#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nef h TRP 57 N 0.00 0.52 -0.38 0.00 0.09 -1.88 -2.60 115.95 111.70 2nef h TRP 57 Ca 0.00 -0.20 -0.04 0.00 0.09 0.00 0.00 58.89 58.74 2nef h TRP 57 Cb 0.00 -0.09 -0.02 0.00 0.08 0.00 0.00 29.16 29.13 2nef h TRP 57 CO 0.00 0.92 0.09 1.25 0.09 0.00 0.00 178.44 180.78 2nef h LEU 58 N 0.30 0.57 0.00 0.11 5.85 -1.88 -1.83 115.31 118.42 2nef h LEU 58 Ca -0.01 -0.24 0.00 0.00 0.84 0.00 0.00 57.88 58.48 2nef h LEU 58 Cb 1.16 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.04 2nef h LEU 58 CO 0.11 0.66 0.00 1.21 -0.34 0.00 0.00 178.44 180.08 2nef n GLU 59 N -4.58 0.16 -2.41 1.25 2.13 -1.23 -4.77 120.64 111.18 2nef n GLU 59 Ca -0.01 0.05 -0.41 0.00 0.66 0.00 0.00 57.16 57.45 2nef n GLU 59 Cb 0.20 -1.50 -0.03 0.00 0.27 0.00 0.00 31.44 30.38 2nef n GLU 59 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2nef s ALA 60 N -2.82 3.41 -0.17 4.31 0.00 -0.69 -4.95 121.76 120.85 2nef s ALA 60 Ca 0.18 0.89 -0.24 0.00 0.00 0.00 0.00 51.96 52.79 2nef s ALA 60 Cb 0.17 -3.41 -0.21 0.00 0.00 0.00 0.00 23.12 19.67 2nef s ALA 60 CO 0.44 -0.36 0.47 -0.56 0.00 0.00 0.00 175.76 175.75 2nef h GLN 61 N 5.70 0.00 -2.99 0.00 3.07 -1.86 -3.37 115.11 115.67 2nef h GLN 61 Ca -0.44 0.00 -0.72 0.00 0.09 0.00 0.00 58.65 57.58 2nef h GLN 61 Cb 1.21 0.00 -0.08 0.00 0.08 0.00 0.00 27.48 28.69 2nef h GLN 61 CO 0.76 0.93 2.79 -0.85 0.09 0.00 0.00 178.83 182.55 2nef n GLU 62 N -4.54 4.05 -0.28 0.06 0.28 -1.26 -4.68 120.64 114.27 2nef n GLU 62 Ca -0.19 -3.07 0.01 0.00 -0.16 0.00 0.00 57.16 53.75 2nef n GLU 62 Cb 0.54 -2.78 0.21 0.00 1.43 0.00 0.00 31.44 30.84 2nef n GLU 62 CO 0.00 0.00 0.00 0.93 -0.16 0.00 0.00 177.13 177.90 2nef h GLU 63 N 5.02 1.08 -2.20 3.44 5.08 -1.90 -2.73 114.58 122.39 2nef h GLU 63 Ca 0.68 -0.07 -0.15 0.00 -1.00 0.00 0.00 59.36 58.83 2nef h GLU 63 Cb 0.38 -0.24 -0.06 0.00 0.50 0.00 0.00 28.75 29.33 2nef h GLU 63 CO 1.62 0.72 -0.21 0.39 -1.00 0.00 0.00 179.01 180.53 2nef n GLU 64 N -4.42 1.59 -2.79 2.33 4.71 -1.26 -4.30 120.64 116.50 2nef n GLU 64 Ca 0.10 -0.79 -0.02 0.00 -0.01 0.00 0.00 57.16 56.44 2nef n GLU 64 Cb 0.06 -1.89 0.02 0.00 -1.01 0.00 0.00 31.44 28.62 2nef n GLU 64 CO 0.00 0.00 0.00 -2.00 0.09 0.00 0.00 177.13 175.22 2nef s GLU 65 N 1.38 0.65 -0.93 3.49 2.12 -1.03 -5.03 118.70 119.36 2nef s GLU 65 Ca 0.53 -0.56 -0.08 0.00 0.36 0.00 0.00 54.97 55.21 2nef s GLU 65 Cb 0.25 -0.01 -0.15 0.00 0.26 0.00 0.00 34.13 34.49 2nef s GLU 65 CO 0.00 -0.83 3.20 0.28 -0.54 0.00 0.00 175.26 177.37 2nef n VAL 66 N 3.09 3.81 -1.02 3.70 0.31 -1.26 -4.77 118.33 122.19 2nef n VAL 66 Ca 0.14 -2.25 -0.31 0.00 -0.01 0.00 0.00 64.34 61.91 2nef n VAL 66 Cb 0.60 -2.32 -0.02 0.00 -0.91 0.00 0.00 33.84 31.19 2nef n VAL 66 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2nef n GLY 67 N 2.98 3.51 3.34 2.92 0.00 -1.26 -4.78 105.19 111.90 2nef n GLY 67 Ca 0.63 -1.14 -0.14 0.00 0.00 0.00 0.00 46.02 45.38 2nef n GLY 67 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2nef s PHE 68 N 3.15 -0.46 -0.97 1.61 0.40 -1.26 -5.07 117.98 115.38 2nef s PHE 68 Ca 0.51 1.07 -0.26 0.00 -0.60 0.00 0.00 56.93 57.66 2nef s PHE 68 Cb 0.13 0.17 -0.24 0.00 0.51 0.00 0.00 43.02 43.60 2nef s PHE 68 CO -0.03 -0.28 2.51 -2.30 0.70 0.00 0.00 175.22 175.81 2nef n PRO 69 N 2.49 0.00 -3.01 0.24 -0.02 -1.26 -4.86 135.00 128.59 2nef n PRO 69 Ca -0.15 0.00 -0.40 0.00 -2.02 0.00 0.00 63.50 60.93 2nef n PRO 69 Cb 0.57 -1.36 -0.05 0.00 -0.02 0.00 0.00 33.50 32.64 2nef n PRO 69 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2nef s VAL 70 N 6.98 4.82 -0.35 -1.45 0.11 -1.26 -5.03 120.40 124.22 2nef s VAL 70 Ca 1.31 1.57 -0.22 0.00 -2.93 0.00 0.00 61.98 61.71 2nef s VAL 70 Cb -1.14 -4.09 0.00 0.00 -1.53 0.00 0.00 36.38 29.63 2nef s VAL 70 CO 0.49 0.34 0.69 0.42 -3.33 0.00 0.00 175.10 173.71 2nef s THR 71 N 0.16 4.83 0.00 5.04 -4.23 -1.20 -5.05 115.64 115.19 2nef s THR 71 Ca 0.38 0.74 0.00 0.00 -1.18 0.00 0.00 61.69 61.63 2nef s THR 71 Cb -0.20 -4.12 0.00 0.00 1.34 0.00 0.00 72.50 69.52 2nef s THR 71 CO 0.21 -0.34 0.00 -0.81 -0.54 0.00 0.00 174.62 173.15 2nef n PRO 72 N 6.17 0.91 -1.51 3.99 -0.04 -1.26 -3.66 135.00 139.60 2nef n PRO 72 Ca 0.01 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.13 2nef n PRO 72 Cb 0.48 0.00 -0.15 0.00 -0.04 0.00 0.00 33.50 33.79 2nef n PRO 72 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2nef n GLN 73 N -0.09 0.15 -3.19 0.54 3.00 -1.26 -4.77 117.38 111.77 2nef n GLN 73 Ca 0.00 -0.06 -0.30 0.00 -0.01 0.00 0.00 57.00 56.64 2nef n GLN 73 Cb 0.00 -1.72 -0.04 0.00 0.00 0.00 0.00 