# 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 104.56 6.66 15.60 23.32 118.79 -161.42 -95.43 140.53 99.97 0.03 0.00 99.93 0.04 0.01 0.00 0.00 0.00 0.01 0.00 1 A C C 60.03 9.73 12.26 22.76 114.84 -114.61 -76.31 142.04 92.91 6.38 0.71 91.17 0.81 1.45 0.18 0.31 0.00 5.37 0.71 2 V C C 69.51 9.34 14.03 24.65 120.72 -160.02 -113.81 134.91 72.41 26.30 1.29 59.25 10.01 2.39 0.35 0.99 0.00 25.04 1.97 3 Y C C 114.54 10.16 14.97 25.92 119.40 -149.29 -102.93 133.45 57.19 41.89 0.92 51.68 3.95 0.88 0.32 0.58 0.00 40.06 2.53 4 V C C 38.42 15.41 13.63 29.45 122.91 -166.45 -116.06 136.03 58.65 40.76 0.59 55.15 2.37 0.40 0.22 0.27 0.00 40.40 1.20 5 K C C 129.19 5.38 18.88 25.61 116.07 -145.06 -98.65 129.35 61.41 38.02 0.57 57.32 2.60 0.58 0.17 0.31 0.00 37.95 1.07 6 F C C 53.68 17.50 12.59 29.46 126.39 -170.04 -120.96 143.30 65.96 33.46 0.59 61.41 3.26 0.69 0.21 0.33 0.00 32.34 1.76 7 K C C 138.20 3.15 21.43 25.15 116.65 -134.63 -96.67 127.48 80.05 19.67 0.28 72.76 6.25 0.65 0.11 0.18 0.00 18.03 2.03 8 V C C 25.36 21.63 10.05 30.47 120.79 -156.61 -103.85 136.81 96.82 3.14 0.04 88.21 8.99 0.09 0.02 0.01 0.00 2.27 0.39 9 P C C 47.59 7.08 16.07 25.11 112.94 -105.10 -64.06 146.95 98.94 0.70 0.36 98.66 0.44 0.11 0.26 0.03 0.00 0.39 0.11 10 E H H 138.72 2.93 14.76 19.29 91.50 -118.09 -58.81 -37.46 4.24 0.01 95.75 1.38 0.82 1.87 95.11 0.82 0.00 0.00 0.01 11 E H H 120.27 1.99 17.95 19.50 91.70 54.83 -64.62 -38.56 2.28 0.01 97.71 0.54 0.26 1.29 96.99 0.91 0.00 0.00 0.00 12 I H H 21.80 16.90 14.26 31.61 92.51 48.52 -66.96 -40.18 0.95 0.01 99.04 0.31 0.10 0.45 98.22 0.91 0.00 0.00 0.00 13 Q H H 45.68 16.57 15.84 32.03 91.34 53.61 -61.95 -42.41 0.36 0.00 99.64 0.11 0.03 0.15 99.58 0.13 0.00 0.00 0.00 14 K H H 125.74 2.21 22.98 24.17 91.72 49.93 -64.39 -40.67 0.32 0.00 99.68 0.07 0.02 0.15 99.72 0.05 0.00 0.00 0.00 15 E H H 82.33 7.03 22.12 29.47 91.60 49.64 -65.00 -41.12 0.27 0.00 99.73 0.05 0.01 0.14 99.77 0.03 0.00 0.00 0.00 16 L H H 4.32 24.96 16.72 41.92 91.34 50.03 -63.81 -43.29 0.25 0.00 99.75 0.04 0.01 0.13 99.79 0.03 0.00 0.00 0.00 17 L H H 50.76 13.94 21.51 35.14 91.21 50.34 -63.11 -41.29 0.28 0.00 99.72 0.04 0.02 0.15 99.76 0.04 0.00 0.00 0.00 18 D H H 84.69 2.31 25.60 26.43 91.67 50.56 -64.47 -40.99 0.63 0.00 99.37 0.08 0.03 0.38 99.41 0.09 0.00 0.00 0.00 19 A H H 13.23 