# 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 41.08 16.67 21.90 37.93 121.39 -160.17 -104.43 134.63 99.71 0.28 0.00 99.76 0.05 0.01 0.00 0.00 0.00 0.17 0.01 1 V C C 14.25 20.76 17.96 38.60 119.66 -158.26 -105.87 131.92 62.79 37.14 0.06 61.63 0.83 0.13 0.02 0.03 0.00 36.53 0.83 2 F E E 66.13 10.86 22.33 33.76 118.23 -157.17 -108.24 128.17 5.22 94.71 0.07 4.59 0.58 0.09 0.04 0.03 0.00 93.53 1.15 3 I E E 10.00 23.17 15.24 38.55 115.93 -167.62 -117.85 118.21 3.19 96.65 0.15 1.93 1.04 0.38 0.09 0.08 0.00 92.59 3.88 4 L C T 55.81 14.26 17.14 32.03 92.90 -16.33 56.10 38.54 99.32 0.38 0.30 0.49 2.31 96.70 0.03 0.17 0.00 0.24 0.05 5 G C T 51.47 4.55 19.15 24.45 94.84 -53.41 81.30 2.72 99.74 0.11 0.15 0.51 2.60 96.69 0.01 0.10 0.00 0.08 0.01 6 V E E 51.52 11.78 14.81 27.79 120.69 113.46 -106.40 132.97 4.08 95.87 0.05 2.41 1.61 0.26 0.03 0.03 0.00 91.70 3.97 7 N E E 79.11 7.49 18.95 27.55 109.96 -130.92 -84.22 118.72 8.38 91.57 0.05 7.10 1.09 0.17 0.02 0.03 0.00 89.98 1.61 8 F C C 21.89 21.21 11.55 32.31 108.41 -163.20 -98.47 86.00 81.67 17.63 0.69 68.78 9.19 2.36 0.23 0.49 0.00 17.83 1.11 9 N C C 77.84 6.27 19.97 26.23 118.09 -138.58 -85.58 157.47 82.06 12.09 5.85 37.77 23.78 20.86 0.95 5.05 0.01 6.60 4.98 10 E C T 112.11 9.15 14.76 24.41 94.15 -84.04 -62.37 -19.46 93.33 0.50 6.16 2.00 16.49 74.86 0.71 5.38 0.00 0.28 0.26 11 H C T 126.36 4.88 17.37 22.98 99.79 43.76 -97.73 -4.56 92.28 1.41 6.31 6.26 14.29 71.43 0.91 5.65 0.00 1.03 0.43 12 K C C 75.44 11.53 17.04 29.16 120.12 89.10 -104.68 132.86 52.96 43.89 3.16 36.05 14.21 3.04 1.46 2.33 0.03 33.96 8.92 13 L E B 39.70 13.46 21.22 35.11 114.00 -136.79 -81.95 130.87 14.74 84.49 0.77 13.99 0.56 0.13 0.86 0.17 0.00 38.80 45.50 14 V H H 3.64 26.35 17.43 44.18 94.41 -133.66 -64.32 -37.06 14.51 4.45 81.04 8.27 1.71 5.09 56.05 24.63 0.05 3.83 0.37 15 Q H H 60.64 16.77 22.68 37.67 91.84 61.15 -63.42 -38.80 10.89 2.88 86.23 2.29 1.65 7.06 56.85 29.35 0.05 2.56 0.20 16 K H H 94.53 7.03 26.72 34.17 93.66 50.53 -70.62 -35.92 6.49 0.85 92.66 1.79 1.05 3.83 56.74 35.78 0.02 0.69 0.11 17 A H H 6.03 20.72 20.66 41.38 91.80 59.60 -64.68 -38.59 6.69 0.18 93.13 1.76 0.86 3.64 53.21 40.36 0.00 0.14 0.02 18 L H G 2.67 26.57 17.35 44.53 91.69 54.07 -71.16 -26.97 8.13 0.16 91.71 1.15 0.88 5.56 34.37 57.87 0.02 0.11 0.03 19 E H G 94.29 11.15 22.04 33.07 91.22 66.31 -67.97 -22.98 21.94 0.16 77.90 1.13 1.43 18.44 21.86 56.89 0.06 0.09 0.10 20 S H G 56.52 8.84 22.37 31.82 93.15 59.12 -84.65 -6.56 41.45 0.31 58.24 2.17 4.28 34.10 9.54 49.45 0.04 0.16 0.25 21 F C S 14.70 23.53 13.74 37.22 118.39 95.02 -91.46 136.81 94.24 4.65 1.11 11.72 80.71 1.27 0.59 0.21 0.00 0.82 4.67 22 Y C T 107.38 10.80 22.57 33.17 108.57 -97.43 -65.49 124.67 98.57 0.37 1.06 0.54 11.89 86.53 0.24 0.45 0.00 0.14 0.21 23 G C T 37.66 8.79 21.81 30.92 96.34 10.57 84.96 -3.51 99.35 0.08 0.57 0.78 11.21 87.54 0.15 0.25 0.00 0.04 0.03 24 L C C 11.28 23.77 12.29 35.82 112.39 109.57 -102.42 112.12 92.03 7.41 0.56 66.41 21.70 1.07 0.44 0.13 0.00 1.44 8.81 25 G C C 27.81 6.32 23.15 29.49 127.65 -164.52 -95.07 171.24 99.41 0.19 0.40 98.27 1.02 0.12 0.41 0.01 0.00 0.04 0.12 26 Q H H 105.24 10.47 16.55 27.44 92.76 -91.50 -60.87 -38.02 2.57 0.00 97.43 0.33 0.38 1.46 97.65 0.18 0.00 0.00 0.00 27 Q H H 124.71 1.72 23.11 23.65 91.90 51.68 -64.40 -40.40 1.80 0.00 98.20 0.23 0.16 1.14 98.29 0.17 0.00 0.00 0.00 28 A H H 17.73 14.19 19.44 34.27 92.08 48.86 -65.35 -41.69 0.54 0.00 99.46 0.13 0.04 0.27 99.45 0.11 0.00 0.00 0.00 29 S H H 2.83 24.70 15.80 40.83 91.11 51.58 -62.69 -43.05 0.08 0.00 99.92 0.01 0.00 0.03 99.93 0.02 0.00 0.00 0.00 30 A H H 47.48 8.56 23.26 32.07 91.51 51.21 -63.37 -41.04 0.04 0.00 99.96 0.00 0.00 0.02 99.97 0.00 0.00 0.00 0.00 31 R H H 115.91 4.08 25.49 29.39 91.77 50.23 -64.25 -42.28 0.04 0.00 99.96 0.00 0.00 0.02 99.97 0.01 0.00 0.00 0.00 32 I H H 5.27 22.51 19.28 42.05 91.53 48.85 -64.05 -43.99 0.05 0.00 99.95 0.00 0.00 0.03 99.95 0.01 0.00 0.00 0.00 33 L H H 12.30 21.43 17.50 38.70 91.59 50.37 -62.83 -41.58 0.15 0.00 99.85 0.01 0.00 0.09 99.84 0.06 0.00 0.00 0.00 34 A H H 67.82 3.66 21.63 25.37 91.72 50.51 -64.82 -39.64 0.65 0.00 99.35 0.01 0.01 0.61 98.98 0.39 0.00 0.00 0.00 35 K H H 109.44 6.78 19.84 27.32 91.65 51.07 -67.21 -32.38 3.85 0.00 96.15 0.03 0.06 4.30 95.12 0.50 0.00 0.00 0.00 36 Y C T 32.09 19.16 14.14 33.29 97.87 38.08 -99.85 3.73 71.90 0.02 28.08 0.28 1.30 70.21 27.28 0.89 0.00 0.01 0.03 37 S C T 81.74 3.09 23.00 26.40 93.96 -122.29 61.14 40.60 99.89 0.00 0.10 1.42 0.65 97.88 0.03 0.02 0.00 0.00 0.00 38 I C C 10.96 24.46 10.63 34.72 118.16 164.28 -91.69 134.07 99.34 0.61 0.04 97.12 2.01 0.04 0.02 0.01 0.00 0.11 0.70 39 H C C 86.00 6.52 23.16 29.90 109.74 -115.24 -73.92 127.19 99.86 0.11 0.03 99.65 0.20 0.04 0.00 0.00 0.00 0.03 0.06 40 P C T 60.51 15.86 14.61 30.27 91.96 -140.07 -63.13 -21.40 99.74 0.06 0.21 0.41 2.64 96.74 0.01 0.15 0.00 0.03 0.02 41 R C T 161.02 2.58 21.23 24.08 93.47 59.28 -89.78 -1.40 99.72 0.07 0.21 0.50 1.95 97.31 0.01 0.18 0.00 0.04 0.01 42 A C C 14.62 16.97 13.19 31.28 117.71 119.73 -69.71 145.03 99.28 0.67 0.05 70.46 28.74 0.17 0.01 0.04 0.00 0.28 0.29 43 K E B 86.84 6.66 24.67 31.61 121.35 -125.75 -85.30 151.65 20.81 79.14 0.05 16.16 0.34 0.01 0.04 0.00 0.00 4.25 79.20 44 M H G 19.77 23.87 14.08 37.73 95.36 -108.21 -58.97 -34.26 11.80 0.10 88.10 0.55 0.94 8.12 0.43 89.89 0.00 0.06 0.01 45 G H G 42.83 8.27 20.69 29.47 93.10 51.66 -50.50 -13.90 11.76 0.03 88.22 0.15 0.54 9.11 0.24 89.94 0.00 0.01 0.00 46 T H G 87.42 3.94 21.49 25.84 95.65 59.95 -93.14 -5.46 11.86 0.05 88.09 0.72 1.34 7.06 0.32 90.53 0.00 0.02 0.01 47 L C S 10.52 24.45 8.12 31.29 116.41 104.20 -75.18 138.73 99.69 0.21 0.10 37.41 62.11 0.12 0.04 0.03 0.00 0.03 0.27 48 P C C 64.98 3.66 19.97 23.60 117.80 -110.49 -68.69 155.60 99.89 0.05 0.06 99.47 0.42 0.02 0.04 0.00 0.00 0.01 0.04 49 P H H 96.77 5.37 13.94 21.25 91.11 -107.58 -57.14 -37.19 1.79 0.00 98.21 0.35 0.23 0.96 98.17 0.29 0.00 0.00 0.00 50 K H H 143.15 1.46 19.09 19.61 91.53 54.88 -64.03 -38.67 0.58 0.00 99.41 0.07 0.04 0.38 99.24 0.27 0.00 0.00 0.00 51 I H H 33.88 14.85 16.46 31.70 92.32 48.55 -66.20 -41.15 0.18 0.00 99.82 0.03 0.01 0.10 99.67 0.19 0.00 0.00 0.00 52 V H H 14.97 20.27 15.80 35.93 91.62 50.69 -62.72 -43.40 0.06 0.00 99.94 0.01 0.00 0.03 99.93 0.03 0.00 0.00 0.00 53 T H H 74.20 3.37 23.36 26.19 91.56 50.03 -63.77 -41.29 0.08 0.00 99.92 0.01 0.00 0.04 99.93 0.01 0.00 0.00 0.00 54 A H H 45.10 5.74 22.30 28.50 91.53 50.59 -64.36 -41.64 0.09 0.00 99.91 0.01 0.00 0.06 99.92 0.01 0.00 0.00 0.00 55 L H H 4.88 23.84 16.66 40.74 91.50 49.92 -64.04 -42.97 0.10 0.00 99.90 0.01 0.00 0.06 99.91 0.02 0.00 0.00 0.00 56 T H H 44.45 14.06 20.27 33.94 91.59 51.59 -62.77 -41.60 0.11 0.00 99.89 0.01 0.00 0.07 99.89 0.03 0.00 0.00 0.00 57 A H H 61.44 2.08 23.30 23.51 91.63 50.56 -64.07 -41.41 0.23 0.00 99.77 0.01 0.01 0.16 99.68 0.13 0.00 0.00 0.00 58 E H H 54.05 11.53 19.02 31.20 92.11 49.36 -65.96 -40.55 0.69 0.00 99.31 0.03 0.02 0.55 99.03 0.36 0.00 0.00 0.00 59 L H H 10.92 23.18 13.02 35.82 91.85 51.64 -67.45 -33.90 3.92 0.00 96.07 0.28 0.22 3.08 95.09 1.32 0.00 0.00 0.00 60 S H H 70.09 5.94 17.76 24.93 91.07 61.36 -68.38 -22.34 37.68 0.05 62.27 1.77 1.59 33.11 61.57 1.90 0.01 0.01 0.03 61 T C T 102.57 1.75 18.95 20.03 96.51 51.44 -89.96 -9.95 65.87 0.11 34.02 4.34 5.52 53.58 34.14 2.29 0.01 0.04 0.08 62 M C C 45.40 17.88 10.09 27.03 115.85 93.51 -85.61 138.05 92.37 1.02 6.60 54.47 32.02 5.76 5.02 1.73 0.00 0.39 0.62 63 T C C 83.66 4.72 19.61 25.00 115.11 -141.68 -96.29 126.99 87.04 9.81 3.16 82.48 2.95 1.77 2.28 0.79 0.00 5.10 4.63 64 I C C 47.10 17.76 11.53 28.43 114.67 -165.24 -100.46 125.41 77.55 15.02 7.42 67.14 6.49 2.73 6.49 1.61 0.00 6.50 9.04 65 E H H 103.88 6.95 16.23 23.82 103.96 -92.45 -66.94 -51.98 45.76 2.33 51.91 16.80 10.43 19.91 35.53 14.95 0.16 1.31 0.90 66 N H H 100.96 3.91 16.73 21.20 100.60 18.08 -80.66 -17.71 47.01 0.79 52.21 9.74 10.12 27.00 36.95 15.26 0.11 0.38 0.45 67 D H H 70.62 6.51 17.21 24.52 99.71 49.63 -80.91 20.34 38.77 0.86 60.37 20.67 5.56 12.84 46.16 13.90 0.02 0.43 0.42 68 A H H 17.51 18.26 13.46 31.50 93.72 67.11 -63.82 -39.14 8.30 0.08 91.62 4.22 1.20 2.97 89.56 1.97 0.00 0.04 0.03 69 R H H 109.72 10.38 18.78 29.35 91.93 54.04 -63.49 -40.96 3.31 0.04 96.65 1.28 0.39 1.58 95.47 1.26 0.00 0.02 0.01 70 R H H 130.67 2.79 21.89 24.13 92.10 50.48 -65.73 -40.60 1.81 0.02 98.17 0.74 0.20 0.83 97.27 0.94 0.00 0.01 0.00 71 L H H 55.71 9.58 20.08 30.45 92.22 50.25 -65.00 -41.86 0.89 0.01 99.10 0.38 0.09 0.38 98.88 0.27 0.00 0.00 0.00 72 V H H 15.69 19.48 17.68 37.03 91.67 49.65 -64.08 -43.18 0.61 0.00 99.38 0.22 0.05 0.28 99.32 0.13 0.00 0.00 0.00 73 L H H 63.41 9.06 21.25 30.87 91.58 50.38 -62.99 -42.09 0.28 0.00 99.72 0.06 0.02 0.14 99.71 0.06 0.00 0.00 0.00 74 D H H 72.98 2.87 23.83 25.69 91.40 49.94 -64.27 -41.61 0.23 0.00 99.77 0.03 0.01 0.14 99.78 0.04 0.00 0.00 0.00 75 N H H 27.87 13.94 19.99 34.51 91.90 50.00 -64.90 -41.71 0.31 0.00 99.69 0.03 0.01 0.20 99.71 0.04 0.00 0.00 0.00 76 I H H 16.25 19.55 17.76 37.24 91.75 50.32 -64.02 -42.34 0.19 0.00 99.81 0.02 0.01 0.12 99.82 0.03 0.00 0.00 0.00 77 K H H 110.62 3.58 23.13 26.55 91.55 51.07 -63.40 -41.58 0.18 0.00 99.82 0.02 0.01 0.11 99.83 0.04 0.00 0.00 0.00 78 R H H 108.95 4.15 21.85 25.92 91.67 49.77 -64.65 -41.34 0.35 0.00 99.65 0.02 0.01 0.26 99.63 0.08 0.00 0.00 0.00 79 L H H 17.05 17.38 14.44 32.42 