30.24 28.48 2nef n GLN 73 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.06 177.20 2nef s VAL 74 N 7.13 4.92 -0.34 5.09 -7.23 -1.26 -4.93 120.40 123.77 2nef s VAL 74 Ca 1.28 0.34 -0.32 0.00 -1.81 0.00 0.00 61.98 61.47 2nef s VAL 74 Cb -0.94 -3.71 -0.14 0.00 0.56 0.00 0.00 36.38 32.15 2nef s VAL 74 CO 0.46 -0.34 1.21 -2.65 -0.31 0.00 0.00 175.10 173.47 2nef n PRO 75 N -0.90 0.00 -1.58 4.82 -0.02 -1.26 -4.66 135.00 131.40 2nef n PRO 75 Ca 0.00 0.00 -0.32 0.00 -2.02 0.00 0.00 63.50 61.16 2nef n PRO 75 Cb 0.54 -1.03 -0.04 0.00 -0.02 0.00 0.00 33.50 32.95 2nef n PRO 75 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2nef s LEU 76 N 2.66 3.30 0.41 2.45 1.43 -1.26 -4.94 118.68 122.73 2nef s LEU 76 Ca 0.75 0.86 -0.15 0.00 -1.03 0.00 0.00 54.13 54.57 2nef s LEU 76 Cb -1.03 -2.51 -0.08 0.00 0.03 0.00 0.00 46.19 42.59 2nef s LEU 76 CO 0.53 -3.06 0.83 -0.13 0.23 0.00 0.00 176.35 174.76 2nef s ARG 77 N 8.35 3.96 -0.05 1.70 1.81 -1.26 -5.02 118.95 128.44 2nef s ARG 77 Ca 0.96 0.74 -0.30 0.00 -1.72 0.00 0.00 55.73 55.41 2nef s ARG 77 Cb -0.16 -2.31 -0.03 0.00 -0.45 0.00 0.00 34.95 31.99 2nef s ARG 77 CO 0.22 -0.02 1.17 -1.25 -0.68 0.00 0.00 175.30 174.74 2nef s PRO 78 N -3.51 4.37 -0.00 3.54 0.04 -1.26 -4.82 135.00 133.36 2nef s PRO 78 Ca 0.56 1.64 -0.30 0.00 0.04 0.00 0.00 61.00 62.94 2nef s PRO 78 Cb -0.10 -3.53 -0.07 0.00 0.04 0.00 0.00 34.50 30.84 2nef s PRO 78 CO 0.24 -0.40 1.63 1.41 0.04 0.00 0.00 177.00 179.92 2nef s MET 79 N 2.04 4.20 0.14 4.56 1.75 -1.26 -4.98 119.30 125.75 2nef s MET 79 Ca 0.55 2.22 -0.13 0.00 -1.25 0.00 0.00 55.69 57.08 2nef s MET 79 Cb -0.24 -3.81 -0.07 0.00 2.84 0.00 0.00 34.83 33.55 2nef s MET 79 CO 0.22 -0.78 0.52 0.95 -0.65 0.00 0.00 175.02 175.29 2nef s THR 80 N 3.38 4.90 0.27 10.11 -4.23 -1.26 -4.91 115.64 123.91 2nef s THR 80 Ca 0.73 0.74 0.01 0.00 -1.18 0.00 0.00 61.69 61.98 2nef s THR 80 Cb -0.36 -3.71 0.26 0.00 1.34 0.00 0.00 72.50 70.03 2nef s THR 80 CO 0.30 0.23 1.75 0.22 -0.54 0.00 0.00 174.62 176.58 2nef h TYR 81 N 3.52 0.76 -0.18 3.99 3.20 -1.93 2.26 116.97 128.58 2nef h TYR 81 Ca -0.49 0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.39 2nef h TYR 81 Cb 1.19 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 39.25 2nef h TYR 81 CO 0.65 0.13 -0.03 -0.22 -1.64 0.00 0.00 178.16 177.05 2nef h LYS 82 N 0.58 0.27 -0.12 1.82 3.64 -1.95 -1.79 116.57 119.02 2nef h LYS 82 Ca 0.49 -0.05 -0.10 0.00 -1.27 0.00 0.00 60.65 59.73 2nef h LYS 82 Cb 0.76 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.53 2nef h LYS 82 CO -0.40 0.32 -0.37 0.00 -2.27 0.00 0.00 179.45 176.73 2nef h ALA 83 N 1.71 1.15 0.43 5.00 0.00 0.33 -1.59 119.26 126.30 2nef h ALA 83 Ca 0.06 -0.39 -0.02 0.00 0.00 0.00 0.00 54.91 54.56 2nef h ALA 83 Cb 0.23 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2nef h ALA 83 CO 0.01 0.56 -0.21 0.00 0.00 0.00 0.00 179.25 179.61 2nef h ALA 84 N 1.40 -0.58 -0.40 0.00 0.00 -0.17 0.15 119.26 119.66 2nef h ALA 84 Ca 0.02 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 2nef h ALA 84 Cb 0.76 0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 2nef h ALA 84 CO 0.06 -0.75 0.10 0.28 0.00 0.00 0.00 179.25 178.94 2nef h VAL 85 N -0.74 1.23 -0.65 0.00 2.07 -1.52 -0.75 116.25 115.88 2nef h VAL 85 Ca -0.06 -0.77 0.01 0.00 0.82 0.00 0.00 66.70 66.70 2nef h VAL 85 Cb 0.52 0.96 -0.03 0.00 -1.52 0.00 0.00 31.29 31.22 2nef h VAL 85 CO 0.10 0.27 0.43 0.44 0.02 0.00 0.00 177.57 178.82 2nef h ASP 86 N 0.51 0.74 -0.86 0.57 5.19 -1.26 -1.43 116.42 119.87 2nef h ASP 86 Ca 0.13 -0.02 -0.01 0.00 -0.62 0.00 0.00 57.03 56.51 2nef h ASP 86 Cb 0.30 -0.18 -0.04 0.00 0.18 0.00 0.00 39.33 39.58 2nef h ASP 86 CO -0.00 0.53 0.52 0.25 -3.12 0.00 0.00 179.24 177.42 2nef h LEU 87 N 0.87 1.04 -0.27 1.55 5.85 -0.37 -1.27 115.31 122.72 2nef h LEU 87 Ca 0.24 -0.06 0.06 0.00 0.84 0.00 0.00 57.88 58.96 2nef h LEU 87 Cb -0.09 -0.26 -0.08 0.00 0.37 0.00 0.00 40.66 40.60 2nef h LEU 87 CO -0.06 0.80 -0.41 0.77 -0.34 0.00 0.00 178.44 179.20 2nef h SER 88 N 1.20 -1.33 0.48 1.25 4.64 -0.01 -0.20 113.55 119.58 2nef h SER 88 Ca 0.31 0.19 -0.11 0.00 -0.47 0.00 0.00 61.79 61.71 2nef h SER 88 Cb -0.05 0.57 -0.02 0.00 -0.31 0.00 0.00 62.40 62.60 2nef h SER 88 CO -0.06 -0.39 -0.52 0.45 -0.87 0.00 0.00 176.83 175.44 2nef h HIS 89 N -0.40 0.05 0.69 4.77 3.86 -1.41 -2.79 115.15 119.93 2nef h HIS 89 Ca 0.11 -0.02 -0.03 0.00 -1.16 0.00 0.00 60.37 59.27 2nef h HIS 89 Cb 0.60 -0.01 -0.00 0.00 1.06 0.00 0.00 27.41 29.05 2nef h HIS 89 CO -0.55 0.56 -0.43 0.35 0.86 0.00 0.00 177.93 178.73 2nef h PHE 90 N 0.04 -1.13 