16.26 19.37 36.19 91.58 50.45 -64.34 -42.26 1.36 0.00 98.64 0.17 0.09 0.90 98.58 0.26 0.00 0.00 0.00 20 V H H 8.09 24.13 16.26 40.12 91.56 50.83 -64.98 -38.76 3.93 0.03 96.04 0.60 0.35 2.66 95.68 0.67 0.01 0.01 0.01 21 A H H 65.38 5.97 21.20 27.96 90.98 56.57 -65.80 -27.71 19.70 0.12 80.18 2.48 1.47 14.93 79.77 1.22 0.02 0.05 0.06 22 K H H 124.86 4.31 21.27 25.84 93.27 55.14 -78.89 -15.80 42.35 0.38 57.27 7.80 4.65 28.84 56.51 1.83 0.03 0.16 0.18 23 A C C 14.64 22.30 11.04 32.06 113.81 88.00 -81.69 141.66 72.90 2.34 24.76 49.50 9.33 12.19 24.12 2.63 0.00 1.67 0.55 24 Q C C 116.90 4.81 20.81 26.26 99.86 -149.31 -74.38 -27.99 86.49 5.47 8.03 48.68 27.66 10.60 4.03 3.55 0.01 4.74 0.73 25 K C E 104.45 7.09 22.44 30.05 125.33 18.92 -130.34 137.03 49.47 43.69 6.84 36.30 7.71 5.63 2.55 3.59 0.02 42.98 1.23 26 I E E 33.48 22.25 15.64 36.93 121.76 -160.51 -112.62 131.02 21.76 76.21 2.03 19.54 1.82 0.63 1.48 0.74 0.00 73.73 2.05 27 K E E 58.28 14.07 21.65 35.56 122.71 -162.60 -111.03 138.77 15.36 83.77 0.87 14.54 0.77 0.25 0.77 0.27 0.00 80.12 3.28 28 K E E 94.64 12.88 21.70 34.07 123.55 -152.50 -111.03 137.24 32.52 66.70 0.78 28.01 3.75 0.64 0.51 0.35 0.00 64.69 2.05 29 G C S 17.04 10.41 24.47 35.69 125.78 15.86 97.29 165.26 86.40 3.87 9.73 25.07 54.99 5.18 10.51 0.95 0.02 2.23 1.04 30 A H H 20.85 21.50 16.38 37.01 92.22 -88.48 -61.17 -39.52 5.82 0.02 94.15 0.76 1.75 3.12 93.86 0.48 0.01 0.01 0.01 31 N H H 102.06 4.11 24.12 28.86 91.64 53.21 -63.76 -40.04 2.73 0.01 97.26 0.30 0.36 1.94 96.92 0.46 0.00 0.00 0.00 32 E H H 77.87 8.20 23.76 32.19 92.02 48.68 -66.38 -40.09 0.98 0.01 99.01 0.22 0.10 0.59 98.73 0.36 0.00 0.00 0.00 33 V H H 1.81 26.68 17.09 44.38 91.64 50.23 -64.26 -43.47 0.29 0.00 99.71 0.06 0.03 0.16 99.66 0.09 0.00 0.00 0.00 34 T H H 24.41 17.52 22.40 39.17 91.46 49.89 -63.20 -42.71 0.18 0.00 99.82 0.03 0.01 0.10 99.82 0.04 0.00 0.00 0.00 35 K H H 107.62 2.82 26.86 28.76 91.71 49.97 -63.87 -41.72 0.14 0.00 99.86 0.01 0.01 0.09 99.85 0.04 0.00 0.00 0.00 36 A H H 10.72 14.48 19.64 35.41 91.42 50.23 -63.93 -42.49 0.19 0.00 99.81 0.02 0.01 0.14 99.76 0.07 0.00 0.00 0.00 37 V H H 5.57 24.55 15.27 39.83 91.74 48.93 -64.37 -43.16 0.31 0.00 99.69 0.02 0.01 0.25 99.45 0.26 0.00 0.00 0.00 38 E H H 106.19 7.83 19.62 28.25 91.37 50.87 -64.41 -34.66 2.07 0.00 97.93 0.03 0.05 