# AA SS3 SS8 ASA HSEa-u HSEa-d CN13 theta tau phi psi P(3-C) P(3-E) P(3-H) P(8-C) P(8-S) P(8-T) P(8-H) P(8-G) P(8-I) P(8-E) P(8-B) 0 M C C 117.85 4.75 11.47 17.92 114.06 -155.73 -95.40 128.01 99.78 0.17 0.04 99.76 0.08 0.04 0.02 0.00 0.00 0.08 0.02 1 M C C 124.00 4.11 8.37 14.29 113.86 -156.01 -95.62 126.21 81.58 7.54 10.88 77.34 1.38 3.32 8.65 1.94 0.00 4.80 2.58 2 R C C 166.35 2.26 8.57 12.55 114.59 -156.32 -95.88 131.54 71.38 10.46 18.16 55.42 8.32 6.46 13.97 5.24 0.02 8.43 2.14 3 R C C 166.98 2.52 8.70 13.03 112.34 -142.16 -91.79 126.51 62.75 11.28 25.96 46.55 8.03 7.20 19.17 7.72 0.02 9.33 1.97 4 L C C 113.97 3.84 8.23 13.87 111.77 -146.09 -90.96 124.44 58.04 8.96 33.00 40.61 8.76 8.09 24.08 9.71 0.03 6.99 1.73 5 A C C 77.93 3.31 9.18 14.21 110.85 -146.31 -88.85 122.17 58.28 8.52 33.20 41.04 8.89 7.87 25.42 8.54 0.03 6.56 1.66 6 L C C 114.64 3.85 9.46 15.10 111.47 -142.04 -91.24 119.64 59.84 8.16 32.01 42.43 9.88 7.16 25.87 6.82 0.03 6.24 1.57 7 Q C C 121.19 3.76 10.31 15.82 113.07 -145.82 -91.80 123.17 63.26 6.77 29.97 46.39 9.88 6.18 25.97 5.02 0.01 5.33 1.21 8 S C C 73.36 4.80 10.24 16.68 110.97 -140.14 -83.98 128.48 58.76 6.32 34.92 41.70 8.13 8.37 28.09 7.51 0.02 4.99 1.20 9 S C C 75.35 4.20 10.73 16.51 108.26 -147.19 -91.39 86.37 52.80 8.18 39.02 33.50 10.19 9.37 29.45 9.61 0.05 6.24 1.58 10 I C C 106.56 5.47 10.19 17.21 108.36 135.72 -92.53 101.26 49.65 12.01 38.34 31.99 9.41 8.53 28.90 9.51 0.09 9.43 2.14 11 R C C 145.16 4.59 11.34 17.66 112.94 -151.62 -92.55 127.17 58.59 11.60 29.80 39.61 9.63 8.79 23.62 6.95 0.05 9.08 2.27 12 R C C 154.14 4.09 11.55 17.42 113.27 -147.03 -94.32 127.77 67.94 10.75 21.31 45.36 11.33 10.40 17.15 5.23 0.04 7.68 2.82 13 A C C 67.80 6.46 10.05 18.03 115.40 -152.03 -93.87 134.33 81.27 5.93 12.80 55.56 18.51 6.75 10.38 3.19 0.01 3.62 1.98 14 T C C 85.68 4.60 11.87 18.10 117.82 -134.85 -97.20 139.43 84.54 3.55 11.91 61.55 16.34 6.34 8.24 4.09 0.00 2.28 1.14 15 P C C 91.48 4.96 11.43 17.91 107.99 -107.37 -70.01 136.90 76.91 3.34 19.75 53.16 10.64 12.67 10.35 9.84 0.00 2.17 1.17 16 F C C 131.53 6.16 10.50 17.95 105.29 -122.49 -84.25 34.20 74.15 4.20 21.65 44.87 14.59 14.64 11.55 10.23 0.01 2.42 1.68 17 A C C 73.82 4.66 11.49 17.63 105.58 63.34 -88.76 47.06 75.01 3.53 21.46 49.35 15.01 10.41 13.68 8.08 0.01 1.99 1.48 18 T C C 80.04 5.94 11.15 18.54 115.81 