0.00 2.45 3.57 0.11 -1.46 116.94 120.51 2nef h PHE 90 Ca -0.00 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.49 2nef h PHE 90 Cb 0.94 0.40 0.00 0.00 2.79 0.00 0.00 35.95 40.08 2nef h PHE 90 CO 0.00 -0.64 0.00 -0.07 -2.23 0.00 0.00 178.31 175.37 2nef h LEU 91 N -1.05 0.00 0.00 0.59 3.38 -1.13 -2.71 115.31 114.39 2nef h LEU 91 Ca -0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2nef h LEU 91 Cb 0.85 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.60 2nef h LEU 91 CO 0.09 0.00 0.00 1.17 0.09 0.00 0.00 178.44 179.79 2nef n LYS 92 N -2.55 0.00 -0.21 1.13 4.81 -0.55 -1.94 118.16 118.85 2nef n LYS 92 Ca -0.01 0.22 -0.08 0.00 -0.87 0.00 0.00 58.31 57.57 2nef n LYS 92 Cb 0.11 -1.15 0.05 0.00 0.02 0.00 0.00 35.03 34.07 2nef n LYS 92 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 2nef h GLU 93 N 0.00 1.06 -1.98 1.64 4.39 -1.64 0.23 114.58 118.29 2nef h GLU 93 Ca 0.00 -0.31 -0.15 0.00 0.34 0.00 0.00 59.36 59.24 2nef h GLU 93 Cb 0.00 -0.11 -0.05 0.00 -0.10 0.00 0.00 28.75 28.48 2nef h GLU 93 CO 0.00 1.01 -0.16 1.63 -1.16 0.00 0.00 179.01 180.33 2nef n LYS 94 N -4.19 1.65 0.00 2.33 5.02 -1.02 -4.22 118.16 117.73 2nef n LYS 94 Ca 0.04 -0.75 0.00 0.00 -2.02 0.00 0.00 58.31 55.57 2nef n LYS 94 Cb 0.32 -1.63 0.00 0.00 -0.02 0.00 0.00 35.03 33.70 2nef n LYS 94 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2nef n GLY 95 N 1.93 0.33 3.49 0.72 0.00 -0.82 -1.08 105.19 109.75 2nef n GLY 95 Ca 0.27 -0.37 -0.13 0.00 0.00 0.00 0.00 46.02 45.79 2nef n GLY 95 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nef n GLY 96 N 0.00 -0.29 0.21 -0.02 0.00 0.79 -4.21 105.19 101.67 2nef n GLY 96 Ca 0.00 0.15 0.13 0.00 0.00 0.00 0.00 46.02 46.30 2nef n GLY 96 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2nef h LEU 97 N 19.07 0.00 -9.57 0.99 5.85 -1.76 -3.42 115.31 126.46 2nef h LEU 97 Ca 0.01 0.00 -0.58 0.00 0.84 0.00 0.00 57.88 58.14 2nef h LEU 97 Cb 1.02 0.00 0.15 0.00 0.37 0.00 0.00 40.66 42.20 2nef h LEU 97 CO 1.10 0.00 -0.14 1.21 -0.34 0.00 0.00 178.44 180.28 2nef n GLU 98 N -2.98 0.84 -0.29 1.25 0.00 -1.26 -0.89 120.64 117.30 2nef n GLU 98 Ca 0.04 0.31 0.00 0.00 0.00 0.00 0.00 57.16 57.51 2nef n GLU 98 Cb 0.49 -1.85 0.00 0.00 0.00 0.00 0.00 31.44 30.08 2nef n GLU 98 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2nef n GLY 99 N 1.52 0.00 3.55 8.31 0.00 0.19 -4.81 105.19 113.95 2nef n GLY 99 Ca 0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 2nef n GLY 99 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2nef s LEU 100 N 0.00 3.23 -0.28 0.99 1.98 -0.07 -4.75 118.68 119.77 2nef s LEU 100 Ca 0.00 -0.40 -0.34 0.00 -2.89 0.00 0.00 54.13 50.50 2nef s LEU 100 Cb 0.00 -2.55 -0.11 0.00 0.66 0.00 0.00 46.19 44.19 2nef s LEU 100 CO 0.00 -1.96 2.12 -0.38 -1.89 0.00 0.00 176.35 174.24 2nef n ILE 101 N 6.68 0.28 -1.77 6.68 2.08 -1.26 -3.54 119.36 128.50 2nef n ILE 101 Ca 0.12 -0.25 -0.42 0.00 0.56 0.00 0.00 62.75 62.75 2nef n ILE 101 Cb 0.50 -1.78 -0.03 0.00 -0.75 0.00 0.00 39.64 37.58 2nef n ILE 101 CO 0.00 0.00 0.00 -2.28 0.56 0.00 0.00 176.55 174.83 2nef s HIS 102 N 6.70 1.43 0.00 1.39 5.65 0.75 -4.84 115.29 126.37 2nef s HIS 102 Ca 1.05 0.65 0.00 0.00 0.25 0.00 0.00 55.06 57.01 2nef s HIS 102 Cb -0.77 -3.99 0.00 0.00 -1.18 0.00 0.00 32.58 26.64 2nef s HIS 102 CO 0.49 -3.48 0.07 0.43 -0.65 0.00 0.00 174.74 171.60 2nef n SER 103 N 11.43 0.00 0.00 9.88 7.64 -1.26 -3.01 113.62 138.30 2nef n SER 103 Ca 0.27 0.07 0.00 0.00 1.01 0.00 0.00 58.87 60.22 2nef n SER 103 Cb 0.46 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.66 2nef n SER 103 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2nef n GLN 104 N -0.13 3.94 0.00 1.43 1.13 -1.26 -4.12 117.38 118.37 2nef n GLN 104 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 2nef n GLN 104 Cb 0.00 -0.33 0.00 0.00 0.11 0.00 0.00 30.24 30.02 2nef n GLN 104 CO 0.00 0.00 0.00 2.89 -1.44 0.00 0.00 177.06 178.51 2nef n ARG 105 N 0.00 0.00 0.11 -1.09 1.85 -1.26 -4.82 116.66 111.45 2nef n ARG 105 Ca 0.00 -0.25 0.16 0.00 -1.00 0.00 0.00 57.85 56.76 2nef n ARG 105 Cb 0.00 -0.46 0.69 0.00 -1.05 0.00 0.00 32.46 31.64 2nef n ARG 105 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2nef h ARG 106 N 0.00 0.00 -0.56 2.89 -0.00 -1.93 0.17 114.38 114.95 2nef h ARG 106 Ca 0.00 0.00 -0.05 0.00 -0.50 0.00 0.00 59.98 59.43 2nef h ARG 106 Cb 0.77 0.00 -0.03 0.00 0.00 0.00 0.00 29.97 30.72 2nef h ARG 106 CO 0.00 0.00 0.14 0.37 0.00 0.00 0.00 179.97 180.48 2nef h GLN 107 N 0.00 0.86 0.48 0.04 4.15 -1.97 -2.60 115.11 116.07 2nef h GLN 107 Ca 0.15 -0.18 -0.01 0.00 