#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nef n TRP 57 N 0.00 0.00 -0.07 0.00 4.27 -1.26 -3.28 117.44 117.10 2nef n TRP 57 Ca 0.00 0.00 -0.08 0.00 -3.89 0.00 0.00 57.50 53.53 2nef n TRP 57 Cb 0.00 -0.15 -0.05 0.00 -1.36 0.00 0.00 31.31 29.75 2nef n TRP 57 CO 0.00 0.00 0.00 -0.07 -2.29 0.00 0.00 177.69 175.33 2nef h LEU 58 N 0.00 0.00 0.00 5.67 4.07 -1.96 -3.43 115.31 119.65 2nef h LEU 58 Ca 0.00 -0.31 0.00 0.00 0.08 0.00 0.00 57.88 57.65 2nef h LEU 58 Cb 0.10 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.84 2nef h LEU 58 CO 0.00 0.83 0.00 -0.62 -1.08 0.00 0.00 178.44 177.57 2nef n GLU 59 N -4.65 0.00 -1.94 1.13 -0.58 -1.21 -4.72 120.64 108.68 2nef n GLU 59 Ca -0.09 0.00 -0.43 0.00 -0.42 0.00 0.00 57.16 56.22 2nef n GLU 59 Cb 0.28 -0.06 -0.03 0.00 -0.57 0.00 0.00 31.44 31.07 2nef n GLU 59 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2nef s ALA 60 N -3.58 3.12 0.00 0.62 0.00 -1.23 -4.82 121.76 115.87 2nef s ALA 60 Ca 0.00 0.58 0.00 0.00 0.00 0.00 0.00 51.96 52.54 2nef s ALA 60 Cb 0.00 -3.93 0.00 0.00 0.00 0.00 0.00 23.12 19.19 2nef s ALA 60 CO 0.00 -2.21 0.70 0.00 0.00 0.00 0.00 175.76 174.24 2nef n GLN 61 N 8.02 0.63 0.13 0.00 10.64 -1.26 -4.22 117.38 131.32 2nef n GLN 61 Ca 0.22 0.00 0.18 0.00 -1.83 0.00 0.00 57.00 55.57 2nef n GLN 61 Cb 0.45 -1.18 0.60 0.00 -0.86 0.00 0.00 30.24 29.25 2nef n GLN 61 CO 0.00 0.00 0.00 1.49 -1.83 0.00 0.00 177.06 176.72 2nef h GLU 62 N 0.87 0.00 0.00 2.61 4.81 -1.87 0.89 114.58 121.89 2nef h GLU 62 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2nef h GLU 62 Cb 0.63 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.01 2nef h GLU 62 CO 0.00 0.00 0.00 -1.91 -0.73 0.00 0.00 179.01 176.37 2nef n GLU 63 N -3.23 0.43 0.30 1.92 4.07 -1.26 -3.65 120.64 119.21 2nef n GLU 63 Ca 0.07 0.00 -0.12 0.00 -0.06 0.00 0.00 57.16 57.05 2nef n GLU 63 Cb 0.80 -1.09 -0.06 0.00 -0.06 0.00 0.00 31.44 31.02 2nef n GLU 63 CO 0.00 0.00 0.00 1.49 -0.06 0.00 0.00 177.13 178.56 2nef h GLU 64 N 0.00 -0.75 0.00 5.31 4.22 0.46 -3.44 114.58 120.38 2nef h GLU 64 Ca 0.00 0.05 -0.04 0.00 0.08 0.00 0.00 59.36 59.46 2nef h GLU 64 Cb 0.00 0.17 0.01 0.00 0.50 0.00 0.00 28.75 29.43 2nef h GLU 64 CO 0.00 -0.50 0.03 -1.91 -2.18 0.00 0.00 179.01 174.44 2nef n GLU 65 N -4.22 0.09 -3.69 1.92 2.13 -1.24 -5.11 120.64 110.52 2nef n GLU 65 Ca -0.10 -0.18 -0.10 0.00 0.66 0.00 0.00 57.16 57.44 2nef n GLU 65 Cb 0.32 -0.09 -0.11 0.00 0.27 0.00 0.00 31.44 31.83 2nef n GLU 65 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2nef s VAL 66 N -0.88 -0.11 0.00 6.31 1.01 -1.26 -5.09 120.40 120.38 2nef s VAL 66 Ca 0.06 0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.14 2nef s VAL 66 Cb -0.00 -0.62 0.00 0.00 0.00 0.00 0.00 36.38 35.76 2nef s VAL 66 CO 0.04 0.04 0.00 0.61 0.00 0.00 0.00 175.10 175.79 2nef n GLY 67 N 4.42 -0.98 2.69 4.51 0.00 -1.26 -4.85 105.19 109.72 2nef n GLY 67 Ca -0.21 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.72 2nef n GLY 67 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2nef n PHE 68 N 0.00 -2.36 -0.83 1.61 -1.74 -1.26 -5.15 117.46 107.74 2nef n PHE 68 Ca 0.00 -2.15 -0.29 0.00 -0.56 0.00 0.00 57.45 54.45 2nef n PHE 68 Cb 0.00 1.43 0.23 0.00 1.52 0.00 0.00 39.48 42.66 2nef n PHE 68 CO 0.00 0.00 0.00 -1.25 -0.56 0.00 0.00 176.76 174.95 2nef s PRO 69 N -0.06 -0.80 0.00 3.97 0.04 -1.26 -5.05 135.00 131.84 2nef s PRO 69 Ca 0.23 0.48 0.00 0.00 0.04 0.00 0.00 61.00 61.75 2nef s PRO 69 Cb 0.35 -1.60 0.00 0.00 0.04 0.00 0.00 34.50 33.29 2nef s PRO 69 CO -0.06 -3.55 0.00 0.28 0.04 0.00 0.00 177.00 173.70 2nef n VAL 70 N -4.74 0.00 -2.95 -0.36 0.31 -1.26 -5.05 118.33 104.27 2nef n VAL 70 Ca 0.06 0.00 -0.31 0.00 -0.01 0.00 0.00 64.34 64.08 2nef n VAL 70 Cb 0.57 -1.87 -0.04 0.00 -0.91 0.00 0.00 33.84 31.59 2nef n VAL 70 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 2nef s THR 71 N -0.50 4.73 -0.73 2.52 -4.23 -1.26 -4.96 115.64 111.22 2nef s THR 71 Ca 0.00 0.78 -0.26 0.00 -1.18 0.00 0.00 61.69 61.03 2nef s THR 71 Cb 0.00 -3.68 -0.05 0.00 1.34 0.00 0.00 72.50 70.11 2nef s THR 71 CO 0.00 -0.39 2.04 -2.16 -0.54 0.00 0.00 174.62 173.57 2nef s PRO 72 N -3.50 2.39 -0.35 3.99 0.04 -1.26 -4.90 135.00 131.41 2nef s PRO 72 Ca 0.53 0.37 -0.00 0.00 0.04 0.00 0.00 61.00 61.94 2nef s PRO 72 Cb -0.10 -4.71 0.12 0.00 0.04 0.00 0.00 34.50 29.84 2nef s PRO 72 CO 0.26 -3.27 0.16 -0.65 0.04 0.00 0.00 177.00 173.53 2nef s GLN 73 N 7.44 0.78 0.04 4.56 -0.21 -1.26 -4.99 119.66 126.02 2nef s GLN 73 Ca 0.76 -1.31 0.03 0.00 0.02 0.00 0.00 55.36 54.86 2nef s GLN 73 Cb -0.11 -1.88 -0.02 0.00 1.00 