109.65 -95.54 132.45 68.47 1.55 29.97 48.43 15.38 4.32 27.29 3.27 0.00 0.77 0.53 19 P H H 91.55 3.63 13.18 17.97 105.34 -109.99 -69.29 132.49 46.74 1.70 51.56 35.68 5.50 6.08 45.78 5.42 0.00 1.13 0.41 20 L H H 93.05 6.63 11.85 19.71 105.11 -113.48 -76.67 28.96 35.98 2.70 61.32 27.21 4.80 5.68 52.74 7.03 0.02 1.94 0.58 21 V H H 74.05 7.91 11.40 20.44 104.68 56.22 -78.65 1.95 30.76 3.14 66.10 23.63 4.34 4.81 57.87 6.42 0.02 2.31 0.60 22 A H H 68.18 4.03 13.95 18.95 99.60 52.64 -73.17 -35.40 30.92 2.65 66.43 22.59 4.81 5.44 59.47 5.26 0.02 1.84 0.57 23 S H H 68.24 4.30 13.78 19.14 98.72 52.57 -74.88 -29.06 33.69 2.25 64.06 23.24 5.81 6.54 56.99 5.38 0.02 1.49 0.54 24 T H H 70.01 8.08 11.72 20.86 100.02 54.96 -80.29 -18.55 32.84 2.55 64.61 22.09 5.32 7.32 56.54 6.34 0.03 1.74 0.63 25 K H H 133.40 3.69 14.50 19.48 100.83 58.22 -76.82 -20.58 35.75 3.14 61.11 22.25 6.66 9.04 52.05 7.06 0.05 2.01 0.88 26 A C H 68.87 4.95 13.62 19.60 102.51 56.23 -78.51 -1.36 48.92 3.26 47.83 29.13 8.85 12.60 40.37 6.02 0.05 1.88 1.10 27 L C C 87.74 8.19 11.69 20.89 103.50 52.79 -85.37 10.54 60.75 2.45 36.80 36.28 13.14 11.93 31.09 5.29 0.03 1.20 1.03 28 N C C 89.01 6.39 12.89 20.62 112.04 63.09 -85.29 131.14 70.67 1.33 28.00 49.67 13.15 7.68 20.79 7.47 0.00 0.67 0.56 29 P C C 90.22 4.44 13.56 19.15 101.25 -117.00 -68.56 -17.68 65.77 1.83 32.40 47.40 6.96 11.17 20.48 12.15 0.00 1.14 0.69 30 M C C 112.32 5.84 12.21 19.27 101.74 59.65 -79.57 -10.13 59.85 4.45 35.70 38.59 8.82 12.43 20.96 14.85 0.02 2.80 1.53 31 C C C 73.49 7.82 11.26 20.13 102.81 72.53 -83.89 4.49 63.60 4.42 31.98 39.40 11.06 13.13 19.96 12.19 0.02 2.68 1.56 32 S C C 77.62 3.89 13.14 18.41 103.50 79.49 -85.37 20.73 67.46 5.10 27.44 38.90 14.23 14.39 17.80 9.86 0.03 3.33 1.47 33 A C C 73.03 4.90 12.26 18.68 107.92 88.72 -88.30 93.88 65.91 8.81 25.29 42.14 13.73 9.79 17.89 7.99 0.03 6.66 1.78 34 I C C 87.80 8.97 11.14 21.15 114.65 138.60 -95.15 128.02 63.06 15.07 21.86 47.61 9.47 5.03 17.65 5.30 0.03 12.75 2.16 35 T C C 83.69 5.07 13.90 20.41 114.78 -148.53 -92.69 131.02 62.54 18.68 18.78 51.58 5.37 4.30 15.20 4.42 0.02 16.94 2.17 36 I C C 87.83 9.08 11.33 21.45 115.44 -161.65 -100.45 128.57 56.73 19.52 23.75 43.41 6.89 5.40 19.43 5.30 0.04 16.95 2.58 37 R C C 134.73 5.70 12.99 20.06 115.88 -165.86 -97.83 134.52 59.46 15.34 25.20 42.15 8.52 7.71 20.49 5.78 