0.77 0.00 0.00 58.65 59.37 2nef h GLN 107 Cb 0.60 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 28.15 2nef h GLN 107 CO -0.00 0.77 -0.37 -0.44 -1.93 0.00 0.00 178.83 176.86 2nef h ASP 108 N 0.83 -0.96 -0.90 -0.69 3.32 -1.03 -1.37 116.42 115.62 2nef h ASP 108 Ca 0.18 0.07 0.21 0.00 0.02 0.00 0.00 57.03 57.51 2nef h ASP 108 Cb 0.30 0.30 -0.12 0.00 0.22 0.00 0.00 39.33 40.04 2nef h ASP 108 CO -0.00 -0.54 0.41 0.40 -1.72 0.00 0.00 179.24 177.79 2nef h ILE 109 N -0.83 0.52 0.00 0.35 1.08 -1.45 0.89 117.51 118.06 2nef h ILE 109 Ca -0.05 -0.15 0.00 0.00 -0.39 0.00 0.00 64.86 64.27 2nef h ILE 109 Cb 0.71 0.03 0.00 0.00 -3.07 0.00 0.00 36.82 34.49 2nef h ILE 109 CO 0.00 0.08 0.00 -0.11 -0.69 0.00 0.00 178.15 177.43 2nef n LEU 110 N -5.01 0.00 -0.30 1.44 7.94 -0.68 0.79 117.00 121.18 2nef n LEU 110 Ca 0.22 0.77 0.06 0.00 -1.11 0.00 0.00 56.01 55.95 2nef n LEU 110 Cb 0.63 -0.27 0.22 0.00 0.53 0.00 0.00 43.42 44.52 2nef n LEU 110 CO 0.14 -0.27 1.12 0.44 -1.11 0.00 0.00 177.39 177.72 2nef h ASP 111 N 0.00 0.59 0.60 1.96 3.32 -1.03 -2.44 116.42 119.43 2nef h ASP 111 Ca 0.00 0.08 -0.03 0.00 0.02 0.00 0.00 57.03 57.10 2nef h ASP 111 Cb 0.00 -0.02 0.01 0.00 0.22 0.00 0.00 39.33 39.53 2nef h ASP 111 CO 0.00 0.27 -0.29 0.25 -1.72 0.00 0.00 179.24 177.75 2nef h LEU 112 N 0.68 -0.69 -0.91 1.55 6.46 0.84 -2.60 115.31 120.65 2nef h LEU 112 Ca 0.45 -0.03 0.25 0.00 -0.12 0.00 0.00 57.88 58.44 2nef h LEU 112 Cb 0.59 0.18 -0.14 0.00 -0.73 0.00 0.00 40.66 40.55 2nef h LEU 112 CO -0.33 -0.37 0.31 -0.25 -0.62 0.00 0.00 178.44 177.18 2nef h TRP 113 N -1.01 0.48 -0.66 1.25 7.01 0.71 1.04 115.95 124.77 2nef h TRP 113 Ca -0.08 0.05 -0.01 0.00 2.11 0.00 0.00 58.89 60.96 2nef h TRP 113 Cb 0.67 -0.06 -0.03 0.00 -2.10 0.00 0.00 29.16 27.64 2nef h TRP 113 CO -0.00 -0.20 0.38 0.82 -2.79 0.00 0.00 178.44 176.65 2nef h ILE 114 N 0.24 1.19 0.60 2.65 2.04 -1.30 -2.78 117.51 120.15 2nef h ILE 114 Ca 0.59 -0.46 -0.03 0.00 1.00 0.00 0.00 64.86 65.96 2nef h ILE 114 Cb 1.22 0.28 0.01 0.00 -0.74 0.00 0.00 36.82 37.59 2nef h ILE 114 CO -0.64 0.21 -0.29 0.22 0.00 0.00 0.00 178.15 177.65 2nef h TYR 115 N 0.91 -0.75 0.00 1.37 3.20 0.15 0.67 116.97 122.52 2nef h TYR 115 Ca 0.24 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.09 2nef h TYR 115 Cb -0.00 0.25 0.00 0.00 1.54 0.00 0.00 36.73 38.51 2nef h TYR 115 CO 0.00 -0.46 0.00 0.72 -1.64 0.00 0.00 178.16 176.78 2nef n HIS 116 N -4.75 0.00 0.00 -3.82 8.25 -0.81 -1.79 115.22 112.29 2nef n HIS 116 Ca -0.10 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.36 2nef n HIS 116 Cb 0.32 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.43 2nef n HIS 116 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2nef n THR 117 N -0.60 0.00 0.75 1.59 -2.24 -1.03 -3.27 114.28 109.48 2nef n THR 117 Ca 0.01 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.92 2nef n THR 117 Cb 0.00 -0.26 0.42 0.00 -2.10 0.00 0.00 70.33 68.39 2nef n THR 117 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2nef n GLN 118 N -0.75 0.17 -1.25 -0.78 6.02 0.02 -4.80 117.38 116.02 2nef n GLN 118 Ca 0.00 0.12 -0.08 0.00 -0.01 0.00 0.00 57.00 57.03 2nef n GLN 118 Cb 0.00 -1.68 -0.04 0.00 1.02 0.00 0.00 30.24 29.54 2nef n GLN 118 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2nef n GLY 119 N 1.38 0.95 3.73 1.08 0.00 -0.04 -4.68 105.19 107.62 2nef n GLY 119 Ca 0.06 -0.23 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 2nef n GLY 119 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2nef s TYR 120 N -2.06 3.39 0.07 1.61 2.02 -1.25 -4.67 117.35 116.47 2nef s TYR 120 Ca 0.00 1.36 -0.31 0.00 -0.37 0.00 0.00 57.07 57.75 2nef s TYR 120 Cb 0.00 -3.47 -0.06 0.00 -0.40 0.00 0.00 41.96 38.03 2nef s TYR 120 CO 0.00 -1.39 1.20 0.12 -1.57 0.00 0.00 175.55 173.92 2nef s PHE 121 N 0.12 3.44 0.00 2.71 2.19 -1.26 -4.47 117.98 120.71 2nef s PHE 121 Ca 0.55 1.30 -0.01 0.00 0.33 0.00 0.00 56.93 59.10 2nef s PHE 121 Cb -0.33 -3.43 -0.04 0.00 -1.31 0.00 0.00 43.02 37.91 2nef s PHE 121 CO 0.36 -1.29 1.67 -0.35 1.83 0.00 0.00 175.22 177.43 2nef n PRO 122 N 3.79 0.84 -0.50 10.12 -0.04 -1.26 -4.25 135.00 143.71 2nef n PRO 122 Ca 0.09 -0.16 -0.01 0.00 -0.04 0.00 0.00 63.50 63.38 2nef n PRO 122 Cb 0.46 -1.32 0.17 0.00 -0.04 0.00 0.00 33.50 32.78 2nef n PRO 122 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2nef n ASP 123 N 1.89 3.40 0.00 3.54 5.75 -1.26 -3.59 116.55 126.28 2nef n ASP 123 Ca 0.07 -2.56 0.00 0.00 -0.01 0.00 0.00 54.79 52.29 2nef n ASP 123 Cb 0.41 -0.62 0.00 0.00 -1.03 0.00 0.00 41.12 39.88 2nef n ASP 123 CO 0.00 0.00 0.00 -2.67 -0.11 0.00 0.00 177.20 174.42 2nef n TRP 124 N 0.14 0.00 -1.48 2.11 4.27 -1.26 -4.87 117.44 116.35 2nef n TRP 124 Ca 0.18 0.00 -0.43 0.00 -3.89 0.00 0.00 57.50 53.37 2nef n TRP 124 Cb 0.83 0.00 -0.02 0.00 -1.36 0.00 0.00 31.31 30.75 2nef n TRP 124 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2nef n GLN 125 N -1.03 2.27 -3.94 -2.67 -0.00 -1.24 -4.54 117.38 106.24 2nef n GLN 125 Ca 0.00 -2.28 -0.22 0.00 -0.00 0.00 0.00 57.00 54.51 2nef n GLN 125 Cb 0.00 -3.13 -0.05 0.00 -0.00 0.00 0.00 30.24 27.06 2nef n GLN 125 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.06 176.26 2nef s ASN 126 N 3.98 5.11 0.03 2.61 -0.87 -1.26 -5.07 114.94 119.46 2nef s ASN 126 Ca 0.51 -0.56 -0.27 0.00 -1.57 0.00 0.00 52.86 50.97 2nef s ASN 126 Cb 0.14 -0.93 0.08 0.00 -0.02 0.00 0.00 41.25 40.52 2nef s ASN 126 CO -0.00 -0.30 0.71 -0.31 -2.57 0.00 0.00 177.10 174.63 2nef s TYR 127 N -2.33 -0.54 0.09 2.20 1.51 -1.26 -2.96 117.35 114.07 2nef s TYR 127 Ca 0.39 0.61 -0.31 0.00 -1.01 0.00 0.00 57.07 56.75 2nef s TYR 127 Cb -0.05 0.50 -0.08 0.00 -0.11 0.00 0.00 41.96 42.21 2nef s TYR 127 CO 0.25 -0.67 1.55 0.95 -1.11 0.00 0.00 175.55 176.52 2nef s THR 128 N -2.54 3.09 -1.20 -0.71 -4.23 -0.88 -4.85 115.64 104.33 2nef s THR 128 Ca -0.03 0.64 -0.15 0.00 -1.18 0.00 0.00 61.69 60.98 2nef s THR 128 Cb -0.01 -3.41 0.16 0.00 1.34 0.00 0.00 72.50 70.58 2nef s THR 128 CO -0.03 0.02 1.46 -2.16 -0.54 0.00 0.00 174.62 173.36 2nef s PRO 129 N 2.03 4.05 0.00 3.99 0.04 -1.26 -4.60 135.00 139.26 2nef s PRO 129 Ca 0.70 -2.46 0.00 0.00 0.04 0.00 0.00 61.00 59.28 2nef s PRO 129 Cb -0.39 -5.12 0.00 0.00 0.04 0.00 0.00 34.50 29.04 2nef s PRO 129 CO 0.31 -1.83 0.00 0.41 0.04 0.00 0.00 177.00 175.93 2nef n GLY 130 N 4.35 -2.25 3.77 0.56 0.00 -1.26 -5.15 105.19 105.22 2nef n GLY 130 Ca 0.37 0.72 -0.31 0.00 0.00 0.00 0.00 46.02 46.80 2nef n GLY 130 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2nef s PRO 131 N 0.00 2.43 0.03 1.61 0.04 -1.26 -4.99 135.00 132.86 2nef s PRO 131 Ca 0.00 1.18 -0.20 0.00 0.04 0.00 0.00 61.00 62.02 2nef s PRO 131 Cb 0.00 -1.92 -0.11 0.00 0.04 0.00 0.00 34.50 32.51 2nef s PRO 131 CO 0.00 -1.51 1.26 0.78 0.04 0.00 0.00 177.00 177.57 2nef h GLY 132 N -0.88 -0.75 -7.27 0.56 0.00 -1.95 -3.36 103.07 89.42 2nef h GLY 132 Ca -0.44 0.28 -0.23 0.00 0.00 0.00 0.00 47.33 46.94 2nef h GLY 132 CO 0.52 -0.27 1.00 1.39 0.00 0.00 0.00 176.54 179.18 2nef n ILE 133 N -3.99 -0.02 -2.38 2.60 2.08 -1.26 -4.55 119.36 111.84 2nef n ILE 133 Ca -0.09 -0.51 -0.42 0.00 0.56 0.00 0.00 62.75 62.29 2nef n ILE 133 Cb 0.28 -1.51 -0.02 0.00 -0.75 0.00 0.00 39.64 37.64 2nef n ILE 133 CO 0.00 0.00 0.00 -0.60 0.56 0.00 0.00 176.55 176.51 2nef s ARG 134 N 8.35 3.49 0.14 0.38 3.52 -1.04 -4.96 118.95 128.82 2nef s ARG 134 Ca 1.08 0.75 -0.24 0.00 -0.13 0.00 0.00 55.73 57.19 2nef s ARG 134 Cb -0.43 -4.05 -0.08 0.00 -1.56 0.00 0.00 34.95 28.83 2nef s ARG 134 CO 0.28 -1.69 0.74 0.71 -0.81 0.00 0.00 175.30 174.53 2nef s TYR 135 N 5.61 3.88 -0.15 5.12 1.51 -1.26 -2.94 117.35 129.11 2nef s TYR 135 Ca 0.58 1.55 -0.29 0.00 -1.01 0.00 0.00 57.07 57.90 2nef s TYR 135 Cb -0.12 -2.72 -0.01 0.00 -0.11 0.00 0.00 41.96 39.00 2nef s TYR 135 CO 0.30 0.51 1.21 -1.25 -1.11 0.00 0.00 175.55 175.22 2nef s PRO 136 N -1.06 4.26 0.22 -1.71 0.04 -1.26 -2.07 135.00 133.42 2nef s PRO 136 Ca 0.35 1.62 -0.08 0.00 0.04 0.00 0.00 61.00 62.92 2nef s PRO 136 Cb -0.22 -3.70 0.18 0.00 0.04 0.00 0.00 34.50 30.79 2nef s PRO 136 CO 0.25 -0.64 1.82 -0.07 0.04 0.00 0.00 177.00 178.40 2nef h LEU 137 N 9.35 1.08-10.18 -3.56 3.38 -1.86 -3.43 115.31 110.09 2nef h LEU 137 Ca -0.27 -0.12 -0.52 0.00 0.09 0.00 0.00 57.88 57.06 2nef h LEU 137 Cb 1.11 -0.28 0.12 0.00 0.09 0.00 0.00 40.66 41.70 2nef h LEU 137 CO 0.95 0.89 0.39 0.42 0.09 0.00 0.00 178.44 181.18 2nef s THR 138 N -5.75 2.90 0.11 0.22 -4.23 -1.26 -4.68 115.64 102.94 2nef s THR 138 Ca -0.13 0.44 -0.01 0.00 -1.18 0.00 0.00 61.69 60.81 2nef s THR 138 Cb 0.16 -2.98 -0.04 0.00 1.34 0.00 0.00 72.50 70.97 2nef s THR 138 CO 0.83 -0.24 0.29 0.12 -0.54 0.00 0.00 174.62 175.08 2nef s PHE 139 N -2.16 3.50 0.00 3.99 2.19 -1.26 -4.37 117.98 119.87 2nef s PHE 139 Ca 0.70 0.34 0.00 0.00 0.33 0.00 0.00 56.93 58.30 2nef s PHE 139 Cb -0.24 -1.83 0.00 0.00 -1.31 0.00 0.00 43.02 39.64 2nef s PHE 139 CO 0.41 0.51 0.00 0.41 1.83 0.00 0.00 175.22 178.38 2nef n GLY 140 N 0.02 2.76 3.55 13.12 0.00 -1.26 -4.89 105.19 118.49 2nef n GLY 140 Ca -0.04 -0.20 -0.37 0.00 0.00 0.00 0.00 46.02 45.40 2nef n GLY 140 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2nef s TRP 