0.00 0.00 33.01 31.99 2nef s GLN 73 CO 0.12 -1.07 -0.10 0.14 -2.12 0.00 0.00 175.29 172.25 2nef s VAL 74 N 1.24 0.78 -0.50 1.09 -7.23 -1.26 -5.07 120.40 109.45 2nef s VAL 74 Ca 0.13 -1.01 -0.44 0.00 -1.81 0.00 0.00 61.98 58.85 2nef s VAL 74 Cb -0.20 -0.77 -0.19 0.00 0.56 0.00 0.00 36.38 35.78 2nef s VAL 74 CO -0.15 -0.20 2.07 -2.65 -0.31 0.00 0.00 175.10 173.86 2nef n PRO 75 N 1.70 0.00 -1.76 4.82 -0.02 -1.26 -4.74 135.00 133.73 2nef n PRO 75 Ca -0.20 0.00 -0.30 0.00 -2.02 0.00 0.00 63.50 60.97 2nef n PRO 75 Cb 0.55 -1.50 -0.04 0.00 -0.02 0.00 0.00 33.50 32.49 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 5.63 3.22 0.29 2.45 1.43 -1.26 -4.94 118.68 125.51 2nef s LEU 76 Ca 1.18 0.40 -0.10 0.00 -1.03 0.00 0.00 54.13 54.58 2nef s LEU 76 Cb -1.50 -2.53 -0.07 0.00 0.03 0.00 0.00 46.19 42.12 2nef s LEU 76 CO 0.68 -2.95 0.63 -0.13 0.23 0.00 0.00 176.35 174.82 2nef s ARG 77 N 7.89 3.81 0.10 1.70 0.52 -1.26 -5.04 118.95 126.67 2nef s ARG 77 Ca 0.84 0.35 -0.30 0.00 -0.52 0.00 0.00 55.73 56.10 2nef s ARG 77 Cb -0.13 -2.55 -0.06 0.00 0.52 0.00 0.00 34.95 32.72 2nef s ARG 77 CO 0.17 0.19 1.17 -1.25 0.02 0.00 0.00 175.30 175.60 2nef s PRO 78 N -3.19 4.47 -0.44 3.54 0.04 -1.26 -4.82 135.00 133.35 2nef s PRO 78 Ca 0.49 1.77 -0.27 0.00 0.04 0.00 0.00 61.00 63.02 2nef s PRO 78 Cb -0.11 -3.32 -0.04 0.00 0.04 0.00 0.00 34.50 31.07 2nef s PRO 78 CO 0.24 -0.16 2.05 1.41 0.04 0.00 0.00 177.00 180.57 2nef s MET 79 N 0.59 2.75 0.27 4.56 1.75 -1.26 -4.95 119.30 123.02 2nef s MET 79 Ca 0.56 1.27 -0.14 0.00 -1.25 0.00 0.00 55.69 56.13 2nef s MET 79 Cb -0.30 -4.39 -0.08 0.00 2.84 0.00 0.00 34.83 32.90 2nef s MET 79 CO 0.31 -2.55 0.67 0.95 -0.65 0.00 0.00 175.02 173.75 2nef s THR 80 N 9.23 4.75 0.26 10.11 -4.23 -1.26 -4.89 115.64 129.61 2nef s THR 80 Ca 0.84 0.84 -0.02 0.00 -1.18 0.00 0.00 61.69 62.17 2nef s THR 80 Cb -0.20 -3.65 0.23 0.00 1.34 0.00 0.00 72.50 70.23 2nef s THR 80 CO 0.28 -0.08 1.77 0.22 -0.54 0.00 0.00 174.62 176.28 2nef h TYR 81 N 2.56 0.78 -0.16 3.99 3.20 -1.92 2.60 116.97 128.03 2nef h TYR 81 Ca -0.48 0.03 0.02 0.00 3.14 0.00 0.00 58.73 61.45 2nef h TYR 81 Cb 1.18 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 39.22 2nef h TYR 81 CO 0.62 0.23 0.11 -0.22 -1.64 0.00 0.00 178.16 177.26 2nef h LYS 82 N 0.66 0.10 -0.54 1.82 3.64 -1.95 -0.18 116.57 120.13 2nef h LYS 82 Ca 0.44 -0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.73 2nef h LYS 82 Cb 0.57 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.34 2nef h LYS 82 CO -0.33 0.07 -0.01 0.00 -2.27 0.00 0.00 179.45 176.91 2nef h ALA 83 N 1.91 0.97 0.18 5.00 0.00 0.41 -0.25 119.26 127.49 2nef h ALA 83 Ca 0.07 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 2nef h ALA 83 Cb 0.14 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2nef h ALA 83 CO -0.01 0.62 -0.09 0.00 0.00 0.00 0.00 179.25 179.78 2nef h ALA 84 N 1.13 -0.24 -0.19 0.00 0.00 0.12 0.11 119.26 120.20 2nef h ALA 84 Ca 0.16 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2nef h ALA 84 Cb 0.51 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 2nef h ALA 84 CO 0.03 -0.52 0.06 0.28 0.00 0.00 0.00 179.25 179.09 2nef h VAL 85 N -0.47 1.19 -0.55 0.00 2.07 -1.40 0.18 116.25 117.26 2nef h VAL 85 Ca -0.02 -0.60 0.02 0.00 0.82 0.00 0.00 66.70 66.92 2nef h VAL 85 Cb 0.36 1.23 -0.04 0.00 -1.52 0.00 0.00 31.29 31.33 2nef h VAL 85 CO 0.04 0.19 0.33 0.44 0.02 0.00 0.00 177.57 178.59 2nef h ASP 86 N 0.13 0.54 -0.87 0.57 5.19 -1.05 -1.32 116.42 119.61 2nef h ASP 86 Ca 0.06 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.46 2nef h ASP 86 Cb 0.24 -0.11 -0.04 0.00 0.18 0.00 0.00 39.33 39.59 2nef h ASP 86 CO -0.00 0.38 0.50 0.25 -3.12 0.00 0.00 179.24 177.25 2nef h LEU 87 N 0.66 1.08 -0.18 1.55 5.85 -0.49 -0.25 115.31 123.54 2nef h LEU 87 Ca 0.22 -0.09 0.04 0.00 0.84 0.00 0.00 57.88 58.90 2nef h LEU 87 Cb 0.01 -0.27 -0.07 0.00 0.37 0.00 0.00 40.66 40.70 2nef h LEU 87 CO -0.09 0.86 -0.45 0.77 -0.34 0.00 0.00 178.44 179.18 2nef h SER 88 N 1.21 -1.43 0.55 1.25 4.64 0.54 0.09 113.55 120.41 2nef h SER 88 Ca 0.31 0.19 -0.12 0.00 -0.47 0.00 0.00 61.79 61.70 2nef h SER 88 Cb 0.00 0.58 -0.02 0.00 -0.31 0.00 0.00 62.40 62.66 2nef h SER 88 CO -0.05 -0.43 -0.55 0.45 -0.87 0.00 0.00 176.83 175.38 2nef h HIS 89 N -0.48 0.00 0.19 4.77 3.86 -1.33 -2.89 115.15 119.26 2nef h HIS 89 Ca 0.08 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.29 2nef h HIS 89 Cb 0.63 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.09 2nef h HIS 89 CO -0.53 0.55 -0.15 0.35 0.86 0.00 0.00 177.93 179.01 2nef h PHE 90 N 0.00 -0.38 0.00 2.45 