2.08 97.55 0.29 0.00 0.00 0.00 39 R C T 148.49 2.51 19.89 22.04 92.23 51.47 -84.50 -5.02 68.38 0.01 31.61 0.19 0.76 67.43 31.03 0.58 0.00 0.00 0.01 40 G C T 40.16 10.29 16.36 27.13 94.77 -113.98 77.16 14.02 99.86 0.00 0.14 0.50 1.75 97.68 0.05 0.02 0.00 0.00 0.00 41 I C S 76.42 8.42 21.48 30.64 95.01 124.44 -81.88 -20.16 99.75 0.21 0.04 28.25 70.51 1.04 0.01 0.02 0.00 0.08 0.09 42 A C C 3.28 25.70 14.13 40.12 122.17 62.96 -109.38 137.47 93.04 6.93 0.03 78.24 14.13 0.46 0.00 0.05 0.00 6.80 0.30 43 K C S 80.55 11.18 27.10 39.19 100.24 -166.12 -96.23 -27.55 91.64 8.35 0.01 13.40 78.18 0.18 0.00 0.00 0.00 8.15 0.07 44 L E E 6.84 22.39 27.08 48.82 137.26 13.28 -146.67 144.89 2.08 97.92 0.00 1.46 0.52 0.02 0.00 0.00 0.00 97.93 0.05 45 V E E 0.77 27.87 27.45 55.34 121.35 -161.42 -119.99 128.63 0.12 99.88 0.00 0.11 0.00 0.00 0.00 0.00 0.00 99.89 0.00 46 I E E 1.98 25.93 29.54 54.90 117.32 -162.49 -110.21 124.91 0.02 99.98 0.00 0.02 0.00 0.00 0.00 0.00 0.00 99.98 0.00 47 I E E 3.68 25.09 26.98 51.04 128.19 -173.38 -124.78 142.80 0.13 99.87 0.00 0.13 0.00 0.00 0.00 0.00 0.00 99.87 0.00 48 A E E 4.21 22.32 21.16 44.03 113.48 -113.74 -73.48 139.57 17.75 82.22 0.03 17.06 0.39 0.03 0.00 0.01 0.00 82.29 0.20 49 E C T 78.44 12.38 21.85 34.57 92.88 -132.41 -66.64 -27.20 89.83 9.17 1.00 5.72 29.71 54.75 0.04 1.11 0.00 8.22 0.45 50 D C T 83.33 6.12 22.93 29.99 94.95 58.95 -89.66 4.82 96.73 2.45 0.82 17.01 32.72 47.02 0.06 0.98 0.00 1.88 0.33 51 V C C 14.18 23.40 10.64 33.29 116.23 111.50 -83.66 135.64 95.21 3.43 1.36 72.81 20.20 1.54 0.67 0.65 0.00 1.09 3.04 52 K C C 126.55 4.45 21.55 26.52 115.17 -140.31 -96.82 133.72 99.49 0.12 0.39 95.45 3.69 0.41 0.26 0.06 0.00 0.04 0.09 53 P H H 58.64 10.58 15.61 26.80 110.14 -90.39 -67.35 146.15 26.18 0.11 73.71 11.07 6.23 8.82 71.08 2.66 0.01 0.04 0.08 54 E H H 113.87 7.17 15.76 24.02 93.97 -117.82 -63.16 -34.40 6.55 0.02 93.43 1.01 0.88 4.36 89.73 3.98 0.02 0.01 0.01 55 E H H 106.87 4.76 19.30 24.62 92.90 54.09 -66.65 -37.35 4.13 0.03 95.84 0.71 0.47 2.76 91.18 4.83 0.02 0.02 0.01 56 V H H 21.60 18.84 16.29 34.59 93.94 48.06 -68.32 -40.20 4.68 0.03 95.29 0.61 0.45 3.39 91.00 4.50 0.02 0.02 0.01 57 V H H 23.42 19.93 17.53 36.66 93.06 49.08 -69.33 -33.05 12.54 0.09 87.36 0.94 1.03 10.58 83.50 3.78 0.08 0.04 0.05 58 A C T 54.49 6.75 22.41 