141 N -1.71 1.94 -0.22 1.61 -0.00 -1.26 -3.66 118.94 115.65 2nef s TRP 141 Ca 0.00 0.36 -0.04 0.00 -0.00 0.00 0.00 56.10 56.42 2nef s TRP 141 Cb 0.00 -4.29 -0.07 0.00 -0.00 0.00 0.00 33.47 29.11 2nef s TRP 141 CO 0.00 -2.11 3.00 0.00 -0.00 0.00 0.00 176.95 177.84 2nef s TYR 143 N -0.46 3.00 -0.23 0.00 2.02 -1.26 -1.75 117.35 118.68 2nef s TYR 143 Ca 0.55 -2.58 -0.13 0.00 -0.37 0.00 0.00 57.07 54.54 2nef s TYR 143 Cb 0.31 -2.49 -0.04 0.00 -0.40 0.00 0.00 41.96 39.34 2nef s TYR 143 CO -0.09 -0.91 0.27 0.15 -1.57 0.00 0.00 175.55 173.40 2nef s LYS 144 N 1.06 4.11 0.64 -0.62 1.02 -0.95 -4.68 119.74 120.30 2nef s LYS 144 Ca 0.11 -0.06 -0.13 0.00 0.02 0.00 0.00 55.97 55.92 2nef s LYS 144 Cb -0.19 -3.55 -0.02 0.00 -0.52 0.00 0.00 37.83 33.55 2nef s LYS 144 CO -0.13 -0.01 1.04 -0.51 -0.92 0.00 0.00 175.35 174.83 2nef s LEU 145 N 1.24 3.29 -0.27 3.17 1.43 -1.15 -0.04 118.68 126.34 2nef s LEU 145 Ca 0.13 1.61 -0.14 0.00 -1.03 0.00 0.00 54.13 54.70 2nef s LEU 145 Cb -0.14 -4.50 0.09 0.00 0.03 0.00 0.00 46.19 41.67 2nef s LEU 145 CO 0.06 -1.15 0.65 -0.69 0.23 0.00 0.00 176.35 175.45 2nef s VAL 146 N -2.91 -0.29 0.78 -1.59 1.01 -0.85 -2.50 120.40 114.05 2nef s VAL 146 Ca 0.59 0.01 -0.12 0.00 0.00 0.00 0.00 61.98 62.46 2nef s VAL 146 Cb -0.13 -0.96 0.06 0.00 0.00 0.00 0.00 36.38 35.35 2nef s VAL 146 CO 0.48 0.01 1.11 -2.16 0.00 0.00 0.00 175.10 174.54 2nef s PRO 147 N 1.99 2.24 -0.04 2.72 0.04 -1.26 -1.19 135.00 139.50 2nef s PRO 147 Ca -0.09 0.45 0.01 0.00 0.04 0.00 0.00 61.00 61.41 2nef s PRO 147 Cb -0.07 -1.95 0.09 0.00 0.04 0.00 0.00 34.50 32.60 2nef s PRO 147 CO -0.19 -1.47 0.89 0.28 0.04 0.00 0.00 177.00 176.55 2nef n VAL 148 N -3.30 0.82 -2.90 -0.36 0.31 -1.24 -4.16 118.33 107.50 2nef n VAL 148 Ca 0.07 -0.19 -0.11 0.00 -0.01 0.00 0.00 64.34 64.10 2nef n VAL 148 Cb 0.58 -0.72 -0.00 0.00 -0.91 0.00 0.00 33.84 32.78 2nef n VAL 148 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2nef n GLU 149 N 0.20 0.58 -0.01 5.55 1.02 -1.26 -4.97 120.64 121.74 2nef n GLU 149 Ca 0.05 -2.25 0.05 0.00 -0.02 0.00 0.00 57.16 55.00 2nef n GLU 149 Cb 0.51 -1.47 0.28 0.00 -0.02 0.00 0.00 31.44 30.73 2nef n GLU 149 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 2nef n PRO 150 N 2.34 1.07 -1.66 3.49 -0.04 -1.26 -4.82 135.00 134.11 2nef n PRO 150 Ca 0.17 -0.11 -0.40 0.00 -0.04 0.00 0.00 63.50 63.13 2nef n PRO 150 Cb 0.57 -1.16 -0.03 0.00 -0.04 0.00 0.00 33.50 32.83 2nef n PRO 150 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2nef s GLU 151 N -1.97 2.65 0.00 0.54 8.01 -1.26 -4.78 118.70 121.89 2nef s GLU 151 Ca 0.15 1.57 0.08 0.00 0.01 0.00 0.00 54.97 56.78 2nef s GLU 151 Cb 0.07 -4.45 0.29 0.00 -4.31 0.00 0.00 34.13 25.73 2nef s GLU 151 CO 0.12 -2.66 1.22 1.17 0.01 0.00 0.00 175.26 175.12 2nef n LYS 152 N 8.88 1.43 -2.07 1.61 4.81 -1.26 -4.88 118.16 126.69 2nef n LYS 152 Ca 0.31 -0.67 -0.27 0.00 -0.87 0.00 0.00 58.31 56.81 2nef n LYS 152 Cb 0.50 -1.18 0.09 0.00 0.02 0.00 0.00 35.03 34.46 2nef n LYS 152 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2nef s LEU 153 N -1.09 2.68 -0.37 3.14 1.43 -1.26 -4.99 118.68 118.22 2nef s LEU 153 Ca 0.16 0.56 -0.29 0.00 -1.03 0.00 0.00 54.13 53.53 2nef s LEU 153 Cb 0.08 -3.10 0.01 0.00 0.03 0.00 0.00 46.19 43.21 2nef s LEU 153 CO 0.11 -1.80 1.26 -0.70 0.23 0.00 0.00 176.35 175.44 2nef s GLU 154 N -5.42 3.82 -0.43 1.70 2.12 -1.26 -4.96 118.70 114.26 2nef s GLU 154 Ca 0.62 1.01 -0.29 0.00 0.36 0.00 0.00 54.97 56.67 2nef s GLU 154 Cb -0.10 -3.90 0.01 0.00 0.26 0.00 0.00 34.13 30.40 2nef s GLU 154 CO 0.47 -1.24 1.42 -1.21 -0.54 0.00 0.00 175.26 174.15 2nef s GLU 155 N 4.32 3.53 0.48 4.30 2.02 -1.26 -4.83 118.70 127.26 2nef s GLU 155 Ca 0.54 0.87 0.24 0.00 0.02 0.00 0.00 54.97 56.64 2nef s GLU 155 Cb -0.13 -4.04 1.30 0.00 0.10 0.00 0.00 34.13 31.35 2nef s GLU 155 CO 0.26 -1.62 1.69 0.00 0.02 0.00 0.00 175.26 175.61 2nef h ALA 156 N 10.79 1.19 -3.00 5.21 0.00 -2.01 -3.41 119.26 128.03 2nef h ALA 156 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2nef h ALA 156 Cb 1.