91.66 50.34 -64.28 -41.38 0.31 0.00 99.69 0.03 0.02 0.21 99.54 0.21 0.00 0.00 0.00 80 R H H 105.19 10.93 16.16 27.37 91.98 51.50 -63.49 -40.58 0.58 0.00 99.42 0.05 0.02 0.43 99.08 0.42 0.00 0.00 0.00 81 D H H 117.22 1.14 19.08 18.91 91.34 51.52 -66.66 -29.98 3.37 0.00 96.63 0.08 0.11 3.07 96.36 0.36 0.00 0.00 0.00 82 M H H 91.33 6.72 15.49 23.35 93.34 52.27 -84.89 -9.14 23.58 0.02 76.39 0.52 1.44 21.05 76.52 0.45 0.01 0.00 0.02 83 G C T 40.36 6.48 17.73 25.25 98.25 -113.24 77.61 15.82 99.46 0.08 0.45 24.04 7.85 67.67 0.26 0.10 0.00 0.04 0.03 84 T C C 28.76 13.31 14.80 29.18 122.56 151.80 -82.66 158.07 97.14 1.68 1.17 86.03 10.12 0.43 1.09 0.15 0.00 0.33 1.84 85 Y H H 99.19 10.29 20.41 31.33 92.03 -116.71 -61.85 -37.84 7.07 0.04 92.90 1.27 2.15 3.46 92.65 0.42 0.01 0.01 0.02 86 R H H 86.39 12.39 20.39 32.58 92.10 53.92 -64.11 -42.16 1.93 0.00 98.07 0.18 0.18 1.35 98.00 0.29 0.00 0.00 0.00 87 G H H 10.00 12.76 17.64 31.95 92.06 50.33 -63.57 -42.51 0.87 0.00 99.13 0.14 0.08 0.51 98.96 0.32 0.00 0.00 0.00 88 R H H 98.27 7.06 21.48 29.05 92.08 49.62 -64.63 -41.72 0.33 0.00 99.67 0.05 0.03 0.19 99.57 0.17 0.00 0.00 0.00 89 R H H 59.12 9.95 17.62 28.83 92.43 49.49 -64.89 -42.15 0.43 0.00 99.57 0.05 0.03 0.28 99.46 0.19 0.00 0.00 0.00 90 H H H 59.69 12.36 15.15 28.13 92.12 49.88 -64.64 -41.59 0.65 0.00 99.35 0.04 0.03 0.48 98.97 0.48 0.00 0.00 0.00 91 A H H 61.71 7.71 16.37 25.15 91.19 53.18 -65.80 -29.36 4.83 0.00 95.17 0.08 0.12 4.68 94.49 0.62 0.00 0.00 0.00 92 M C T 109.70 4.07 16.26 21.22 92.97 50.86 -88.89 -0.26 68.19 0.01 31.80 0.22 0.72 68.06 30.23 0.76 0.00 0.00 0.01 93 G C T 54.79 2.62 16.65 20.07 95.12 -106.14 80.34 13.29 99.78 0.00 0.22 0.95 0.78 98.14 0.11 0.02 0.00 0.00 0.00 94 L C C 59.04 10.05 11.49 23.20 117.68 147.53 -86.58 140.65 99.85 0.12 0.03 93.68 6.10 0.08 0.01 0.01 0.00 0.03 0.09 95 P C C 75.48 5.34 18.17 24.26 112.19 -104.07 -66.49 143.80 99.24 0.52 0.25 94.78 3.83 0.62 0.07 0.12 0.00 0.18 0.40 96 V C C 50.79 16.58 11.03 26.67 115.47 -162.99 -106.09 132.11 87.63 10.61 1.75 74.65 9.07 2.10 0.81 0.82 0.00 2.16 10.39 97 R C T 149.74 4.68 15.96 21.78 107.98 -109.81 -80.05 114.89 88.69 4.32 6.99 25.28 29.48 34.58 2.86 3.56 0.01 2.03 2.19 98 G C T 46.86 5.63 13.79 20.57 101.08 5.50 80.74 2.71 88.53 2.02 9.45 22.00 29.65 37.54 4.14 4.59 0.01 0.88 1.19 99 Q C C 100.49 6.66 12.59 20.58 