0.04 13.19 2.12 38 E C C 122.28 4.74 13.50 19.55 107.62 -129.78 -84.73 106.95 65.84 9.09 25.07 43.44 10.59 10.92 19.86 6.28 0.03 7.19 1.69 39 A C C 64.06 7.26 11.39 19.73 104.31 -132.04 -81.08 32.74 66.58 4.51 28.91 40.70 12.18 13.22 22.98 6.67 0.02 3.01 1.21 40 S C C 68.53 5.63 12.51 19.43 105.41 83.94 -88.13 35.09 67.06 3.69 29.25 42.38 11.64 12.45 23.82 6.29 0.02 2.36 1.05 41 T C C 83.14 5.83 12.28 19.40 107.39 97.15 -93.93 45.32 56.55 4.91 38.54 34.23 12.25 10.80 31.61 6.66 0.06 3.16 1.24 42 V C H 86.14 6.06 12.99 20.39 113.22 135.83 -95.46 122.63 49.05 8.06 42.89 31.37 9.53 9.16 36.05 6.27 0.08 6.00 1.55 43 A C H 61.25 7.01 13.59 21.75 108.03 -131.23 -84.87 123.83 45.85 9.73 44.43 31.20 7.91 7.58 38.12 5.76 0.06 7.83 1.55 44 I C H 84.07 9.18 13.00 23.01 107.90 -160.46 -89.51 78.79 44.48 11.17 44.35 31.21 7.52 6.52 39.27 4.66 0.07 9.01 1.73 45 S C C 56.16 5.69 16.57 23.02 112.49 -113.99 -85.15 144.61 53.03 6.28 40.68 40.42 6.07 6.27 37.78 3.67 0.01 4.58 1.20 46 V H H 70.61 11.08 13.96 25.32 95.47 -107.63 -66.47 -35.89 24.21 1.57 74.21 12.69 5.47 8.45 68.22 3.70 0.06 0.95 0.45 47 Q H H 109.16 4.39 17.86 22.88 93.93 53.91 -66.24 -37.71 21.02 0.71 78.28 6.83 3.70 11.69 72.57 4.42 0.09 0.42 0.28 48 G H H 30.27 5.37 17.50 23.86 93.55 51.27 -65.43 -39.97 19.65 0.40 79.94 6.67 3.02 10.97 73.98 4.89 0.06 0.23 0.18 49 L H H 53.16 12.12 16.50 28.87 92.97 52.54 -66.60 -39.96 10.28 0.28 89.44 4.12 1.70 5.13 83.64 5.11 0.04 0.17 0.11 50 H H H 78.82 12.68 18.18 30.49 92.48 53.44 -64.40 -40.48 10.28 0.60 89.11 3.60 1.53 5.78 83.62 4.78 0.07 0.43 0.18 51 Y H H 127.06 4.68 21.88 26.54 92.62 49.85 -66.55 -40.21 10.45 0.95 88.60 3.45 1.59 6.06 84.00 3.83 0.07 0.77 0.23 52 V H H 76.36 5.33 22.77 28.06 92.47 49.38 -65.74 -41.80 8.16 0.83 91.01 2.91 1.31 4.27 88.82 1.77 0.05 0.66 0.21 53 G H H 15.37 15.39 18.78 33.99 92.85 49.88 -65.50 -41.62 8.85 0.42 90.74 3.02 1.23 4.71 89.26 1.35 0.02 0.26 0.14 54 T H H 51.35 11.62 21.31 32.76 92.04 51.50 -64.26 -41.18 5.99 0.14 93.87 1.86 0.87 3.29 92.62 1.20 0.02 0.07 0.07 55 G H H 34.19 5.06 24.17 29.06 92.02 50.51 -63.96 -42.38 5.29 0.12 94.58 1.83 0.71 2.77 93.32 1.23 0.02 0.06 0.05 56 L H H 68.13 8.82 23.84 32.66 92.03 49.25 -65.18 -41.71 4.28 0.09 95.63 1.45 0.57 2.33 94.32 1.24 0.02 0.04 0.03 57 A H H 23.57 16.88 19.96 36.37 91.95 51.77 -64.30 -41.20 4.78 0.10 95.12 