3.57 0.37 -0.59 116.94 122.36 2nef h PHE 90 Ca -0.01 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 2nef h PHE 90 Cb 0.98 0.14 -0.00 0.00 2.79 0.00 0.00 35.95 39.86 2nef h PHE 90 CO 0.00 -0.22 -0.03 -0.07 -2.23 0.00 0.00 178.31 175.75 2nef h LEU 91 N -0.34 0.00 0.04 0.59 3.38 -1.00 -2.66 115.31 115.32 2nef h LEU 91 Ca -0.01 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2nef h LEU 91 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2nef h LEU 91 CO -0.01 0.03 -0.02 0.50 0.09 0.00 0.00 178.44 179.03 2nef h LYS 92 N 0.00 -0.05 0.00 1.13 3.64 -0.89 -2.80 116.57 117.60 2nef h LYS 92 Ca -0.00 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.30 2nef h LYS 92 Cb 0.16 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 2nef h LYS 92 CO 0.00 0.08 -0.42 1.49 -2.27 0.00 0.00 179.45 178.33 2nef h GLU 93 N -0.18 0.00 -1.00 1.90 4.81 -1.26 -2.87 114.58 115.98 2nef h GLU 93 Ca -0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2nef h GLU 93 Cb 0.16 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.54 2nef h GLU 93 CO 0.01 0.42 0.00 1.63 -0.73 0.00 0.00 179.01 180.34 2nef n LYS 94 N -3.85 0.84 0.00 1.92 4.76 -1.06 -4.89 118.16 115.88 2nef n LYS 94 Ca -0.01 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.43 2nef n LYS 94 Cb 0.47 -1.25 0.00 0.00 -1.84 0.00 0.00 35.03 32.42 2nef n LYS 94 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2nef n GLY 95 N 0.34 2.40 3.34 0.72 0.00 -1.08 -4.63 105.19 106.28 2nef n GLY 95 Ca 0.00 -2.04 -0.46 0.00 0.00 0.00 0.00 46.02 43.52 2nef n GLY 95 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2nef s GLY 96 N 0.00 2.66 0.34 -0.02 0.00 -1.26 -4.40 107.32 104.64 2nef s GLY 96 Ca 0.00 -3.33 0.26 0.00 0.00 0.00 0.00 44.72 41.65 2nef s GLY 96 CO 0.00 1.34 1.76 -2.00 0.00 0.00 0.00 173.10 174.20 2nef h LEU 97 N 7.92 0.00 -9.94 0.66 5.85 -1.86 -3.43 115.31 114.51 2nef h LEU 97 Ca 0.12 0.00 -0.56 0.00 0.84 0.00 0.00 57.88 58.29 2nef h LEU 97 Cb 1.02 0.00 0.17 0.00 0.37 0.00 0.00 40.66 42.23 2nef h LEU 97 CO 0.81 0.00 0.12 1.21 -0.34 0.00 0.00 178.44 180.24 2nef n GLU 98 N -2.63 0.59 -0.36 1.25 0.00 -1.26 -2.11 120.64 116.12 2nef n GLU 98 Ca 0.04 0.25 0.00 0.00 0.00 0.00 0.00 57.16 57.45 2nef n GLU 98 Cb 0.39 -2.23 0.00 0.00 0.00 0.00 0.00 31.44 29.60 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 1.12 0.00 3.63 8.31 0.00 -0.36 -4.85 105.19 113.04 2nef n GLY 99 Ca 0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.72 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 3.90 -0.34 0.99 2.96 -0.90 -4.78 118.68 120.51 2nef s LEU 100 Ca 0.00 1.22 -0.28 0.00 -0.22 0.00 0.00 54.13 54.86 2nef s LEU 100 Cb 0.00 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 43.11 2nef s LEU 100 CO 0.00 -1.04 2.12 -0.63 -1.32 0.00 0.00 176.35 175.48 2nef s ILE 101 N 4.26 3.16 -0.52 6.68 -1.09 -1.26 -2.30 121.20 130.12 2nef s ILE 101 Ca 0.55 0.15 -0.27 0.00 -2.23 0.00 0.00 60.65 58.85 2nef s ILE 101 Cb -0.17 -3.26 -0.04 0.00 -1.58 0.00 0.00 42.46 37.42 2nef s ILE 101 CO 0.22 -0.19 2.08 -2.28 -1.23 0.00 0.00 174.94 173.53 2nef s HIS 102 N 8.89 1.43 0.00 3.97 5.65 1.13 -4.87 115.29 131.49 2nef s HIS 102 Ca 0.92 1.06 0.00 0.00 0.25 0.00 0.00 55.06 57.28 2nef s HIS 102 Cb -0.25 -3.89 0.00 0.00 -1.18 0.00 0.00 32.58 27.26 2nef s HIS 102 CO 0.31 -2.53 0.26 0.45 -0.65 0.00 0.00 174.74 172.58 2nef n SER 103 N 13.67 0.00 0.00 9.88 2.88 -1.26 -3.35 113.62 135.44 2nef n SER 103 Ca 0.27 0.31 0.00 0.00 -1.33 0.00 0.00 58.87 58.12 2nef n SER 103 Cb 0.52 -0.08 0.00 0.00 -0.75 0.00 0.00 64.21 63.90 2nef n SER 103 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 2nef n GLN 104 N -0.75 0.00 0.11 -1.46 7.27 -1.26 -4.83 117.38 116.47 2nef n GLN 104 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 57.00 57.04 2nef n GLN 104 Cb 0.00 0.00 0.16 0.00 2.41 0.00 0.00 30.24 32.81 2nef n GLN 104 CO 0.00 0.00 0.00 -0.09 0.07 0.00 0.00 177.06 177.04 2nef h ARG 105 N 0.00 0.11 -0.13 3.69 2.43 -2.00 -2.78 114.38 115.70 2nef h ARG 105 Ca 0.00 -0.08 0.04 0.00 -0.81 0.00 0.00 59.98 59.13 2nef h ARG 105 Cb 0.00 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 2nef h ARG 105 CO 0.00 0.67 0.13 0.00 -1.51 0.00 0.00 179.97 179.26 2nef h ARG 106 N 0.08 0.00 0.35 0.20 3.08 -1.96 -2.20 114.38 113.94 2nef h ARG 106 Ca -0.01 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 2nef h ARG 106 Cb 1.