 116.55 118.38 1gvg n ASP 303 Ca -0.04 -0.12 -0.46 0.00 2.57 0.00 0.00 54.79 56.74 1gvg n ASP 303 Cb 0.26 -0.28 -0.04 0.00 1.84 0.00 0.00 41.12 42.90 1gvg n ASP 303 CO 0.00 0.00 0.00 -1.14 -1.07 0.00 0.00 177.20 174.99 1gvg n ARG 304 N -1.28 2.21 -1.59 -1.24 0.63 -1.26 -4.71 116.66 109.41 1gvg n ARG 304 Ca 0.13 0.80 -0.48 0.00 -0.92 0.00 0.00 57.85 57.39 1gvg n ARG 304 Cb 0.21 -2.59 -0.03 0.00 0.45 0.00 0.00 32.46 30.50 1gvg n ARG 304 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1gvg n ASN 305 N 4.06 1.56 0.00 6.15 3.02 -1.26 -3.33 115.26 125.46 1gvg n ASN 305 Ca 0.18 1.15 0.00 0.00 -0.03 0.00 0.00 54.58 55.88 1gvg n ASN 305 Cb 0.30 -1.26 0.00 0.00 -0.61 0.00 0.00 39.78 38.20 1gvg n ASN 305 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1gvg n GLY 306 N 1.93 3.15 0.15 7.41 0.00 -1.26 -4.96 105.19 111.62 1gvg n GLY 306 Ca 0.14 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.01 1gvg n GLY 306 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1gvg h GLN 307 N 2.12 0.42 -5.90 1.61 4.20 -1.81 -3.46 115.11 112.30 1gvg h GLN 307 Ca 0.00 -0.47 -0.62 0.00 0.06 0.00 0.00 58.65 57.62 1gvg h GLN 307 Cb 0.00 0.14 -0.30 0.00 0.30 0.00 0.00 27.48 27.62 1gvg h GLN 307 CO 0.00 1.14 -0.86 -0.51 -0.67 0.00 0.00 178.83 177.93 1gvg s LEU 308 N -7.70 2.02 0.00 1.46 1.43 -1.26 -4.95 118.68 109.67 1gvg s LEU 308 Ca -0.06 -0.40 0.01 0.00 -1.03 0.00 0.00 54.13 52.65 1gvg s LEU 308 Cb 0.08 -1.12 0.00 0.00 0.03 0.00 0.00 46.19 45.18 1gvg s LEU 308 CO 0.87 0.23 0.36 -1.54 0.23 0.00 0.00 176.35 176.51 1gvg n SER 309 N 2.76 0.72 0.00 2.29 3.41 -1.26 -5.07 113.62 116.47 1gvg n SER 309 Ca -0.16 -0.86 0.00 0.00 -0.26 0.00 0.00 58.87 57.59 1gvg n SER 309 Cb 0.53 0.35 0.00 0.00 -0.26 0.00 0.00 64.21 64.83 1gvg n SER 309 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1gvg n GLY 310 N 0.40 4.11 2.74 5.00 0.00 -1.26 -5.02 105.19 111.17 1gvg n GLY 310 Ca 0.00 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 44.90 1gvg n GLY 310 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gvg n GLY 311 N -0.28 1.07 3.75 -0.02 0.00 -1.26 -5.02 105.19 103.43 1gvg n GLY 311 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 1gvg n GLY 311 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1gvg s GLU 312 N -0.09 2.90 0.11 1.61 8.01 -1.26 -5.05 118.70 124.94 1gvg s GLU 312 Ca 0.00 1.92 0.07 0.00 0.01 0.00 0.00 54.97 56.97 1gvg s GLU 312 Cb 0.00 -1.95 -0.04 0.00 -4.31 0.00 0.00 34.13 27.84 1gvg s GLU 312 CO 0.00 -1.29 -0.16 1.03 0.01 0.00 0.00 175.26 174.85 1gvg s ARG 313 N -3.28 1.03 0.06 1.61 0.52 -1.26 -5.09 118.95 112.53 1gvg s ARG 313 Ca 0.78 -1.16 -0.31 0.00 -0.52 0.00 0.00 55.73 54.52 1gvg s ARG 313 Cb -0.33 -1.07 -0.07 0.00 0.52 0.00 0.00 34.95 33.99 1gvg s ARG 313 