1.61 0.60 2.63 93.84 1.22 0.02 0.05 0.03 58 A H H 49.59 7.68 23.82 31.57 91.93 51.33 -64.38 -41.34 5.46 0.15 94.39 1.80 0.67 3.08 92.94 1.36 0.02 0.09 0.05 59 I H H 90.68 4.05 25.41 29.26 91.97 49.47 -64.72 -41.80 4.65 0.15 95.20 1.41 0.63 2.72 93.56 1.53 0.03 0.09 0.05 60 A H H 27.27 13.95 20.27 34.29 91.99 51.08 -64.34 -41.92 6.18 0.17 93.66 1.50 0.71 4.02 91.59 1.98 0.04 0.10 0.06 61 L H H 58.15 13.15 21.45 34.25 92.09 50.23 -64.52 -41.36 8.83 0.19 90.98 1.75 1.04 6.22 88.55 2.20 0.06 0.10 0.08 62 A H H 58.84 4.49 24.36 28.43 92.02 49.82 -64.77 -41.37 9.02 0.15 90.83 1.65 1.20 6.15 89.28 1.54 0.05 0.06 0.08 63 G H H 28.53 7.09 22.42 29.94 92.22 49.96 -64.98 -42.05 11.99 0.17 87.84 2.43 1.61 7.91 86.12 1.71 0.04 0.07 0.09 64 V H H 42.21 13.79 20.21 33.84 92.17 50.19 -65.47 -41.11 10.30 0.11 89.59 1.68 1.28 7.19 87.85 1.83 0.05 0.05 0.07 65 G H H 29.11 8.92 21.64 30.70 92.02 52.01 -64.17 -41.77 9.00 0.10 90.90 1.52 1.06 6.25 89.49 1.53 0.05 0.04 0.06 66 L H H 90.63 3.93 24.07 27.72 91.85 49.59 -65.34 -41.03 6.69 0.05 93.25 0.92 0.75 4.79 92.47 0.99 0.03 0.02 0.04 67 G H H 22.08 10.12 20.34 30.83 92.32 50.64 -64.62 -42.16 5.87 0.04 94.08 0.92 0.61 4.12 93.61 0.67 0.02 0.01 0.03 68 I H H 58.76 11.90 20.93 32.76 91.85 50.21 -64.30 -41.32 1.51 0.00 98.49 0.32 0.14 0.84 98.44 0.26 0.00 0.00 0.00 69 G H H 31.03 6.91 21.34 28.66 91.80 51.32 -64.17 -41.60 0.88 0.00 99.12 0.16 0.07 0.51 99.06 0.19 0.00 0.00 0.00 70 T H H 69.18 5.25 22.39 27.73 92.14 49.27 -65.36 -41.21 0.91 0.00 99.09 0.11 0.06 0.65 98.99 0.19 0.00 0.00 0.00 71 I H H 60.16 10.62 20.34 30.82 91.99 49.22 -64.80 -42.55 0.82 0.00 99.18 0.07 0.05 0.61 99.14 0.13 0.00 0.00 0.00 72 F H H 82.81 9.71 20.82 30.65 91.93 49.34 -64.25 -41.72 0.60 0.00 99.40 0.06 0.04 0.39 99.43 0.08 0.00 0.00 0.00 73 G H H 30.04 6.13 20.51 27.23 91.65 51.66 -63.60 -41.48 0.46 0.00 99.54 0.04 0.02 0.30 99.56 0.08 0.00 0.00 0.00 74 N H H 78.62 6.07 21.58 27.72 92.10 49.85 -65.87 -40.20 0.50 0.00 99.50 0.03 0.02 0.36 99.49 0.09 0.00 0.00 0.00 75 L H H 56.43 11.38 18.76 30.22 92.26 50.58 -64.88 -41.37 0.54 0.00 99.46 0.03 0.02 0.40 99.45 0.09 0.00 0.00 0.00 76 L H H 72.96 7.39 19.72 27.72 91.95 49.74 -64.60 -41.74 0.57 0.00 99.43 0.05 0.03 0.39 99.40 0.12 0.00 0.00 0.00 77 V H H 74.74 3.47 20.69 23.78 91.89 49.31 -64.53 -41.84 0.64 0.00 99.36 0.06 0.03 0.45 99.17 0.29 