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.12 2nef h ARG 106 CO 0.08 0.00 -0.17 0.37 -1.07 0.00 0.00 179.97 179.19 2nef h GLN 107 N 0.00 -0.45 0.38 0.04 4.15 -1.88 -1.18 115.11 116.17 2nef h GLN 107 Ca 0.06 0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.50 2nef h GLN 107 Cb 0.32 0.10 -0.02 0.00 0.21 0.00 0.00 27.48 28.10 2nef h GLN 107 CO -0.00 -0.23 -0.32 -0.44 -1.93 0.00 0.00 178.83 175.90 2nef h ASP 108 N -0.58 -0.85 -0.85 -0.69 5.19 -1.55 -0.18 116.42 116.91 2nef h ASP 108 Ca -0.05 0.07 0.25 0.00 -0.62 0.00 0.00 57.03 56.67 2nef h ASP 108 Cb 0.43 0.28 -0.03 0.00 0.18 0.00 0.00 39.33 40.18 2nef h ASP 108 CO 0.08 -0.47 0.70 0.40 -3.12 0.00 0.00 179.24 176.83 2nef h ILE 109 N -0.71 0.40 0.00 0.35 2.04 -1.46 0.49 117.51 118.62 2nef h ILE 109 Ca -0.03 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.83 2nef h ILE 109 Cb 0.62 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 37.19 2nef h ILE 109 CO -0.02 0.00 0.00 -0.11 0.00 0.00 0.00 178.15 178.02 2nef n LEU 110 N -3.97 0.19 -0.30 1.44 -0.00 -0.11 -1.76 117.00 112.49 2nef n LEU 110 Ca 0.18 0.73 -0.04 0.00 -0.00 0.00 0.00 56.01 56.87 2nef n LEU 110 Cb 1.00 -0.41 0.07 0.00 -0.00 0.00 0.00 43.42 44.08 2nef n LEU 110 CO 0.34 -0.41 1.19 0.44 -0.00 0.00 0.00 177.39 178.95 2nef h ASP 111 N 0.00 0.97 0.78 1.96 3.32 -1.07 -2.51 116.42 119.87 2nef h ASP 111 Ca 0.00 -0.06 -0.04 0.00 0.02 0.00 0.00 57.03 56.96 2nef h ASP 111 Cb 0.00 -0.24 0.01 0.00 0.22 0.00 0.00 39.33 39.31 2nef h ASP 111 CO 0.00 0.74 -0.37 0.25 -1.72 0.00 0.00 179.24 178.14 2nef h LEU 112 N 1.12 -0.89 -0.98 1.55 6.46 -0.15 -2.12 115.31 120.30 2nef h LEU 112 Ca 0.30 0.03 0.26 0.00 -0.12 0.00 0.00 57.88 58.35 2nef h LEU 112 Cb -0.07 0.23 -0.13 0.00 -0.73 0.00 0.00 40.66 39.96 2nef h LEU 112 CO -0.06 -0.57 0.54 -0.25 -0.62 0.00 0.00 178.44 177.48 2nef h TRP 113 N -1.18 0.90 -0.33 1.25 7.01 -1.36 1.74 115.95 123.98 2nef h TRP 113 Ca -0.11 0.04 0.01 0.00 2.11 0.00 0.00 58.89 60.94 2nef h TRP 113 Cb 0.80 -0.24 -0.02 0.00 -2.10 0.00 0.00 29.16 27.60 2nef h TRP 113 CO 0.02 -0.04 0.22 0.82 -2.79 0.00 0.00 178.44 176.67 2nef h ILE 114 N 0.46 1.06 0.53 2.65 1.08 -1.21 -2.68 117.51 119.40 2nef h ILE 114 Ca 0.65 -0.14 -0.03 0.00 -0.39 0.00 0.00 64.86 64.96 2nef h ILE 114 Cb 1.33 0.62 0.01 0.00 -3.07 0.00 0.00 36.82 35.70 2nef h ILE 114 CO -0.53 0.07 -0.25 0.22 -0.69 0.00 0.00 178.15 176.97 2nef h TYR 115 N 0.41 -0.66 -0.01 1.37 3.20 0.33 0.50 116.97 122.11 2nef h TYR 115 Ca 0.12 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.98 2nef h TYR 115 Cb 0.01 0.22 -0.00 0.00 1.54 0.00 0.00 36.73 38.49 2nef h TYR 115 CO -0.00 -0.41 0.19 1.12 -1.64 0.00 0.00 178.16 177.42 2nef h HIS 116 N -0.88 0.00 0.00 -3.82 2.07 -1.43 0.26 115.15 111.34 2nef h HIS 116 Ca -0.07 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.45 2nef h HIS 116 Cb 0.54 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.52 2nef h HIS 116 CO 0.05 0.00 -0.16 0.25 -3.07 0.00 0.00 177.93 175.01 2nef n THR 117 N -3.00 0.29 -0.01 6.12 -2.24 -1.02 -4.77 114.28 109.65 2nef n THR 117 Ca -0.02 0.44 -0.19 0.00 -2.27 0.00 0.00 64.05 62.00 2nef n THR 117 Cb 0.25 -1.67 -0.14 0.00 -2.10 0.00 0.00 70.33 66.68 2nef n THR 117 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 2nef h GLN 118 N -0.20 0.18 0.00 -0.78 4.20 -0.04 -3.49 115.11 114.98 2nef h GLN 118 Ca 0.00 -0.30 0.00 0.00 0.06 0.00 0.00 58.65 58.41 2nef h GLN 118 Cb 0.16 0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.05 2nef h GLN 118 CO 0.00 1.14 0.00 0.41 -0.67 0.00 0.00 178.83 179.71 2nef n GLY 119 N 1.65 0.78 3.74 3.46 0.00 0.90 -4.81 105.19 110.91 2nef n GLY 119 Ca -0.19 -0.18 -0.41 0.00 0.00 0.00 0.00 46.02 45.24 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 -2.00 3.48 0.25 1.61 2.02 -1.26 -4.75 117.35 116.71 2nef s TYR 120 Ca 0.00 1.49 -0.30 0.00 -0.37 0.00 0.00 57.07 57.90 2nef s TYR 120 Cb 0.00 -3.37 -0.09 0.00 -0.40 0.00 0.00 41.96 38.09 2nef s TYR 120 CO 0.00 -0.98 1.17 -0.59 -1.57 0.00 0.00 175.55 173.57 2nef s PHE 121 N -0.14 3.45 -0.63 2.71 -0.12 -1.26 -4.69 117.98 117.30 2nef s PHE 121 Ca 0.51 1.56 -0.28 0.00 -0.05 0.00 0.00 56.93 58.68 2nef s PHE 121 Cb -0.31 -3.40 0.02 0.00 -0.63 0.00 0.00 43.02 38.70 2nef s PHE 121 CO 0.36 -0.98 1.35 -1.25 -0.05 0.00 0.00 175.22 174.65 2nef s PRO 122 N -1.06 3.27 0.00 1.99 0.04 -1.26 -4.63 135.00 133.35 2nef s PRO 122 Ca 0.48 0.19 0.01 0.00 0.04 0.00 0.00 61.00 61.73 2nef s PRO 122 Cb -0.33 -4.13 0.02 0.00 0.04 0.00 0.00 34.50 30.09 2nef s PRO 122 CO 0.41 -2.00 0.68 -0.40 0.04 0.00 0.00 177.00 175.73 2nef n ASP 123 N 9.47 -0.08 0.00 6.66 5.75 -1.26 -4.89 116.55 132.20 2nef n ASP 123 Ca 0.09 -1.36 0.00 0.00 -0.01 0.00 0.00 54.79 53.51 2nef n ASP 123 Cb 0.49 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.57 