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2nef h ALA 156 CO 1.10 -0.19 0.00 0.09 0.00 0.00 0.00 179.25 180.25 2nef n ASN 157 N -2.49 -1.10 -2.09 0.00 3.02 -1.26 -5.00 115.26 106.34 2nef n ASN 157 Ca -0.02 -0.02 -0.01 0.00 -0.03 0.00 0.00 54.58 54.51 2nef n ASN 157 Cb 0.27 0.00 0.04 0.00 -0.61 0.00 0.00 39.78 39.47 2nef n ASN 157 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 2nef n LYS 158 N -1.11 0.86 -4.03 3.52 2.85 -1.26 -5.11 118.16 113.87 2nef n LYS 158 Ca 0.00 -2.08 -0.11 0.00 -1.05 0.00 0.00 58.31 55.07 2nef n LYS 158 Cb 0.00 -0.29 -0.04 0.00 -0.65 0.00 0.00 35.03 34.04 2nef n LYS 158 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 2nef s ASP 174 N -2.15 0.30 -0.01 -5.58 1.01 -1.26 -5.18 116.67 103.80 2nef s ASP 174 Ca 0.19 -1.18 -0.23 0.00 0.71 0.00 0.00 52.55 52.04 2nef s ASP 174 Cb 0.31 0.63 0.05 0.00 1.01 0.00 0.00 42.92 44.91 2nef s ASP 174 CO -0.09 -1.23 0.52 -1.81 0.21 0.00 0.00 175.17 172.77 2nef s ASP 175 N -3.11 -0.45 -0.45 0.27 1.01 -1.26 -5.11 116.67 107.57 2nef s ASP 175 Ca 0.26 0.35 -0.28 0.00 0.71 0.00 0.00 52.55 53.59 2nef s ASP 175 Cb -0.00 0.46 -0.01 0.00 1.01 0.00 0.00 42.92 44.37 2nef s ASP 175 CO 0.14 -0.60 1.64 -2.16 0.21 0.00 0.00 175.17 174.40 2nef s PRO 176 N -1.64 3.25 0.00 8.23 0.04 -1.26 -4.83 135.00 138.79 2nef s PRO 176 Ca -0.10 0.97 0.25 0.00 0.04 0.00 0.00 61.00 62.16 2nef s PRO 176 Cb -0.02 -4.18 1.15 0.00 0.04 0.00 0.00 34.50 31.50 2nef s PRO 176 CO 0.05 -1.97 1.82 -1.91 0.04 0.00 0.00 177.00 175.03 2nef n GLU 177 N 8.53 0.15 -2.75 4.56 2.13 -1.26 -4.74 120.64 127.26 2nef n GLU 177 Ca 0.19 0.06 -0.41 0.00 0.66 0.00 0.00 57.16 57.66 2nef n GLU 177 Cb 0.49 -1.50 -0.04 0.00 0.27 0.00 0.00 31.44 30.65 2nef n GLU 177 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 2nef s ARG 178 N -2.83 4.65 -1.22 5.31 1.81 -1.26 -4.93 118.95 120.48 2nef s ARG 178 Ca 0.17 1.40 -0.18 0.00 -1.72 0.00 0.00 55.73 55.40 2nef s ARG 178 Cb 0.17 -3.39 -0.02 0.00 -0.45 0.00 0.00 34.95 31.25 2nef s ARG 178 CO 0.43 0.17 2.00 0.39 -0.68 0.00 0.00 175.30 177.61 2nef n GLU 179 N 3.01 2.43 -2.84 3.54 4.71 -1.26 -4.83 120.64 125.41 2nef n GLU 179 Ca 0.03 -2.55 -0.44 0.00 -0.01 0.00 0.00 57.16 54.19 2nef n GLU 179 Cb 0.50 -3.30 0.00 0.00 -1.01 0.00 0.00 31.44 27.62 2nef n GLU 179 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 2nef n VAL 180 N 5.98 4.35 -4.90 2.62 0.31 -1.25 -4.27 118.33 121.17 2nef n VAL 180 Ca 0.50 -4.76 -0.33 0.00 -0.01 0.00 0.00 64.34 59.74 2nef n VAL 180 Cb 0.42 -2.43 -0.15 0.00 -0.91 0.00 0.00 33.84 30.77 2nef n VAL 180 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2nef s LEU 181 N 0.69 2.58 -0.14 7.52 1.43 -1.16 -3.67 118.68 125.92 2nef s LEU 181 Ca 0.40 -0.35 -0.08 0.00 -1.03 0.00 0.00 54.13 53.08 2nef s LEU 181 Cb -0.00 -1.55 -0.04 0.00 0.03 0.00 0.00 46.19 44.62 2nef s LEU 181 CO -0.00 0.21 0.14 -1.83 0.23 0.00 0.00 176.35 175.10 2nef s GLU 182 N 0.08 3.67 -0.28 1.70 -1.05 -0.33 0.27 118.70 122.76 2nef s GLU 182 Ca -0.07 -0.14 -0.29 0.00 -0.15 0.00 0.00 54.97 54.32 2nef s GLU 182 Cb -0.15 -3.26 -0.00 0.00 -0.44 0.00 0.00 34.13 30.28 2nef s GLU 182 CO 0.05 0.64 1.33 -1.58 0.95 0.00 0.00 175.26 176.65 2nef s TRP 183 N -0.62 2.64 -0.54 4.83 0.51 -1.23 -2.00 118.94 122.52 2nef s TRP 183 Ca 0.13 0.85 -0.19 0.00 -2.12 0.00 0.00 56.10 54.77 2nef s TRP 183 Cb -0.12 -3.87 0.08 0.00 -0.81 0.00 0.00 33.47 28.74 2nef s TRP 183 CO 0.02 -1.85 0.66 0.50 -0.51 0.00 0.00 176.95 175.77 2nef s ARG 184 N 4.15 3.09 0.21 4.98 6.06 0.94 0.53 118.95 138.91 2nef s ARG 184 Ca 0.58 -1.06 -0.30 0.00 -2.50 0.00 0.00 55.73 52.44 2nef s ARG 184 Cb -0.18 -4.17 -0.09 0.00 0.06 0.00 0.00 34.95 30.57 2nef s ARG 184 CO 0.23 -1.35 1.38 0.12 -2.50 0.00 0.00 175.30 173.18 2nef s PHE 185 N 2.66 3.16 -0.41 5.12 2.19 -1.26 -2.24 117.98 127.19 2nef s PHE 185 Ca 0.14 1.08 0.09 0.00 0.33 0.00 0.00 56.93 58.57 2nef s PHE 185 Cb -0.21 -3.71 0.36 0.00 -1.31 0.00 0.00 43.02 38.15 2nef s PHE 185 CO 0.10 -2.32 1.11 -3.47 1.83 0.00 0.00 175.22 172.47 2nef n ASP 186 N 2.74 -1.25 -0.06 6.13 2.03 -0.72 -4.98 116.55 120.45 2nef n ASP 186 Ca 0.07 -3.10 0.17 0.00 0.52 0.00 0.00 54.79 52.46 2nef n ASP 186 Cb 0.41 0.95 0.26 0.00 -0.72 0.00 0.00 41.12 42.03 2nef n ASP 186 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 2nef n SER 187 N 0.00 0.00 0.17 1.67 2.88 -1.26 0.13 113.62 117.22 2nef n SER 187 Ca 0.07 0.57 0.12 0.00 -1.33 0.00 0.00 58.87 58.29 2nef n SER 187 Cb 0.75 -0.16 0.61 0.00 -0.75 0.00 0.00 64.21 64.67 2nef n SER 187 CO 0.00 0.00 0.00 0.08 -1.23 0.00 0.00 175.04 173.89 2nef h ARG 188 N 0.00 0.00 0.00 -1.46 0.11 -1.93 -0.31 114.38 110.79 2nef h ARG 188 Ca 0.30 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.38 2nef h ARG 188 Cb 2.21 0.00 0.00 0.00 1.11 0.00 0.00 29.97 33.29 2nef h ARG 188 CO -0.00 0.00 0.00 -0.11 0.10 0.00 0.00 179.97 179.96 2nef n LEU 189 N -2.31 0.00 0.00 0.08 -0.00 0.36 -2.22 117.00 112.91 2nef n LEU 189 Ca -0.01 0.00 0.13 0.00 -0.00 0.00 0.00 56.01 56.13 2nef n LEU 189 Cb 0.06 0.00 0.74 0.00 -0.00 0.00 0.00 43.42 44.22 2nef n LEU 189 CO 0.11 0.00 0.96 0.00 -0.00 0.00 