29.65 91.85 63.40 -66.89 -28.71 59.41 0.08 40.50 0.98 1.91 56.28 37.62 3.08 0.02 0.03 0.08 59 H C T 67.12 11.46 22.00 33.75 95.63 49.80 -86.17 -16.73 59.20 0.04 40.76 1.60 1.51 56.30 36.84 3.67 0.01 0.01 0.04 60 L H H 2.12 27.55 16.70 44.94 91.84 79.28 -60.53 -44.94 0.83 0.00 99.17 0.18 0.08 0.38 99.10 0.26 0.00 0.00 0.00 61 P H H 37.50 14.53 21.18 35.56 91.29 51.96 -62.74 -40.96 0.19 0.00 99.81 0.02 0.01 0.11 99.67 0.19 0.00 0.00 0.00 62 Y H H 118.97 2.96 25.27 27.23 91.69 49.98 -64.20 -41.90 0.06 0.00 99.94 0.01 0.00 0.04 99.83 0.13 0.00 0.00 0.00 63 L H H 19.60 14.62 19.43 34.99 91.97 49.68 -64.29 -42.84 0.08 0.00 99.92 0.00 0.00 0.05 99.90 0.05 0.00 0.00 0.00 64 C H H 5.34 22.45 13.67 36.38 91.56 49.90 -63.74 -42.85 0.27 0.00 99.73 0.03 0.01 0.17 99.74 0.05 0.00 0.00 0.00 65 E H H 126.22 3.60 18.52 23.14 91.76 49.15 -64.40 -40.91 0.33 0.00 99.67 0.01 0.01 0.25 99.58 0.14 0.00 0.00 0.00 66 E H H 135.14 1.98 17.72 19.74 91.84 50.35 -66.05 -34.30 1.81 0.00 98.19 0.04 0.05 1.68 97.99 0.25 0.00 0.00 0.00 67 K H H 87.32 10.43 13.94 25.21 95.26 41.26 -94.24 -0.23 19.47 0.01 80.51 0.34 0.87 18.02 80.29 0.46 0.01 0.00 0.01 68 G C T 58.31 1.81 20.96 22.40 93.65 -118.99 66.40 31.34 99.90 0.01 0.09 8.55 1.66 89.72 0.04 0.02 0.00 0.00 0.00 69 I C C 14.18 22.67 12.01 34.53 116.25 151.46 -97.45 130.57 99.79 0.21 0.00 96.14 3.70 0.01 0.00 0.00 0.00 0.11 0.03 70 P C C 45.28 9.20 25.47 35.71 113.21 -114.15 -67.70 141.29 99.07 0.93 0.00 98.50 0.70 0.01 0.00 0.00 0.00 0.76 0.03 71 Y E E 38.66 23.66 16.36 39.11 132.90 -172.62 -133.27 146.45 2.43 97.57 0.00 2.52 0.07 0.00 0.00 0.00 0.00 96.67 0.74 72 A E E 20.68 15.97 25.58 41.14 126.01 -166.74 -126.37 135.38 0.33 99.67 0.00 0.32 0.01 0.00 0.00 0.00 0.00 99.65 0.02 73 Y E E 80.39 16.44 24.01 39.07 117.24 -146.98 -99.02 128.42 1.64 98.36 0.00 1.59 0.03 0.00 0.00 0.00 0.00 98.30 0.07 74 V E E 12.75 20.90 16.88 37.83 121.88 -169.98 -118.31 130.12 31.87 68.10 0.02 31.31 0.56 0.04 0.01 0.01 0.00 67.55 0.51 75 A C S 60.87 7.73 22.58 30.66 96.21 -149.26 -75.55 -22.95 96.34 3.54 0.12 28.25 67.32 0.94 0.03 0.06 0.00 3.20 0.19 76 S C S 41.57 6.07 24.49 30.87 137.84 18.32 -146.95 162.06 96.24 1.38 2.38 44.92 49.79 1.58 2.22 0.31 0.00 0.39 0.81 77 K H H 55.73 20.37 15.01 34.41 91.92 -112.35 -60.82 -36.50 2.10 0.00 97.90 0.31 0.42 1.18 97.66 0.43 