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 0.02 0.00 -2.41 2.11 4.27 -1.26 -4.93 117.44 115.23 2nef n TRP 124 Ca -0.03 0.00 -0.38 0.00 -3.89 0.00 0.00 57.50 53.20 2nef n TRP 124 Cb 0.59 0.00 -0.03 0.00 -1.36 0.00 0.00 31.31 30.50 2nef n TRP 124 CO 0.00 0.00 0.00 1.14 -2.29 0.00 0.00 177.69 176.54 2nef s GLN 125 N -1.68 3.21 -0.40 -2.67 1.03 -1.26 -4.60 119.66 113.29 2nef s GLN 125 Ca 0.00 -0.60 0.06 0.00 0.04 0.00 0.00 55.36 54.86 2nef s GLN 125 Cb 0.00 -4.94 0.17 0.00 0.03 0.00 0.00 33.01 28.27 2nef s GLN 125 CO 0.00 -2.46 0.51 -0.80 -2.54 0.00 0.00 175.29 170.00 2nef s ASN 126 N 5.55 -0.28 0.34 12.60 0.01 -1.26 -5.13 114.94 126.77 2nef s ASN 126 Ca 0.50 -1.21 0.00 0.00 -0.71 0.00 0.00 52.86 51.44 2nef s ASN 126 Cb -0.04 1.30 0.00 0.00 0.41 0.00 0.00 41.25 42.92 2nef s ASN 126 CO 0.00 -0.21 0.00 -1.22 -1.51 0.00 0.00 177.10 174.17 2nef n TYR 127 N 4.27 -1.36 -1.80 2.20 4.02 -1.26 -3.15 117.16 120.08 2nef n TYR 127 Ca 0.12 0.00 -0.36 0.00 -0.01 0.00 0.00 57.90 57.64 2nef n TYR 127 Cb 0.51 0.00 0.06 0.00 -0.02 0.00 0.00 39.34 39.89 2nef n TYR 127 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 2nef s THR 128 N -0.34 2.29 -0.03 -0.72 -4.23 -0.89 -4.63 115.64 107.09 2nef s THR 128 Ca 0.00 0.18 -0.01 0.00 -1.18 0.00 0.00 61.69 60.67 2nef s THR 128 Cb 0.00 -3.02 -0.03 0.00 1.34 0.00 0.00 72.50 70.79 2nef s THR 128 CO 0.00 -0.04 2.29 -0.81 -0.54 0.00 0.00 174.62 175.52 2nef n PRO 129 N -1.90 1.25 -3.89 3.99 -0.04 -1.26 -4.86 135.00 128.29 2nef n PRO 129 Ca 0.15 -0.32 0.01 0.00 -0.04 0.00 0.00 63.50 63.30 2nef n PRO 129 Cb 0.49 -1.23 0.01 0.00 -0.04 0.00 0.00 33.50 32.73 2nef n PRO 129 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2nef n GLY 130 N 1.57 0.34 0.00 0.55 0.00 -1.26 -5.17 105.19 101.22 2nef n GLY 130 Ca 0.10 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 45.05 2nef n GLY 130 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2nef n PRO 131 N -0.84 1.99 -1.16 1.61 -0.02 -1.26 -4.83 135.00 130.49 2nef n PRO 131 Ca 0.02 0.00 0.15 0.00 -2.02 0.00 0.00 63.50 61.65 2nef n PRO 131 Cb 0.56 0.00 -0.06 0.00 -0.02 0.00 0.00 33.50 33.99 2nef n PRO 131 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2nef n GLY 132 N 0.00 -2.54 3.56 -1.23 0.00 -1.26 -4.54 105.19 99.18 2nef n GLY 132 Ca 0.00 -1.18 -0.54 0.00 0.00 0.00 0.00 46.02 44.30 2nef n GLY 132 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2nef n ILE 133 N -3.96 0.25 -2.27 -0.61 -0.00 -1.26 -4.80 119.36 106.71 2nef n ILE 133 Ca -0.03 -0.14 -0.36 0.00 -0.00 0.00 0.00 62.75 62.22 2nef n ILE 133 Cb 0.54 -1.38 -0.04 0.00 -0.00 0.00 0.00 39.64 38.76 2nef n ILE 133 CO 0.00 0.00 0.00 -0.13 -0.00 0.00 0.00 176.55 176.42 2nef s ARG 134 N 4.95 2.96 0.39 0.38 0.52 -1.01 -4.88 118.95 122.26 2nef s ARG 134 Ca 1.05 -0.27 -0.20 0.00 -0.52 0.00 0.00 55.73 55.79 2nef s ARG 134 Cb -0.99 -4.80 -0.10 0.00 0.52 0.00 0.00 34.95 29.57 2nef s ARG 134 CO 0.58 -2.69 0.89 0.71 0.02 0.00 0.00 175.30 174.81 2nef s TYR 135 N 7.71 3.36 -0.34 -0.53 1.51 -1.26 -2.78 117.35 125.03 2nef s TYR 135 Ca 0.56 1.51 -0.29 0.00 -1.01 0.00 0.00 57.07 57.85 2nef s TYR 135 Cb -0.07 -2.77 0.01 0.00 -0.11 0.00 0.00 41.96 39.03 2nef s TYR 135 CO 0.05 -0.02 1.16 -1.25 -1.11 0.00 0.00 175.55 174.38 2nef s PRO 136 N -3.02 3.96 0.20 -1.71 0.04 -1.26 -2.09 135.00 131.12 2nef s PRO 136 Ca 0.59 1.05 -0.11 0.00 0.04 0.00 0.00 61.00 62.57 2nef s PRO 136 Cb -0.10 -3.81 0.14 0.00 0.04 0.00 0.00 34.50 30.76 2nef s PRO 136 CO 0.15 -1.05 1.87 -0.07 0.04 0.00 0.00 177.00 177.94 2nef h LEU 137 N 10.54 0.81-10.15 -3.56 3.38 -1.80 -3.42 115.31 111.11 2nef h LEU 137 Ca -0.23 -0.02 -0.52 0.00 0.09 0.00 0.00 57.88 57.20 2nef h LEU 137 Cb 1.07 -0.20 0.11 0.00 0.09 0.00 0.00 40.66 41.73 2nef h LEU 137 CO 1.05 0.59 0.41 0.42 0.09 0.00 0.00 178.44 181.00 2nef s THR 138 N -6.14 2.93 0.14 0.22 -4.23 -1.26 -4.79 115.64 102.51 2nef s THR 138 Ca -0.13 0.49 0.01 0.00 -1.18 0.00 0.00 61.69 60.88 2nef s THR 138 Cb 0.14 -3.07 -0.04 0.00 1.34 0.00 0.00 72.50 70.87 2nef s THR 138 CO 0.77 -0.21 0.29 0.12 -0.54 0.00 0.00 174.62 175.05 2nef s PHE 139 N -2.01 3.49 0.00 3.99 5.36 -1.26 -4.42 117.98 123.13 2nef s PHE 139 Ca 0.72 0.20 0.00 0.00 -0.96 0.00 0.00 56.93 56.88 2nef s PHE 139 Cb -0.25 -1.73 0.00 0.00 -0.34 0.00 0.00 43.02 40.70 2nef s PHE 139 CO 0.38 0.51 0.00 0.41 -1.46 0.00 0.00 175.22 175.05 2nef n GLY 140 N -0.36 2.89 3.55 13.12 0.00 -1.26 -4.89 105.19 118.23 2nef n GLY 140 Ca -0.06 -0.63 -0.38 0.00 0.00 0.00 0.00 46.02 44.95 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 -1.22 2.00 -0.04 1.61 -0.00 -1.26 -3.79 