105.20 109.44 -83.77 4.61 76.50 1.88 21.62 37.35 26.19 13.51 15.51 5.41 0.02 0.68 1.34 100 Q C C 108.97 4.99 14.22 20.39 104.87 72.60 -86.69 53.58 70.82 1.61 27.57 46.07 14.97 9.62 23.65 4.06 0.01 0.63 0.98 101 T H H 59.94 9.50 12.55 23.01 100.71 126.83 -74.62 -32.37 41.57 0.95 57.48 26.82 9.33 6.75 52.68 3.59 0.01 0.40 0.43 102 R H H 145.08 4.96 15.13 21.18 95.21 57.48 -68.14 -35.74 24.30 0.48 75.21 12.28 5.59 7.65 70.55 3.50 0.02 0.23 0.18 103 N H H 93.00 3.28 17.22 20.75 96.15 51.93 -71.28 -35.34 24.31 0.52 75.17 13.39 4.50 7.48 70.82 3.34 0.01 0.26 0.19 104 Q H H 73.11 9.08 16.15 26.03 95.14 52.03 -69.42 -36.50 19.84 0.44 79.72 12.15 3.60 4.97 76.58 2.33 0.01 0.21 0.15 105 I H H 47.38 13.11 14.97 28.48 93.76 53.76 -66.20 -40.37 13.06 0.27 86.68 8.32 2.14 3.11 84.67 1.55 0.00 0.12 0.08 106 A H H 57.54 3.48 19.84 23.35 92.58 51.68 -64.90 -41.10 8.31 0.16 91.53 4.80 1.26 2.51 89.95 1.35 0.00 0.08 0.05 107 N H H 71.87 4.10 19.51 24.02 92.44 50.27 -65.74 -39.84 7.47 0.15 92.38 3.91 1.13 2.71 90.68 1.44 0.00 0.08 0.04 108 A H H 20.61 13.40 14.72 29.28 92.45 52.08 -64.68 -41.25 4.92 0.08 95.00 2.31 0.75 1.96 93.52 1.39 0.00 0.04 0.02 109 R H H 116.05 7.19 17.83 25.83 91.93 51.59 -64.33 -40.79 5.06 0.09 94.85 2.22 0.76 2.25 92.79 1.90 0.01 0.05 0.02 110 K H H 124.84 2.09 19.01 20.47 92.38 50.64 -65.49 -40.00 7.19 0.10 92.71 2.62 0.99 3.68 90.10 2.51 0.01 0.06 0.03 111 L H H 74.64 6.66 16.22 24.13 92.91 50.38 -67.79 -36.51 12.19 0.13 87.68 3.69 1.77 6.85 84.69 2.87 0.02 0.06 0.06 112 N H H 51.98 11.52 12.75 25.08 95.77 54.46 -74.49 -24.48 30.93 0.33 68.75 11.50 4.53 15.18 65.85 2.62 0.02 0.14 0.17 113 K H H 119.22 4.12 14.69 19.84 95.93 64.59 -68.51 -29.97 39.10 0.67 60.23 19.65 7.07 13.39 55.24 4.02 0.02 0.30 0.32 114 I H H 98.72 4.35 12.58 18.03 97.23 60.93 -72.77 -34.37 35.62 1.07 63.31 20.11 7.12 9.85 53.73 8.19 0.03 0.56 0.42 115 E H H 119.63 3.97 11.79 17.19 99.56 55.61 -79.12 -15.61 40.82 1.24 57.94 23.00 6.01 12.79 48.57 8.44 0.02 0.67 0.51 116 R C H 142.02 5.17 9.65 16.30 100.75 64.70 -80.73 -9.47 52.11 1.20 46.70 27.45 7.18 18.70 38.57 6.89 0.02 0.57 0.62 117 H C C 142.06 2.65 9.83 14.02 102.72 64.87 -87.45 12.05 77.69 0.69 21.62 54.51 2.53 19.96 20.20 2.08 0.00 0.30 0.42 118 G C C 50.97 3.36 12.73 17.51 110.64 -106.71 83.84 1.22 99.94 0.02 0.04 99.28 0.20 0.48 0.02 0.00 0.00 0.01 0.01