0.00 0.00 0.00 78 Q H H 110.69 4.69 22.32 27.88 91.63 55.24 -63.09 -40.96 0.97 0.00 99.03 0.13 0.09 0.65 98.63 0.51 0.00 0.00 0.00 79 D H H 60.99 7.02 23.34 30.69 92.07 48.68 -66.30 -40.44 0.62 0.00 99.38 0.10 0.06 0.39 98.70 0.74 0.00 0.00 0.00 80 L H H 2.60 25.94 16.69 43.06 91.72 51.20 -63.43 -43.82 0.26 0.00 99.74 0.03 0.02 0.17 99.56 0.22 0.00 0.00 0.00 81 G H H 7.09 18.13 18.53 37.00 91.51 50.76 -62.14 -43.20 0.74 0.00 99.25 0.08 0.05 0.51 99.00 0.35 0.00 0.00 0.00 82 K H H 140.43 1.81 24.41 25.28 91.70 49.71 -64.25 -40.62 0.99 0.00 99.01 0.06 0.05 0.79 98.38 0.72 0.00 0.00 0.00 83 A H H 32.51 14.14 19.24 33.42 91.43 51.95 -66.24 -33.51 3.53 0.00 96.46 0.10 0.14 3.31 95.74 0.71 0.00 0.00 0.00 84 A C T 6.99 22.99 15.17 38.27 93.13 45.87 -85.88 -8.51 56.36 0.02 43.62 0.29 0.94 55.47 42.25 1.02 0.01 0.01 0.02 85 G C T 54.90 2.04 22.68 24.24 94.83 -113.06 79.29 16.84 99.45 0.01 0.54 1.09 1.10 97.43 0.31 0.06 0.00 0.00 0.00 86 L C C 32.12 19.04 9.47 27.48 125.85 135.49 -102.98 151.86 98.61 0.53 0.85 80.40 16.23 1.81 0.42 0.38 0.00 0.15 0.60 87 E C S 162.62 0.87 20.15 19.16 95.19 -136.12 -81.90 -11.55 99.23 0.36 0.41 19.38 77.70 2.30 0.13 0.18 0.00 0.16 0.14 88 V C S 52.37 11.49 17.69 30.02 129.66 54.03 -122.09 150.51 98.18 1.21 0.61 12.50 83.93 2.11 0.21 0.25 0.00 0.53 0.47 89 A C C 43.91 11.81 23.39 35.16 112.97 -99.75 -68.61 140.49 95.45 3.75 0.80 87.16 6.63 1.72 0.24 0.59 0.00 2.33 1.33 90 A C C 5.97 24.76 19.26 43.77 128.79 -167.10 -125.07 145.33 76.56 22.76 0.67 72.06 3.69 0.48 0.33 0.41 0.00 18.93 4.10 91 S C C 16.94 18.40 27.33 45.19 102.12 -164.71 -93.96 -24.34 70.25 29.39 0.35 37.04 33.45 0.79 0.08 0.21 0.00 27.78 0.65 92 S E E 4.33 23.51 27.86 50.54 139.00 6.97 -150.11 151.97 12.14 87.56 0.30 9.80 2.08 0.20 0.09 0.12 0.00 87.28 0.42 93 V E E 2.01 26.98 27.56 54.08 128.91 -164.33 -133.67 140.64 1.06 98.80 0.14 0.89 0.07 0.01 0.09 0.02 0.00 98.86 0.05 94 A E E 5.90 22.65 28.75 50.39 122.64 -163.36 -118.47 132.27 0.64 99.25 0.11 0.54 0.03 0.01 0.07 0.01 0.00 99.32 0.02 95 I E E 6.94 23.79 22.95 46.70 112.59 -145.80 -96.18 121.21 2.78 97.12 0.09 2.68 0.09 0.02 0.07 0.02 0.00 96.98 0.15 96 I E E 50.06 14.41 22.97 36.99 100.62 -174.91 -91.25 -27.53 37.35 61.84 0.81 25.45 11.57 1.62 0.27 0.48 0.00 59.94 0.67 97 N C S 76.61 6.72 22.86 29.92 125.35 28.31 -132.86 132.29 74.39 22.64 2.97 32.67 35.00 7.44 0.87 1.85 0.01 20.68 1.47 98 E C T 97.61 13.52 15.61 28.55 108.21 -120.37 -68.49 127.95 76.31 5.73 17.96 17.64 18.90 40.76 7.62 9.31 0.09 4.07 1.61 99 G C T 42.32 5.37 19.15 25.35 98.33 47.91 84.00 -14.91 77.69 2.13 20.18 19.32 17.79 41.29 10.10 9.28 0.04 1.20 0.97 100 D C C 71.63 8.14 18.79 27.57 96.72 66.76 -88.56 -2.97 66.93 1.77 31.30 44.71 9.81 12.08 22.46 9.19 0.00 0.91 0.83 101 A H H 9.93 22.35 11.60 33.20 95.18 87.21 -68.39 -27.12 47.73 0.61 51.66 35.42 5.28 7.03 47.36 4.37 0.00 0.28 0.26 102 E H H 121.60 2.73 21.95 24.64 92.18 65.60 -62.93 -39.68 15.03 0.15 84.82 9.72 2.24 3.50 82.04 2.37 0.00 0.06 0.05 103 E H H 98.03 5.28 21.54 27.13 91.93 50.78 -65.36 -39.30 6.48 0.09 93.43 3.78 0.84 2.08 91.43 1.81 0.00 0.05 0.03 104 L H H 6.99 24.05 15.03 39.05 92.14 51.77 -64.66 -41.40 2.88 0.04 97.08 1.58 0.34 1.00 95.89 1.14 0.00 0.03 0.01 105 K H H 93.77 10.24 21.07 31.36 91.47 53.14 -62.36 -40.98 1.76 0.03 98.21 0.96 0.22 0.61 97.71 0.48 0.00 0.01 0.00 106 V H H 77.57 2.56 23.62 24.86 91.57 50.40 -63.90 -42.01 1.37 0.02 98.61 0.67 0.17 0.52 98.35 0.28 0.00 0.01 0.00 107 L H H 17.47 17.14 19.20 36.71 92.03 49.89 -64.25 -42.58 0.99 0.02 98.99 0.40 0.11 0.43 98.82 0.23 0.00 0.01 0.00 108 I H H 18.12 19.67 17.78 37.28 91.60 50.60 -63.18 -42.39 0.98 0.02 99.01 0.35 0.10 0.46 98.82 0.26 0.00 0.01 0.00 109 E H H 111.43 2.51 23.19 24.83 91.56 50.84 -63.95 -40.73 1.75 0.02 98.23 0.49 0.17 0.97 97.94 0.41 0.00 0.01 0.01 110 K H H 92.65 6.33 20.66 27.44 92.12 49.97 -65.46 -40.13 4.33 0.05 95.62 0.84 0.42 2.88 95.12 0.69 0.01 0.02 0.02 111 V H H 9.56 21.16 14.30 35.64 92.31 49.85 -65.92 -40.85 7.71 0.17 92.13 2.01 1.11 4.59 90.97 1.16 0.03 0.08 0.07 112 N H H 73.54 7.73 17.86 26.49 92.26 54.55 -63.97 -38.15 13.41 0.43 86.17 5.46 1.88 6.49 81.97 3.77 0.02 0.25 0.15 113 V H H 90.87 2.36 18.00 19.92 93.02 53.44 -68.07 -35.33 22.26 0.42 77.32 5.81 2.51 13.96 71.92 5.36 0.04 0.25 0.16 114 L H H 56.14 12.41 12.32 25.25 94.86 55.63 -73.52 -25.57 28.81 0.72 70.47 9.18 4.13 16.26 65.61 4.09 0.05 0.37 0.31 115 K C H 101.32 9.98 11.20 21.66 100.00 61.62 -81.17 -7.90 54.81 1.48 43.72 32.33 2.28 19.74 41.97 2.23 0.00 0.61 0.83 116 Q C C 131.57 2.78 14.35 18.41 104.76 99.79 -79.36 82.30 99.94 0.02 0.04 99.80 0.06 0.10 0.02 0.00 0.00 0.01 0.00