118.94 116.24 2nef s TRP 141 Ca 0.00 0.27 -0.01 0.00 -0.00 0.00 0.00 56.10 56.35 2nef s TRP 141 Cb 0.00 -4.34 -0.02 0.00 -0.00 0.00 0.00 33.47 29.10 2nef s TRP 141 CO 0.00 -2.10 2.29 0.00 -0.00 0.00 0.00 176.95 177.15 2nef s TYR 143 N -0.05 2.57 -0.12 0.00 2.02 -1.26 -1.56 117.35 118.95 2nef s TYR 143 Ca 0.16 -1.72 0.03 0.00 -0.37 0.00 0.00 57.07 55.17 2nef s TYR 143 Cb 0.09 -1.70 0.00 0.00 -0.40 0.00 0.00 41.96 39.95 2nef s TYR 143 CO -0.01 -0.77 -0.22 -1.59 -1.57 0.00 0.00 175.55 171.39 2nef s LYS 144 N 1.34 3.06 0.64 -0.62 -2.85 -1.17 -4.57 119.74 115.58 2nef s LYS 144 Ca -0.02 -0.86 -0.11 0.00 -1.00 0.00 0.00 55.97 53.98 2nef s LYS 144 Cb -0.17 -2.38 -0.03 0.00 -2.06 0.00 0.00 37.83 33.20 2nef s LYS 144 CO -0.08 0.11 1.04 -0.51 0.10 0.00 0.00 175.35 176.01 2nef s LEU 145 N 0.52 3.18 -0.29 2.77 1.43 -1.12 -1.45 118.68 123.73 2nef s LEU 145 Ca -0.14 1.43 -0.09 0.00 -1.03 0.00 0.00 54.13 54.30 2nef s LEU 145 Cb -0.17 -4.43 0.13 0.00 0.03 0.00 0.00 46.19 41.75 2nef s LEU 145 CO 0.05 -1.02 0.61 -0.69 0.23 0.00 0.00 176.35 175.53 2nef s VAL 146 N -3.17 -0.95 0.98 -1.59 1.01 -1.05 -2.41 120.40 113.22 2nef s VAL 146 Ca 0.56 0.02 -0.21 0.00 0.00 0.00 0.00 61.98 62.35 2nef s VAL 146 Cb -0.12 -0.95 -0.06 0.00 0.00 0.00 0.00 36.38 35.25 2nef s VAL 146 CO 0.54 0.01 -0.81 -2.65 0.00 0.00 0.00 175.10 172.19 2nef n PRO 147 N 5.44 -0.65 -2.73 2.72 -0.02 -1.26 -3.13 135.00 135.36 2nef n PRO 147 Ca -0.10 -0.19 -0.43 0.00 -2.02 0.00 0.00 63.50 60.75 2nef n PRO 147 Cb 0.49 -1.23 0.00 0.00 -0.02 0.00 0.00 33.50 32.74 2nef n PRO 147 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2nef n VAL 148 N -3.79 4.08 0.03 -1.45 0.31 -1.18 -4.76 118.33 111.58 2nef n VAL 148 Ca -0.00 -4.37 -0.10 0.00 -0.01 0.00 0.00 64.34 59.86 2nef n VAL 148 Cb 0.61 -2.40 0.04 0.00 -0.91 0.00 0.00 33.84 31.17 2nef n VAL 148 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2nef h GLU 149 N 7.35 0.46 -4.55 5.55 4.39 -1.94 -3.38 114.58 122.46 2nef h GLU 149 Ca 0.39 -0.34 -0.74 0.00 0.34 0.00 0.00 59.36 59.01 2nef h GLU 149 Cb 0.87 0.06 -0.18 0.00 -0.10 0.00 0.00 28.75 29.39 2nef h GLU 149 CO 1.37 0.96 1.35 -0.35 -1.16 0.00 0.00 179.01 181.19 2nef n PRO 150 N -3.89 3.41 -0.17 2.33 -0.04 -1.26 -4.88 135.00 130.50 2nef n PRO 150 Ca -0.04 -3.87 -0.00 0.00 -0.04 0.00 0.00 63.50 59.55 2nef n PRO 150 Cb 0.66 -2.99 -0.01 0.00 -0.04 0.00 0.00 33.50 31.12 2nef n PRO 150 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2nef n GLU 151 N 5.25 0.34 -0.32 0.54 0.00 -1.26 -4.23 120.64 120.97 2nef n GLU 151 Ca 0.36 -0.04 -0.05 0.00 0.00 0.00 0.00 57.16 57.43 2nef n GLU 151 Cb 0.42 -1.39 0.05 0.00 0.00 0.00 0.00 31.44 30.52 2nef n GLU 151 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.13 178.30 2nef n LYS 152 N 1.98 1.40 0.00 5.31 4.81 -1.26 -4.85 118.16 125.55 2nef n LYS 152 Ca 0.02 -0.80 0.00 0.00 -0.87 0.00 0.00 58.31 56.66 2nef n LYS 152 Cb 0.17 -1.35 0.00 0.00 0.02 0.00 0.00 35.03 33.86 2nef n LYS 152 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 2nef n LEU 153 N 0.08 0.00 -2.73 3.14 4.77 -1.26 -5.08 117.00 115.92 2nef n LEU 153 Ca 0.15 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 56.06 2nef n LEU 153 Cb 0.78 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.92 2nef n LEU 153 CO 0.15 0.00 0.28 -1.84 -1.33 0.00 0.00 177.39 174.65 2nef n GLU 154 N 0.00 0.64 0.00 3.23 0.28 -1.26 -5.15 120.64 118.38 2nef n GLU 154 Ca 0.00 -1.53 0.00 0.00 -0.16 0.00 0.00 57.16 55.47 2nef n GLU 154 Cb 0.00 -1.22 0.00 0.00 1.43 0.00 0.00 31.44 31.65 2nef n GLU 154 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 2nef n GLU 155 N 1.67 0.41 0.00 3.44 4.71 -1.26 -5.07 120.64 124.54 2nef n GLU 155 Ca 0.08 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.23 2nef n GLU 155 Cb 0.64 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 31.07 2nef n GLU 155 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2nef n ALA 156 N -3.00 0.05 -1.47 0.62 0.00 -1.26 -4.97 120.51 110.48 2nef n ALA 156 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.05 2nef n ALA 156 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 2nef n ALA 156 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2nef n ASN 157 N 0.00 8.31 -3.64 0.00 0.23 -1.26 -4.77 115.26 114.13 2nef n ASN 157 Ca 0.00 -2.70 -0.07 0.00 -0.53 0.00 0.00 54.58 51.28 2nef n ASN 157 Cb 0.00 -1.53 -0.07 0.00 -2.08 0.00 0.00 39.78 36.10 2nef n ASN 157 CO 0.00 0.00 0.00 -0.75 -0.93 0.00 0.00 177.26 175.58 2nef s LYS 158 N 1.61 0.45 0.00 -3.83 2.20 -1.26 -5.18 119.74 113.73 2nef s LYS 158 Ca 0.65 0.58 0.00 0.00 -0.36 0.00 