0.00 0.00 0.00 78 A H H 33.84 6.79 17.05 25.41 92.02 50.36 -64.44 -40.90 0.89 0.00 99.11 0.06 0.04 0.67 98.69 0.54 0.00 0.00 0.00 79 C H H 39.89 9.88 14.06 25.36 92.17 50.83 -65.94 -37.81 1.98 0.00 98.01 0.11 0.10 1.66 97.20 0.92 0.00 0.00 0.00 80 A H H 67.28 3.94 15.22 20.20 91.88 54.47 -67.56 -30.39 8.99 0.01 91.00 0.21 0.30 8.57 90.04 0.86 0.01 0.00 0.00 81 R H H 162.08 1.71 15.36 16.93 95.58 45.23 -82.37 -25.28 18.55 0.02 81.43 0.39 1.44 16.52 81.08 0.53 0.03 0.00 0.02 82 Q C C 82.74 5.56 11.81 19.30 113.90 26.50 -131.90 88.27 99.77 0.11 0.12 85.22 14.33 0.20 0.08 0.03 0.00 0.03 0.12 83 P H G 89.52 5.28 11.17 18.72 93.38 -171.97 -62.59 -27.89 29.01 0.06 70.93 2.12 1.59 23.73 7.37 65.11 0.00 0.03 0.03 84 N H G 126.46 1.12 15.44 15.87 92.25 63.56 -75.05 -11.41 26.43 0.08 73.49 1.72 1.54 22.06 10.34 64.24 0.00 0.05 0.05 85 L H G 49.30 9.98 11.20 22.88 95.67 69.11 -84.55 -5.59 15.88 0.17 83.94 8.29 1.66 5.47 25.93 58.50 0.00 0.11 0.04 86 T H H 58.40 11.03 12.79 24.70 93.12 92.13 -61.07 -41.94 3.25 0.02 96.72 1.78 0.35 1.06 94.00 2.79 0.00 0.01 0.00 87 K H H 140.04 1.56 18.61 19.37 91.81 51.22 -64.65 -39.74 1.16 0.01 98.83 0.30 0.10 0.63 96.65 2.31 0.00 0.00 0.00 88 M H H 95.77 3.51 18.47 22.15 92.10 49.79 -65.53 -40.48 0.72 0.00 99.28 0.16 0.05 0.40 97.40 1.99 0.00 0.00 0.00 89 L H H 37.21 13.76 14.31 28.86 91.85 50.95 -64.25 -42.02 0.51 0.00 99.49 0.11 0.04 0.27 99.11 0.46 0.00 0.00 0.00 90 F H H 91.17 8.56 17.86 27.10 91.91 50.22 -64.17 -40.76 0.47 0.00 99.53 0.12 0.04 0.23 99.48 0.12 0.00 0.00 0.00 91 N H H 88.27 2.39 20.77 22.18 91.97 50.57 -64.41 -41.65 0.54 0.00 99.46 0.12 0.04 0.31 99.44 0.09 0.00 0.00 0.00 92 Y H H 102.57 6.66 19.73 26.85 92.10 49.24 -65.80 -40.81 0.42 0.00 99.58 0.08 0.03 0.25 99.56 0.08 0.00 0.00 0.00 93 A H H 21.41 15.37 15.66 31.56 91.80 51.20 -64.24 -41.63 0.42 0.00 99.58 0.07 0.02 0.26 99.59 0.07 0.00 0.00 0.00 94 I H H 85.65 5.67 20.71 26.78 91.81 49.28 -64.24 -41.99 0.33 0.00 99.67 0.03 0.02 0.22 99.67 0.06 0.00 0.00 0.00 95 L H H 95.02 2.34 22.59 23.67 91.52 48.98 -64.40 -42.01 0.30 0.00 99.70 0.03 0.01 0.20 99.67 0.08 0.00 0.00 0.00 96 G H H 18.01 11.14 18.08 30.30 91.60 50.41 -64.23 -41.62 0.59 0.00 99.41 0.05 0.02 0.42 99.35 0.15 0.00 0.00 0.00 97 F H H 60.00 14.07 18.19 32.20 92.22 50.01 -65.01 -41.21 0.74 0.00 99.26 0.06 0.04 0.53 99.18 0.19 0.00 0.00 