CO 0.36 0.23 1.54 0.00 0.02 0.00 0.00 175.30 177.45 1gvg s ALA 314 N -1.62 3.65 0.00 2.13 0.00 -1.26 -1.71 121.76 122.95 1gvg s ALA 314 Ca 0.06 1.10 0.00 0.00 0.00 0.00 0.00 51.96 53.12 1gvg s ALA 314 Cb -0.08 -3.64 0.00 0.00 0.00 0.00 0.00 23.12 19.40 1gvg s ALA 314 CO 0.04 -0.98 0.00 0.41 0.00 0.00 0.00 175.76 175.23 1gvg n GLY 315 N 3.82 1.06 3.74 0.00 0.00 0.01 -4.62 105.19 109.20 1gvg n GLY 315 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 1gvg n GLY 315 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1gvg s ASP 316 N -1.99 4.54 -0.11 1.61 -0.00 -0.69 -4.68 116.67 115.35 1gvg s ASP 316 Ca 0.00 2.23 0.03 0.00 -0.00 0.00 0.00 52.55 54.80 1gvg s ASP 316 Cb 0.00 -2.58 -0.00 0.00 -0.00 0.00 0.00 42.92 40.34 1gvg s ASP 316 CO 0.00 -2.02 -0.21 -0.69 -0.00 0.00 0.00 175.17 172.25 1gvg s VAL 317 N -2.11 2.34 0.16 -1.27 1.01 -1.26 -0.98 120.40 118.30 1gvg s VAL 317 Ca 0.72 -0.92 0.08 0.00 0.00 0.00 0.00 61.98 61.86 1gvg s VAL 317 Cb -0.26 -1.92 -0.04 0.00 0.00 0.00 0.00 36.38 34.16 1gvg s VAL 317 CO 0.44 0.55 -0.10 0.68 0.00 0.00 0.00 175.10 176.67 1gvg s VAL 318 N 0.36 3.22 0.49 2.92 -7.23 -0.22 -4.85 120.40 115.10 1gvg s VAL 318 Ca -0.16 -1.57 -0.03 0.00 -1.81 0.00 0.00 61.98 58.41 1gvg s VAL 318 Cb -0.17 -2.57 -0.01 0.00 0.56 0.00 0.00 36.38 34.18 1gvg s VAL 318 CO 0.08 -0.06 0.77 0.00 -0.31 0.00 0.00 175.10 175.58 1gvg s ALA 319 N -1.58 3.51 0.02 1.32 0.00 -1.26 -0.79 121.76 122.98 1gvg s ALA 319 Ca 0.24 -0.78 -0.30 0.00 0.00 0.00 0.00 51.96 51.12 1gvg s ALA 319 Cb -0.09 -2.41 -0.04 0.00 0.00 0.00 0.00 23.12 20.58 1gvg s ALA 319 CO 0.15 -0.48 1.00 0.12 0.00 0.00 0.00 175.76 176.55 1gvg s PHE 320 N -2.73 3.65 -0.06 0.00 2.19 -1.26 -4.93 117.98 114.85 1gvg s PHE 320 Ca 0.49 1.67 -0.02 0.00 0.33 0.00 0.00 56.93 59.40 1gvg s PHE 320 Cb -0.10 -3.15 0.04 0.00 -1.31 0.00 0.00 43.02 38.50 1gvg s PHE 320 CO 0.42 -0.12 0.10 0.99 1.83 0.00 0.00 175.22 178.44 1gvg s THR 321 N 0.89 -0.16 0.48 0.12 2.01 -1.26 -5.09 115.64 112.63 1gvg s THR 321 Ca 0.52 0.39 -0.21 0.00 0.31 0.00 0.00 61.69 62.70 1gvg s THR 321 Cb -0.22 -0.21 -0.08 0.00 0.01 0.00 0.00 72.50 72.00 1gvg s THR 321 CO 0.28 0.16 1.07 -2.16 -0.69 0.00 0.00 174.62 173.29 1gvg s PRO 322 N 2.14 3.75 0.56 4.92 0.04 -1.26 -1.33 135.00 143.82 1gvg s PRO 322 Ca 0.03 1.47 -0.19 0.00 0.04 0.00 0.00 61.00 62.36 1gvg s PRO 322 Cb -0.12 -2.16 -0.05 0.00 0.04 0.00 0.00 34.50 32.21 1gvg s PRO 322 CO -0.04 -0.49 1.12 1.03 0.04 0.00 0.00 177.00 178.66 1gvg s ARG 323 N -3.09 3.28 0.00 4.56 0.52 -0.21 -4.61 118.95 119.39 1gvg s ARG 323 Ca 0.67 1.57 0.00 0.00 -0.52 0.00 0.00 55.73 57.44 1gvg s ARG 323 Cb -0.20 -2.00 0.00 0.00 0.52 0.00 0.00 34.95 33.27 1gvg s ARG 323 CO 0.24 -0.90 0.00 0.41 0.02 0.00 0.00 175.30 175.06