0.00 55.97 56.84 2nef s LYS 158 Cb 0.18 0.19 0.00 0.00 -1.51 0.00 0.00 37.83 36.69 2nef s LYS 158 CO -0.07 -0.06 0.00 -0.25 -0.36 0.00 0.00 175.35 174.61 2nef n ASP 174 N 2.49 0.00 -2.88 1.43 9.92 -1.26 -4.96 116.55 121.29 2nef n ASP 174 Ca -0.14 0.00 -0.11 0.00 -0.53 0.00 0.00 54.79 54.01 2nef n ASP 174 Cb 0.56 0.00 0.01 0.00 -0.64 0.00 0.00 41.12 41.05 2nef n ASP 174 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 2nef n ASP 175 N 0.00 -2.38 -3.14 -2.24 5.75 -1.26 -5.05 116.55 108.23 2nef n ASP 175 Ca 0.00 -3.02 -0.04 0.00 -0.01 0.00 0.00 54.79 51.72 2nef n ASP 175 Cb 0.00 1.21 0.04 0.00 -1.03 0.00 0.00 41.12 41.34 2nef n ASP 175 CO 0.00 0.00 0.00 -2.65 -0.11 0.00 0.00 177.20 174.44 2nef n PRO 176 N 2.10 -0.25 0.00 0.11 -0.02 -1.26 -4.77 135.00 130.91 2nef n PRO 176 Ca 0.15 -0.19 0.13 0.00 -2.02 0.00 0.00 63.50 61.57 2nef n PRO 176 Cb 0.58 -0.40 0.74 0.00 -0.02 0.00 0.00 33.50 34.40 2nef n PRO 176 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2nef n GLU 177 N -0.99 0.96 -2.48 -0.52 4.71 -1.26 -4.52 120.64 116.54 2nef n GLU 177 Ca 0.02 0.00 -0.41 0.00 -0.01 0.00 0.00 57.16 56.76 2nef n GLU 177 Cb 0.08 -1.41 -0.01 0.00 -1.01 0.00 0.00 31.44 29.09 2nef n GLU 177 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 2nef n ARG 178 N -0.91 2.95 -2.53 3.49 1.74 -1.26 -4.96 116.66 115.19 2nef n ARG 178 Ca 0.19 -3.14 -0.41 0.00 -0.77 0.00 0.00 57.85 53.72 2nef n ARG 178 Cb 0.09 -3.53 -0.04 0.00 -1.02 0.00 0.00 32.46 27.96 2nef n ARG 178 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2nef s GLU 179 N 4.53 4.61 0.65 5.56 2.02 -1.26 -5.04 118.70 129.77 2nef s GLU 179 Ca 0.56 1.71 -0.05 0.00 0.02 0.00 0.00 54.97 57.20 2nef s GLU 179 Cb 0.04 -3.27 0.04 0.00 0.10 0.00 0.00 34.13 31.03 2nef s GLU 179 CO 0.08 0.11 0.95 0.08 0.02 0.00 0.00 175.26 176.50 2nef s VAL 180 N -0.37 2.82 0.07 2.63 1.01 -1.26 -4.88 120.40 120.42 2nef s VAL 180 Ca 0.48 -0.22 0.07 0.00 0.00 0.00 0.00 61.98 62.32 2nef s VAL 180 Cb -0.29 -3.16 -0.04 0.00 0.00 0.00 0.00 36.38 32.89 2nef s VAL 180 CO 0.35 -0.17 -0.16 -0.76 0.00 0.00 0.00 175.10 174.37 2nef s LEU 181 N -5.10 2.75 0.00 3.92 1.43 -1.21 -3.09 118.68 117.37 2nef s LEU 181 Ca 0.57 -0.45 0.08 0.00 -1.03 0.00 0.00 54.13 53.31 2nef s LEU 181 Cb -0.11 -1.60 -0.02 0.00 0.03 0.00 0.00 46.19 44.50 2nef s LEU 181 CO 0.44 0.22 -0.26 -1.83 0.23 0.00 0.00 176.35 175.15 2nef s GLU 182 N -1.80 1.96 -0.44 1.70 -1.05 -1.18 0.36 118.70 118.25 2nef s GLU 182 Ca 0.17 -0.97 -0.29 0.00 -0.15 0.00 0.00 54.97 53.73 2nef s GLU 182 Cb -0.11 -1.97 0.01 0.00 -0.44 0.00 0.00 34.13 31.62 2nef s GLU 182 CO 0.08 0.53 1.41 -1.58 0.95 0.00 0.00 175.26 176.66 2nef s TRP 183 N -0.66 2.38 -0.63 4.83 0.51 -0.97 -2.54 118.94 121.85 2nef s TRP 183 Ca 0.10 0.65 -0.20 0.00 -2.12 0.00 0.00 56.10 54.53 2nef s TRP 183 Cb -0.10 -4.33 0.10 0.00 -0.81 0.00 0.00 33.47 28.33 2nef s TRP 183 CO -0.00 -1.97 0.80 1.03 -0.51 0.00 0.00 176.95 176.30 2nef s ARG 184 N 5.03 3.10 0.26 4.98 1.81 -0.53 -1.22 118.95 132.39 2nef s ARG 184 Ca 0.60 -1.24 -0.30 0.00 -1.72 0.00 0.00 55.73 53.07 2nef s ARG 184 Cb -0.13 -4.30 -0.10 0.00 -0.45 0.00 0.00 34.95 29.98 2nef s ARG 184 CO 0.32 -1.62 1.35 0.12 -0.68 0.00 0.00 175.30 174.78 2nef s PHE 185 N 3.00 3.11 -0.42 -0.53 2.19 -1.26 -3.05 117.98 121.02 2nef s PHE 185 Ca 0.16 1.23 0.09 0.00 0.33 0.00 0.00 56.93 58.73 2nef s PHE 185 Cb -0.21 -3.70 0.35 0.00 -1.31 0.00 0.00 43.02 38.15 2nef s PHE 185 CO 0.06 -2.12 1.08 -3.47 1.83 0.00 0.00 175.22 172.60 2nef n ASP 186 N 1.90 -1.39 -0.30 6.13 2.03 -0.60 -4.98 116.55 119.33 2nef n ASP 186 Ca 0.04 -3.25 0.30 0.00 0.52 0.00 0.00 54.79 52.40 2nef n ASP 186 Cb 0.42 1.10 0.46 0.00 -0.72 0.00 0.00 41.12 42.37 2nef n ASP 186 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 2nef n SER 187 N 0.12 0.00 0.27 1.67 3.41 -1.26 0.16 113.62 117.99 2nef n SER 187 Ca 0.08 0.70 0.13 0.00 -0.26 0.00 0.00 58.87 59.53 2nef n SER 187 Cb 0.73 -0.28 0.78 0.00 -0.26 0.00 0.00 64.21 65.18 2nef n SER 187 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 175.04 174.96 2nef h ARG 188 N 0.00 0.00 0.00 4.33 0.11 -1.93 0.48 114.38 117.36 2nef h ARG 188 Ca 0.53 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.61 2nef h ARG 188 Cb 2.71 0.00 0.00 0.00 1.11 0.00 0.00 29.97 33.79 2nef h ARG 188 CO -0.01 0.09 0.00 -0.11 0.10 0.00 0.00 179.97 180.04 2nef n LEU 189 N -3.70 0.00 0.00 0.08 0.00 0.42 -1.51 117.00 112.29 2nef n LEU 189 Ca -0.02 0.00 0.13 0.00 0.00 0.00 0.00 56.01 56.11 2nef n LEU 189 Cb 0.19 0.00 0.69 0.00 0.00 0.00 0.00 43.42 44.31 2nef n LEU 189 CO 0.29 0.00 0.93 0.00 