0.00 177.39 178.46 2nef n ALA 190 N -0.90 2.42 -1.18 1.96 0.00 -0.13 -3.64 120.51 119.04 2nef n ALA 190 Ca 0.04 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.33 2nef n ALA 190 Cb 0.02 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.04 2nef n ALA 190 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 2nef n PHE 191 N -1.11 0.00 0.00 0.00 1.16 -0.94 -4.94 117.46 111.63 2nef n PHE 191 Ca 0.17 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.75 2nef n PHE 191 Cb 0.13 0.01 0.00 0.00 -1.61 0.00 0.00 39.48 38.02 2nef n PHE 191 CO 0.00 0.00 0.00 -2.39 -1.87 0.00 0.00 176.76 172.50 2nef n HIS 192 N 0.00 -0.16 -1.50 2.97 1.44 -1.24 -5.04 115.22 111.70 2nef n HIS 192 Ca 0.00 0.00 -0.01 0.00 -2.01 0.00 0.00 57.72 55.70 2nef n HIS 192 Cb 0.51 0.00 -0.01 0.00 0.12 0.00 0.00 29.99 30.61 2nef n HIS 192 CO 0.00 0.00 0.00 -2.39 -2.81 0.00 0.00 176.34 171.14 2nef n HIS 193 N -0.16 0.00 -0.01 -1.40 1.44 -1.26 -5.02 115.22 108.81 2nef n HIS 193 Ca 0.00 -0.08 -0.00 0.00 -2.01 0.00 0.00 57.72 55.63 2nef n HIS 193 Cb 0.00 0.27 -0.00 0.00 0.12 0.00 0.00 29.99 30.38 2nef n HIS 193 CO 0.00 0.00 0.00 0.52 -2.81 0.00 0.00 176.34 174.05 2nef h MET 194 N 0.00 0.00 -1.20 -1.40 2.86 -1.97 -2.17 114.93 111.05 2nef h MET 194 Ca -0.09 0.00 0.34 0.00 -2.06 0.00 0.00 59.70 57.89 2nef h MET 194 Cb 0.56 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 32.17 2nef h MET 194 CO -0.05 0.00 0.85 0.00 1.06 0.00 0.00 176.91 178.77 2nef h ALA 195 N -1.87 3.04 0.06 6.32 0.00 -1.92 0.34 119.26 125.23 2nef h ALA 195 Ca 0.00 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2nef h ALA 195 Cb 0.01 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2nef h ALA 195 CO 0.00 -1.40 -0.03 -0.09 0.00 0.00 0.00 179.25 177.73 2nef h ARG 196 N 0.05 -0.08 0.00 0.00 2.43 -1.84 -3.08 114.38 111.86 2nef h ARG 196 Ca 0.58 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.76 2nef h ARG 196 Cb 2.23 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 31.80 2nef h ARG 196 CO -0.05 0.50 0.00 0.39 -1.51 0.00 0.00 179.97 179.30 2nef n GLU 197 N -4.82 0.16 0.05 0.20 1.02 0.14 -2.68 120.64 114.71 2nef n GLU 197 Ca -0.08 0.40 -0.03 0.00 -0.02 0.00 0.00 57.16 57.42 2nef n GLU 197 Cb 0.31 -1.81 -0.01 0.00 -0.02 0.00 0.00 31.44 29.90 2nef n GLU 197 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2nef h LEU 198 N 0.00 -0.15 -5.80 -4.62 3.38 -0.41 -3.44 115.31 104.26 2nef h LEU 198 Ca 0.00 0.01 -0.42 0.00 0.09 0.00 0.00 57.88 57.55 2nef h LEU 198 Cb 0.34 0.04 -0.30 0.00 0.09 0.00 0.00 40.66 40.84 2nef h LEU 198 CO 0.00 0.15 -0.80 1.41 0.09 0.00 0.00 178.44 179.28 2nef n HIS 199 N -3.91 -1.99 0.05 1.13 8.25 -1.17 -4.98 115.22 112.61 2nef n HIS 199 Ca -0.02 -2.60 -0.17 0.00 -0.26 0.00 0.00 57.72 54.67 2nef n HIS 199 Cb 0.07 0.69 -0.14 0.00 1.12 0.00 0.00 29.99 31.73 2nef n HIS 199 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2nef h PRO 200 N 5.18 0.25 0.00 -0.41 0.13 -1.72 -3.32 132.00 132.12 2nef h PRO 200 Ca 0.16 -0.42 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 2nef h PRO 200 Cb 0.98 0.16 0.00 0.00 0.13 0.00 0.00 31.00 32.27 2nef h PRO 200 CO 0.26 1.10 0.28 -0.85 -0.23 0.00 0.00 178.00 178.56 2nef n GLU 201 N -3.44 0.06 0.00 0.86 0.28 -1.26 -0.08 120.64 117.05 2nef n GLU 201 Ca -0.19 0.47 0.00 0.00 -0.16 0.00 0.00 57.16 57.29 2nef n GLU 201 Cb 1.05 -1.97 0.00 0.00 1.43 0.00 0.00 31.44 31.95 2nef n GLU 201 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 2nef n TYR 202 N -1.79 0.00 -2.56 -1.84 4.02 -1.25 -3.40 117.16 110.34 2nef n TYR 202 Ca -0.01 0.00 -0.01 0.00 -0.01 0.00 0.00 57.90 57.88 2nef n TYR 202 Cb 0.29 -0.02 0.04 0.00 -0.02 0.00 0.00 39.34 39.63 2nef n TYR 202 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 2nef n PHE 203 N -0.40 -0.12 0.15 -0.72 3.01 0.88 -4.89 117.46 115.37 2nef n PHE 203 Ca 0.00 -1.34 0.10 0.00 1.01 0.00 0.00 57.45 57.22 2nef n PHE 203 Cb 0.04 0.38 0.51 0.00 -0.01 0.00 0.00 39.48 40.40 2nef n PHE 203 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 2nef n LYS 204 N -0.47 0.12 -2.73 -1.08 5.02 -1.22 -3.76 118.16 114.04 2nef n LYS 204 Ca -0.06 0.62 -0.05 0.00 -2.02 0.00 0.00 58.31 56.80 2nef n LYS 204 Cb 0.88 -1.92 0.03 0.00 -0.02 0.00 0.00 35.03 34.00 2nef n LYS 204 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2nef n ASN 205 N -2.16 -2.69 0.00 4.39 5.15 -1.26 -5.18 115.26 113.51 2nef n ASN 205 Ca -0.01 -2.52 0.00 0.00 -0.60 0.00 0.00 54.58 51.45 2nef n ASN 205 Cb 0.05 1.47 0.00 0.00 -0.53 0.00 0.00 39.78 40.77 2nef n ASN 205 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66