0.00 98 A H H 55.42 4.01 21.63 25.64 91.54 51.64 -63.48 -42.05 0.83 0.00 99.17 0.10 0.05 0.54 99.15 0.16 0.00 0.00 0.00 99 L H H 88.64 3.72 22.58 25.94 91.91 48.97 -65.15 -41.45 1.20 0.00 98.79 0.23 0.10 0.74 98.71 0.21 0.00 0.00 0.00 100 T H H 26.06 15.63 17.62 33.58 91.92 50.25 -64.60 -41.44 1.02 0.00 98.98 0.25 0.07 0.55 98.95 0.18 0.00 0.00 0.00 101 E H H 76.21 11.42 19.96 31.32 91.75 51.02 -63.71 -40.85 0.74 0.00 99.26 0.11 0.04 0.44 99.29 0.11 0.00 0.00 0.00 102 A H H 57.61 2.59 22.99 24.45 91.47 50.60 -63.91 -42.43 0.54 0.00 99.46 0.08 0.03 0.31 99.50 0.08 0.00 0.00 0.00 103 I H H 67.82 7.51 21.48 29.46 92.07 49.66 -64.84 -41.55 0.27 0.00 99.73 0.04 0.01 0.15 99.75 0.05 0.00 0.00 0.00 104 G H H 9.66 17.35 16.25 34.07 91.61 51.93 -63.31 -41.92 0.25 0.00 99.75 0.04 0.01 0.15 99.76 0.04 0.00 0.00 0.00 105 L H H 84.43 4.92 22.05 26.99 91.66 50.22 -64.18 -41.79 0.14 0.00 99.86 0.01 0.00 0.09 99.87 0.03 0.00 0.00 0.00 106 F H H 115.39 2.49 22.84 24.15 91.66 49.82 -64.61 -42.14 0.07 0.00 99.93 0.01 0.00 0.04 99.93 0.01 0.00 0.00 0.00 107 A H H 22.90 12.63 17.03 30.78 91.86 51.06 -64.19 -41.96 0.05 0.00 99.95 0.00 0.00 0.03 99.96 0.01 0.00 0.00 0.00 108 L H H 62.27 10.83 18.31 29.61 91.81 50.58 -64.41 -41.61 0.05 0.00 99.95 0.00 0.00 0.03 99.95 0.01 0.00 0.00 0.00 109 M H H 102.62 2.68 21.00 22.78 91.71 50.05 -64.40 -41.77 0.08 0.00 99.92 0.00 0.00 0.05 99.92 0.02 0.00 0.00 0.00 110 L H H 75.01 4.75 18.86 24.19 92.05 49.30 -65.15 -41.31 0.15 0.00 99.85 0.01 0.00 0.10 99.84 0.04 0.00 0.00 0.00 111 A H H 26.42 11.51 14.32 27.27 91.66 51.63 -63.87 -41.39 0.33 0.00 99.67 0.02 0.01 0.24 99.54 0.18 0.00 0.00 0.00 112 F H H 105.46 4.62 16.59 21.82 91.89 50.19 -64.30 -40.58 0.47 0.00 99.53 0.03 0.02 0.35 99.05 0.55 0.00 0.00 0.00 113 L H H 99.09 2.13 15.61 17.74 92.07 50.42 -65.30 -39.76 0.76 0.00 99.23 0.06 0.03 0.56 98.08 1.26 0.00 0.00 0.00 114 M H H 95.40 5.58 13.05 19.76 92.53 50.85 -67.11 -37.04 3.81 0.01 96.18 0.24 0.18 3.10 94.04 2.44 0.00 0.00 0.00 115 L H H 95.56 5.95 11.63 18.73 93.39 50.20 -71.47 -31.42 16.75 0.04 83.20 1.18 0.86 14.10 81.71 2.10 0.01 0.02 0.02 116 F H H 151.25 1.99 11.14 13.91 97.88 45.79 -89.81 -7.26 45.65 0.39 53.96 17.34 1.40 25.31 53.77 1.77 0.01 0.14 0.26 117 S C C 69.26 5.02 10.89 17.55 105.26 92.23 -79.09 98.92 99.93 0.05 0.02 99.84 0.07 0.04 0.01 0.00 0.00 0.02 0.01