0.00 0.00 0.00 177.39 178.61 2nef n ALA 190 N -0.91 2.35 -0.54 1.96 0.00 0.16 -4.16 120.51 119.37 2nef n ALA 190 Ca 0.04 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2nef n ALA 190 Cb 0.02 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.06 2nef n ALA 190 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2nef n PHE 191 N -1.16 0.00 -1.51 0.00 3.72 -0.57 -4.87 117.46 113.07 2nef n PHE 191 Ca 0.15 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.26 2nef n PHE 191 Cb 0.15 0.00 0.12 0.00 -0.94 0.00 0.00 39.48 38.81 2nef n PHE 191 CO 0.00 0.00 0.00 -3.38 -0.05 0.00 0.00 176.76 173.33 2nef s HIS 192 N -0.46 2.62 -0.32 1.38 -3.43 -1.26 -5.06 115.29 108.76 2nef s HIS 192 Ca 0.00 1.00 0.03 0.00 -0.80 0.00 0.00 55.06 55.29 2nef s HIS 192 Cb 0.00 -3.26 0.16 0.00 -1.43 0.00 0.00 32.58 28.05 2nef s HIS 192 CO 0.00 -2.14 0.42 -1.58 -2.00 0.00 0.00 174.74 169.44 2nef s HIS 193 N -3.20 -0.89 0.10 0.38 2.46 -1.26 -4.80 115.29 108.07 2nef s HIS 193 Ca 0.63 0.01 -0.10 0.00 0.47 0.00 0.00 55.06 56.07 2nef s HIS 193 Cb -0.15 -0.18 -0.17 0.00 -0.13 0.00 0.00 32.58 31.95 2nef s HIS 193 CO 0.54 -1.00 1.25 1.98 -2.47 0.00 0.00 174.74 175.04 2nef h MET 194 N 7.78 0.61 -1.10 2.88 4.05 -1.95 -3.21 114.93 123.98 2nef h MET 194 Ca -0.04 -0.63 0.31 0.00 -0.28 0.00 0.00 59.70 59.06 2nef h MET 194 Cb 1.11 0.17 -0.06 0.00 -0.80 0.00 0.00 31.60 32.02 2nef h MET 194 CO 0.23 1.24 0.76 0.00 0.23 0.00 0.00 176.91 179.37 2nef h ALA 195 N 0.55 2.78 -0.21 0.39 0.00 -1.93 0.30 119.26 121.13 2nef h ALA 195 Ca -0.10 -0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.62 2nef h ALA 195 Cb 1.61 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.47 2nef h ALA 195 CO 0.18 -1.14 -0.58 -0.09 0.00 0.00 0.00 179.25 177.63 2nef h ARG 196 N 0.13 0.77 0.00 0.00 2.43 -1.86 -3.03 114.38 112.82 2nef h ARG 196 Ca 0.56 -0.54 -0.01 0.00 -0.81 0.00 0.00 59.98 59.17 2nef h ARG 196 Cb 1.94 0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 31.57 2nef h ARG 196 CO -0.11 1.16 -0.06 1.49 -1.51 0.00 0.00 179.97 180.94 2nef h GLU 197 N 0.50 0.00 0.00 0.20 4.81 -0.57 -3.25 114.58 116.26 2nef h GLU 197 Ca -0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2nef h GLU 197 Cb 1.20 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.58 2nef h GLU 197 CO 0.12 0.06 0.00 1.28 -0.73 0.00 0.00 179.01 179.75 2nef n LEU 198 N -3.18 0.23 -3.34 1.64 4.77 -0.44 -4.86 117.00 111.81 2nef n LEU 198 Ca 0.01 0.53 -0.19 0.00 -0.03 0.00 0.00 56.01 56.33 2nef n LEU 198 Cb 0.35 -0.45 -0.08 0.00 -2.33 0.00 0.00 43.42 40.91 2nef n LEU 198 CO 0.29 -0.45 -0.18 -1.00 -1.33 0.00 0.00 177.39 174.72 2nef s HIS 199 N -1.20 -0.08 -0.42 -1.77 3.76 -1.16 -4.98 115.29 109.44 2nef s HIS 199 Ca 0.00 -1.09 0.23 0.00 -0.15 0.00 0.00 55.06 54.05 2nef s HIS 199 Cb 0.00 -0.49 0.21 0.00 1.11 0.00 0.00 32.58 33.42 2nef s HIS 199 CO 0.00 -0.95 1.27 -1.00 -0.85 0.00 0.00 174.74 173.21 2nef h PRO 200 N 6.76 0.00 0.00 8.40 0.13 -1.75 -3.34 132.00 142.21 2nef h PRO 200 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 2nef h PRO 200 Cb 1.03 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.16 2nef h PRO 200 CO 0.21 0.00 0.13 0.39 -0.23 0.00 0.00 178.00 178.50 2nef n GLU 201 N -2.56 0.00 0.00 0.86 1.02 -1.26 -0.88 120.64 117.82 2nef n GLU 201 Ca 0.02 0.33 0.00 0.00 -0.02 0.00 0.00 57.16 57.49 2nef n GLU 201 Cb 0.51 -1.63 0.00 0.00 -0.02 0.00 0.00 31.44 30.29 2nef n GLU 201 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2nef n TYR 202 N -1.32 0.00 0.00 -0.32 4.01 -1.25 -3.76 117.16 114.52 2nef n TYR 202 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 2nef n TYR 202 Cb 0.13 -0.04 0.00 0.00 -0.31 0.00 0.00 39.34 39.12 2nef n TYR 202 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 2nef n PHE 203 N -0.19 -0.60 -1.59 -0.72 3.01 -0.06 -5.10 117.46 112.21 2nef n PHE 203 Ca 0.00 0.00 -0.35 0.00 1.01 0.00 0.00 57.45 58.11 2nef n PHE 203 Cb 0.11 0.35 0.08 0.00 -0.01 0.00 0.00 39.48 40.01 2nef n PHE 203 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 2nef s LYS 204 N -1.71 2.35 0.55 -1.08 -0.14 -1.18 -4.95 119.74 113.59 2nef s LYS 204 Ca 0.00 1.85 -0.19 0.00 -1.36 0.00 0.00 55.97 56.27 2nef s LYS 204 Cb 0.00 -1.85 -0.05 0.00 -1.68 0.00 0.00 37.83 34.25 2nef s LYS 204 CO 0.00 -1.69 1.16 0.54 -0.76 0.00 0.00 175.35 174.59 2nef s ASN 205 N -1.80 5.58 0.00 2.83 2.20 -1.26 -4.87 114.94 117.61 2nef s ASN 205 Ca 0.77 2.25 0.31 0.00 -0.94 0.00 0.00 52.86 55.25 2nef s ASN 205 Cb -0.32 -2.59 1.70 0.00 -2.00 0.00 0.00 41.25 38.04 2nef s ASN 205 CO 0.42 -1.32 2.11 0.00 -2.94 0.00 0.00 177.10 175.37